#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lfg n ARG 2 N 0.00 0.00 -1.68 1.61 1.85 -1.26 -4.89 116.66 112.29 1lfg n ARG 2 Ca 0.00 0.00 -0.35 0.00 -1.00 0.00 0.00 57.85 56.50 1lfg n ARG 2 Cb 0.00 -0.03 -0.03 0.00 -1.05 0.00 0.00 32.46 31.34 1lfg n ARG 2 CO 0.00 0.00 0.00 -2.13 -0.01 0.00 0.00 177.63 175.49 1lfg n ARG 3 N 0.00 3.81 -0.27 2.89 3.00 -1.26 -4.87 116.66 119.96 1lfg n ARG 3 Ca 0.00 -2.80 0.00 0.00 -0.00 0.00 0.00 57.85 55.05 1lfg n ARG 3 Cb 0.04 -2.52 0.04 0.00 0.00 0.00 0.00 32.46 30.01 1lfg n ARG 3 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 1lfg n ARG 4 N 2.00 -0.15 -3.53 -0.14 0.63 -1.26 -4.75 116.66 109.46 1lfg n ARG 4 Ca 0.62 1.12 -0.11 0.00 -0.92 0.00 0.00 57.85 58.56 1lfg n ARG 4 Cb 0.35 -1.66 -0.02 0.00 0.45 0.00 0.00 32.46 31.58 1lfg n ARG 4 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 1lfg s SER 5 N -5.25 -0.47 -0.82 6.15 0.01 -1.26 -4.71 113.70 107.35 1lfg s SER 5 Ca -0.10 -0.16 -0.10 0.00 1.31 0.00 0.00 55.95 56.90 1lfg s SER 5 Cb 0.16 0.61 0.21 0.00 0.21 0.00 0.00 66.02 67.21 1lfg s SER 5 CO 0.53 -1.03 0.74 -0.69 0.41 0.00 0.00 173.24 173.19 1lfg s VAL 6 N -3.79 5.10 -0.29 3.43 1.01 -1.24 -4.98 120.40 119.63 1lfg s VAL 6 Ca 0.03 -2.85 -0.28 0.00 0.00 0.00 0.00 61.98 58.88 1lfg s VAL 6 Cb -0.02 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 1lfg s VAL 6 CO -0.09 -1.02 2.13 -1.10 0.00 0.00 0.00 175.10 175.02 1lfg s GLN 7 N -0.23 3.04 0.26 2.72 -0.21 -1.26 -3.89 119.66 120.09 1lfg s GLN 7 Ca 0.20 1.77 -0.21 0.00 0.02 0.00 0.00 55.36 57.14 1lfg s GLN 7 Cb -0.12 -4.36 -0.09 0.00 1.00 0.00 0.00 33.01 29.44 1lfg s GLN 7 CO -0.08 -2.20 0.79 -0.46 -2.12 0.00 0.00 175.29 171.22 1lfg s TRP 8 N 8.45 3.65 -0.26 0.91 -0.11 -0.67 -0.15 118.94 130.75 1lfg s TRP 8 Ca 0.94 1.49 -0.09 0.00 1.22 0.00 0.00 56.10 59.66 1lfg s TRP 8 Cb -0.28 -2.70 -0.04 0.00 -1.50 0.00 0.00 33.47 28.95 1lfg s TRP 8 CO 0.33 0.29 0.14 0.00 -4.62 0.00 0.00 176.95 173.09 1lfg s ALA 10 N 1.58 3.87 -0.45 0.00 0.00 0.23 -4.81 121.76 122.17 1lfg s ALA 10 Ca 0.07 -0.86 0.06 0.00 0.00 0.00 0.00 51.96 51.23 1lfg s ALA 10 Cb -0.15 -1.94 0.18 0.00 0.00 0.00 0.00 23.12 21.20 1lfg s ALA 10 CO 0.07 0.49 1.14 1.33 0.00 0.00 0.00 175.76 178.80 1lfg n VAL 11 N -0.54 1.08 -3.79 0.00 0.24 -1.26 -2.06 118.33 112.00 1lfg n VAL 11 Ca -0.05 -1.08 -0.04 0.00 -2.04 0.00 0.00 64.34 61.13 1lfg n VAL 11 Cb 0.54 0.44 0.02 0.00 -1.47 0.00 0.00 33.84 33.37 1lfg n VAL 11 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1lfg n SER 12 N -0.05 -1.62 -0.07 -1.34 3.41 -1.19 -4.27 113.62 108.49 1lfg n SER 12 Ca 0.07 -1.93 -0.10 0.00 -0.26 0.00 0.00 58.87 56.65 1lfg n SER 12 Cb 0.37 2.65 -0.08 0.00 -0.26 0.00 0.00 64.21 66.89 1lfg n SER 12 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1lfg h ASN 13 N 1.70 0.00 -0.42 4.04 -0.73 -1.97 -2.56 115.58 115.64 1lfg h ASN 13 Ca -0.25 -0.56 0.09 0.00 1.87 0.00 0.00 56.30 57.45 1lfg h ASN 13 Cb 1.04 0.00 -0.09 0.00 0.27 0.00 0.00 38.32 39.54 1lfg h ASN 13 CO 0.33 0.87 -0.26 1.55 -0.37 0.00 0.00 177.43 179.55 1lfg h PRO 14 N -1.00 -0.18 -0.65 6.67 0.13 -1.98 0.83 132.00 135.83 1lfg h PRO 14 Ca -0.04 0.01 0.11 0.00 -0.87 0.00 0.00 66.00 65.21 1lfg h PRO 14 Cb 0.67 0.04 -0.12 0.00 0.13 0.00 0.00 31.00 31.73 1lfg h PRO 14 CO -0.02 -0.12 -0.38 0.93 -0.23 0.00 0.00 178.00 178.18 1lfg h GLU 15 N -0.18 -0.15 -0.48 0.86 5.08 -1.96 1.04 114.58 118.78 1lfg h GLU 15 Ca 0.19 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.55 1lfg h GLU 15 Cb 0.49 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 1lfg h GLU 15 CO -0.53 -0.10 0.23 0.00 -1.00 0.00 0.00 179.01 177.61 1lfg h ALA 16 N 0.91 1.49 0.00 3.43 0.00 -0.60 0.93 119.26 125.42 1lfg h ALA 16 Ca 0.23 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 1lfg h ALA 16 Cb 0.56 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1lfg h ALA 16 CO -0.73 0.41 -0.49 1.15 0.00 0.00 0.00 179.25 179.59 1lfg h THR 17 N 0.68 1.30 0.02 0.00 2.02 0.52 -1.90 112.91 115.55 1lfg h THR 17 Ca 0.17 -1.71 -0.05 0.00 0.77 0.00 0.00 66.41 65.59 1lfg h THR 17 Cb 0.08 1.93 0.00 0.00 -1.74 0.00 0.00 68.15 68.43 1lfg h THR 17 CO -0.02 0.48 -0.21 0.50 0.37 0.00 0.00 175.52 176.64 1lfg h LYS 18 N 0.00 0.11 0.00 6.66 3.64 0.38 -3.24 116.57 124.12 1lfg h LYS 18 Ca -0.00 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 1lfg h LYS 18 Cb 0.89 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.76 1lfg h LYS 18 CO 0.06 0.97 0.01 0.00 -2.27 0.00 0.00 179.45 178.22 1lfg h PHE 20 N 0.00 0.49 0.46 0.00 0.04 -1.43 -2.68 116.94 113.83 1lfg h PHE 20 Ca 0.00 -0.36 -0.02 0.00 2.80 0.00 0.00 57.97 60.39 1lfg h PHE 20 Cb 0.02 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.16 1lfg h PHE 20 CO 0.00 1.73 -0.22 -0.56 -0.60 0.00 0.00 178.31 178.66 1lfg h GLN 21 N -0.03 -0.60 -0.01 1.51 3.07 -1.56 1.07 115.11 118.56 1lfg h GLN 21 Ca -0.40 0.04 0.00 0.00 0.09 0.00 0.00 58.65 58.39 1lfg h GLN 21 Cb 1.97 0.14 -0.00 0.00 0.08 0.00 0.00 27.48 29.67 1lfg h GLN 21 CO 0.08 -0.38 -0.01 1.87 0.09 0.00 0.00 178.83 180.48 1lfg n TRP 22 N -5.34 -0.00 -0.35 0.06 -0.00 -0.86 0.24 117.44 111.19 1lfg n TRP 22 Ca -0.11 0.01 0.11 0.00 -0.00 0.00 0.00 57.50 57.51 1lfg n TRP 22 Cb 0.27 -0.35 0.29 0.00 -0.00 0.00 0.00 31.31 31.52 1lfg n TRP 22 CO 0.00 0.00 0.00 0.37 -0.00 0.00 0.00 177.69 178.06 1lfg h GLN 23 N 0.00 0.75 -0.43 5.87 4.15 -1.03 -1.24 115.11 123.17 1lfg h GLN 23 Ca 0.00 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.37 1lfg h GLN 23 Cb 0.00 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.50 1lfg h GLN 23 CO -0.01 0.50 0.26 0.07 -1.93 0.00 0.00 178.83 177.71 1lfg h ARG 24 N 0.77 0.59 0.00 1.69 0.11 1.18 -2.80 114.38 115.92 1lfg h ARG 24 Ca 0.55 -0.06 -0.07 0.00 0.10 0.00 0.00 59.98 60.51 1lfg h ARG 24 Cb 0.81 -0.12 -0.01 0.00 1.11 0.00 0.00 29.97 31.76 1lfg h ARG 24 CO -0.37 0.44 -0.31 -0.91 0.10 0.00 0.00 179.97 178.92 1lfg h ASN 25 N 0.57 0.00 0.14 0.08 -0.26 -0.12 -3.01 115.58 112.98 1lfg h ASN 25 Ca 0.15 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.89 1lfg h ASN 25 Cb 0.01 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.27 1lfg h ASN 25 CO -0.03 0.31 -0.07 0.24 -1.06 0.00 0.00 177.43 176.83 1lfg h MET 26 N 0.00 -0.18 0.00 0.81 2.86 -0.99 -2.95 114.93 114.48 1lfg h MET 26 Ca -0.00 0.01 -0.10 0.00 -2.06 0.00 0.00 59.70 57.55 1lfg h MET 26 Cb 0.98 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.67 1lfg h MET 26 CO 0.04 0.09 -0.47 0.07 1.06 0.00 0.00 176.91 177.70 1lfg h ARG 27 N -0.43 0.00 -0.50 1.72 0.11 -1.63 0.40 114.38 114.04 1lfg h ARG 27 Ca -0.02 0.00 0.04 0.00 0.10 0.00 0.00 59.98 60.10 1lfg h ARG 27 Cb 0.34 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.40 1lfg h ARG 27 CO 0.03 0.47 0.34 -0.22 0.10 0.00 0.00 179.97 180.68 1lfg h LYS 28 N 0.00 0.51 -0.27 0.08 3.64 -1.51 -1.19 116.57 117.84 1lfg h LYS 28 Ca -0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1lfg h LYS 28 Cb 1.11 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 1lfg h LYS 28 CO 0.06 0.34 0.00 0.28 -2.27 0.00 0.00 179.45 177.86 1lfg n VAL 29 N -4.47 0.41 -1.53 2.00 0.31 -1.12 -4.96 118.33 108.96 1lfg n VAL 29 Ca 0.06 -0.71 -0.11 0.00 -0.01 0.00 0.00 64.34 63.57 1lfg n VAL 29 Cb 0.18 1.03 -0.04 0.00 -0.91 0.00 0.00 33.84 34.10 1lfg n VAL 29 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1lfg n ARG 30 N 1.18 -0.82 -1.45 5.55 5.12 -0.45 -5.03 116.66 120.76 1lfg n ARG 30 Ca 0.15 0.82 -0.30 0.00 -1.93 0.00 0.00 57.85 56.60 1lfg n ARG 30 Cb 0.52 -4.84 0.20 0.00 -1.16 0.00 0.00 32.46 27.18 1lfg n ARG 30 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1lfg s GLY 31 N -2.79 1.64 0.55 -0.13 0.00 0.14 -4.96 107.32 101.77 1lfg s GLY 31 Ca 0.00 -0.92 -0.21 0.00 0.00 0.00 0.00 44.72 43.59 1lfg s GLY 31 CO 0.00 -0.15 1.26 -4.14 0.00 0.00 0.00 173.10 170.07 1lfg s PRO 32 N -5.52 3.18 0.56 2.90 0.02 -1.26 -4.48 135.00 130.41 1lfg s PRO 32 Ca 0.70 1.99 -0.15 0.00 0.02 0.00 0.00 61.00 63.56 1lfg s PRO 32 Cb -0.09 -2.16 -0.06 0.00 0.02 0.00 0.00 34.50 32.21 1lfg s PRO 32 CO 0.55 -1.08 1.01 -1.25 -0.33 0.00 0.00 177.00 175.90 1lfg s PRO 33 N -3.03 3.70 -0.26 5.54 0.04 -1.26 -4.72 135.00 135.02 1lfg s PRO 33 Ca 0.72 0.94 -0.11 0.00 0.04 0.00 0.00 61.00 62.60 1lfg s PRO 33 Cb -0.34 -2.10 0.10 0.00 0.04 0.00 0.00 34.50 32.20 1lfg s PRO 33 CO 0.39 -0.48 0.58 0.54 0.04 0.00 0.00 177.00 178.08 1lfg s VAL 34 N -2.77 -0.56 0.07 -0.36 0.11 -1.26 -3.72 120.40 111.91 1lfg s VAL 34 Ca 0.59 0.05 0.06 0.00 -2.93 0.00 0.00 61.98 59.74 1lfg s VAL 34 Cb -0.11 -0.88 -0.04 0.00 -1.53 0.00 0.00 36.38 33.82 1lfg s VAL 34 CO 0.39 0.02 -0.09 -0.94 -3.33 0.00 0.00 175.10 171.15 1lfg s SER 35 N 2.34 4.46 0.07 3.54 1.04 -1.25 -4.45 113.70 119.45 1lfg s SER 35 Ca -0.07 -0.30 -0.04 0.00 0.48 0.00 0.00 55.95 56.02 1lfg s SER 35 Cb -0.10 -0.92 -0.05 0.00 0.10 0.00 0.00 66.02 65.05 1lfg s SER 35 CO -0.17 0.22 0.30 0.00 0.98 0.00 0.00 173.24 174.56 1lfg s ILE 37 N -1.49 1.32 0.05 0.00 1.09 -0.83 -4.94 121.20 116.40 1lfg s ILE 37 Ca 0.34 -1.28 0.09 0.00 -1.10 0.00 0.00 60.65 58.71 1lfg s ILE 37 Cb -0.13 -1.22 -0.03 0.00 -1.06 0.00 0.00 42.46 40.02 1lfg s ILE 37 CO 0.22 -0.08 -0.24 -0.75 -0.10 0.00 0.00 174.94 173.99 1lfg s LYS 38 N -1.57 1.86 0.36 2.79 2.36 -1.26 0.74 119.74 125.03 1lfg s LYS 38 Ca 0.02 -1.09 -0.17 0.00 -2.55 0.00 0.00 55.97 52.19 1lfg s LYS 38 Cb -0.09 -2.03 0.05 0.00 -1.05 0.00 0.00 37.83 34.71 1lfg s LYS 38 CO 0.02 0.52 0.80 1.03 1.55 0.00 0.00 175.35 179.28 1lfg s ARG 39 N -1.31 2.12 0.00 4.03 1.81 -0.87 -4.88 118.95 119.85 1lfg s ARG 39 Ca 0.12 -1.35 0.12 0.00 -1.72 0.00 0.00 55.73 52.90 1lfg s ARG 39 Cb -0.10 0.60 -0.03 0.00 -0.45 0.00 0.00 34.95 34.97 1lfg s ARG 39 CO 0.03 -0.99 0.64 -0.25 -0.68 0.00 0.00 175.30 174.05 1lfg n ASP 40 N -1.31 1.14 -3.50 0.23 8.00 -1.26 -3.19 116.55 116.67 1lfg n ASP 40 Ca -0.08 -1.07 -0.11 0.00 0.71 0.00 0.00 54.79 54.25 1lfg n ASP 40 Cb 0.60 0.59 -0.02 0.00 -0.02 0.00 0.00 41.12 42.27 1lfg n ASP 40 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1lfg s SER 41 N -1.62 -0.49 0.23 -2.24 1.04 -1.26 -4.85 113.70 104.51 1lfg s SER 41 Ca 0.08 -0.08 -0.07 0.00 0.48 0.00 0.00 55.95 56.37 1lfg s SER 41 Cb 0.09 0.57 0.39 0.00 0.10 0.00 0.00 66.02 67.18 1lfg s SER 41 CO 0.33 -0.95 1.71 -0.65 0.98 0.00 0.00 173.24 174.66 1lfg h PRO 42 N 2.00 0.32 -0.67 4.02 0.11 -1.94 0.38 132.00 136.23 1lfg h PRO 42 Ca -0.30 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.81 1lfg h PRO 42 Cb 1.29 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.29 1lfg h PRO 42 CO 0.35 0.21 0.44 0.82 -0.21 0.00 0.00 178.00 179.61 1lfg h ILE 43 N 0.33 1.14 -0.15 4.15 1.08 -1.99 0.21 117.51 122.29 1lfg h ILE 43 Ca 0.38 -0.30 -0.11 0.00 -0.39 0.00 0.00 64.86 64.44 1lfg h ILE 43 Cb 0.58 0.20 0.00 0.00 -3.07 0.00 0.00 36.82 34.53 1lfg h ILE 43 CO -0.43 0.16 -0.33 1.56 -0.69 0.00 0.00 178.15 178.42 1lfg h GLN 44 N 0.86 0.49 -0.66 2.37 4.20 -1.27 -2.44 115.11 118.67 1lfg h GLN 44 Ca 0.26 -0.32 -0.03 0.00 0.06 0.00 0.00 58.65 58.62 1lfg h GLN 44 Cb -0.03 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.77 1lfg h GLN 44 CO -0.06 0.93 0.31 0.00 -0.67 0.00 0.00 178.83 179.34 1lfg h ILE 46 N 0.91 1.16 -0.12 0.00 2.04 -0.52 -2.43 117.51 118.55 1lfg h ILE 46 Ca 0.22 -0.37 -0.03 0.00 1.00 0.00 0.00 64.86 65.68 1lfg h ILE 46 Cb 0.13 -0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 36.18 1lfg h ILE 46 CO -0.03 0.20 -0.04 1.56 0.00 0.00 0.00 178.15 179.84 1lfg h GLN 47 N 1.09 0.23 -0.77 2.37 4.20 -1.17 -1.76 115.11 119.29 1lfg h GLN 47 Ca 0.33 -0.10 0.16 0.00 0.06 0.00 0.00 58.65 59.11 1lfg h GLN 47 Cb -0.02 -0.01 -0.11 0.00 0.30 0.00 0.00 27.48 27.64 1lfg h GLN 47 CO -0.11 0.56 0.27 0.00 -0.67 0.00 0.00 178.83 178.88 1lfg h ALA 48 N 0.67 1.08 -0.07 3.87 0.00 -0.72 -2.56 119.26 121.53 1lfg h ALA 48 Ca 0.03 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1lfg h ALA 48 Cb 0.48 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 1lfg h ALA 48 CO 0.01 -0.29 0.05 0.82 0.00 0.00 0.00 179.25 179.84 1lfg h ILE 49 N 0.36 1.05 0.00 0.00 2.04 -1.33 0.89 117.51 120.52 1lfg h ILE 49 Ca 0.44 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 66.17 1lfg h ILE 49 Cb 0.74 0.99 -0.00 0.00 -0.74 0.00 0.00 36.82 37.81 1lfg h ILE 49 CO -0.47 0.04 -0.04 0.00 0.00 0.00 0.00 178.15 177.68 1lfg h ALA 50 N 0.99 1.11 -1.04 1.87 0.00 -0.91 -3.02 119.26 118.26 1lfg h ALA 50 Ca 0.03 -0.04 -0.55 0.00 0.00 0.00 0.00 54.91 54.35 1lfg h ALA 50 Cb 0.03 -0.01 -0.42 0.00 0.00 0.00 0.00 17.79 17.39 1lfg h ALA 50 CO -0.01 0.05 -0.80 -0.85 0.00 0.00 0.00 179.25 177.64 1lfg n GLU 51 N -3.30 3.42 -3.44 0.00 0.28 -1.10 -5.02 120.64 111.48 1lfg n GLU 51 Ca -0.02 -4.26 -0.20 0.00 -0.16 0.00 0.00 57.16 52.53 1lfg n GLU 51 Cb 0.19 -2.22 -0.04 0.00 1.43 0.00 0.00 31.44 30.81 1lfg n GLU 51 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1lfg n ASN 52 N -0.60 -1.37 -0.92 -1.84 3.02 -1.07 -4.83 115.26 107.65 1lfg n ASN 52 Ca 0.40 -0.33 0.07 0.00 -0.03 0.00 0.00 54.58 54.69 1lfg n ASN 52 Cb 0.84 -1.27 0.23 0.00 -0.61 0.00 0.00 39.78 38.97 1lfg n ASN 52 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1lfg n ARG 53 N -3.19 3.03 0.00 3.52 1.74 0.28 -4.95 116.66 117.09 1lfg n ARG 53 Ca 0.06 -2.43 0.00 0.00 -0.77 0.00 0.00 57.85 54.70 1lfg n ARG 53 Cb 0.47 -1.54 0.00 0.00 -1.02 0.00 0.00 32.46 30.37 1lfg n ARG 53 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1lfg n ALA 54 N 0.46 0.00 -0.03 7.54 0.00 -1.24 -4.88 120.51 122.36 1lfg n ALA 54 Ca 0.17 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.58 1lfg n ALA 54 Cb 0.63 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.04 1lfg n ALA 54 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1lfg n ASP 55 N 0.00 3.55 -3.68 0.00 8.00 0.78 -4.00 116.55 121.20 1lfg n ASP 55 Ca 0.00 -0.02 -0.10 0.00 0.71 0.00 0.00 54.79 55.38 1lfg n ASP 55 Cb 0.00 0.33 -0.05 0.00 -0.02 0.00 0.00 41.12 41.38 1lfg n ASP 55 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1lfg s ALA 56 N -2.14 -0.78 -0.26 2.24 0.00 -0.92 -4.43 121.76 115.47 1lfg s ALA 56 Ca -0.06 -0.16 -0.25 0.00 0.00 0.00 0.00 51.96 51.49 1lfg s ALA 56 Cb 0.02 0.63 0.09 0.00 0.00 0.00 0.00 23.12 23.86 1lfg s ALA 56 CO 0.20 -0.60 0.86 0.54 0.00 0.00 0.00 175.76 176.75 1lfg s VAL 57 N -3.75 0.00 -0.21 0.00 0.11 -1.23 -1.47 120.40 113.86 1lfg s VAL 57 Ca 0.03 0.00 -0.20 0.00 -2.93 0.00 0.00 61.98 58.88 1lfg s VAL 57 Cb 0.02 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.85 1lfg s VAL 57 CO -0.11 0.00 0.62 0.28 -3.33 0.00 0.00 175.10 172.55 1lfg s THR 58 N 0.19 5.02 0.28 5.04 -1.32 -1.26 -1.11 115.64 122.49 1lfg s THR 58 Ca 0.01 1.15 0.11 0.00 -1.21 0.00 0.00 61.69 61.74 1lfg s THR 58 Cb -0.05 -3.93 -0.05 0.00 -1.51 0.00 0.00 72.50 66.97 1lfg s THR 58 CO -0.01 0.10 -0.11 -0.76 -2.21 0.00 0.00 174.62 171.63 1lfg s LEU 59 N 1.99 2.86 0.59 9.08 1.43 -0.01 -4.94 118.68 129.69 1lfg s LEU 59 Ca 0.28 -0.87 -0.09 0.00 -1.03 0.00 0.00 54.13 52.41 1lfg s LEU 59 Cb -0.16 -1.37 -0.03 0.00 0.03 0.00 0.00 46.19 44.66 1lfg s LEU 59 CO 0.10 0.01 0.97 -0.62 0.23 0.00 0.00 176.35 177.03 1lfg s ASP 60 N -3.59 6.14 0.25 2.29 2.15 -1.26 -1.63 116.67 121.03 1lfg s ASP 60 Ca 0.31 1.23 -0.05 0.00 0.43 0.00 0.00 52.55 54.47 1lfg s ASP 60 Cb -0.05 -2.33 0.49 0.00 -0.30 0.00 0.00 42.92 40.73 1lfg s ASP 60 CO 0.17 -0.84 1.64 1.23 -0.17 0.00 0.00 175.17 177.19 1lfg h GLY 61 N -0.20 0.94 0.92 2.66 0.00 -1.85 0.15 103.07 105.69 1lfg h GLY 61 Ca -0.45 0.09 0.11 0.00 0.00 0.00 0.00 47.33 47.08 1lfg h GLY 61 CO 0.62 -0.31 0.45 -1.33 0.00 0.00 0.00 176.54 175.97 1lfg h GLY 62 N 0.12 0.69 0.91 4.60 0.00 -1.91 -0.48 103.07 107.00 1lfg h GLY 62 Ca 0.44 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1lfg h GLY 62 CO -0.67 0.11 -1.04 0.69 0.00 0.00 0.00 176.54 175.63 1lfg n PHE 63 N -4.48 0.79 -0.18 5.60 3.01 0.24 -3.13 117.46 119.31 1lfg n PHE 63 Ca 0.11 0.23 -0.09 0.00 1.01 0.00 0.00 57.45 58.72 1lfg n PHE 63 Cb 0.40 -0.85 0.01 0.00 -0.01 0.00 0.00 39.48 39.03 1lfg n PHE 63 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1lfg h ILE 64 N 0.00 1.24 0.06 4.37 2.04 0.72 0.47 117.51 126.41 1lfg h ILE 64 Ca 0.00 -0.83 0.03 0.00 1.00 0.00 0.00 64.86 65.05 1lfg h ILE 64 Cb 0.95 0.80 -0.05 0.00 -0.74 0.00 0.00 36.82 37.78 1lfg h ILE 64 CO 0.00 0.30 -0.39 0.22 0.00 0.00 0.00 178.15 178.28 1lfg h TYR 65 N 0.71 -1.10 -0.52 1.37 3.20 -1.30 0.13 116.97 119.46 1lfg h TYR 65 Ca 0.16 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.04 1lfg h TYR 65 Cb 0.32 0.48 -0.03 0.00 1.54 0.00 0.00 36.73 39.04 1lfg h TYR 65 CO 0.02 -0.48 0.21 0.93 -1.64 0.00 0.00 178.16 177.20 1lfg h GLU 66 N -0.59 0.75 0.00 1.82 4.39 -1.48 -1.67 114.58 117.80 1lfg h GLU 66 Ca 0.04 -0.11 -0.10 0.00 0.34 0.00 0.00 59.36 59.53 1lfg h GLU 66 Cb 0.64 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 1lfg h GLU 66 CO -0.27 0.61 -0.48 0.00 -1.16 0.00 0.00 179.01 177.71 1lfg h ALA 67 N 1.49 1.08 0.00 3.43 0.00 -0.46 -3.00 119.26 121.80 1lfg h ALA 67 Ca 0.18 -0.44 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 1lfg h ALA 67 Cb 0.14 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1lfg h ALA 67 CO -0.02 0.60 -0.08 0.78 0.00 0.00 0.00 179.25 180.54 1lfg h GLY 68 N 1.71 0.00 -1.79 0.00 0.00 0.20 -0.82 103.07 102.38 1lfg h GLY 68 Ca -0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 1lfg h GLY 68 CO 0.06 0.00 0.39 1.08 0.00 0.00 0.00 176.54 178.08 1lfg s LEU 69 N -6.26 3.42 0.71 3.11 1.43 -1.07 -3.72 118.68 116.29 1lfg s LEU 69 Ca 0.06 2.17 -0.14 0.00 -1.03 0.00 0.00 54.13 55.18 1lfg s LEU 69 Cb 0.06 -4.57 0.03 0.00 0.03 0.00 0.00 46.19 41.74 1lfg s LEU 69 CO 0.66 -1.80 1.14 0.00 0.23 0.00 0.00 176.35 176.58 1lfg s ALA 70 N -2.11 2.27 -1.68 4.21 0.00 -1.26 -1.26 121.76 121.94 1lfg s ALA 70 Ca 0.71 0.64 0.13 0.00 0.00 0.00 0.00 51.96 53.44 1lfg s ALA 70 Cb -0.24 -3.37 0.42 0.00 0.00 0.00 0.00 23.12 19.92 1lfg s ALA 70 CO 0.41 -1.61 1.31 -0.35 0.00 0.00 0.00 175.76 175.52 1lfg n PRO 71 N -2.71 2.33 -0.07 0.00 -0.04 -1.26 -4.83 135.00 128.41 1lfg n PRO 71 Ca 0.11 -1.67 -0.13 0.00 -0.04 0.00 0.00 63.50 61.77 1lfg n PRO 71 Cb 0.51 -1.48 -0.11 0.00 -0.04 0.00 0.00 33.50 32.38 1lfg n PRO 71 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1lfg h TYR 72 N 2.57 0.00 -6.28 0.54 0.05 -1.44 -3.49 116.97 108.92 1lfg h TYR 72 Ca 0.00 0.00 -0.49 0.00 0.05 0.00 0.00 58.73 58.29 1lfg h TYR 72 Cb 0.78 0.00 -0.11 0.00 1.01 0.00 0.00 36.73 38.40 1lfg h TYR 72 CO 0.38 0.94 -0.74 1.63 -1.05 0.00 0.00 178.16 179.31 1lfg n LYS 73 N -4.60 -4.14 -1.66 4.88 4.01 -0.75 -4.82 118.16 111.07 1lfg n LYS 73 Ca -0.12 0.49 -0.30 0.00 -0.51 0.00 0.00 58.31 57.86 1lfg n LYS 73 Cb 0.45 -5.28 0.07 0.00 -0.51 0.00 0.00 35.03 29.76 1lfg n LYS 73 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1lfg s LEU 74 N -7.11 2.75 -0.02 -0.35 1.43 -0.33 -3.75 118.68 111.30 1lfg s LEU 74 Ca 0.64 1.29 0.02 0.00 -1.03 0.00 0.00 54.13 55.05 1lfg s LEU 74 Cb -0.34 -3.99 0.00 0.00 0.03 0.00 0.00 46.19 41.90 1lfg s LEU 74 CO 0.79 -1.71 -0.08 -0.60 0.23 0.00 0.00 176.35 174.98 1lfg s ARG 75 N -5.21 0.86 0.04 1.70 3.52 -0.16 -4.13 118.95 115.56 1lfg s ARG 75 Ca 0.60 -0.28 -0.30 0.00 -0.13 0.00 0.00 55.73 55.61 1lfg s ARG 75 Cb -0.13 -0.81 -0.07 0.00 -1.56 0.00 0.00 34.95 32.37 1lfg s ARG 75 CO 0.54 0.12 1.51 -2.14 -0.81 0.00 0.00 175.30 174.51 1lfg s PRO 76 N 0.14 4.25 -0.06 5.12 0.02 -1.26 -0.41 135.00 142.79 1lfg s PRO 76 Ca -0.02 2.14 0.12 0.00 0.02 0.00 0.00 61.00 63.25 1lfg s PRO 76 Cb -0.07 -3.56 -0.17 0.00 0.02 0.00 0.00 34.50 30.72 1lfg s PRO 76 CO 0.00 -0.64 0.18 1.33 -0.33 0.00 0.00 177.00 177.54 1lfg n VAL 77 N 4.64 0.34 -3.75 3.83 0.24 -0.60 -4.77 118.33 118.26 1lfg n VAL 77 Ca 0.14 -0.37 -0.13 0.00 -2.04 0.00 0.00 64.34 61.94 1lfg n VAL 77 Cb 0.42 -0.17 -0.13 0.00 -1.47 0.00 0.00 33.84 32.49 1lfg n VAL 77 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1lfg s ALA 78 N -2.62 -0.55 -0.15 2.33 0.00 -1.18 -1.61 121.76 117.98 1lfg s ALA 78 Ca -0.05 0.89 -0.06 0.00 0.00 0.00 0.00 51.96 52.74 1lfg s ALA 78 Cb 0.06 -0.56 -0.04 0.00 0.00 0.00 0.00 23.12 22.58 1lfg s ALA 78 CO 0.50 -0.17 0.07 0.00 0.00 0.00 0.00 175.76 176.16 1lfg s ALA 79 N 0.96 3.50 0.60 0.00 0.00 0.14 -1.01 121.76 125.96 1lfg s ALA 79 Ca -0.07 -0.73 -0.18 0.00 0.00 0.00 0.00 51.96 50.98 1lfg s ALA 79 Cb -0.08 -1.85 -0.03 0.00 0.00 0.00 0.00 23.12 21.16 1lfg s ALA 79 CO -0.06 0.36 1.20 -1.21 0.00 0.00 0.00 175.76 176.05 1lfg s GLU 80 N -0.20 2.93 -0.10 0.00 2.02 -0.33 -0.94 118.70 122.09 1lfg s GLU 80 Ca 0.08 1.79 0.02 0.00 0.02 0.00 0.00 54.97 56.89 1lfg s GLU 80 Cb -0.12 -1.93 -0.01 0.00 0.10 0.00 0.00 34.13 32.17 1lfg s GLU 80 CO 0.01 -1.23 -0.17 0.08 0.02 0.00 0.00 175.26 173.97 1lfg s VAL 81 N -1.66 2.72 0.21 2.63 1.01 -0.90 -4.58 120.40 119.82 1lfg s VAL 81 Ca 0.77 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.95 1lfg s VAL 81 Cb -0.30 -2.09 0.00 0.00 0.00 0.00 0.00 36.38 34.00 1lfg s VAL 81 CO 0.34 0.55 0.04 -1.22 0.00 0.00 0.00 175.10 174.81 1lfg n TYR 82 N 3.17 0.10 -2.19 5.22 4.01 0.59 -0.93 117.16 127.14 1lfg n TYR 82 Ca -0.18 -1.02 0.00 0.00 -0.16 0.00 0.00 57.90 56.54 1lfg n TYR 82 Cb 0.53 -0.15 0.00 0.00 -0.31 0.00 0.00 39.34 39.41 1lfg n TYR 82 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1lfg n GLY 83 N 2.44 0.48 3.36 2.72 0.00 -1.26 -0.94 105.19 111.99 1lfg n GLY 83 Ca -0.07 -1.02 -0.19 0.00 0.00 0.00 0.00 46.02 44.75 1lfg n GLY 83 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1lfg s THR 84 N 0.00 0.66 -0.34 2.61 -4.23 -1.22 -4.82 115.64 108.31 1lfg s THR 84 Ca 0.00 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 58.68 1lfg s THR 84 Cb 0.00 -2.63 0.17 0.00 1.34 0.00 0.00 72.50 71.38 1lfg s THR 84 CO 0.00 0.00 1.53 -0.62 -0.54 0.00 0.00 174.62 174.99 1lfg n GLU 85 N -0.56 0.11 -0.07 3.99 -0.58 -1.26 -1.58 120.64 120.69 1lfg n GLU 85 Ca -0.01 0.61 -0.03 0.00 -0.42 0.00 0.00 57.16 57.31 1lfg n GLU 85 Cb 0.66 -1.88 -0.16 0.00 -0.57 0.00 0.00 31.44 29.49 1lfg n GLU 85 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1lfg n ARG 86 N -2.11 0.68 -3.21 3.49 3.00 -1.26 -4.63 116.66 112.61 1lfg n ARG 86 Ca -0.01 -0.06 -0.24 0.00 -0.01 0.00 0.00 57.85 57.53 1lfg n ARG 86 Cb 0.03 -1.53 -0.07 0.00 0.00 0.00 0.00 32.46 30.90 1lfg n ARG 86 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 1lfg n GLN 87 N -2.60 0.91 -2.35 5.56 6.02 -0.61 -5.11 117.38 119.20 1lfg n GLN 87 Ca -0.24 -3.38 -0.33 0.00 -0.01 0.00 0.00 57.00 53.05 1lfg n GLN 87 Cb 0.97 -1.35 -0.02 0.00 1.02 0.00 0.00 30.24 30.86 1lfg n GLN 87 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1lfg s PRO 88 N -1.40 3.73 -0.04 -1.09 0.04 -0.94 -3.36 135.00 131.94 1lfg s PRO 88 Ca 0.36 1.14 -0.11 0.00 0.04 0.00 0.00 61.00 62.43 1lfg s PRO 88 Cb 0.18 -2.10 0.02 0.00 0.04 0.00 0.00 34.50 32.64 1lfg s PRO 88 CO -0.10 -0.46 0.24 -0.98 0.04 0.00 0.00 177.00 175.74 1lfg s ARG 89 N -3.80 0.49 -0.52 4.56 1.70 -0.12 -4.97 118.95 116.29 1lfg s ARG 89 Ca 0.63 -0.05 0.02 0.00 -0.47 0.00 0.00 55.73 55.85 1lfg s ARG 89 Cb -0.13 0.22 0.44 0.00 -0.57 0.00 0.00 34.95 34.91 1lfg s ARG 89 CO 0.29 -0.11 1.63 0.25 -1.08 0.00 0.00 175.30 176.27 1lfg n THR 90 N 1.91 3.09 -3.94 4.99 -2.24 -1.26 -0.30 114.28 116.54 1lfg n THR 90 Ca -0.19 -3.75 -0.09 0.00 -2.27 0.00 0.00 64.05 57.75 1lfg n THR 90 Cb 0.57 -1.17 -0.06 0.00 -2.10 0.00 0.00 70.33 67.57 1lfg n THR 90 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 1lfg s HIS 91 N -3.74 0.31 0.25 4.78 0.00 -1.26 -1.94 115.29 113.70 1lfg s HIS 91 Ca 0.57 -0.67 -0.10 0.00 -3.00 0.00 0.00 55.06 51.86 1lfg s HIS 91 Cb 0.45 0.10 -0.01 0.00 -4.00 0.00 0.00 32.58 29.13 1lfg s HIS 91 CO -0.05 -0.85 0.43 1.52 -1.00 0.00 0.00 174.74 174.79 1lfg s TYR 92 N -3.97 0.55 -0.03 0.38 1.13 0.24 -4.79 117.35 110.86 1lfg s TYR 92 Ca 0.18 -0.88 0.02 0.00 -1.41 0.00 0.00 57.07 54.98 1lfg s TYR 92 Cb 0.01 0.06 -0.03 0.00 -1.10 0.00 0.00 41.96 40.90 1lfg s TYR 92 CO 0.03 -0.97 -0.07 0.71 -2.51 0.00 0.00 175.55 172.74 1lfg s TYR 93 N -3.90 2.90 -0.36 -3.49 1.51 -1.26 0.41 117.35 113.16 1lfg s TYR 93 Ca 0.26 -0.01 -0.18 0.00 -1.01 0.00 0.00 57.07 56.12 1lfg s TYR 93 Cb 0.00 -1.66 -0.00 0.00 -0.11 0.00 0.00 41.96 40.19 1lfg s TYR 93 CO 0.11 0.34 0.49 0.00 -1.11 0.00 0.00 175.55 175.39 1lfg s ALA 94 N -0.90 3.47 0.41 3.71 0.00 -0.73 -1.90 121.76 125.82 1lfg s ALA 94 Ca 0.15 -1.08 0.07 0.00 0.00 0.00 0.00 51.96 51.09 1lfg s ALA 94 Cb -0.11 -3.01 -0.06 0.00 0.00 0.00 0.00 23.12 19.94 1lfg s ALA 94 CO 0.04 -1.25 0.14 0.14 0.00 0.00 0.00 175.76 174.83 1lfg s VAL 95 N 2.35 2.22 -0.22 0.00 -7.23 -0.25 0.36 120.40 117.62 1lfg s VAL 95 Ca 0.17 -1.76 0.01 0.00 -1.81 0.00 0.00 61.98 58.60 1lfg s VAL 95 Cb -0.16 -2.98 0.05 0.00 0.56 0.00 0.00 36.38 33.85 1lfg s VAL 95 CO 0.13 0.00 -0.11 0.00 -0.31 0.00 0.00 175.10 174.82 1lfg s ALA 96 N -2.63 2.17 -0.13 1.32 0.00 -1.26 -2.91 121.76 118.31 1lfg s ALA 96 Ca 0.39 -1.38 -0.06 0.00 0.00 0.00 0.00 51.96 50.92 1lfg s ALA 96 Cb 0.05 -1.38 -0.04 0.00 0.00 0.00 0.00 23.12 21.76 1lfg s ALA 96 CO 0.21 -0.93 0.08 0.08 0.00 0.00 0.00 175.76 175.19 1lfg s VAL 97 N 1.31 4.94 0.14 0.00 1.01 -0.03 -0.01 120.40 127.76 1lfg s VAL 97 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 61.98 61.94 1lfg s VAL 97 Cb -0.17 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 1lfg s VAL 97 CO -0.07 0.56 0.07 0.68 0.00 0.00 0.00 175.10 176.33 1lfg s VAL 98 N -0.47 0.08 -0.03 2.92 -7.23 -0.09 0.14 120.40 115.74 1lfg s VAL 98 Ca 0.10 -1.92 -0.15 0.00 -1.81 0.00 0.00 61.98 58.20 1lfg s VAL 98 Cb -0.12 -2.12 -0.05 0.00 0.56 0.00 0.00 36.38 34.65 1lfg s VAL 98 CO 0.02 -0.39 0.40 -0.54 -0.31 0.00 0.00 175.10 174.28 1lfg s LYS 99 N -4.07 3.98 0.77 4.82 1.02 -1.26 -0.48 119.74 124.52 1lfg s LYS 99 Ca 0.27 0.38 -0.16 0.00 0.02 0.00 0.00 55.97 56.48 1lfg s LYS 99 Cb 0.07 -3.26 -0.05 0.00 -0.52 0.00 0.00 37.83 34.08 1lfg s LYS 99 CO 0.03 0.60 0.30 1.63 -0.92 0.00 0.00 175.35 177.00 1lfg n LYS 100 N 2.16 0.14 0.00 1.68 5.02 0.17 -3.62 118.16 123.70 1lfg n LYS 100 Ca -0.13 0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 1lfg n LYS 100 Cb 0.52 -1.67 0.00 0.00 -0.02 0.00 0.00 35.03 33.87 1lfg n LYS 100 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1lfg n GLY 101 N 1.90 2.73 3.95 0.72 0.00 -1.26 -5.00 105.19 108.23 1lfg n GLY 101 Ca 0.08 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 1lfg n GLY 101 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1lfg s GLY 102 N -2.53 2.09 -0.45 -0.02 0.00 -1.24 -5.09 107.32 100.09 1lfg s GLY 102 Ca 0.00 -1.70 0.07 0.00 0.00 0.00 0.00 44.72 43.09 1lfg s GLY 102 CO 0.00 -1.79 0.67 1.44 0.00 0.00 0.00 173.10 173.42 1lfg n SER 103 N -1.90 -1.53 -4.04 1.64 7.64 -1.26 -5.08 113.62 109.09 1lfg n SER 103 Ca 0.06 -2.93 -0.19 0.00 1.01 0.00 0.00 58.87 56.82 1lfg n SER 103 Cb 0.63 0.62 -0.15 0.00 -1.01 0.00 0.00 64.21 64.30 1lfg n SER 103 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1lfg s PHE 104 N -0.07 0.90 0.18 1.43 -0.12 -1.26 -5.17 117.98 113.86 1lfg s PHE 104 Ca 0.33 -0.17 0.03 0.00 -0.05 0.00 0.00 56.93 57.07 1lfg s PHE 104 Cb 0.16 -0.58 0.03 0.00 -0.63 0.00 0.00 43.02 42.00 1lfg s PHE 104 CO -0.17 -0.02 0.21 1.04 -0.05 0.00 0.00 175.22 176.24 1lfg n GLN 105 N 2.84 0.98 0.01 1.99 1.13 -1.26 -4.97 117.38 118.11 1lfg n GLN 105 Ca -0.14 -0.99 0.11 0.00 -1.94 0.00 0.00 57.00 54.05 1lfg n GLN 105 Cb 0.57 -0.02 0.49 0.00 0.11 0.00 0.00 30.24 31.39 1lfg n GLN 105 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 1lfg n LEU 106 N 0.00 0.10 -0.06 1.08 7.94 -1.26 -3.26 117.00 121.53 1lfg n LEU 106 Ca 0.03 0.51 0.12 0.00 -1.11 0.00 0.00 56.01 55.56 1lfg n LEU 106 Cb 0.19 -0.49 0.15 0.00 0.53 0.00 0.00 43.42 43.80 1lfg n LEU 106 CO 0.12 -0.13 0.34 -0.46 -1.11 0.00 0.00 177.39 176.15 1lfg n ASN 107 N -1.59 0.79 -2.58 1.96 2.04 -1.26 -4.44 115.26 110.19 1lfg n ASN 107 Ca 0.05 -0.61 -0.29 0.00 -0.44 0.00 0.00 54.58 53.30 1lfg n ASN 107 Cb 0.28 0.45 0.00 0.00 -2.53 0.00 0.00 39.78 37.98 1lfg n ASN 107 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 1lfg n GLU 108 N -1.30 3.36 -0.00 -3.83 1.02 -1.20 -4.78 120.64 113.91 1lfg n GLU 108 Ca 0.06 -4.43 0.09 0.00 -0.02 0.00 0.00 57.16 52.86 1lfg n GLU 108 Cb 0.34 -2.25 -0.11 0.00 -0.02 0.00 0.00 31.44 29.40 1lfg n GLU 108 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1lfg n LEU 109 N -0.47 0.55 -4.57 -4.62 4.77 -1.26 -4.70 117.00 106.71 1lfg n LEU 109 Ca 0.40 -0.33 -0.52 0.00 -0.03 0.00 0.00 56.01 55.52 1lfg n LEU 109 Cb 0.59 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.62 1lfg n LEU 109 CO 0.35 0.14 0.80 1.67 -1.33 0.00 0.00 177.39 179.02 1lfg n GLN 110 N -1.65 0.95 -0.68 3.23 7.27 -1.26 -1.12 117.38 124.12 1lfg n GLN 110 Ca 0.01 0.34 0.00 0.00 0.07 0.00 0.00 57.00 57.42 1lfg n GLN 110 Cb 0.34 -1.92 0.00 0.00 2.41 0.00 0.00 30.24 31.07 1lfg n GLN 110 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1lfg n GLY 111 N 2.25 1.09 3.94 1.69 0.00 0.26 -4.97 105.19 109.45 1lfg n GLY 111 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1lfg n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lfg s LEU 112 N 0.00 2.73 -0.02 0.99 1.02 -0.27 -3.71 118.68 119.42 1lfg s LEU 112 Ca 0.00 0.23 0.03 0.00 0.02 0.00 0.00 54.13 54.41 1lfg s LEU 112 Cb 0.00 -2.31 -0.03 0.00 0.02 0.00 0.00 46.19 43.87 1lfg s LEU 112 CO 0.00 -2.64 -0.10 -0.54 0.02 0.00 0.00 176.35 173.10 1lfg s LYS 113 N -5.82 2.53 0.08 1.70 1.02 -1.26 -1.52 119.74 116.47 1lfg s LYS 113 Ca 0.73 -0.70 0.08 0.00 0.02 0.00 0.00 55.97 56.09 1lfg s LYS 113 Cb -0.04 -2.46 -0.03 0.00 -0.52 0.00 0.00 37.83 34.78 1lfg s LYS 113 CO 0.52 0.61 -0.20 -1.54 -0.92 0.00 0.00 175.35 173.83 1lfg s SER 114 N -1.13 2.41 -0.16 2.83 1.04 -0.27 0.78 113.70 119.18 1lfg s SER 114 Ca 0.15 -0.63 -0.01 0.00 0.48 0.00 0.00 55.95 55.93 1lfg s SER 114 Cb -0.11 -0.15 -0.01 0.00 0.10 0.00 0.00 66.02 65.85 1lfg s SER 114 CO 0.04 0.07 -0.10 0.00 0.98 0.00 0.00 173.24 174.23 1lfg s HIS 116 N 0.79 2.22 0.14 0.00 3.76 -0.79 -1.88 115.29 119.54 1lfg s HIS 116 Ca -0.04 -0.37 0.12 0.00 -0.15 0.00 0.00 55.06 54.63 1lfg s HIS 116 Cb -0.15 -1.05 0.24 0.00 1.11 0.00 0.00 32.58 32.73 1lfg s HIS 116 CO 0.01 0.55 1.53 1.79 -0.85 0.00 0.00 174.74 177.77 1lfg h THR 117 N 2.86 1.29 0.00 1.30 1.35 -1.73 -3.42 112.91 114.55 1lfg h THR 117 Ca -0.43 -2.34 0.00 0.00 -0.55 0.00 0.00 66.41 63.09 1lfg h THR 117 Cb 1.23 2.32 0.00 0.00 -1.73 0.00 0.00 68.15 69.97 1lfg h THR 117 CO 0.53 0.63 0.00 0.61 -0.25 0.00 0.00 175.52 177.04 1lfg n GLY 118 N 0.69 2.43 3.75 5.82 0.00 -1.26 -1.30 105.19 115.31 1lfg n GLY 118 Ca -0.00 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 44.70 1lfg n GLY 118 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1lfg s LEU 119 N 0.00 4.39 0.00 0.99 2.96 0.16 -3.40 118.68 123.78 1lfg s LEU 119 Ca 0.00 2.71 0.00 0.00 -0.22 0.00 0.00 54.13 56.62 1lfg s LEU 119 Cb 0.00 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 43.06 1lfg s LEU 119 CO 0.00 -0.69 0.00 0.54 -1.32 0.00 0.00 176.35 174.88 1lfg n ARG 120 N 1.95 -0.47 -3.25 1.98 3.00 -1.26 -4.98 116.66 113.62 1lfg n ARG 120 Ca 0.05 0.12 -0.34 0.00 -0.01 0.00 0.00 57.85 57.67 1lfg n ARG 120 Cb 0.40 -3.69 -0.06 0.00 0.00 0.00 0.00 32.46 29.11 1lfg n ARG 120 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 1lfg s ARG 121 N -0.71 3.99 0.02 5.56 0.52 -1.22 -4.04 118.95 123.08 1lfg s ARG 121 Ca 0.00 0.56 -0.07 0.00 -0.52 0.00 0.00 55.73 55.70 1lfg s ARG 121 Cb 0.00 -2.69 -0.03 0.00 0.52 0.00 0.00 34.95 32.76 1lfg s ARG 121 CO 0.00 0.32 1.11 1.15 0.02 0.00 0.00 175.30 177.90 1lfg h THR 122 N 2.31 0.00 0.00 0.02 2.02 -1.94 0.43 112.91 115.76 1lfg h THR 122 Ca -0.48 0.00 -0.21 0.00 0.77 0.00 0.00 66.41 66.50 1lfg h THR 122 Cb 1.18 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.56 1lfg h THR 122 CO 0.66 0.00 -0.98 0.00 0.37 0.00 0.00 175.52 175.57 1lfg h ALA 123 N -1.28 0.38 0.00 6.16 0.00 -1.91 0.66 119.26 123.27 1lfg h ALA 123 Ca 0.00 -0.89 -0.04 0.00 0.00 0.00 0.00 54.91 53.98 1lfg h ALA 123 Cb 0.14 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1lfg h ALA 123 CO -0.07 1.21 -0.79 0.78 0.00 0.00 0.00 179.25 180.38 1lfg h GLY 124 N 2.89 0.00 0.00 0.00 0.00 -1.59 -3.37 103.07 101.01 1lfg h GLY 124 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1lfg h GLY 124 CO 0.13 0.00 0.00 1.87 0.00 0.00 0.00 176.54 178.54 1lfg n TRP 125 N -2.88 0.00 -0.32 5.60 -0.00 0.13 -4.22 117.44 115.76 1lfg n TRP 125 Ca -0.01 0.00 0.01 0.00 -0.00 0.00 0.00 57.50 57.51 1lfg n TRP 125 Cb 0.62 0.06 0.08 0.00 -0.00 0.00 0.00 31.31 32.07 1lfg n TRP 125 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 177.69 176.78 1lfg h ASN 126 N 0.00 -1.06 0.32 5.87 2.35 -0.99 -2.09 115.58 119.97 1lfg h ASN 126 Ca 0.00 0.28 -0.02 0.00 -0.55 0.00 0.00 56.30 56.01 1lfg h ASN 126 Cb 0.00 0.62 0.00 0.00 0.05 0.00 0.00 38.32 38.99 1lfg h ASN 126 CO 0.00 -0.30 -0.15 0.58 -1.65 0.00 0.00 177.43 175.91 1lfg h VAL 127 N -0.02 0.63 -0.75 2.81 2.07 -1.09 -1.83 116.25 118.06 1lfg h VAL 127 Ca 0.38 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1lfg h VAL 127 Cb 0.62 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 31.29 1lfg h VAL 127 CO -0.91 0.12 0.48 1.55 0.02 0.00 0.00 177.57 178.83 1lfg h PRO 128 N -0.84 1.00 -0.22 1.57 0.13 -1.74 -2.10 132.00 129.80 1lfg h PRO 128 Ca -0.04 -0.07 -0.05 0.00 -0.87 0.00 0.00 66.00 64.96 1lfg h PRO 128 Cb 0.52 -0.22 -0.01 0.00 0.13 0.00 0.00 31.00 31.43 1lfg h PRO 128 CO 0.07 0.68 -0.06 0.82 -0.23 0.00 0.00 178.00 179.28 1lfg h ILE 129 N 1.02 1.29 -0.54 -3.56 1.08 -1.48 -1.91 117.51 113.39 1lfg h ILE 129 Ca 0.27 -1.06 -0.04 0.00 -0.39 0.00 0.00 64.86 63.65 1lfg h ILE 129 Cb -0.09 1.52 -0.03 0.00 -3.07 0.00 0.00 36.82 35.16 1lfg h ILE 129 CO -0.06 0.32 0.19 1.23 -0.69 0.00 0.00 178.15 179.15 1lfg h GLY 130 N 0.17 0.86 1.69 5.37 0.00 -1.23 -0.09 103.07 109.83 1lfg h GLY 130 Ca 0.06 -0.45 -0.08 0.00 0.00 0.00 0.00 47.33 46.86 1lfg h GLY 130 CO 0.02 0.43 -0.20 -0.84 0.00 0.00 0.00 176.54 175.95 1lfg h THR 131 N 0.79 1.24 0.00 4.70 2.02 -1.18 -3.18 112.91 117.29 1lfg h THR 131 Ca 0.18 -1.09 -0.01 0.00 0.77 0.00 0.00 66.41 66.27 1lfg h THR 131 Cb 0.20 1.30 -0.00 0.00 -1.74 0.00 0.00 68.15 67.91 1lfg h THR 131 CO -0.01 0.34 -0.64 -0.07 0.37 0.00 0.00 175.52 175.51 1lfg h LEU 132 N 0.34 0.00 -0.75 2.58 3.38 -0.90 -3.40 115.31 116.56 1lfg h LEU 132 Ca 0.06 0.00 0.20 0.00 0.09 0.00 0.00 57.88 58.23 1lfg h LEU 132 Cb 0.55 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.16 1lfg h LEU 132 CO 0.04 0.03 -0.00 -1.14 0.09 0.00 0.00 178.44 177.45 1lfg n ARG 133 N -2.85 -0.06 -0.30 1.13 0.63 -0.09 -0.62 116.66 114.50 1lfg n ARG 133 Ca 0.01 1.13 0.15 0.00 -0.92 0.00 0.00 57.85 58.22 1lfg n ARG 133 Cb 0.56 -1.78 0.41 0.00 0.45 0.00 0.00 32.46 32.10 1lfg n ARG 133 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 1lfg h PRO 134 N 0.00 0.59 0.00 -0.14 0.11 -1.85 -2.07 132.00 128.65 1lfg h PRO 134 Ca 0.44 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.52 1lfg h PRO 134 Cb 0.90 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.87 1lfg h PRO 134 CO -0.71 0.39 -0.03 0.74 -0.21 0.00 0.00 178.00 178.18 1lfg h PHE 135 N 0.61 0.00 -0.01 0.65 0.04 -1.20 -3.39 116.94 113.65 1lfg h PHE 135 Ca 0.52 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.29 1lfg h PHE 135 Cb 1.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.15 1lfg h PHE 135 CO -0.00 0.00 -0.08 1.28 -0.60 0.00 0.00 178.31 178.90 1lfg n LEU 136 N -2.38 0.59 -4.15 1.54 4.77 -0.78 -4.94 117.00 111.65 1lfg n LEU 136 Ca 0.05 -0.09 -0.35 0.00 -0.03 0.00 0.00 56.01 55.59 1lfg n LEU 136 Cb 0.45 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.38 1lfg n LEU 136 CO 0.31 0.10 -0.05 0.59 -1.33 0.00 0.00 177.39 177.01 1lfg n ASN 137 N -0.77 -2.99 -4.79 -1.43 5.03 -1.26 -4.84 115.26 104.21 1lfg n ASN 137 Ca 0.16 -0.95 -0.36 0.00 0.87 0.00 0.00 54.58 54.31 1lfg n ASN 137 Cb 0.27 -2.48 -0.07 0.00 -1.02 0.00 0.00 39.78 36.48 1lfg n ASN 137 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 1lfg s TRP 138 N -3.19 3.63 -0.68 3.10 -0.00 -1.26 -4.94 118.94 115.60 1lfg s TRP 138 Ca 0.71 1.75 0.25 0.00 -0.00 0.00 0.00 56.10 58.80 1lfg s TRP 138 Cb -0.39 -2.90 0.47 0.00 -0.00 0.00 0.00 33.47 30.64 1lfg s TRP 138 CO 0.87 0.16 1.43 2.41 -0.00 0.00 0.00 176.95 181.83 1lfg n THR 139 N 0.36 0.39 0.00 5.86 -1.04 -1.26 -4.91 114.28 113.68 1lfg n THR 139 Ca 0.03 -0.26 0.00 0.00 -2.04 0.00 0.00 64.05 61.77 1lfg n THR 139 Cb 0.51 -0.22 0.00 0.00 -1.82 0.00 0.00 70.33 68.80 1lfg n THR 139 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1lfg n GLY 140 N 1.34 -0.02 3.64 3.41 0.00 -1.26 -4.91 105.19 107.39 1lfg n GLY 140 Ca 0.04 -1.93 -0.30 0.00 0.00 0.00 0.00 46.02 43.83 1lfg n GLY 140 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1lfg s PRO 141 N -1.17 0.64 0.00 1.61 0.04 -1.26 -2.68 135.00 132.19 1lfg s PRO 141 Ca 0.00 1.08 0.19 0.00 0.04 0.00 0.00 61.00 62.31 1lfg s PRO 141 Cb 0.00 -1.72 0.96 0.00 0.04 0.00 0.00 34.50 33.78 1lfg s PRO 141 CO 0.00 -2.74 1.60 -0.35 0.04 0.00 0.00 177.00 175.55 1lfg n PRO 142 N -4.26 0.24 -2.03 0.56 -0.04 -1.26 -4.99 135.00 123.22 1lfg n PRO 142 Ca 0.08 0.11 -0.42 0.00 -0.04 0.00 0.00 63.50 63.22 1lfg n PRO 142 Cb 0.54 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.47 1lfg n PRO 142 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1lfg s GLU 143 N -2.62 4.21 0.54 0.54 2.12 -1.09 -4.94 118.70 117.46 1lfg s GLU 143 Ca 0.17 2.18 -0.22 0.00 0.36 0.00 0.00 54.97 57.47 1lfg s GLU 143 Cb 0.13 -3.74 -0.05 0.00 0.26 0.00 0.00 34.13 30.73 1lfg s GLU 143 CO 0.30 -0.74 1.37 -2.14 -0.54 0.00 0.00 175.26 173.52 1lfg s PRO 144 N 3.12 3.17 0.52 4.30 0.02 -1.26 -4.56 135.00 140.31 1lfg s PRO 144 Ca 0.71 2.27 0.30 0.00 0.02 0.00 0.00 61.00 64.30 1lfg s PRO 144 Cb -0.35 -2.29 1.29 0.00 0.02 0.00 0.00 34.50 33.17 1lfg s PRO 144 CO 0.30 -1.18 1.97 0.97 -0.33 0.00 0.00 177.00 178.73 1lfg h ILE 145 N 1.52 0.29 -0.77 2.83 6.09 -1.92 -2.39 117.51 123.15 1lfg h ILE 145 Ca -0.51 -0.70 0.10 0.00 -1.37 0.00 0.00 64.86 62.38 1lfg h ILE 145 Cb 1.30 1.54 -0.07 0.00 0.47 0.00 0.00 36.82 40.06 1lfg h ILE 145 CO 0.57 0.10 0.41 -0.33 -3.07 0.00 0.00 178.15 175.83 1lfg h GLU 146 N 0.00 0.67 -0.98 2.19 3.07 -1.98 -1.16 114.58 116.40 1lfg h GLU 146 Ca -0.00 -0.04 0.01 0.00 -0.50 0.00 0.00 59.36 58.82 1lfg h GLU 146 Cb 0.53 -0.15 -0.05 0.00 -0.84 0.00 0.00 28.75 28.24 1lfg h GLU 146 CO 0.01 0.44 0.63 0.00 -1.40 0.00 0.00 179.01 178.70 1lfg h ALA 147 N 1.45 1.24 -0.24 3.43 0.00 -1.80 -0.99 119.26 122.34 1lfg h ALA 147 Ca 0.38 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 55.07 1lfg h ALA 147 Cb 0.38 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1lfg h ALA 147 CO -0.26 0.65 -0.42 0.00 0.00 0.00 0.00 179.25 179.22 1lfg h ALA 148 N 1.35 0.82 -0.00 0.00 0.00 -1.34 -2.38 119.26 117.71 1lfg h ALA 148 Ca 0.36 -0.45 -0.17 0.00 0.00 0.00 0.00 54.91 54.65 1lfg h ALA 148 Cb -0.13 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1lfg h ALA 148 CO -0.07 0.65 -0.77 -0.24 0.00 0.00 0.00 179.25 178.82 1lfg h VAL 149 N 0.48 1.53 0.00 0.00 3.04 -0.83 -2.41 116.25 118.06 1lfg h VAL 149 Ca 0.04 -2.56 -0.01 0.00 -1.01 0.00 0.00 66.70 63.16 1lfg h VAL 149 Cb 0.93 2.39 -0.00 0.00 -2.01 0.00 0.00 31.29 32.59 1lfg h VAL 149 CO 0.08 0.74 -0.05 0.00 -1.01 0.00 0.00 177.57 177.32 1lfg h ALA 150 N 1.19 1.65 0.00 3.17 0.00 -1.14 0.33 119.26 124.46 1lfg h ALA 150 Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1lfg h ALA 150 Cb 1.36 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1lfg h ALA 150 CO 0.10 0.07 -0.89 0.00 0.00 0.00 0.00 179.25 178.53 1lfg h ARG 151 N 0.00 0.00 0.38 0.00 3.08 -1.19 -3.38 114.38 113.27 1lfg h ARG 151 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 1lfg h ARG 151 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1lfg h ARG 151 CO 0.01 0.00 -0.18 0.35 -1.07 0.00 0.00 179.97 179.07 1lfg h PHE 152 N 0.00 -0.47 -3.42 3.04 3.57 0.06 -3.45 116.94 116.27 1lfg h PHE 152 Ca 0.00 -0.01 -0.50 0.00 3.53 0.00 0.00 57.97 60.99 1lfg h PHE 152 Cb 0.94 0.16 0.01 0.00 2.79 0.00 0.00 35.95 39.85 1lfg h PHE 152 CO 0.00 -0.30 0.01 -0.06 -2.23 0.00 0.00 178.31 175.74 1lfg s PHE 153 N -3.59 3.51 0.15 0.41 0.08 -0.12 0.91 117.98 119.33 1lfg s PHE 153 Ca -0.07 0.77 -0.10 0.00 0.12 0.00 0.00 56.93 57.65 1lfg s PHE 153 Cb 0.01 -2.24 -0.01 0.00 -0.57 0.00 0.00 43.02 40.21 1lfg s PHE 153 CO 0.22 -0.07 1.51 0.66 -0.10 0.00 0.00 175.22 177.45 1lfg h SER 154 N 0.94 1.01 -5.03 1.36 4.64 -1.35 -3.45 113.55 111.67 1lfg h SER 154 Ca -0.48 -0.43 -0.04 0.00 -0.47 0.00 0.00 61.79 60.37 1lfg h SER 154 Cb 1.20 -0.28 -0.14 0.00 -0.31 0.00 0.00 62.40 62.87 1lfg h SER 154 CO 0.63 1.23 0.08 0.00 -0.87 0.00 0.00 176.83 177.90 1lfg s ALA 155 N -4.52 -1.34 0.29 5.18 0.00 -1.26 -4.96 121.76 115.16 1lfg s ALA 155 Ca -0.11 0.43 -0.11 0.00 0.00 0.00 0.00 51.96 52.17 1lfg s ALA 155 Cb 0.12 0.62 0.01 0.00 0.00 0.00 0.00 23.12 23.86 1lfg s ALA 155 CO 0.88 -0.62 0.54 -1.12 0.00 0.00 0.00 175.76 175.43 1lfg s SER 156 N -2.41 0.16 -0.25 0.00 0.01 -0.64 -1.12 113.70 109.45 1lfg s SER 156 Ca -0.01 -1.08 0.01 0.00 1.31 0.00 0.00 55.95 56.18 1lfg s SER 156 Cb -0.00 0.65 0.07 0.00 0.21 0.00 0.00 66.02 66.95 1lfg s SER 156 CO -0.08 -1.28 -0.04 0.00 0.41 0.00 0.00 173.24 172.25 1lfg s VAL 158 N 1.30 1.48 -0.03 0.00 1.01 0.59 -1.88 120.40 122.87 1lfg s VAL 158 Ca -0.04 -3.38 -0.38 0.00 0.00 0.00 0.00 61.98 58.18 1lfg s VAL 158 Cb -0.19 -1.99 -0.16 0.00 0.00 0.00 0.00 36.38 34.04 1lfg s VAL 158 CO -0.07 -1.14 1.47 -2.65 0.00 0.00 0.00 175.10 172.72 1lfg n PRO 159 N 2.45 1.17 0.00 2.72 -0.02 -1.26 -0.01 135.00 140.05 1lfg n PRO 159 Ca 0.25 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 1lfg n PRO 159 Cb 0.42 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 1lfg n PRO 159 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1lfg n GLY 160 N 3.07 0.38 3.62 -1.23 0.00 -0.64 -0.66 105.19 109.73 1lfg n GLY 160 Ca 0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.94 1lfg n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lfg s ALA 161 N -2.00 0.60 -0.62 4.61 0.00 0.99 -4.89 121.76 120.44 1lfg s ALA 161 Ca 0.00 -0.16 -0.23 0.00 0.00 0.00 0.00 51.96 51.57 1lfg s ALA 161 Cb 0.00 -3.20 0.06 0.00 0.00 0.00 0.00 23.12 19.99 1lfg s ALA 161 CO 0.00 -3.09 0.94 0.34 0.00 0.00 0.00 175.76 173.95 1lfg s ASP 162 N -3.08 6.22 0.33 0.00 -1.08 -1.26 -4.86 116.67 112.93 1lfg s ASP 162 Ca 0.66 -0.82 0.12 0.00 -0.52 0.00 0.00 52.55 51.98 1lfg s ASP 162 Cb -0.21 -2.42 0.98 0.00 -1.46 0.00 0.00 42.92 39.82 1lfg s ASP 162 CO 0.60 -1.36 1.68 0.50 0.52 0.00 0.00 175.17 177.11 1lfg h LYS 163 N 9.48 0.38 0.00 4.34 3.64 -1.92 0.37 116.57 132.86 1lfg h LYS 163 Ca -0.28 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 1lfg h LYS 163 Cb 1.07 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 1lfg h LYS 163 CO 1.15 0.25 0.00 0.41 -2.27 0.00 0.00 179.45 178.99 1lfg n GLY 164 N -1.30 -3.47 0.09 5.01 0.00 -1.26 -1.80 105.19 102.45 1lfg n GLY 164 Ca 0.29 0.69 -0.04 0.00 0.00 0.00 0.00 46.02 46.95 1lfg n GLY 164 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1lfg h GLN 165 N 0.00 0.00 -1.93 1.61 4.20 -1.95 -3.39 115.11 113.64 1lfg h GLN 165 Ca 0.00 0.00 -0.55 0.00 0.06 0.00 0.00 58.65 58.16 1lfg h GLN 165 Cb 0.00 0.00 -0.41 0.00 0.30 0.00 0.00 27.48 27.37 1lfg h GLN 165 CO 0.00 0.85 -0.82 1.19 -0.67 0.00 0.00 178.83 179.38 1lfg n PHE 166 N -3.46 2.93 -0.31 2.96 3.72 0.13 -4.88 117.46 118.54 1lfg n PHE 166 Ca -0.00 -3.64 0.16 0.00 -0.05 0.00 0.00 57.45 53.91 1lfg n PHE 166 Cb 0.83 -0.37 0.34 0.00 -0.94 0.00 0.00 39.48 39.34 1lfg n PHE 166 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1lfg h PRO 167 N 2.89 0.24 -0.99 -1.08 0.13 -1.50 -0.91 132.00 130.78 1lfg h PRO 167 Ca 0.14 -0.01 0.18 0.00 -0.87 0.00 0.00 66.00 65.44 1lfg h PRO 167 Cb 0.75 -0.05 -0.10 0.00 0.13 0.00 0.00 31.00 31.73 1lfg h PRO 167 CO 0.74 0.16 0.61 -0.97 -0.23 0.00 0.00 178.00 178.31 1lfg h ASN 168 N 0.25 0.74 0.64 1.44 -1.24 -1.90 0.26 115.58 115.76 1lfg h ASN 168 Ca 0.60 0.08 0.00 0.00 0.71 0.00 0.00 56.30 57.69 1lfg h ASN 168 Cb 1.27 -0.06 0.00 0.00 0.73 0.00 0.00 38.32 40.26 1lfg h ASN 168 CO -0.64 0.29 0.00 0.18 -1.29 0.00 0.00 177.43 175.97 1lfg n LEU 169 N -4.69 0.47 -0.00 0.34 4.77 -0.35 -1.62 117.00 115.91 1lfg n LEU 169 Ca 0.22 0.62 0.02 0.00 -0.03 0.00 0.00 56.01 56.84 1lfg n LEU 169 Cb 0.56 -0.56 -0.03 0.00 -2.33 0.00 0.00 43.42 41.07 1lfg n LEU 169 CO 0.24 -0.48 -0.23 0.00 -1.33 0.00 0.00 177.39 175.59 1lfg n ARG 171 N -1.32 0.00 0.00 0.00 1.74 -0.11 -0.73 116.66 116.25 1lfg n ARG 171 Ca 0.00 0.75 0.03 0.00 -0.77 0.00 0.00 57.85 57.86 1lfg n ARG 171 Cb 0.08 -1.18 0.18 0.00 -1.02 0.00 0.00 32.46 30.52 1lfg n ARG 171 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1lfg n LEU 172 N -2.36 0.00 -4.78 0.55 4.77 -0.73 -4.82 117.00 109.64 1lfg n LEU 172 Ca 0.00 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.61 1lfg n LEU 172 Cb 0.00 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 1lfg n LEU 172 CO 0.00 0.00 0.79 0.00 -1.33 0.00 0.00 177.39 176.85 1lfg n ALA 174 N -0.37 3.88 -1.22 0.00 0.00 -1.26 -4.79 120.51 116.76 1lfg n ALA 174 Ca 0.07 -0.43 -0.35 0.00 0.00 0.00 0.00 53.44 52.73 1lfg n ALA 174 Cb 0.49 -1.00 0.10 0.00 0.00 0.00 0.00 19.45 19.05 1lfg n ALA 174 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lfg n GLY 175 N 1.48 -0.43 3.16 0.00 0.00 -1.26 -4.83 105.19 103.31 1lfg n GLY 175 Ca 0.05 -0.42 -0.36 0.00 0.00 0.00 0.00 46.02 45.28 1lfg n GLY 175 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1lfg s THR 176 N -1.97 3.30 0.00 2.61 2.01 -1.26 -3.98 115.64 116.35 1lfg s THR 176 Ca 0.72 -1.72 0.00 0.00 0.31 0.00 0.00 61.69 61.00 1lfg s THR 176 Cb -0.32 -3.10 0.00 0.00 0.01 0.00 0.00 72.50 69.10 1lfg s THR 176 CO 0.52 -0.45 0.00 0.61 -0.69 0.00 0.00 174.62 174.61 1lfg n GLY 177 N 4.64 0.72 0.07 4.40 0.00 -1.26 -4.13 105.19 109.63 1lfg n GLY 177 Ca -0.07 -1.68 0.14 0.00 0.00 0.00 0.00 46.02 44.42 1lfg n GLY 177 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1lfg n GLU 178 N 0.00 0.55 0.10 1.61 1.02 -1.26 -2.93 120.64 119.73 1lfg n GLU 178 Ca 0.00 -0.13 -0.02 0.00 -0.02 0.00 0.00 57.16 56.98 1lfg n GLU 178 Cb 0.00 -1.50 0.21 0.00 -0.02 0.00 0.00 31.44 30.13 1lfg n GLU 178 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1lfg h ASN 179 N 0.33 0.24 -1.46 1.62 4.21 -1.91 -3.43 115.58 115.17 1lfg h ASN 179 Ca 0.00 -0.11 -0.75 0.00 1.21 0.00 0.00 56.30 56.66 1lfg h ASN 179 Cb 0.34 -0.07 0.03 0.00 -1.12 0.00 0.00 38.32 37.50 1lfg h ASN 179 CO 0.00 0.66 0.66 1.17 -1.29 0.00 0.00 177.43 178.63 1lfg n LYS 180 N -4.00 0.89 -2.24 0.81 4.81 -1.15 -0.45 118.16 116.83 1lfg n LYS 180 Ca -0.02 0.32 -0.20 0.00 -0.87 0.00 0.00 58.31 57.54 1lfg n LYS 180 Cb 0.50 -1.95 -0.03 0.00 0.02 0.00 0.00 35.03 33.58 1lfg n LYS 180 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1lfg s ALA 182 N -2.96 2.76 -1.15 0.00 0.00 0.40 -1.62 121.76 119.20 1lfg s ALA 182 Ca 0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 51.96 51.76 1lfg s ALA 182 Cb 0.00 -3.09 0.26 0.00 0.00 0.00 0.00 23.12 20.28 1lfg s ALA 182 CO 0.00 -1.16 1.72 0.34 0.00 0.00 0.00 175.76 176.66 1lfg n PHE 183 N -3.06 2.51 -3.94 0.00 -0.00 -1.26 -4.37 117.46 107.35 1lfg n PHE 183 Ca 0.07 -2.64 -0.00 0.00 -0.00 0.00 0.00 57.45 54.87 1lfg n PHE 183 Cb 0.55 -1.48 0.02 0.00 -0.00 0.00 0.00 39.48 38.57 1lfg n PHE 183 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 1lfg n SER 184 N 1.85 -1.41 0.21 -2.13 3.41 -1.26 -4.98 113.62 109.31 1lfg n SER 184 Ca 0.36 -1.56 0.15 0.00 -0.26 0.00 0.00 58.87 57.55 1lfg n SER 184 Cb 0.32 2.25 0.58 0.00 -0.26 0.00 0.00 64.21 67.10 1lfg n SER 184 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1lfg h SER 185 N 1.89 0.00 -0.03 4.04 0.02 -1.95 -1.78 113.55 115.73 1lfg h SER 185 Ca -0.23 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.73 1lfg h SER 185 Cb 1.13 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.67 1lfg h SER 185 CO 0.32 0.00 0.08 1.56 -1.14 0.00 0.00 176.83 177.65 1lfg h GLN 186 N 0.00 0.00 -4.56 3.45 1.08 -1.94 -3.35 115.11 109.80 1lfg h GLN 186 Ca 0.00 0.00 -0.71 0.00 -1.45 0.00 0.00 58.65 56.49 1lfg h GLN 186 Cb 0.49 0.00 -0.22 0.00 -0.05 0.00 0.00 27.48 27.70 1lfg h GLN 186 CO 0.00 0.00 -0.46 -2.00 -0.95 0.00 0.00 178.83 175.42 1lfg s GLU 187 N -4.33 3.02 0.56 1.46 2.56 -0.67 -4.67 118.70 116.63 1lfg s GLU 187 Ca -0.05 -0.97 0.31 0.00 0.00 0.00 0.00 54.97 54.26 1lfg s GLU 187 Cb 0.13 -3.89 1.69 0.00 2.00 0.00 0.00 34.13 34.07 1lfg s GLU 187 CO 0.45 -0.69 2.16 -1.00 -0.56 0.00 0.00 175.26 175.62 1lfg h PRO 188 N 8.56 0.00 -0.54 4.30 0.13 -1.84 -2.47 132.00 140.15 1lfg h PRO 188 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1lfg h PRO 188 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1lfg h PRO 188 CO 0.70 0.06 0.00 0.66 -0.23 0.00 0.00 178.00 179.19 1lfg n TYR 189 N -3.55 1.42 -2.93 1.56 4.01 -1.26 -4.12 117.16 112.28 1lfg n TYR 189 Ca -0.02 -0.67 -0.37 0.00 -0.16 0.00 0.00 57.90 56.68 1lfg n TYR 189 Cb 0.18 -0.29 -0.06 0.00 -0.31 0.00 0.00 39.34 38.86 1lfg n TYR 189 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 1lfg s PHE 190 N -2.13 3.68 0.00 -0.72 5.36 -0.93 -2.12 117.98 121.12 1lfg s PHE 190 Ca 0.48 1.60 0.00 0.00 -0.96 0.00 0.00 56.93 58.05 1lfg s PHE 190 Cb 0.33 -2.78 0.00 0.00 -0.34 0.00 0.00 43.02 40.23 1lfg s PHE 190 CO 0.19 0.28 0.00 0.45 -1.46 0.00 0.00 175.22 174.68 1lfg n SER 191 N 0.66 -3.11 0.04 6.13 2.88 -0.42 -1.31 113.62 118.48 1lfg n SER 191 Ca -0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 1lfg n SER 191 Cb 0.50 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.89 1lfg n SER 191 CO 0.00 0.00 0.00 1.88 -1.23 0.00 0.00 175.04 175.69 1lfg h TYR 192 N 0.00 -0.01 -0.32 0.66 0.05 -1.92 -1.27 116.97 114.16 1lfg h TYR 192 Ca 0.00 -0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.64 1lfg h TYR 192 Cb 0.00 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.74 1lfg h TYR 192 CO 0.00 0.07 -0.36 0.77 -1.05 0.00 0.00 178.16 177.59 1lfg h SER 193 N -0.08 0.87 0.17 3.88 0.02 -1.96 -1.84 113.55 114.60 1lfg h SER 193 Ca -0.00 -0.48 -0.01 0.00 -0.84 0.00 0.00 61.79 60.46 1lfg h SER 193 Cb 0.08 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.38 1lfg h SER 193 CO 0.00 1.17 -0.09 1.23 -1.14 0.00 0.00 176.83 178.01 1lfg h GLY 194 N 0.58 -0.24 0.16 -3.77 0.00 -1.11 -0.14 103.07 98.55 1lfg h GLY 194 Ca 0.05 0.09 0.17 0.00 0.00 0.00 0.00 47.33 47.64 1lfg h GLY 194 CO 0.09 -0.09 0.50 0.00 0.00 0.00 0.00 176.54 177.03 1lfg h ALA 195 N 0.60 1.43 -0.52 3.60 0.00 -0.68 0.17 119.26 123.86 1lfg h ALA 195 Ca -0.02 0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 1lfg h ALA 195 Cb 0.18 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1lfg h ALA 195 CO 0.03 -0.09 -0.14 0.35 0.00 0.00 0.00 179.25 179.41 1lfg h PHE 196 N 0.66 1.11 -0.26 0.00 3.57 -1.09 -2.94 116.94 118.00 1lfg h PHE 196 Ca 0.51 -0.24 -0.07 0.00 3.53 0.00 0.00 57.97 61.71 1lfg h PHE 196 Cb 0.76 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.23 1lfg h PHE 196 CO -0.07 1.05 -0.09 -0.22 -2.23 0.00 0.00 178.31 176.75 1lfg h LYS 197 N 0.87 0.52 -0.99 1.11 3.64 0.97 -1.64 116.57 121.06 1lfg h LYS 197 Ca 0.13 -0.21 0.22 0.00 -1.27 0.00 0.00 60.65 59.52 1lfg h LYS 197 Cb 0.70 -0.02 -0.10 0.00 -0.41 0.00 0.00 32.23 32.40 1lfg h LYS 197 CO 0.05 0.76 0.62 0.00 -2.27 0.00 0.00 179.45 178.61 1lfg h LEU 199 N 0.58 -0.33 -0.21 0.00 5.85 -1.30 -0.07 115.31 119.83 1lfg h LEU 199 Ca 0.57 -0.21 0.05 0.00 0.84 0.00 0.00 57.88 59.13 1lfg h LEU 199 Cb 1.14 0.09 -0.07 0.00 0.37 0.00 0.00 40.66 42.18 1lfg h LEU 199 CO -0.33 0.10 -0.43 0.11 -0.34 0.00 0.00 178.44 177.55 1lfg h LYS 200 N -0.85 -0.44 0.00 1.25 1.57 -0.35 0.23 116.57 117.99 1lfg h LYS 200 Ca -0.04 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1lfg h LYS 200 Cb 0.52 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.92 1lfg h LYS 200 CO 0.07 -0.29 0.12 -0.25 -0.57 0.00 0.00 179.45 178.52 1lfg n ASP 201 N -5.43 0.19 0.00 0.86 8.00 0.10 -4.78 116.55 115.49 1lfg n ASP 201 Ca -0.03 0.51 0.00 0.00 0.71 0.00 0.00 54.79 55.98 1lfg n ASP 201 Cb 0.36 -0.51 0.00 0.00 -0.02 0.00 0.00 41.12 40.95 1lfg n ASP 201 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lfg n GLY 202 N -1.35 0.50 0.15 0.44 0.00 0.79 -4.94 105.19 100.77 1lfg n GLY 202 Ca -0.00 -0.45 -0.12 0.00 0.00 0.00 0.00 46.02 45.45 1lfg n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lfg h ALA 203 N 0.00 0.42 -2.16 4.61 0.00 -1.19 -3.46 119.26 117.47 1lfg h ALA 203 Ca 0.00 -0.71 -0.42 0.00 0.00 0.00 0.00 54.91 53.78 1lfg h ALA 203 Cb 0.00 -0.04 -0.14 0.00 0.00 0.00 0.00 17.79 17.61 1lfg h ALA 203 CO 0.00 0.85 -0.67 0.20 0.00 0.00 0.00 179.25 179.62 1lfg s GLY 204 N -4.44 1.59 0.12 0.00 0.00 -0.87 -4.88 107.32 98.84 1lfg s GLY 204 Ca -0.05 -1.78 0.23 0.00 0.00 0.00 0.00 44.72 43.12 1lfg s GLY 204 CO 0.85 -1.72 1.01 1.22 0.00 0.00 0.00 173.10 174.46 1lfg n ASP 205 N -0.45 0.65 -3.80 1.64 8.00 0.23 -4.58 116.55 118.24 1lfg n ASP 205 Ca -0.06 0.10 -0.12 0.00 0.71 0.00 0.00 54.79 55.41 1lfg n ASP 205 Cb 0.63 0.70 -0.11 0.00 -0.02 0.00 0.00 41.12 42.33 1lfg n ASP 205 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1lfg s VAL 206 N -3.31 0.03 -0.08 2.53 0.11 -1.09 -4.59 120.40 114.00 1lfg s VAL 206 Ca 0.01 -0.21 0.04 0.00 -2.93 0.00 0.00 61.98 58.89 1lfg s VAL 206 Cb 0.12 -0.39 -0.01 0.00 -1.53 0.00 0.00 36.38 34.57 1lfg s VAL 206 CO 0.80 -0.11 -0.19 0.00 -3.33 0.00 0.00 175.10 172.26 1lfg s ALA 207 N -0.38 2.40 -0.65 1.54 0.00 0.12 -1.40 121.76 123.40 1lfg s ALA 207 Ca -0.05 -0.98 -0.08 0.00 0.00 0.00 0.00 51.96 50.85 1lfg s ALA 207 Cb -0.03 -0.90 0.17 0.00 0.00 0.00 0.00 23.12 22.36 1lfg s ALA 207 CO 0.01 0.39 0.52 -0.06 0.00 0.00 0.00 175.76 176.62 1lfg s PHE 208 N -0.10 3.52 0.00 0.00 0.08 -0.79 -0.85 117.98 119.84 1lfg s PHE 208 Ca -0.04 -2.27 0.00 0.00 0.12 0.00 0.00 56.93 54.74 1lfg s PHE 208 Cb -0.14 -3.47 0.00 0.00 -0.57 0.00 0.00 43.02 38.84 1lfg s PHE 208 CO 0.04 -0.93 0.00 0.44 -0.10 0.00 0.00 175.22 174.67 1lfg n ILE 209 N 4.01 0.00 -3.40 0.64 -5.35 -1.15 -3.34 119.36 110.78 1lfg n ILE 209 Ca 0.05 0.00 -0.22 0.00 -0.27 0.00 0.00 62.75 62.31 1lfg n ILE 209 Cb 0.41 0.00 -0.01 0.00 -1.74 0.00 0.00 39.64 38.31 1lfg n ILE 209 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1lfg s ARG 210 N -0.49 3.31 0.63 6.28 1.70 -1.26 -1.09 118.95 128.03 1lfg s ARG 210 Ca 0.00 -0.56 0.41 0.00 -0.47 0.00 0.00 55.73 55.11 1lfg s ARG 210 Cb 0.00 -2.70 2.09 0.00 -0.57 0.00 0.00 34.95 33.77 1lfg s ARG 210 CO 0.00 0.08 2.25 1.05 -1.08 0.00 0.00 175.30 177.60 1lfg h GLU 211 N 0.76 0.00 0.00 3.89 9.09 -1.75 -3.26 114.58 123.31 1lfg h GLU 211 Ca -0.49 0.00 -0.15 0.00 0.05 0.00 0.00 59.36 58.78 1lfg h GLU 211 Cb 1.24 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 28.31 1lfg h GLU 211 CO 0.59 0.00 -1.28 0.66 0.05 0.00 0.00 179.01 179.03 1lfg h SER 212 N 0.00 0.00 -0.61 3.06 4.64 -1.96 -3.40 113.55 115.28 1lfg h SER 212 Ca -0.00 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 61.41 1lfg h SER 212 Cb 0.17 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.15 1lfg h SER 212 CO 0.00 0.52 -0.46 0.74 -0.87 0.00 0.00 176.83 176.76 1lfg h THR 213 N 0.00 0.07 -0.75 2.95 2.02 -1.96 1.58 112.91 116.82 1lfg h THR 213 Ca -0.13 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.13 1lfg h THR 213 Cb 1.51 0.07 -0.05 0.00 -1.74 0.00 0.00 68.15 67.94 1lfg h THR 213 CO 0.04 0.00 0.49 1.62 0.37 0.00 0.00 175.52 178.04 1lfg h VAL 214 N -0.22 0.97 0.13 3.16 3.04 -1.81 0.34 116.25 121.87 1lfg h VAL 214 Ca 0.18 -0.24 -0.28 0.00 -1.01 0.00 0.00 66.70 65.34 1lfg h VAL 214 Cb 0.56 0.20 0.02 0.00 -2.01 0.00 0.00 31.29 30.05 1lfg h VAL 214 CO -0.71 0.13 -1.24 -0.26 -1.01 0.00 0.00 177.57 174.48 1lfg h PHE 215 N 0.71 0.69 -0.33 3.17 -1.00 -0.82 -1.58 116.94 117.78 1lfg h PHE 215 Ca 0.34 -0.47 -0.10 0.00 2.81 0.00 0.00 57.97 60.55 1lfg h PHE 215 Cb 0.38 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 39.89 1lfg h PHE 215 CO -0.00 1.34 -0.20 0.93 -1.61 0.00 0.00 178.31 178.78 1lfg h GLU 216 N 0.15 0.62 0.00 1.51 5.08 0.33 -3.29 114.58 118.97 1lfg h GLU 216 Ca -0.16 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 57.98 1lfg h GLU 216 Cb 1.93 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 31.14 1lfg h GLU 216 CO 0.22 0.78 -1.49 -0.25 -1.00 0.00 0.00 179.01 177.26 1lfg n ASP 217 N -4.14 0.49 -4.11 1.42 8.00 -0.01 -4.69 116.55 113.51 1lfg n ASP 217 Ca 0.00 -0.45 -0.36 0.00 0.71 0.00 0.00 54.79 54.68 1lfg n ASP 217 Cb 0.39 1.47 -0.11 0.00 -0.02 0.00 0.00 41.12 42.86 1lfg n ASP 217 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1lfg s LEU 218 N -3.81 5.25 0.02 0.64 1.43 -0.59 -4.99 118.68 116.62 1lfg s LEU 218 Ca -0.00 -2.32 -0.06 0.00 -1.03 0.00 0.00 54.13 50.72 1lfg s LEU 218 Cb 0.15 -1.84 -0.02 0.00 0.03 0.00 0.00 46.19 44.50 1lfg s LEU 218 CO 0.88 -0.49 1.10 0.77 0.23 0.00 0.00 176.35 178.85 1lfg h SER 219 N 7.70 -0.31 -3.38 2.29 4.64 -1.84 -3.43 113.55 119.22 1lfg h SER 219 Ca -0.09 0.04 -0.52 0.00 -0.47 0.00 0.00 61.79 60.74 1lfg h SER 219 Cb 1.01 0.12 0.02 0.00 -0.31 0.00 0.00 62.40 63.25 1lfg h SER 219 CO 0.71 -0.09 0.60 -0.62 -0.87 0.00 0.00 176.83 176.56 1lfg s ASP 220 N -2.98 7.01 0.42 4.97 2.15 -1.26 -4.95 116.67 122.03 1lfg s ASP 220 Ca -0.03 2.26 0.11 0.00 0.43 0.00 0.00 52.55 55.32 1lfg s ASP 220 Cb 0.01 -2.60 0.90 0.00 -0.30 0.00 0.00 42.92 40.93 1lfg s ASP 220 CO 0.11 -0.45 1.97 -0.33 -0.17 0.00 0.00 175.17 176.30 1lfg h GLU 221 N 5.62 0.18 0.00 4.34 4.39 -2.02 -2.07 114.58 125.02 1lfg h GLU 221 Ca -0.44 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.18 1lfg h GLU 221 Cb 1.21 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.83 1lfg h GLU 221 CO 0.77 0.28 -0.21 0.00 -1.16 0.00 0.00 179.01 178.70 1lfg h ALA 222 N 1.74 0.89 -0.22 3.43 0.00 -1.95 -3.28 119.26 119.87 1lfg h ALA 222 Ca 0.04 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.60 1lfg h ALA 222 Cb 0.28 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1lfg h ALA 222 CO 0.01 0.26 -0.52 1.05 0.00 0.00 0.00 179.25 180.05 1lfg h GLU 223 N 0.00 0.62 -0.20 0.00 4.11 -1.75 -3.19 114.58 114.17 1lfg h GLU 223 Ca -0.00 -0.38 -0.05 0.00 0.07 0.00 0.00 59.36 59.00 1lfg h GLU 223 Cb 1.05 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.32 1lfg h GLU 223 CO 0.03 0.99 -0.09 0.00 0.07 0.00 0.00 179.01 180.00 1lfg h ARG 224 N 0.48 0.31 0.00 1.06 3.08 -1.69 -1.91 114.38 115.71 1lfg h ARG 224 Ca 0.02 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 1lfg h ARG 224 Cb 1.07 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 31.08 1lfg h ARG 224 CO 0.10 0.42 -0.00 -0.44 -1.07 0.00 0.00 179.97 178.98 1lfg h ASP 225 N 0.30 0.00 0.29 7.04 5.19 -1.66 0.97 116.42 128.55 1lfg h ASP 225 Ca 0.06 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.47 1lfg h ASP 225 Cb 0.35 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.86 1lfg h ASP 225 CO 0.02 0.00 0.00 -0.62 -3.12 0.00 0.00 179.24 175.52 1lfg n GLU 226 N -3.51 0.57 -4.28 3.56 1.02 -0.72 -4.81 120.64 112.47 1lfg n GLU 226 Ca -0.03 0.02 -0.27 0.00 -0.02 0.00 0.00 57.16 56.86 1lfg n GLU 226 Cb 0.08 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 29.91 1lfg n GLU 226 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1lfg s TYR 227 N -2.34 2.65 0.15 -0.32 2.02 0.34 0.42 117.35 120.27 1lfg s TYR 227 Ca 0.31 -0.21 -0.02 0.00 -0.37 0.00 0.00 57.07 56.78 1lfg s TYR 227 Cb 0.18 -1.32 -0.04 0.00 -0.40 0.00 0.00 41.96 40.39 1lfg s TYR 227 CO 0.36 0.49 0.11 -1.21 -1.57 0.00 0.00 175.55 173.73 1lfg s GLU 228 N -2.69 1.04 0.04 -0.62 2.02 0.36 -4.22 118.70 114.62 1lfg s GLU 228 Ca 0.24 -1.45 0.06 0.00 0.02 0.00 0.00 54.97 53.84 1lfg s GLU 228 Cb -0.09 0.27 -0.03 0.00 0.10 0.00 0.00 34.13 34.37 1lfg s GLU 228 CO 0.15 -0.32 -0.15 -0.51 0.02 0.00 0.00 175.26 174.45 1lfg s LEU 229 N -3.07 2.78 -0.37 1.80 1.43 -0.71 -0.91 118.68 119.63 1lfg s LEU 229 Ca 0.27 -0.36 -0.17 0.00 -1.03 0.00 0.00 54.13 52.85 1lfg s LEU 229 Cb 0.07 -1.62 0.00 0.00 0.03 0.00 0.00 46.19 44.67 1lfg s LEU 229 CO 0.04 0.25 0.43 -0.76 0.23 0.00 0.00 176.35 176.55 1lfg s LEU 230 N -1.50 4.53 0.27 1.79 1.43 0.98 -2.78 118.68 123.40 1lfg s LEU 230 Ca 0.16 -0.30 -0.08 0.00 -1.03 0.00 0.00 54.13 52.88 1lfg s LEU 230 Cb -0.11 -2.43 -0.06 0.00 0.03 0.00 0.00 46.19 43.62 1lfg s LEU 230 CO 0.07 -0.46 0.57 0.00 0.23 0.00 0.00 176.35 176.76 1lfg h PRO 232 N 2.06 0.00 -0.92 0.00 0.11 -1.85 -2.19 132.00 129.21 1lfg h PRO 232 Ca -0.47 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.12 1lfg h PRO 232 Cb 1.18 0.00 -0.29 0.00 0.11 0.00 0.00 31.00 32.00 1lfg h PRO 232 CO 0.67 0.00 0.59 -0.40 -0.21 0.00 0.00 178.00 178.65 1lfg n ASP 233 N -2.51 4.57 -3.95 -2.05 5.75 -1.26 -4.92 116.55 112.19 1lfg n ASP 233 Ca -0.02 -3.68 -0.26 0.00 -0.01 0.00 0.00 54.79 50.83 1lfg n ASP 233 Cb 0.10 -0.84 -0.02 0.00 -1.03 0.00 0.00 41.12 39.33 1lfg n ASP 233 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1lfg n ASN 234 N -1.08 -0.40 -4.14 -1.12 3.02 -0.82 -5.00 115.26 105.72 1lfg n ASN 234 Ca 0.57 -1.01 -0.17 0.00 -0.03 0.00 0.00 54.58 53.94 1lfg n ASN 234 Cb 1.35 -3.03 -0.12 0.00 -0.61 0.00 0.00 39.78 37.37 1lfg n ASN 234 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1lfg s THR 235 N -3.96 0.95 0.10 3.41 -4.23 -1.24 -4.91 115.64 105.76 1lfg s THR 235 Ca 0.01 -1.24 -0.03 0.00 -1.18 0.00 0.00 61.69 59.25 1lfg s THR 235 Cb -0.01 -0.94 -0.05 0.00 1.34 0.00 0.00 72.50 72.84 1lfg s THR 235 CO 0.89 -0.27 0.30 -0.13 -0.54 0.00 0.00 174.62 174.88 1lfg s ARG 236 N -1.69 3.55 0.12 3.99 0.52 -1.26 0.19 118.95 124.37 1lfg s ARG 236 Ca -0.04 -0.21 -0.11 0.00 -0.52 0.00 0.00 55.73 54.85 1lfg s ARG 236 Cb -0.10 -2.95 0.01 0.00 0.52 0.00 0.00 34.95 32.43 1lfg s ARG 236 CO 0.02 0.54 0.28 0.15 0.02 0.00 0.00 175.30 176.30 1lfg s LYS 237 N -2.48 0.98 0.74 3.54 3.01 -1.12 -4.94 119.74 119.47 1lfg s LYS 237 Ca 0.37 -0.93 -0.15 0.00 -1.01 0.00 0.00 55.97 54.25 1lfg s LYS 237 Cb -0.13 0.39 0.04 0.00 -1.01 0.00 0.00 37.83 37.13 1lfg s LYS 237 CO 0.25 -0.35 1.22 -2.14 0.51 0.00 0.00 175.35 174.83 1lfg s PRO 238 N -3.87 2.07 0.66 -1.68 0.02 -1.26 -1.74 135.00 129.20 1lfg s PRO 238 Ca 0.07 1.79 0.39 0.00 0.02 0.00 0.00 61.00 63.27 1lfg s PRO 238 Cb 0.04 -1.82 2.17 0.00 0.02 0.00 0.00 34.50 34.91 1lfg s PRO 238 CO -0.09 -1.90 2.26 -0.39 -0.33 0.00 0.00 177.00 176.55 1lfg h VAL 239 N -0.35 0.08 -0.01 3.83 -1.51 -1.89 -2.49 116.25 113.92 1lfg h VAL 239 Ca -0.48 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.99 1lfg h VAL 239 Cb 1.30 0.92 0.00 0.00 -2.13 0.00 0.00 31.29 31.38 1lfg h VAL 239 CO 0.49 0.00 -0.48 -0.90 -1.23 0.00 0.00 177.57 175.45 1lfg n ASP 240 N -3.17 1.08 -1.38 4.19 5.75 -1.26 -3.82 116.55 117.94 1lfg n ASP 240 Ca -0.02 -0.86 -0.05 0.00 -0.01 0.00 0.00 54.79 53.85 1lfg n ASP 240 Cb 0.15 0.37 0.13 0.00 -1.03 0.00 0.00 41.12 40.74 1lfg n ASP 240 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1lfg n LYS 241 N -0.89 2.11 -0.16 0.11 4.01 -0.94 -4.65 118.16 117.76 1lfg n LYS 241 Ca 0.09 -1.41 -0.03 0.00 -0.51 0.00 0.00 58.31 56.44 1lfg n LYS 241 Cb 0.37 -1.68 0.06 0.00 -0.51 0.00 0.00 35.03 33.27 1lfg n LYS 241 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1lfg h PHE 242 N 1.07 0.35 -0.68 2.13 -5.15 -1.76 -1.55 116.94 111.35 1lfg h PHE 242 Ca 0.16 0.02 0.28 0.00 -0.20 0.00 0.00 57.97 58.24 1lfg h PHE 242 Cb 1.56 -0.08 -0.12 0.00 0.22 0.00 0.00 35.95 37.53 1lfg h PHE 242 CO 0.63 0.13 0.36 1.63 -2.00 0.00 0.00 178.31 179.06 1lfg n LYS 243 N -4.98 -0.04 -0.25 6.09 4.76 -1.26 -2.16 118.16 120.32 1lfg n LYS 243 Ca 0.05 0.94 0.08 0.00 -2.87 0.00 0.00 58.31 56.51 1lfg n LYS 243 Cb 0.19 -1.68 0.22 0.00 -1.84 0.00 0.00 35.03 31.91 1lfg n LYS 243 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1lfg n ASP 244 N -4.54 3.31 -2.77 4.39 8.00 -0.60 -4.78 116.55 119.55 1lfg n ASP 244 Ca 0.26 -1.99 -0.03 0.00 0.71 0.00 0.00 54.79 53.73 1lfg n ASP 244 Cb 0.87 -0.33 0.01 0.00 -0.02 0.00 0.00 41.12 41.65 1lfg n ASP 244 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1lfg s HIS 246 N 0.96 0.16 -0.69 0.00 -3.43 -1.20 -4.48 115.29 106.61 1lfg s HIS 246 Ca 0.28 -0.55 0.23 0.00 -0.80 0.00 0.00 55.06 54.22 1lfg s HIS 246 Cb 0.02 -0.08 0.16 0.00 -1.43 0.00 0.00 32.58 31.25 1lfg s HIS 246 CO -0.06 -0.50 1.14 1.28 -2.00 0.00 0.00 174.74 174.60 1lfg n LEU 247 N 0.15 0.63 0.00 5.38 4.77 0.16 -4.54 117.00 123.54 1lfg n LEU 247 Ca -0.16 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 1lfg n LEU 247 Cb 0.61 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1lfg n LEU 247 CO 0.23 0.05 0.00 0.00 -1.33 0.00 0.00 177.39 176.33 1lfg n ALA 248 N -1.76 0.00 -3.26 -1.18 0.00 -1.22 -4.97 120.51 108.11 1lfg n ALA 248 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.10 1lfg n ALA 248 Cb 0.42 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.74 1lfg n ALA 248 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1lfg s ARG 249 N -2.00 3.15 0.15 0.00 3.52 -1.26 -1.77 118.95 120.74 1lfg s ARG 249 Ca 0.00 -0.81 0.10 0.00 -0.13 0.00 0.00 55.73 54.90 1lfg s ARG 249 Cb 0.00 -3.28 -0.04 0.00 -1.56 0.00 0.00 34.95 30.07 1lfg s ARG 249 CO 0.00 -0.38 -0.23 0.14 -0.81 0.00 0.00 175.30 174.01 1lfg s VAL 250 N 1.49 2.11 0.49 7.11 -7.23 0.17 -4.94 120.40 119.59 1lfg s VAL 250 Ca 0.03 -1.85 -0.23 0.00 -1.81 0.00 0.00 61.98 58.12 1lfg s VAL 250 Cb -0.17 -1.94 -0.06 0.00 0.56 0.00 0.00 36.38 34.77 1lfg s VAL 250 CO 0.01 -0.09 1.29 -2.16 -0.31 0.00 0.00 175.10 173.84 1lfg s PRO 251 N -2.39 3.50 0.62 4.82 0.04 -1.26 0.82 135.00 141.14 1lfg s PRO 251 Ca 0.15 2.09 -0.17 0.00 0.04 0.00 0.00 61.00 63.12 1lfg s PRO 251 Cb -0.08 -2.41 -0.02 0.00 0.04 0.00 0.00 34.50 32.03 1lfg s PRO 251 CO 0.07 -0.86 1.12 -1.54 0.04 0.00 0.00 177.00 175.83 1lfg s SER 252 N -1.02 5.33 1.02 6.66 1.04 -0.82 -4.67 113.70 121.25 1lfg s SER 252 Ca 0.66 2.06 -0.13 0.00 0.48 0.00 0.00 55.95 59.02 1lfg s SER 252 Cb -0.36 -2.56 0.14 0.00 0.10 0.00 0.00 66.02 63.34 1lfg s SER 252 CO 0.44 -1.48 0.74 1.41 0.98 0.00 0.00 173.24 175.33 1lfg n HIS 253 N -2.02 -0.61 -3.78 5.02 8.25 -1.26 -4.71 115.22 116.11 1lfg n HIS 253 Ca 0.11 0.19 -0.10 0.00 -0.26 0.00 0.00 57.72 57.65 1lfg n HIS 253 Cb 0.52 -1.81 -0.07 0.00 1.12 0.00 0.00 29.99 29.75 1lfg n HIS 253 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1lfg s ALA 254 N -2.46 -0.55 -0.07 -1.41 0.00 -0.64 -1.18 121.76 115.45 1lfg s ALA 254 Ca 0.63 -0.21 -0.27 0.00 0.00 0.00 0.00 51.96 52.11 1lfg s ALA 254 Cb -0.21 0.41 -0.03 0.00 0.00 0.00 0.00 23.12 23.29 1lfg s ALA 254 CO 0.64 -0.46 0.88 0.08 0.00 0.00 0.00 175.76 176.89 1lfg s VAL 255 N -3.08 4.91 0.33 0.00 1.01 -0.18 -0.83 120.40 122.56 1lfg s VAL 255 Ca -0.01 1.80 0.08 0.00 0.00 0.00 0.00 61.98 63.84 1lfg s VAL 255 Cb 0.01 -4.20 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 1lfg s VAL 255 CO -0.07 0.13 0.24 0.68 0.00 0.00 0.00 175.10 176.09 1lfg s VAL 256 N 1.34 3.46 0.25 2.92 -7.23 -0.26 -1.56 120.40 119.31 1lfg s VAL 256 Ca 0.45 -1.46 -0.06 0.00 -1.81 0.00 0.00 61.98 59.09 1lfg s VAL 256 Cb -0.19 -3.14 0.03 0.00 0.56 0.00 0.00 36.38 33.64 1lfg s VAL 256 CO 0.20 -0.19 0.45 0.00 -0.31 0.00 0.00 175.10 175.25 1lfg n ALA 257 N -1.30 -0.80 -1.77 1.32 0.00 0.45 -3.47 120.51 114.94 1lfg n ALA 257 Ca -0.03 -0.94 -0.38 0.00 0.00 0.00 0.00 53.44 52.10 1lfg n ALA 257 Cb 0.60 0.75 -0.05 0.00 0.00 0.00 0.00 19.45 20.76 1lfg n ALA 257 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1lfg s ARG 258 N -2.25 4.45 -0.03 0.00 0.52 -1.26 -0.99 118.95 119.38 1lfg s ARG 258 Ca 0.14 1.52 -0.25 0.00 -0.52 0.00 0.00 55.73 56.62 1lfg s ARG 258 Cb -0.02 -2.81 -0.21 0.00 0.52 0.00 0.00 34.95 32.43 1lfg s ARG 258 CO 0.10 0.11 1.15 0.77 0.02 0.00 0.00 175.30 177.45 1lfg h SER 259 N 3.11 0.13 0.12 0.23 0.02 -1.89 -3.22 113.55 112.05 1lfg h SER 259 Ca -0.47 -0.63 -0.01 0.00 -0.84 0.00 0.00 61.79 59.84 1lfg h SER 259 Cb 1.21 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.71 1lfg h SER 259 CO 0.64 0.74 -0.06 1.62 -1.14 0.00 0.00 176.83 178.64 1lfg h VAL 260 N -0.47 0.00 -1.82 2.27 3.04 -1.94 -3.41 116.25 113.92 1lfg h VAL 260 Ca -0.00 -0.77 -0.52 0.00 -1.01 0.00 0.00 66.70 64.40 1lfg h VAL 260 Cb 0.74 0.00 -0.41 0.00 -2.01 0.00 0.00 31.29 29.60 1lfg h VAL 260 CO 0.02 0.00 -0.91 0.59 -1.01 0.00 0.00 177.57 176.26 1lfg n ASN 261 N -4.56 3.00 -0.00 3.17 5.03 -1.26 -4.97 115.26 115.67 1lfg n ASN 261 Ca -0.02 -3.34 0.21 0.00 0.87 0.00 0.00 54.58 52.30 1lfg n ASN 261 Cb 0.06 -0.55 0.70 0.00 -1.02 0.00 0.00 39.78 38.97 1lfg n ASN 261 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 1lfg h GLY 262 N 2.90 0.00 -2.55 7.41 0.00 -1.79 -3.47 103.07 105.56 1lfg h GLY 262 Ca 0.12 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.26 1lfg h GLY 262 CO 0.68 0.00 -0.29 0.28 0.00 0.00 0.00 176.54 177.21 1lfg n LYS 263 N -4.30 -2.61 -0.27 4.80 5.02 -1.26 -4.40 118.16 115.13 1lfg n LYS 263 Ca 0.10 0.42 0.12 0.00 -2.02 0.00 0.00 58.31 56.93 1lfg n LYS 263 Cb 0.63 -4.26 0.38 0.00 -0.02 0.00 0.00 35.03 31.76 1lfg n LYS 263 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1lfg h GLU 264 N -0.78 0.68 -0.14 1.97 3.07 -1.91 -2.39 114.58 115.08 1lfg h GLU 264 Ca -0.25 -0.04 -0.22 0.00 -0.50 0.00 0.00 59.36 58.34 1lfg h GLU 264 Cb 1.17 -0.15 0.01 0.00 -0.84 0.00 0.00 28.75 28.94 1lfg h GLU 264 CO 0.27 0.45 -0.79 -0.44 -1.40 0.00 0.00 179.01 177.10 1lfg h ASP 265 N 0.70 0.91 -0.35 1.42 3.32 -1.99 -2.79 116.42 117.63 1lfg h ASP 265 Ca 0.45 -0.60 0.07 0.00 0.02 0.00 0.00 57.03 56.98 1lfg h ASP 265 Cb 0.72 -0.27 -0.08 0.00 0.22 0.00 0.00 39.33 39.93 1lfg h ASP 265 CO -0.21 1.40 -0.15 0.00 -1.72 0.00 0.00 179.24 178.56 1lfg h ALA 266 N 0.58 0.13 -0.00 3.45 0.00 -1.89 1.22 119.26 122.75 1lfg h ALA 266 Ca -0.05 0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1lfg h ALA 266 Cb 1.42 0.38 -0.03 0.00 0.00 0.00 0.00 17.79 19.56 1lfg h ALA 266 CO 0.16 -0.52 -0.12 0.82 0.00 0.00 0.00 179.25 179.59 1lfg h ILE 267 N -0.09 0.70 -0.30 0.00 2.04 -1.45 0.28 117.51 118.69 1lfg h ILE 267 Ca 0.18 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.90 1lfg h ILE 267 Cb 0.35 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1lfg h ILE 267 CO -0.41 0.00 -0.37 -0.25 0.00 0.00 0.00 178.15 177.12 1lfg h TRP 268 N -0.20 0.82 0.21 1.37 2.91 -1.19 0.17 115.95 120.03 1lfg h TRP 268 Ca 0.04 -0.23 -0.01 0.00 1.13 0.00 0.00 58.89 59.83 1lfg h TRP 268 Cb 0.26 -0.18 0.00 0.00 -0.51 0.00 0.00 29.16 28.73 1lfg h TRP 268 CO -0.18 0.96 -0.11 -0.97 -1.03 0.00 0.00 178.44 177.11 1lfg h ASN 269 N 0.57 -0.26 -0.06 2.65 -1.24 0.18 -0.31 115.58 117.12 1lfg h ASN 269 Ca 0.05 0.01 0.03 0.00 0.71 0.00 0.00 56.30 57.10 1lfg h ASN 269 Cb 0.89 0.07 -0.03 0.00 0.73 0.00 0.00 38.32 39.98 1lfg h ASN 269 CO 0.08 -0.18 -0.13 0.25 -1.29 0.00 0.00 177.43 176.16 1lfg h LEU 270 N -0.29 -0.38 -0.56 0.34 5.85 -0.21 -2.72 115.31 117.35 1lfg h LEU 270 Ca -0.03 0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.77 1lfg h LEU 270 Cb 0.23 0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 1lfg h LEU 270 CO 0.04 -0.17 0.36 -0.07 -0.34 0.00 0.00 178.44 178.26 1lfg h LEU 271 N -0.18 0.61 -0.78 2.25 3.38 -0.59 -0.60 115.31 119.40 1lfg h LEU 271 Ca 0.06 -0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.11 1lfg h LEU 271 Cb 0.27 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 40.81 1lfg h LEU 271 CO -0.17 0.44 0.44 -0.09 0.09 0.00 0.00 178.44 179.15 1lfg h ARG 272 N 0.73 0.74 0.02 1.13 2.43 -0.89 -0.00 114.38 118.54 1lfg h ARG 272 Ca 0.21 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1lfg h ARG 272 Cb -0.05 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.33 1lfg h ARG 272 CO -0.06 0.49 -0.01 1.96 -1.51 0.00 0.00 179.97 180.84 1lfg h GLN 273 N 0.77 -0.02 -0.72 0.20 1.08 -1.34 -3.01 115.11 112.06 1lfg h GLN 273 Ca 0.36 0.00 0.13 0.00 -1.45 0.00 0.00 58.65 57.70 1lfg h GLN 273 Cb 0.29 0.01 -0.09 0.00 -0.05 0.00 0.00 27.48 27.64 1lfg h GLN 273 CO -0.22 0.64 0.27 0.00 -0.95 0.00 0.00 178.83 178.56 1lfg h ALA 274 N 0.22 0.98 -0.54 3.87 0.00 -0.96 0.60 119.26 123.43 1lfg h ALA 274 Ca -0.00 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1lfg h ALA 274 Cb 0.67 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1lfg h ALA 274 CO 0.00 -0.22 0.32 0.37 0.00 0.00 0.00 179.25 179.72 1lfg h GLN 275 N 0.42 0.74 0.69 0.00 4.15 -1.05 0.81 115.11 120.86 1lfg h GLN 275 Ca 0.39 -0.07 -0.03 0.00 0.77 0.00 0.00 58.65 59.70 1lfg h GLN 275 Cb 0.57 -0.15 0.01 0.00 0.21 0.00 0.00 27.48 28.12 1lfg h GLN 275 CO -0.39 0.55 -0.33 1.49 -1.93 0.00 0.00 178.83 178.21 1lfg h GLU 276 N 0.73 -0.89 -0.24 1.69 4.81 -0.91 0.38 114.58 120.15 1lfg h GLU 276 Ca 0.19 0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.38 1lfg h GLU 276 Cb 0.01 0.20 -0.00 0.00 0.63 0.00 0.00 28.75 29.59 1lfg h GLU 276 CO -0.03 -0.59 -0.25 0.87 -0.73 0.00 0.00 179.01 178.27 1lfg h LYS 277 N -0.94 0.59 0.00 1.92 1.57 -1.00 -3.38 116.57 115.33 1lfg h LYS 277 Ca -0.09 -0.32 -0.01 0.00 -1.87 0.00 0.00 60.65 58.35 1lfg h LYS 277 Cb 0.72 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.02 1lfg h LYS 277 CO 0.16 0.91 -0.26 1.19 -0.57 0.00 0.00 179.45 180.88 1lfg n PHE 278 N -4.35 0.00 -1.97 -1.35 3.72 0.27 -3.90 117.46 109.87 1lfg n PHE 278 Ca -0.05 -0.83 -0.29 0.00 -0.05 0.00 0.00 57.45 56.24 1lfg n PHE 278 Cb 0.44 -0.14 0.11 0.00 -0.94 0.00 0.00 39.48 38.95 1lfg n PHE 278 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1lfg s GLY 279 N -2.47 1.65 0.00 1.37 0.00 0.14 -0.89 107.32 107.11 1lfg s GLY 279 Ca 0.26 -0.83 0.00 0.00 0.00 0.00 0.00 44.72 44.16 1lfg s GLY 279 CO -0.01 -0.29 0.00 1.17 0.00 0.00 0.00 173.10 173.97 1lfg n LYS 280 N -3.33 0.00 -2.44 2.90 0.00 -1.26 -2.70 118.16 111.32 1lfg n LYS 280 Ca 0.10 0.00 -0.20 0.00 0.00 0.00 0.00 58.31 58.21 1lfg n LYS 280 Cb 0.61 0.00 0.02 0.00 0.00 0.00 0.00 35.03 35.65 1lfg n LYS 280 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1lfg n ASP 281 N 0.00 -2.82 0.00 3.14 -0.08 -1.26 -4.92 116.55 110.61 1lfg n ASP 281 Ca 0.00 -0.15 0.00 0.00 -1.51 0.00 0.00 54.79 53.13 1lfg n ASP 281 Cb 0.00 -0.84 0.00 0.00 2.34 0.00 0.00 41.12 42.62 1lfg n ASP 281 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1lfg n LYS 282 N -0.30 3.95 -3.62 -0.67 5.02 -1.10 -5.08 118.16 116.37 1lfg n LYS 282 Ca -0.06 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.21 1lfg n LYS 282 Cb 0.36 -0.60 -0.05 0.00 -0.02 0.00 0.00 35.03 34.72 1lfg n LYS 282 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1lfg s SER 283 N -0.62 -1.03 0.09 4.39 0.01 -1.25 -4.79 113.70 110.50 1lfg s SER 283 Ca 0.00 1.46 0.28 0.00 1.31 0.00 0.00 55.95 58.99 1lfg s SER 283 Cb 0.00 2.04 1.03 0.00 0.21 0.00 0.00 66.02 69.30 1lfg s SER 283 CO 0.00 -0.21 1.85 -0.81 0.41 0.00 0.00 173.24 174.48 1lfg n PRO 284 N 5.14 0.12 0.04 12.44 -0.04 -1.26 -3.19 135.00 148.25 1lfg n PRO 284 Ca -0.13 0.10 -0.13 0.00 -0.04 0.00 0.00 63.50 63.30 1lfg n PRO 284 Cb 0.51 -1.64 -0.08 0.00 -0.04 0.00 0.00 33.50 32.26 1lfg n PRO 284 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1lfg h LYS 285 N 0.00 -0.05 -2.85 0.54 1.57 -1.99 -3.45 116.57 110.34 1lfg h LYS 285 Ca 0.00 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.66 1lfg h LYS 285 Cb 0.61 0.01 -0.23 0.00 0.08 0.00 0.00 32.23 32.70 1lfg h LYS 285 CO 0.00 0.10 -0.27 0.12 -0.57 0.00 0.00 179.45 178.84 1lfg s PHE 286 N -5.62 -0.37 -0.25 -1.35 5.36 -1.19 -5.12 117.98 109.43 1lfg s PHE 286 Ca -0.14 0.86 0.01 0.00 -0.96 0.00 0.00 56.93 56.69 1lfg s PHE 286 Cb 0.05 0.14 0.04 0.00 -0.34 0.00 0.00 43.02 42.91 1lfg s PHE 286 CO 0.66 -0.25 -0.09 -0.65 -1.46 0.00 0.00 175.22 173.43 1lfg s GLN 287 N -0.14 2.53 0.31 10.12 -0.21 -1.26 -4.44 119.66 126.56 1lfg s GLN 287 Ca -0.03 -1.17 0.02 0.00 0.02 0.00 0.00 55.36 54.20 1lfg s GLN 287 Cb -0.03 -2.92 0.57 0.00 1.00 0.00 0.00 33.01 31.63 1lfg s GLN 287 CO 0.01 -0.48 1.91 1.25 -2.12 0.00 0.00 175.29 175.86 1lfg h LEU 288 N 7.89 0.87 -3.90 2.90 5.85 -1.34 -2.68 115.31 124.90 1lfg h LEU 288 Ca -0.27 0.01 -0.61 0.00 0.84 0.00 0.00 57.88 57.85 1lfg h LEU 288 Cb 1.08 -0.18 -0.32 0.00 0.37 0.00 0.00 40.66 41.61 1lfg h LEU 288 CO 0.53 0.55 0.38 0.49 -0.34 0.00 0.00 178.44 180.04 1lfg n PHE 289 N -4.49 2.99 -3.80 1.25 3.72 -1.26 -4.68 117.46 111.18 1lfg n PHE 289 Ca 0.14 -2.68 -0.10 0.00 -0.05 0.00 0.00 57.45 54.76 1lfg n PHE 289 Cb 0.22 -1.09 -0.07 0.00 -0.94 0.00 0.00 39.48 37.60 1lfg n PHE 289 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1lfg s GLY 290 N -2.29 -0.02 0.12 1.37 0.00 -1.01 -1.10 107.32 104.39 1lfg s GLY 290 Ca 0.60 -0.30 0.11 0.00 0.00 0.00 0.00 44.72 45.13 1lfg s GLY 290 CO 0.01 -0.49 -0.27 -0.56 0.00 0.00 0.00 173.10 171.79 1lfg s SER 291 N -2.42 3.27 0.74 1.64 0.01 -1.26 -4.83 113.70 110.85 1lfg s SER 291 Ca -0.01 -0.74 -0.15 0.00 1.31 0.00 0.00 55.95 56.36 1lfg s SER 291 Cb 0.01 -0.22 0.01 0.00 0.21 0.00 0.00 66.02 66.03 1lfg s SER 291 CO -0.07 0.18 0.89 -2.65 0.41 0.00 0.00 173.24 172.00 1lfg n PRO 292 N 0.97 0.39 -0.32 12.44 -0.02 -1.26 -4.84 135.00 142.36 1lfg n PRO 292 Ca -0.18 0.19 0.30 0.00 -2.02 0.00 0.00 63.50 61.79 1lfg n PRO 292 Cb 0.53 -2.16 0.53 0.00 -0.02 0.00 0.00 33.50 32.38 1lfg n PRO 292 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1lfg n SER 293 N -1.61 0.26 -0.34 2.55 2.88 -1.26 -1.60 113.62 114.50 1lfg n SER 293 Ca 0.12 1.36 0.12 0.00 -1.33 0.00 0.00 58.87 59.14 1lfg n SER 293 Cb 0.50 -0.66 0.25 0.00 -0.75 0.00 0.00 64.21 63.55 1lfg n SER 293 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1lfg n GLY 294 N -1.29 -0.38 3.86 0.46 0.00 -1.26 -5.00 105.19 101.57 1lfg n GLY 294 Ca 0.33 -0.49 -0.22 0.00 0.00 0.00 0.00 46.02 45.65 1lfg n GLY 294 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1lfg s GLN 295 N -2.48 2.43 -0.08 1.61 -1.52 -0.63 -5.15 119.66 113.84 1lfg s GLN 295 Ca 0.23 -1.66 -0.05 0.00 -1.95 0.00 0.00 55.36 51.92 1lfg s GLN 295 Cb 0.19 -2.27 0.03 0.00 -0.22 0.00 0.00 33.01 30.74 1lfg s GLN 295 CO 0.53 -0.26 0.20 0.15 -0.25 0.00 0.00 175.29 175.66 1lfg s LYS 296 N -4.13 0.18 -1.11 2.91 -0.14 -1.26 -4.75 119.74 111.43 1lfg s LYS 296 Ca 0.45 0.39 -0.21 0.00 -1.36 0.00 0.00 55.97 55.25 1lfg s LYS 296 Cb -0.02 -0.06 -0.00 0.00 -1.68 0.00 0.00 37.83 36.07 1lfg s LYS 296 CO 0.26 -0.12 0.77 -0.25 -0.76 0.00 0.00 175.35 175.26 1lfg n ASP 297 N 3.79 -5.30 -4.69 2.83 8.00 -1.26 -4.94 116.55 114.97 1lfg n ASP 297 Ca -0.21 -1.01 -0.40 0.00 0.71 0.00 0.00 54.79 53.88 1lfg n ASP 297 Cb 0.55 -3.19 -0.05 0.00 -0.02 0.00 0.00 41.12 38.41 1lfg n ASP 297 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1lfg s LEU 298 N -6.41 4.23 0.00 0.64 2.01 -1.26 -4.28 118.68 113.61 1lfg s LEU 298 Ca 0.44 0.99 0.00 0.00 0.01 0.00 0.00 54.13 55.57 1lfg s LEU 298 Cb -0.17 -2.96 0.00 0.00 0.01 0.00 0.00 46.19 43.07 1lfg s LEU 298 CO 0.87 -0.18 0.00 0.18 1.01 0.00 0.00 176.35 178.23 1lfg n LEU 299 N 4.34 0.00 -4.05 1.79 4.77 -1.26 -4.78 117.00 117.81 1lfg n LEU 299 Ca -0.02 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.88 1lfg n LEU 299 Cb 0.51 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.51 1lfg n LEU 299 CO 0.45 0.00 -0.24 -0.36 -1.33 0.00 0.00 177.39 175.92 1lfg s PHE 300 N 0.00 0.56 0.20 -1.77 0.08 -1.26 -4.49 117.98 111.29 1lfg s PHE 300 Ca 0.00 -1.00 -0.30 0.00 0.12 0.00 0.00 56.93 55.75 1lfg s PHE 300 Cb 0.00 -0.31 -0.09 0.00 -0.57 0.00 0.00 43.02 42.05 1lfg s PHE 300 CO 0.00 -0.51 1.41 0.21 -0.10 0.00 0.00 175.22 176.23 1lfg s LYS 301 N -3.96 4.30 0.36 0.44 2.36 -1.26 -4.34 119.74 117.63 1lfg s LYS 301 Ca 0.14 2.20 -0.27 0.00 -2.55 0.00 0.00 55.97 55.49 1lfg s LYS 301 Cb 0.07 -3.17 -0.09 0.00 -1.05 0.00 0.00 37.83 33.58 1lfg s LYS 301 CO -0.04 -0.40 1.23 -0.51 1.55 0.00 0.00 175.35 177.18 1lfg s ASP 302 N 0.62 6.69 -0.36 1.43 1.01 -1.26 -2.29 116.67 122.51 1lfg s ASP 302 Ca 0.61 2.52 0.00 0.00 0.71 0.00 0.00 52.55 56.39 1lfg s ASP 302 Cb -0.40 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 40.90 1lfg s ASP 302 CO 0.37 -0.57 0.00 -1.20 0.21 0.00 0.00 175.17 173.98 1lfg n SER 303 N 0.53 -3.77 -4.79 0.27 7.64 -0.26 -5.01 113.62 108.23 1lfg n SER 303 Ca 0.02 0.08 -0.31 0.00 1.01 0.00 0.00 58.87 59.67 1lfg n SER 303 Cb 0.44 -1.57 0.07 0.00 -1.01 0.00 0.00 64.21 62.14 1lfg n SER 303 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1lfg s ALA 304 N -2.01 2.42 -0.38 -0.43 0.00 -0.97 -4.77 121.76 115.62 1lfg s ALA 304 Ca 0.00 0.23 0.12 0.00 0.00 0.00 0.00 51.96 52.31 1lfg s ALA 304 Cb 0.00 -3.24 -0.15 0.00 0.00 0.00 0.00 23.12 19.73 1lfg s ALA 304 CO 0.00 -1.53 0.42 0.44 0.00 0.00 0.00 175.76 175.09 1lfg n ILE 305 N -3.28 0.00 -3.65 0.00 -5.35 -0.10 -4.78 119.36 102.19 1lfg n ILE 305 Ca 0.09 -0.24 0.00 0.00 -0.27 0.00 0.00 62.75 62.33 1lfg n ILE 305 Cb 0.53 0.76 0.00 0.00 -1.74 0.00 0.00 39.64 39.19 1lfg n ILE 305 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1lfg n GLY 306 N 1.45 -0.59 3.45 3.28 0.00 -1.25 -4.69 105.19 106.83 1lfg n GLY 306 Ca 0.01 -0.95 -0.23 0.00 0.00 0.00 0.00 46.02 44.85 1lfg n GLY 306 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1lfg s PHE 307 N -3.00 2.13 -0.08 1.61 0.08 -1.26 -2.13 117.98 115.33 1lfg s PHE 307 Ca 0.00 -0.46 -0.01 0.00 0.12 0.00 0.00 56.93 56.58 1lfg s PHE 307 Cb 0.00 -1.02 0.03 0.00 -0.57 0.00 0.00 43.02 41.45 1lfg s PHE 307 CO 0.00 0.56 -0.03 0.45 -0.10 0.00 0.00 175.22 176.10 1lfg s SER 308 N -3.47 1.68 0.34 1.36 0.15 -0.11 -4.88 113.70 108.77 1lfg s SER 308 Ca 0.29 -0.16 -0.28 0.00 0.70 0.00 0.00 55.95 56.50 1lfg s SER 308 Cb -0.02 -0.57 -0.10 0.00 -1.71 0.00 0.00 66.02 63.63 1lfg s SER 308 CO 0.13 -0.15 1.28 -0.60 1.20 0.00 0.00 173.24 175.10 1lfg s ARG 309 N 1.73 4.29 -0.30 5.44 3.52 -1.26 -0.68 118.95 131.69 1lfg s ARG 309 Ca 0.02 2.14 -0.14 0.00 -0.13 0.00 0.00 55.73 57.62 1lfg s ARG 309 Cb -0.13 -3.00 -0.03 0.00 -1.56 0.00 0.00 34.95 30.24 1lfg s ARG 309 CO -0.05 -0.21 0.34 0.08 -0.81 0.00 0.00 175.30 174.65 1lfg s VAL 310 N -1.18 5.19 0.21 7.11 1.01 -0.63 -4.88 120.40 127.21 1lfg s VAL 310 Ca 0.50 0.31 -0.32 0.00 0.00 0.00 0.00 61.98 62.47 1lfg s VAL 310 Cb -0.38 -3.72 -0.15 0.00 0.00 0.00 0.00 36.38 32.13 1lfg s VAL 310 CO 0.50 0.07 1.21 -2.65 0.00 0.00 0.00 175.10 174.23 1lfg n PRO 311 N 5.32 1.42 0.07 2.72 -0.02 -1.26 -4.82 135.00 138.43 1lfg n PRO 311 Ca -0.09 0.50 0.21 0.00 -2.02 0.00 0.00 63.50 62.10 1lfg n PRO 311 Cb 0.50 -2.02 0.71 0.00 -0.02 0.00 0.00 33.50 32.67 1lfg n PRO 311 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1lfg h PRO 312 N 3.40 0.00 0.00 0.52 0.11 -1.95 -1.61 132.00 132.47 1lfg h PRO 312 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1lfg h PRO 312 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1lfg h PRO 312 CO 0.70 0.00 0.00 -2.13 -0.21 0.00 0.00 178.00 176.36 1lfg n ARG 313 N -3.60 0.34 -2.92 1.05 3.00 -1.26 -4.83 116.66 108.44 1lfg n ARG 313 Ca 0.08 0.03 -0.40 0.00 -0.00 0.00 0.00 57.85 57.56 1lfg n ARG 313 Cb 0.71 -1.50 -0.04 0.00 0.00 0.00 0.00 32.46 31.62 1lfg n ARG 313 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1lfg s ILE 314 N -2.62 4.91 0.47 5.15 1.01 -0.61 -5.02 121.20 124.49 1lfg s ILE 314 Ca 0.24 1.69 0.04 0.00 0.00 0.00 0.00 60.65 62.62 1lfg s ILE 314 Cb 0.18 -4.15 -0.03 0.00 0.01 0.00 0.00 42.46 38.47 1lfg s ILE 314 CO 0.42 0.25 0.06 1.51 0.00 0.00 0.00 174.94 177.18 1lfg s ASP 315 N 0.64 4.14 0.13 3.58 -4.77 -1.26 -4.69 116.67 114.44 1lfg s ASP 315 Ca 0.42 -1.47 -0.24 0.00 -3.30 0.00 0.00 52.55 47.96 1lfg s ASP 315 Cb -0.19 0.13 -0.03 0.00 -1.09 0.00 0.00 42.92 41.73 1lfg s ASP 315 CO 0.22 -0.72 1.64 0.77 0.70 0.00 0.00 175.17 177.78 1lfg h SER 316 N 1.43 -0.70 -0.41 2.11 4.64 -1.90 0.24 113.55 118.96 1lfg h SER 316 Ca -0.43 0.11 0.09 0.00 -0.47 0.00 0.00 61.79 61.08 1lfg h SER 316 Cb 1.28 0.30 -0.09 0.00 -0.31 0.00 0.00 62.40 63.59 1lfg h SER 316 CO 0.74 -0.29 -0.26 1.23 -0.87 0.00 0.00 176.83 177.39 1lfg h GLY 317 N -0.32 -0.05 2.00 -0.77 0.00 -1.95 0.60 103.07 102.59 1lfg h GLY 317 Ca 0.09 0.33 -0.05 0.00 0.00 0.00 0.00 47.33 47.69 1lfg h GLY 317 CO -0.26 -0.21 -0.22 1.41 0.00 0.00 0.00 176.54 177.26 1lfg h LEU 318 N -0.18 0.00 -0.12 3.11 3.38 -1.70 -2.66 115.31 117.15 1lfg h LEU 318 Ca 0.19 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.93 1lfg h LEU 318 Cb 0.49 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.25 1lfg h LEU 318 CO -0.52 0.22 -0.82 0.22 0.09 0.00 0.00 178.44 177.64 1lfg h TYR 319 N 0.00 1.05 -0.01 1.13 5.03 0.19 -3.20 116.97 121.15 1lfg h TYR 319 Ca -0.00 -0.49 -0.11 0.00 2.58 0.00 0.00 58.73 60.71 1lfg h TYR 319 Cb 0.48 -0.15 -0.01 0.00 1.55 0.00 0.00 36.73 38.59 1lfg h TYR 319 CO 0.00 1.32 -0.51 -0.07 -1.32 0.00 0.00 178.16 177.58 1lfg h LEU 320 N 0.48 0.03 0.00 2.82 3.38 0.36 -3.46 115.31 118.91 1lfg h LEU 320 Ca -0.07 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1lfg h LEU 320 Cb 1.46 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.20 1lfg h LEU 320 CO 0.17 0.53 0.00 0.61 0.09 0.00 0.00 178.44 179.84 1lfg n GLY 321 N -0.07 1.03 0.29 0.83 0.00 -1.03 -4.22 105.19 102.02 1lfg n GLY 321 Ca -0.02 -1.66 -0.09 0.00 0.00 0.00 0.00 46.02 44.26 1lfg n GLY 321 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1lfg h SER 322 N 0.00 0.96 0.33 1.61 4.64 -1.82 0.68 113.55 119.95 1lfg h SER 322 Ca 0.00 -0.26 -0.01 0.00 -0.47 0.00 0.00 61.79 61.05 1lfg h SER 322 Cb 0.00 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 61.82 1lfg h SER 322 CO 0.00 0.98 -0.33 1.23 -0.87 0.00 0.00 176.83 177.84 1lfg h GLY 323 N 0.91 -1.07 0.86 -0.77 0.00 -1.88 -1.73 103.07 99.38 1lfg h GLY 323 Ca 0.18 0.49 -0.02 0.00 0.00 0.00 0.00 47.33 47.99 1lfg h GLY 323 CO 0.01 -0.34 -0.17 -1.82 0.00 0.00 0.00 176.54 174.23 1lfg h TYR 324 N -0.66 -0.43 -1.00 5.60 3.20 -1.73 0.35 116.97 122.29 1lfg h TYR 324 Ca -0.04 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 61.94 1lfg h TYR 324 Cb 0.57 0.14 -0.09 0.00 1.54 0.00 0.00 36.73 38.90 1lfg h TYR 324 CO -0.19 -0.18 0.63 0.35 -1.64 0.00 0.00 178.16 177.13 1lfg h PHE 325 N -0.61 1.13 0.00 -3.82 3.57 0.28 -1.54 116.94 115.95 1lfg h PHE 325 Ca -0.05 0.03 -0.23 0.00 3.53 0.00 0.00 57.97 61.26 1lfg h PHE 325 Cb 0.44 -0.36 -0.03 0.00 2.79 0.00 0.00 35.95 38.79 1lfg h PHE 325 CO -0.02 0.44 -1.15 1.79 -2.23 0.00 0.00 178.31 177.14 1lfg h THR 326 N 0.98 1.53 -0.84 4.41 1.35 -0.97 -3.16 112.91 116.21 1lfg h THR 326 Ca 0.50 -3.27 0.03 0.00 -0.55 0.00 0.00 66.41 63.11 1lfg h THR 326 Cb 0.50 2.76 -0.05 0.00 -1.73 0.00 0.00 68.15 69.64 1lfg h THR 326 CO -0.27 0.87 0.55 0.00 -0.25 0.00 0.00 175.52 176.42 1lfg h ALA 327 N 1.00 1.46 0.23 6.62 0.00 -0.29 0.22 119.26 128.50 1lfg h ALA 327 Ca -0.07 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1lfg h ALA 327 Cb 1.82 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1lfg h ALA 327 CO 0.12 0.47 -0.11 0.82 0.00 0.00 0.00 179.25 180.55 1lfg h ILE 328 N 1.07 0.84 -0.83 0.00 2.04 -1.30 -2.98 117.51 116.35 1lfg h ILE 328 Ca 0.33 -0.49 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 1lfg h ILE 328 Cb -0.02 1.12 -0.04 0.00 -0.74 0.00 0.00 36.82 37.14 1lfg h ILE 328 CO -0.09 0.11 0.46 1.56 0.00 0.00 0.00 178.15 180.18 1lfg h GLN 329 N -0.56 1.15 0.00 2.37 4.20 -1.48 -1.83 115.11 118.95 1lfg h GLN 329 Ca -0.03 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.55 1lfg h GLN 329 Cb 0.41 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 27.97 1lfg h GLN 329 CO 0.05 0.84 0.00 0.09 -0.67 0.00 0.00 178.83 179.14 1lfg n ASN 330 N -4.34 0.00 0.19 1.46 5.03 0.75 -2.16 115.26 116.19 1lfg n ASN 330 Ca 0.09 0.20 0.09 0.00 0.87 0.00 0.00 54.58 55.83 1lfg n ASN 330 Cb 0.09 -0.31 0.15 0.00 -1.02 0.00 0.00 39.78 38.69 1lfg n ASN 330 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 1lfg h LEU 331 N 0.00 0.00 -3.62 3.41 3.38 -1.33 -3.10 115.31 114.06 1lfg h LEU 331 Ca 0.00 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 1lfg h LEU 331 Cb 0.09 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.74 1lfg h LEU 331 CO 0.00 0.19 0.18 0.54 0.09 0.00 0.00 178.44 179.45 1lfg n ARG 332 N -3.16 3.43 -4.18 1.13 1.74 -0.92 -4.79 116.66 109.91 1lfg n ARG 332 Ca 0.03 -3.07 -0.16 0.00 -0.77 0.00 0.00 57.85 53.88 1lfg n ARG 332 Cb 0.59 -2.12 -0.11 0.00 -1.02 0.00 0.00 32.46 29.80 1lfg n ARG 332 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1lfg s LYS 333 N -3.00 0.86 0.93 5.56 1.02 -1.17 -4.85 119.74 119.09 1lfg s LYS 333 Ca 0.52 -1.09 -0.12 0.00 0.02 0.00 0.00 55.97 55.31 1lfg s LYS 333 Cb 0.42 -0.70 0.15 0.00 -0.52 0.00 0.00 37.83 37.18 1lfg s LYS 333 CO 0.11 0.13 1.09 -1.54 -0.92 0.00 0.00 175.35 174.23 1lfg s SER 334 N -2.17 3.21 0.48 2.83 1.04 -1.26 -4.79 113.70 113.05 1lfg s SER 334 Ca 0.03 1.34 0.24 0.00 0.48 0.00 0.00 55.95 58.04 1lfg s SER 334 Cb -0.06 -2.01 1.24 0.00 0.10 0.00 0.00 66.02 65.28 1lfg s SER 334 CO 0.01 -2.78 2.00 -0.33 0.98 0.00 0.00 173.24 173.12 1lfg h GLU 335 N -1.65 0.00 0.21 4.02 5.08 -1.91 -1.68 114.58 118.65 1lfg h GLU 335 Ca -0.51 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 57.57 1lfg h GLU 335 Cb 1.30 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.58 1lfg h GLU 335 CO 0.56 0.18 -1.23 0.93 -1.00 0.00 0.00 179.01 178.45 1lfg h GLU 336 N 0.00 0.45 -0.03 2.33 3.07 -1.98 -0.89 114.58 117.53 1lfg h GLU 336 Ca -0.00 -0.76 -0.13 0.00 -0.50 0.00 0.00 59.36 57.96 1lfg h GLU 336 Cb 0.43 0.28 -0.02 0.00 -0.84 0.00 0.00 28.75 28.61 1lfg h GLU 336 CO 0.02 1.37 -0.59 1.49 -1.40 0.00 0.00 179.01 179.89 1lfg h GLU 337 N -0.06 0.10 -0.20 2.33 4.81 -1.90 -1.63 114.58 118.04 1lfg h GLU 337 Ca -0.22 -0.07 -0.19 0.00 -0.13 0.00 0.00 59.36 58.75 1lfg h GLU 337 Cb 1.96 0.01 0.00 0.00 0.63 0.00 0.00 28.75 31.36 1lfg h GLU 337 CO 0.23 0.66 -0.65 0.28 -0.73 0.00 0.00 179.01 178.79 1lfg h VAL 338 N 0.07 1.30 0.00 0.32 2.07 -1.31 -2.69 116.25 116.01 1lfg h VAL 338 Ca -0.01 -1.88 -0.09 0.00 0.82 0.00 0.00 66.70 65.55 1lfg h VAL 338 Cb 1.07 1.84 -0.01 0.00 -1.52 0.00 0.00 31.29 32.66 1lfg h VAL 338 CO 0.08 0.60 -0.41 0.00 0.02 0.00 0.00 177.57 177.86 1lfg h ALA 339 N 0.72 0.97 -0.07 1.67 0.00 -0.92 -2.62 119.26 119.01 1lfg h ALA 339 Ca -0.02 -0.37 -0.16 0.00 0.00 0.00 0.00 54.91 54.37 1lfg h ALA 339 Cb 1.25 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1lfg h ALA 339 CO 0.13 0.51 -0.65 0.00 0.00 0.00 0.00 179.25 179.24 1lfg h ALA 340 N 1.59 0.77 0.00 0.00 0.00 -1.27 -2.62 119.26 117.73 1lfg h ALA 340 Ca -0.00 -0.57 -0.16 0.00 0.00 0.00 0.00 54.91 54.18 1lfg h ALA 340 Cb 0.95 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1lfg h ALA 340 CO 0.05 0.75 -0.74 -0.09 0.00 0.00 0.00 179.25 179.23 1lfg h ARG 341 N 0.19 0.00 0.01 0.00 9.65 -1.32 -2.74 114.38 120.17 1lfg h ARG 341 Ca -0.01 0.00 -0.19 0.00 -1.10 0.00 0.00 59.98 58.68 1lfg h ARG 341 Cb 1.18 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.74 1lfg h ARG 341 CO 0.10 0.74 -0.87 0.00 2.80 0.00 0.00 179.97 182.74 1lfg h ARG 342 N 0.00 0.10 0.03 0.20 3.08 -1.40 -3.29 114.38 113.12 1lfg h ARG 342 Ca -0.01 -0.12 -0.24 0.00 0.07 0.00 0.00 59.98 59.68 1lfg h ARG 342 Cb 1.43 0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.52 1lfg h ARG 342 CO 0.10 0.91 -1.02 0.00 -1.07 0.00 0.00 179.97 178.88 1lfg h ALA 343 N 1.05 0.30 -2.55 0.04 0.00 -1.50 -3.47 119.26 113.13 1lfg h ALA 343 Ca -0.03 -0.75 -0.48 0.00 0.00 0.00 0.00 54.91 53.66 1lfg h ALA 343 Cb 1.51 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.27 1lfg h ALA 343 CO 0.12 0.85 0.35 0.50 0.00 0.00 0.00 179.25 181.07 1lfg s ARG 344 N -3.12 4.67 -0.28 0.00 3.52 -1.04 -4.94 118.95 117.76 1lfg s ARG 344 Ca -0.05 1.38 -0.08 0.00 -0.13 0.00 0.00 55.73 56.85 1lfg s ARG 344 Cb 0.08 -2.95 -0.01 0.00 -1.56 0.00 0.00 34.95 30.51 1lfg s ARG 344 CO 0.87 0.35 0.10 0.08 -0.81 0.00 0.00 175.30 175.90 1lfg s VAL 345 N -1.48 4.32 -0.30 7.11 1.01 0.43 -4.94 120.40 126.56 1lfg s VAL 345 Ca 0.47 -0.38 -0.13 0.00 0.00 0.00 0.00 61.98 61.94 1lfg s VAL 345 Cb -0.21 -3.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.01 1lfg s VAL 345 CO 0.26 0.19 0.29 -0.69 0.00 0.00 0.00 175.10 175.15 1lfg s VAL 346 N 1.59 5.23 0.06 2.92 1.01 -1.26 -0.73 120.40 129.22 1lfg s VAL 346 Ca 0.05 0.19 -0.20 0.00 0.00 0.00 0.00 61.98 62.02 1lfg s VAL 346 Cb -0.16 -3.68 -0.06 0.00 0.00 0.00 0.00 36.38 32.48 1lfg s VAL 346 CO 0.04 0.10 0.60 0.86 0.00 0.00 0.00 175.10 176.71 1lfg s TRP 347 N 1.90 3.78 -0.23 5.22 -0.11 0.15 -0.29 118.94 129.36 1lfg s TRP 347 Ca 0.10 1.30 -0.09 0.00 1.22 0.00 0.00 56.10 58.63 1lfg s TRP 347 Cb -0.16 -2.57 -0.04 0.00 -1.50 0.00 0.00 33.47 29.20 1lfg s TRP 347 CO 0.11 0.50 0.11 0.00 -4.62 0.00 0.00 176.95 173.05 1lfg s ALA 349 N 1.16 3.70 -0.53 0.00 0.00 -1.11 -4.67 121.76 120.31 1lfg s ALA 349 Ca 0.06 -0.64 -0.08 0.00 0.00 0.00 0.00 51.96 51.30 1lfg s ALA 349 Cb -0.14 -2.18 0.14 0.00 0.00 0.00 0.00 23.12 20.94 1lfg s ALA 349 CO 0.04 0.23 0.39 0.08 0.00 0.00 0.00 175.76 176.51 1lfg s VAL 350 N 0.13 4.16 0.00 0.00 1.01 -1.26 -1.07 120.40 123.37 1lfg s VAL 350 Ca 0.11 -2.12 0.00 0.00 0.00 0.00 0.00 61.98 59.97 1lfg s VAL 350 Cb -0.12 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.54 1lfg s VAL 350 CO 0.00 -0.81 0.00 0.61 0.00 0.00 0.00 175.10 174.90 1lfg n GLY 351 N 4.50 1.38 0.24 4.51 0.00 -0.86 -4.28 105.19 110.68 1lfg n GLY 351 Ca -0.02 -1.81 -0.00 0.00 0.00 0.00 0.00 46.02 44.19 1lfg n GLY 351 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1lfg h GLU 352 N 0.00 0.46 -0.35 1.61 3.07 -1.93 -1.09 114.58 116.35 1lfg h GLU 352 Ca 0.00 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.81 1lfg h GLU 352 Cb 0.00 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 27.79 1lfg h GLU 352 CO 0.00 0.30 0.14 1.96 -1.40 0.00 0.00 179.01 180.01 1lfg h GLN 353 N 0.47 0.52 -0.34 2.33 4.20 -1.98 -0.36 115.11 119.95 1lfg h GLN 353 Ca 0.30 -0.10 -0.07 0.00 0.06 0.00 0.00 58.65 58.85 1lfg h GLN 353 Cb 0.33 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 1lfg h GLN 353 CO -0.27 0.51 -0.07 0.93 -0.67 0.00 0.00 178.83 179.26 1lfg h GLU 354 N 0.41 0.56 -0.15 1.46 5.08 -1.63 -2.41 114.58 117.91 1lfg h GLU 354 Ca 0.11 -0.15 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1lfg h GLU 354 Cb 0.19 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1lfg h GLU 354 CO -0.01 0.64 0.08 1.25 -1.00 0.00 0.00 179.01 179.97 1lfg h LEU 355 N 0.52 0.12 -0.02 1.33 5.85 -0.15 0.07 115.31 123.04 1lfg h LEU 355 Ca 0.10 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.86 1lfg h LEU 355 Cb 0.44 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.39 1lfg h LEU 355 CO 0.02 0.09 -0.45 0.03 -0.34 0.00 0.00 178.44 177.79 1lfg h ARG 356 N 0.17 -0.57 -0.74 1.25 3.08 -1.08 0.91 114.38 117.39 1lfg h ARG 356 Ca 0.06 0.04 0.03 0.00 0.07 0.00 0.00 59.98 60.18 1lfg h ARG 356 Cb 0.00 0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.13 1lfg h ARG 356 CO -0.03 -0.38 0.47 -0.22 -1.07 0.00 0.00 179.97 178.74 1lfg h LYS 357 N -0.59 0.89 -0.38 0.04 3.64 -1.18 -1.74 116.57 117.25 1lfg h LYS 357 Ca 0.04 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.39 1lfg h LYS 357 Cb 0.67 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 32.26 1lfg h LYS 357 CO -0.34 0.59 0.20 0.00 -2.27 0.00 0.00 179.45 177.63 1lfg h ASN 359 N 0.41 -0.95 -0.71 0.00 2.35 0.12 0.16 115.58 116.97 1lfg h ASN 359 Ca 0.15 0.18 0.13 0.00 -0.55 0.00 0.00 56.30 56.21 1lfg h ASN 359 Cb 0.04 0.46 -0.13 0.00 0.05 0.00 0.00 38.32 38.74 1lfg h ASN 359 CO -0.09 -0.29 -0.28 1.56 -1.65 0.00 0.00 177.43 176.67 1lfg h GLN 360 N -0.21 -0.08 -0.37 0.81 4.20 -0.92 0.09 115.11 118.63 1lfg h GLN 360 Ca 0.18 0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.82 1lfg h GLN 360 Cb 0.51 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.29 1lfg h GLN 360 CO -0.52 -0.05 -0.11 2.35 -0.67 0.00 0.00 178.83 179.82 1lfg h TRP 361 N -0.08 0.69 0.36 2.96 7.01 -0.71 -3.25 115.95 122.93 1lfg h TRP 361 Ca 0.30 -0.12 -0.01 0.00 2.11 0.00 0.00 58.89 61.17 1lfg h TRP 361 Cb 0.56 -0.18 -0.01 0.00 -2.10 0.00 0.00 29.16 27.43 1lfg h TRP 361 CO -0.65 0.73 -0.26 1.03 -2.79 0.00 0.00 178.44 176.50 1lfg h SER 362 N 0.59 -0.66 -0.03 2.65 0.87 0.13 -2.95 113.55 114.15 1lfg h SER 362 Ca 0.10 0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.72 1lfg h SER 362 Cb 0.54 0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 62.70 1lfg h SER 362 CO 0.03 -0.39 0.03 1.23 -0.53 0.00 0.00 176.83 177.20 1lfg h GLY 363 N -0.61 0.00 -2.05 5.77 0.00 -1.50 -1.89 103.07 102.80 1lfg h GLY 363 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.30 1lfg h GLY 363 CO 0.01 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.59 1lfg n LEU 364 N -3.83 3.13 -0.64 3.11 4.32 -1.13 -4.37 117.00 117.58 1lfg n LEU 364 Ca -0.02 -1.38 0.13 0.00 -0.02 0.00 0.00 56.01 54.72 1lfg n LEU 364 Cb 0.12 -0.25 0.38 0.00 -1.62 0.00 0.00 43.42 42.05 1lfg n LEU 364 CO 0.27 0.69 0.79 -1.54 -1.22 0.00 0.00 177.39 176.38 1lfg n SER 365 N 1.26 2.01 -3.76 -1.43 3.41 -0.71 -4.98 113.62 109.42 1lfg n SER 365 Ca 0.19 -1.67 -0.24 0.00 -0.26 0.00 0.00 58.87 56.89 1lfg n SER 365 Cb 0.55 -0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.51 1lfg n SER 365 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1lfg n GLU 366 N 0.58 -3.59 -0.93 4.33 1.02 -1.26 -2.62 120.64 118.16 1lfg n GLU 366 Ca 0.17 0.53 0.00 0.00 -0.02 0.00 0.00 57.16 57.84 1lfg n GLU 366 Cb 0.44 -4.79 0.00 0.00 -0.02 0.00 0.00 31.44 27.07 1lfg n GLU 366 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1lfg n GLY 367 N -1.72 0.14 0.07 0.62 0.00 -1.26 -4.91 105.19 98.15 1lfg n GLY 367 Ca -0.26 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.70 1lfg n GLY 367 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1lfg h SER 368 N 0.00 0.00 -4.20 1.61 4.64 -1.83 -3.45 113.55 110.32 1lfg h SER 368 Ca 0.00 0.00 -0.69 0.00 -0.47 0.00 0.00 61.79 60.63 1lfg h SER 368 Cb 0.62 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 62.42 1lfg h SER 368 CO 0.00 0.94 -0.85 -0.69 -0.87 0.00 0.00 176.83 175.35 1lfg s VAL 369 N -2.71 2.37 0.12 0.95 1.01 -1.26 -0.43 120.40 120.45 1lfg s VAL 369 Ca -0.00 -0.97 0.02 0.00 0.00 0.00 0.00 61.98 61.03 1lfg s VAL 369 Cb 0.09 -1.87 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 1lfg s VAL 369 CO 0.81 0.58 -0.06 0.28 0.00 0.00 0.00 175.10 176.71 1lfg s THR 370 N -0.44 0.74 -0.07 3.92 -1.32 0.09 -4.50 115.64 114.06 1lfg s THR 370 Ca 0.05 -1.96 0.01 0.00 -1.21 0.00 0.00 61.69 58.58 1lfg s THR 370 Cb -0.12 -1.77 -0.03 0.00 -1.51 0.00 0.00 72.50 69.07 1lfg s THR 370 CO 0.01 -0.80 -0.07 0.00 -2.21 0.00 0.00 174.62 171.55 1lfg s SER 372 N -0.72 2.00 0.18 0.00 0.15 -0.25 -4.88 113.70 110.18 1lfg s SER 372 Ca 0.11 -1.17 -0.19 0.00 0.70 0.00 0.00 55.95 55.40 1lfg s SER 372 Cb -0.11 -0.03 0.04 0.00 -1.71 0.00 0.00 66.02 64.21 1lfg s SER 372 CO 0.02 -0.44 0.55 -0.94 1.20 0.00 0.00 173.24 173.63 1lfg s SER 373 N -3.30 -0.35 0.26 5.45 1.04 -1.26 -2.73 113.70 112.81 1lfg s SER 373 Ca 0.26 -0.33 -0.20 0.00 0.48 0.00 0.00 55.95 56.17 1lfg s SER 373 Cb 0.05 0.59 0.02 0.00 0.10 0.00 0.00 66.02 66.77 1lfg s SER 373 CO 0.08 -1.03 0.67 0.00 0.98 0.00 0.00 173.24 173.93 1lfg s ALA 374 N -3.83 -1.09 -2.00 5.32 0.00 -0.23 -4.91 121.76 115.01 1lfg s ALA 374 Ca 0.06 -0.34 0.22 0.00 0.00 0.00 0.00 51.96 51.90 1lfg s ALA 374 Cb -0.01 0.88 -0.01 0.00 0.00 0.00 0.00 23.12 23.99 1lfg s ALA 374 CO -0.06 -0.99 1.07 -1.13 0.00 0.00 0.00 175.76 174.65 1lfg n SER 375 N -0.44 2.02 -4.24 0.00 3.41 -1.26 -2.03 113.62 111.07 1lfg n SER 375 Ca -0.05 -1.51 -0.15 0.00 -0.26 0.00 0.00 58.87 56.90 1lfg n SER 375 Cb 0.60 0.47 -0.10 0.00 -0.26 0.00 0.00 64.21 64.91 1lfg n SER 375 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1lfg s THR 376 N -2.40 1.21 0.19 6.66 -4.23 -1.26 -4.52 115.64 111.29 1lfg s THR 376 Ca 0.18 -1.92 -0.08 0.00 -1.18 0.00 0.00 61.69 58.69 1lfg s THR 376 Cb 0.18 -1.71 0.05 0.00 1.34 0.00 0.00 72.50 72.35 1lfg s THR 376 CO 0.55 -0.63 1.62 0.74 -0.54 0.00 0.00 174.62 176.36 1lfg h THR 377 N 3.06 1.27 -0.29 3.99 2.02 -1.92 -2.73 112.91 118.31 1lfg h THR 377 Ca -0.37 -1.26 0.03 0.00 0.77 0.00 0.00 66.41 65.58 1lfg h THR 377 Cb 1.19 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.57 1lfg h THR 377 CO 0.59 0.44 0.09 -0.33 0.37 0.00 0.00 175.52 176.68 1lfg h GLU 378 N 0.85 0.21 -0.35 6.66 5.08 -1.97 -0.40 114.58 124.65 1lfg h GLU 378 Ca 0.13 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 1lfg h GLU 378 Cb 0.67 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 1lfg h GLU 378 CO 0.05 0.14 0.12 -0.44 -1.00 0.00 0.00 179.01 177.87 1lfg h ASP 379 N 0.21 0.45 0.34 1.42 3.32 -1.97 -1.62 116.42 118.58 1lfg h ASP 379 Ca 0.13 -0.05 -0.19 0.00 0.02 0.00 0.00 57.03 56.94 1lfg h ASP 379 Cb 0.11 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.54 1lfg h ASP 379 CO -0.14 0.43 -0.80 0.00 -1.72 0.00 0.00 179.24 177.01 1lfg h ILE 381 N 0.23 1.25 -0.27 0.00 2.04 -0.34 -1.66 117.51 118.77 1lfg h ILE 381 Ca -0.04 -1.07 0.01 0.00 1.00 0.00 0.00 64.86 64.76 1lfg h ILE 381 Cb 1.39 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 38.35 1lfg h ILE 381 CO 0.13 0.38 0.14 0.00 0.00 0.00 0.00 178.15 178.80 1lfg h ALA 382 N 1.20 0.32 -0.99 1.87 0.00 -1.25 -1.20 119.26 119.21 1lfg h ALA 382 Ca 0.14 0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.11 1lfg h ALA 382 Cb 0.50 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 1lfg h ALA 382 CO 0.03 -0.25 0.64 -0.07 0.00 0.00 0.00 179.25 179.59 1lfg h LEU 383 N 0.29 1.03 -0.88 0.00 3.38 -1.14 0.17 115.31 118.17 1lfg h LEU 383 Ca 0.11 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 1lfg h LEU 383 Cb 0.02 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1lfg h LEU 383 CO -0.06 0.67 -0.43 -0.37 0.09 0.00 0.00 178.44 178.33 1lfg h VAL 384 N 1.18 1.01 -0.13 1.22 -1.51 -0.82 -1.67 116.25 115.52 1lfg h VAL 384 Ca 0.42 -1.67 -0.04 0.00 -1.23 0.00 0.00 66.70 64.18 1lfg h VAL 384 Cb 0.13 1.99 -0.00 0.00 -2.13 0.00 0.00 31.29 31.27 1lfg h VAL 384 CO -0.16 0.42 -0.08 -0.07 -1.23 0.00 0.00 177.57 176.45 1lfg h LEU 385 N 0.00 0.30 0.00 4.19 3.38 0.45 -2.72 115.31 120.91 1lfg h LEU 385 Ca -0.00 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1lfg h LEU 385 Cb 0.95 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.62 1lfg h LEU 385 CO 0.06 0.67 0.00 0.29 0.09 0.00 0.00 178.44 179.55 1lfg n LYS 386 N -4.65 0.52 -0.83 1.13 5.02 0.06 -3.70 118.16 115.72 1lfg n LYS 386 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 1lfg n LYS 386 Cb 0.30 -1.28 0.00 0.00 -0.02 0.00 0.00 35.03 34.03 1lfg n LYS 386 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1lfg n GLY 387 N 0.04 0.65 0.00 0.72 0.00 -1.03 -4.82 105.19 100.74 1lfg n GLY 387 Ca 0.07 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.19 1lfg n GLY 387 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1lfg n GLU 388 N -1.99 0.08 -3.67 1.61 2.13 -0.68 -4.74 120.64 113.38 1lfg n GLU 388 Ca 0.00 0.14 -0.12 0.00 0.66 0.00 0.00 57.16 57.84 1lfg n GLU 388 Cb 0.00 -1.50 -0.06 0.00 0.27 0.00 0.00 31.44 30.15 1lfg n GLU 388 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1lfg s ALA 389 N -2.88 -0.93 -0.06 4.31 0.00 -0.89 -4.93 121.76 116.39 1lfg s ALA 389 Ca 0.12 0.17 0.05 0.00 0.00 0.00 0.00 51.96 52.30 1lfg s ALA 389 Cb 0.13 0.42 -0.07 0.00 0.00 0.00 0.00 23.12 23.60 1lfg s ALA 389 CO 0.35 -0.49 0.02 -0.25 0.00 0.00 0.00 175.76 175.38 1lfg n ASP 390 N 0.34 3.60 -3.52 0.00 8.00 0.60 -4.06 116.55 121.51 1lfg n ASP 390 Ca -0.18 -0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.22 1lfg n ASP 390 Cb 0.61 0.61 -0.02 0.00 -0.02 0.00 0.00 41.12 42.29 1lfg n ASP 390 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1lfg s ALA 391 N -2.14 -1.64 0.03 2.24 0.00 -0.91 -4.16 121.76 115.17 1lfg s ALA 391 Ca -0.03 0.56 -0.27 0.00 0.00 0.00 0.00 51.96 52.22 1lfg s ALA 391 Cb 0.02 0.70 0.09 0.00 0.00 0.00 0.00 23.12 23.93 1lfg s ALA 391 CO 0.23 -0.79 0.78 0.00 0.00 0.00 0.00 175.76 175.98 1lfg s MET 392 N -3.51 0.97 0.01 0.00 0.23 -1.22 0.77 119.30 116.55 1lfg s MET 392 Ca 0.04 -0.25 -0.24 0.00 -1.03 0.00 0.00 55.69 54.21 1lfg s MET 392 Cb -0.02 0.45 -0.05 0.00 -1.53 0.00 0.00 34.83 33.68 1lfg s MET 392 CO -0.08 -0.40 0.73 0.45 -2.03 0.00 0.00 175.02 173.69 1lfg s SER 393 N -2.29 7.13 0.05 -1.18 0.15 -1.26 -1.14 113.70 115.16 1lfg s SER 393 Ca 0.01 1.35 0.03 0.00 0.70 0.00 0.00 55.95 58.04 1lfg s SER 393 Cb -0.01 -2.44 -0.02 0.00 -1.71 0.00 0.00 66.02 61.83 1lfg s SER 393 CO -0.07 -0.01 -0.10 -0.76 1.20 0.00 0.00 173.24 173.50 1lfg s LEU 394 N 0.15 2.25 0.69 3.45 1.43 0.14 -4.94 118.68 121.84 1lfg s LEU 394 Ca 0.38 -0.55 -0.16 0.00 -1.03 0.00 0.00 54.13 52.77 1lfg s LEU 394 Cb -0.20 -0.27 0.02 0.00 0.03 0.00 0.00 46.19 45.77 1lfg s LEU 394 CO 0.21 -0.15 1.20 -0.62 0.23 0.00 0.00 176.35 177.22 1lfg s ASP 395 N -1.55 4.55 0.60 2.29 2.15 -1.26 -1.10 116.67 122.36 1lfg s ASP 395 Ca -0.07 2.33 0.35 0.00 0.43 0.00 0.00 52.55 55.58 1lfg s ASP 395 Cb -0.10 -2.59 1.94 0.00 -0.30 0.00 0.00 42.92 41.87 1lfg s ASP 395 CO 0.01 -2.02 2.25 1.23 -0.17 0.00 0.00 175.17 176.47 1lfg h GLY 396 N 0.04 0.00 0.93 2.66 0.00 -1.80 -2.30 103.07 102.60 1lfg h GLY 396 Ca -0.48 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.84 1lfg h GLY 396 CO 0.52 0.00 -0.05 -1.33 0.00 0.00 0.00 176.54 175.68 1lfg h GLY 397 N 0.27 -0.13 2.00 4.60 0.00 -1.91 -3.03 103.07 104.87 1lfg h GLY 397 Ca -0.00 0.05 -0.14 0.00 0.00 0.00 0.00 47.33 47.24 1lfg h GLY 397 CO 0.00 -0.05 -0.68 -0.97 0.00 0.00 0.00 176.54 174.85 1lfg h TYR 398 N -0.20 0.00 0.00 5.60 0.05 -1.59 -2.73 116.97 118.11 1lfg h TYR 398 Ca -0.01 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.76 1lfg h TYR 398 Cb 0.16 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.90 1lfg h TYR 398 CO -0.05 0.68 -0.05 0.28 -1.05 0.00 0.00 178.16 177.97 1lfg h VAL 399 N 0.00 0.19 0.16 -2.88 2.07 -1.33 -0.15 116.25 114.31 1lfg h VAL 399 Ca -0.01 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.06 1lfg h VAL 399 Cb 1.35 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 1lfg h VAL 399 CO 0.09 0.05 -0.08 0.22 0.02 0.00 0.00 177.57 177.87 1lfg h TYR 400 N 0.00 -0.20 -0.17 1.57 3.20 -1.37 -1.54 116.97 118.47 1lfg h TYR 400 Ca -0.00 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.89 1lfg h TYR 400 Cb 0.36 0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.67 1lfg h TYR 400 CO 0.00 0.24 -0.02 1.15 -1.64 0.00 0.00 178.16 177.89 1lfg h THR 401 N -0.82 0.87 -0.88 1.81 2.02 -1.56 0.20 112.91 114.55 1lfg h THR 401 Ca -0.02 -0.01 0.01 0.00 0.77 0.00 0.00 66.41 67.16 1lfg h THR 401 Cb 0.53 0.83 -0.04 0.00 -1.74 0.00 0.00 68.15 67.72 1lfg h THR 401 CO 0.04 0.01 0.58 0.00 0.37 0.00 0.00 175.52 176.51 1lfg h ALA 402 N 1.15 1.12 -0.32 6.16 0.00 -1.09 -2.12 119.26 124.16 1lfg h ALA 402 Ca 0.08 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.78 1lfg h ALA 402 Cb 0.10 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 1lfg h ALA 402 CO -0.15 0.50 -0.39 0.78 0.00 0.00 0.00 179.25 180.00 1lfg h GLY 403 N 1.18 0.90 1.27 0.00 0.00 -0.88 -0.60 103.07 104.93 1lfg h GLY 403 Ca 0.32 -0.96 0.10 0.00 0.00 0.00 0.00 47.33 46.80 1lfg h GLY 403 CO -0.07 0.87 0.27 0.50 0.00 0.00 0.00 176.54 178.10 1lfg h LYS 404 N 0.60 0.00 -0.17 4.80 1.79 -0.06 1.03 116.57 124.56 1lfg h LYS 404 Ca 0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.51 1lfg h LYS 404 Cb 0.99 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.64 1lfg h LYS 404 CO 0.09 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 178.46 1lfg n GLY 406 N 0.90 0.89 3.87 0.00 0.00 0.35 -5.04 105.19 106.17 1lfg n GLY 406 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 1lfg n GLY 406 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lfg s LEU 407 N 0.00 3.16 0.06 0.99 1.43 -0.28 -4.70 118.68 119.34 1lfg s LEU 407 Ca 0.00 1.36 0.06 0.00 -1.03 0.00 0.00 54.13 54.52 1lfg s LEU 407 Cb 0.00 -4.35 -0.03 0.00 0.03 0.00 0.00 46.19 41.84 1lfg s LEU 407 CO 0.00 -0.97 -0.17 0.68 0.23 0.00 0.00 176.35 176.11 1lfg s VAL 408 N -3.22 1.40 0.11 -1.59 -7.23 0.07 -4.19 120.40 105.75 1lfg s VAL 408 Ca 0.56 -1.22 -0.31 0.00 -1.81 0.00 0.00 61.98 59.20 1lfg s VAL 408 Cb -0.11 -1.26 -0.07 0.00 0.56 0.00 0.00 36.38 35.50 1lfg s VAL 408 CO 0.53 0.01 1.26 -2.16 -0.31 0.00 0.00 175.10 174.44 1lfg s PRO 409 N -1.40 4.41 -0.12 4.82 0.04 -1.26 -0.38 135.00 141.10 1lfg s PRO 409 Ca 0.04 1.90 0.01 0.00 0.04 0.00 0.00 61.00 62.98 1lfg s PRO 409 Cb -0.09 -3.29 -0.08 0.00 0.04 0.00 0.00 34.50 31.09 1lfg s PRO 409 CO 0.02 -0.28 -0.11 1.33 0.04 0.00 0.00 177.00 178.00 1lfg n VAL 410 N 3.58 0.69 -3.87 -0.36 0.24 0.32 -4.78 118.33 114.15 1lfg n VAL 410 Ca 0.09 -0.26 -0.11 0.00 -2.04 0.00 0.00 64.34 62.02 1lfg n VAL 410 Cb 0.45 -0.97 -0.10 0.00 -1.47 0.00 0.00 33.84 31.75 1lfg n VAL 410 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1lfg s LEU 411 N -5.76 1.55 0.08 1.34 1.43 -1.23 -4.47 118.68 111.63 1lfg s LEU 411 Ca -0.16 -0.20 0.05 0.00 -1.03 0.00 0.00 54.13 52.79 1lfg s LEU 411 Cb 0.04 0.67 -0.04 0.00 0.03 0.00 0.00 46.19 46.90 1lfg s LEU 411 CO 0.27 -0.37 -0.05 0.00 0.23 0.00 0.00 176.35 176.44 1lfg s ALA 412 N -1.38 3.12 -0.10 4.21 0.00 0.64 0.85 121.76 129.10 1lfg s ALA 412 Ca -0.15 -1.15 -0.30 0.00 0.00 0.00 0.00 51.96 50.36 1lfg s ALA 412 Cb -0.08 -1.07 -0.03 0.00 0.00 0.00 0.00 23.12 21.95 1lfg s ALA 412 CO 0.02 0.67 1.33 -1.21 0.00 0.00 0.00 175.76 176.56 1lfg s GLU 413 N -2.15 4.26 0.13 0.00 2.02 0.43 -0.98 118.70 122.41 1lfg s GLU 413 Ca 0.23 1.79 -0.21 0.00 0.02 0.00 0.00 54.97 56.80 1lfg s GLU 413 Cb -0.11 -3.72 -0.07 0.00 0.10 0.00 0.00 34.13 30.32 1lfg s GLU 413 CO 0.15 -0.65 0.65 1.21 0.02 0.00 0.00 175.26 176.64 1lfg s ASN 414 N 2.06 7.15 0.27 -0.19 3.84 0.18 -4.54 114.94 123.71 1lfg s ASN 414 Ca 0.59 1.39 0.05 0.00 0.21 0.00 0.00 52.86 55.10 1lfg s ASN 414 Cb -0.26 -2.40 -0.06 0.00 -0.55 0.00 0.00 41.25 37.98 1lfg s ASN 414 CO 0.20 0.21 -0.03 -0.31 -2.79 0.00 0.00 177.10 174.39 1lfg s TYR 415 N -1.20 1.83 0.62 0.43 2.02 -1.26 0.16 117.35 119.96 1lfg s TYR 415 Ca 0.33 -0.80 -0.15 0.00 -0.37 0.00 0.00 57.07 56.09 1lfg s TYR 415 Cb -0.20 -1.07 -0.13 0.00 -0.40 0.00 0.00 41.96 40.16 1lfg s TYR 415 CO 0.21 0.15 -0.38 1.17 -1.57 0.00 0.00 175.55 175.14 1lfg n LYS 416 N -0.54 0.00 -1.63 -0.62 4.81 -1.26 -4.89 118.16 114.03 1lfg n LYS 416 Ca -0.05 0.00 -0.05 0.00 -0.87 0.00 0.00 58.31 57.34 1lfg n LYS 416 Cb 0.64 -0.85 0.01 0.00 0.02 0.00 0.00 35.03 34.85 1lfg n LYS 416 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1lfg n SER 417 N 2.52 0.77 -0.78 3.14 3.41 -1.26 -4.92 113.62 116.50 1lfg n SER 417 Ca 0.03 -1.36 0.00 0.00 -0.26 0.00 0.00 58.87 57.27 1lfg n SER 417 Cb 0.43 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 1lfg n SER 417 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1lfg n ALA 418 N -2.82 1.67 -2.58 7.33 0.00 -1.26 -4.55 120.51 118.30 1lfg n ALA 418 Ca -0.03 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.34 1lfg n ALA 418 Cb 0.13 -1.00 0.03 0.00 0.00 0.00 0.00 19.45 18.61 1lfg n ALA 418 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1lfg n GLN 419 N 0.62 -1.26 0.00 0.00 3.00 -1.26 -5.03 117.38 113.45 1lfg n GLN 419 Ca 0.00 0.73 0.00 0.00 -0.01 0.00 0.00 57.00 57.72 1lfg n GLN 419 Cb 0.12 -4.25 0.00 0.00 0.00 0.00 0.00 30.24 26.11 1lfg n GLN 419 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 1lfg n SER 420 N -2.27 0.00 -4.55 1.08 3.41 -1.26 -5.06 113.62 104.97 1lfg n SER 420 Ca -0.03 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.20 1lfg n SER 420 Cb 0.55 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.55 1lfg n SER 420 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1lfg n SER 421 N -0.69 -0.04 -0.02 4.04 3.41 -1.26 -5.08 113.62 113.99 1lfg n SER 421 Ca 0.00 0.77 0.00 0.00 -0.26 0.00 0.00 58.87 59.38 1lfg n SER 421 Cb 0.00 -1.30 0.00 0.00 -0.26 0.00 0.00 64.21 62.65 1lfg n SER 421 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1lfg n ASP 422 N -0.28 0.00 -3.60 4.04 8.00 -1.26 -4.82 116.55 118.64 1lfg n ASP 422 Ca 0.13 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.23 1lfg n ASP 422 Cb 0.48 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.55 1lfg n ASP 422 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1lfg n PRO 423 N 0.00 2.38 -1.28 -0.24 -0.02 -1.26 -4.84 135.00 129.74 1lfg n PRO 423 Ca 0.00 -2.18 -0.58 0.00 -2.02 0.00 0.00 63.50 58.72 1lfg n PRO 423 Cb 0.00 -3.03 -0.12 0.00 -0.02 0.00 0.00 33.50 30.33 1lfg n PRO 423 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1lfg n ASP 424 N 6.16 0.71 0.03 2.55 -0.08 -1.26 -4.89 116.55 119.77 1lfg n ASP 424 Ca 0.53 0.63 0.14 0.00 -1.51 0.00 0.00 54.79 54.58 1lfg n ASP 424 Cb 0.35 -0.90 0.56 0.00 2.34 0.00 0.00 41.12 43.47 1lfg n ASP 424 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1lfg n PRO 425 N 7.61 0.07 -1.53 -0.67 -0.04 -1.26 -3.39 135.00 135.78 1lfg n PRO 425 Ca 0.56 0.05 -0.18 0.00 -0.04 0.00 0.00 63.50 63.90 1lfg n PRO 425 Cb -0.03 -1.58 0.09 0.00 -0.04 0.00 0.00 33.50 31.94 1lfg n PRO 425 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1lfg n ASN 426 N -1.69 4.40 0.21 3.54 4.13 -1.26 -4.75 115.26 119.84 1lfg n ASN 426 Ca 0.07 -3.79 0.04 0.00 1.68 0.00 0.00 54.58 52.58 1lfg n ASN 426 Cb 0.36 -0.50 0.46 0.00 -1.54 0.00 0.00 39.78 38.56 1lfg n ASN 426 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1lfg h VAL 428 N 0.00 0.19 -0.06 0.00 2.07 -1.85 -2.92 116.25 113.67 1lfg h VAL 428 Ca -0.00 -0.59 0.00 0.00 0.82 0.00 0.00 66.70 66.93 1lfg h VAL 428 Cb 0.42 1.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.69 1lfg h VAL 428 CO 0.03 0.06 0.00 0.47 0.02 0.00 0.00 177.57 178.15 1lfg n ASP 429 N -3.22 1.81 -4.60 0.57 8.00 -0.92 -2.16 116.55 116.03 1lfg n ASP 429 Ca -0.00 -1.48 -0.43 0.00 0.71 0.00 0.00 54.79 53.59 1lfg n ASP 429 Cb 0.30 -0.04 -0.02 0.00 -0.02 0.00 0.00 41.12 41.34 1lfg n ASP 429 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1lfg s ARG 430 N -0.66 3.73 0.41 -1.24 3.52 -0.90 -4.97 118.95 118.84 1lfg s ARG 430 Ca 0.09 0.56 -0.23 0.00 -0.13 0.00 0.00 55.73 56.01 1lfg s ARG 430 Cb 0.06 -3.90 -0.12 0.00 -1.56 0.00 0.00 34.95 29.43 1lfg s ARG 430 CO 0.08 -1.33 0.76 -2.30 -0.81 0.00 0.00 175.30 171.69 1lfg n PRO 431 N 7.71 0.89 -2.68 5.12 -0.02 -1.26 -4.91 135.00 139.84 1lfg n PRO 431 Ca 0.11 0.32 -0.36 0.00 -2.02 0.00 0.00 63.50 61.55 1lfg n PRO 431 Cb 0.49 -1.73 -0.05 0.00 -0.02 0.00 0.00 33.50 32.19 1lfg n PRO 431 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1lfg s VAL 432 N -1.36 4.01 -0.90 -1.45 -7.23 -1.26 -5.01 120.40 107.19 1lfg s VAL 432 Ca 0.63 1.56 0.08 0.00 -1.81 0.00 0.00 61.98 62.45 1lfg s VAL 432 Cb -0.60 -3.82 0.11 0.00 0.56 0.00 0.00 36.38 32.64 1lfg s VAL 432 CO 0.57 0.03 0.89 -0.62 -0.31 0.00 0.00 175.10 175.66 1lfg n GLU 433 N 0.15 0.98 0.00 4.82 1.02 -1.26 -5.07 120.64 121.28 1lfg n GLU 433 Ca 0.04 -1.26 0.00 0.00 -0.02 0.00 0.00 57.16 55.92 1lfg n GLU 433 Cb 0.50 -1.17 0.00 0.00 -0.02 0.00 0.00 31.44 30.76 1lfg n GLU 433 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1lfg n GLY 434 N 0.39 -0.72 3.45 0.62 0.00 -1.26 -4.98 105.19 102.69 1lfg n GLY 434 Ca 0.06 -1.67 -0.22 0.00 0.00 0.00 0.00 46.02 44.19 1lfg n GLY 434 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1lfg s TYR 435 N -2.31 1.98 -0.15 1.61 1.13 -0.27 -4.87 117.35 114.47 1lfg s TYR 435 Ca 0.00 -0.91 -0.04 0.00 -1.41 0.00 0.00 57.07 54.71 1lfg s TYR 435 Cb 0.00 -1.28 -0.03 0.00 -1.10 0.00 0.00 41.96 39.55 1lfg s TYR 435 CO 0.00 0.07 -0.00 -0.51 -2.51 0.00 0.00 175.55 172.60 1lfg s LEU 436 N -3.49 3.48 -0.17 -3.49 1.02 -1.26 -1.46 118.68 113.31 1lfg s LEU 436 Ca 0.35 -0.01 -0.22 0.00 0.02 0.00 0.00 54.13 54.27 1lfg s LEU 436 Cb 0.08 -1.84 -0.02 0.00 0.02 0.00 0.00 46.19 44.43 1lfg s LEU 436 CO 0.15 0.22 0.69 0.00 0.02 0.00 0.00 176.35 177.42 1lfg s ALA 437 N 0.09 3.51 0.24 4.21 0.00 0.64 -2.87 121.76 127.59 1lfg s ALA 437 Ca 0.02 -0.15 0.05 0.00 0.00 0.00 0.00 51.96 51.88 1lfg s ALA 437 Cb -0.13 -3.03 -0.05 0.00 0.00 0.00 0.00 23.12 19.91 1lfg s ALA 437 CO 0.02 -0.52 -0.05 0.14 0.00 0.00 0.00 175.76 175.35 1lfg s VAL 438 N 1.83 1.38 -0.29 0.00 -7.23 0.10 -0.05 120.40 116.13 1lfg s VAL 438 Ca 0.32 -2.09 -0.01 0.00 -1.81 0.00 0.00 61.98 58.39 1lfg s VAL 438 Cb -0.16 -2.33 0.05 0.00 0.56 0.00 0.00 36.38 34.50 1lfg s VAL 438 CO 0.12 -0.37 -0.03 0.00 -0.31 0.00 0.00 175.10 174.51 1lfg s ALA 439 N -3.19 2.76 -0.01 1.32 0.00 -1.26 -2.27 121.76 119.11 1lfg s ALA 439 Ca 0.27 -1.75 0.01 0.00 0.00 0.00 0.00 51.96 50.49 1lfg s ALA 439 Cb 0.04 -1.85 -0.04 0.00 0.00 0.00 0.00 23.12 21.27 1lfg s ALA 439 CO 0.09 -1.24 0.03 0.08 0.00 0.00 0.00 175.76 174.73 1lfg s VAL 440 N 1.22 4.40 0.11 0.00 1.01 -0.56 -1.77 120.40 124.82 1lfg s VAL 440 Ca -0.06 -0.51 -0.07 0.00 0.00 0.00 0.00 61.98 61.34 1lfg s VAL 440 Cb -0.20 -2.98 -0.01 0.00 0.00 0.00 0.00 36.38 33.19 1lfg s VAL 440 CO -0.02 0.37 0.18 0.68 0.00 0.00 0.00 175.10 176.31 1lfg s VAL 441 N -1.12 0.12 0.28 2.92 -7.23 -0.46 -1.81 120.40 113.10 1lfg s VAL 441 Ca 0.21 -1.42 -0.29 0.00 -1.81 0.00 0.00 61.98 58.66 1lfg s VAL 441 Cb -0.12 -1.62 -0.10 0.00 0.56 0.00 0.00 36.38 35.11 1lfg s VAL 441 CO 0.11 -0.55 1.09 -0.13 -0.31 0.00 0.00 175.10 175.32 1lfg s ARG 442 N -3.93 4.65 0.34 4.82 0.52 -1.26 0.73 118.95 124.81 1lfg s ARG 442 Ca 0.12 1.79 0.03 0.00 -0.52 0.00 0.00 55.73 57.15 1lfg s ARG 442 Cb 0.05 -3.19 0.64 0.00 0.52 0.00 0.00 34.95 32.96 1lfg s ARG 442 CO -0.06 0.22 1.96 -0.09 0.02 0.00 0.00 175.30 177.35 1lfg h ARG 443 N 3.84 0.86 -0.72 3.54 2.43 -0.93 -2.59 114.38 120.81 1lfg h ARG 443 Ca -0.47 -0.05 0.15 0.00 -0.81 0.00 0.00 59.98 58.81 1lfg h ARG 443 Cb 1.21 -0.19 -0.05 0.00 -0.42 0.00 0.00 29.97 30.52 1lfg h ARG 443 CO 0.67 0.57 0.49 0.77 -1.51 0.00 0.00 179.97 180.96 1lfg h SER 444 N 0.88 0.32 0.00 -3.80 0.02 -1.93 -3.15 113.55 105.90 1lfg h SER 444 Ca 0.32 0.02 -0.08 0.00 -0.84 0.00 0.00 61.79 61.20 1lfg h SER 444 Cb 0.14 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.60 1lfg h SER 444 CO -0.10 0.16 -0.02 0.47 -1.14 0.00 0.00 176.83 176.20 1lfg n ASP 445 N -4.46 3.14 -0.43 3.07 8.00 -0.98 -4.71 116.55 120.18 1lfg n ASP 445 Ca 0.14 -2.02 0.35 0.00 0.71 0.00 0.00 54.79 53.97 1lfg n ASP 445 Cb 0.55 -0.80 0.57 0.00 -0.02 0.00 0.00 41.12 41.42 1lfg n ASP 445 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1lfg n THR 446 N 2.45 -0.14 0.90 -3.53 -2.24 -1.19 -0.64 114.28 109.90 1lfg n THR 446 Ca 0.19 1.34 0.12 0.00 -2.27 0.00 0.00 64.05 63.44 1lfg n THR 446 Cb 0.48 -2.21 0.26 0.00 -2.10 0.00 0.00 70.33 66.77 1lfg n THR 446 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1lfg n SER 447 N -4.03 0.50 -4.66 3.42 3.41 -1.26 -4.89 113.62 106.11 1lfg n SER 447 Ca 0.33 -0.10 -0.43 0.00 -0.26 0.00 0.00 58.87 58.41 1lfg n SER 447 Cb 1.35 0.17 -0.02 0.00 -0.26 0.00 0.00 64.21 65.45 1lfg n SER 447 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1lfg s LEU 448 N -3.27 4.19 0.00 1.04 1.98 0.19 -4.91 118.68 117.90 1lfg s LEU 448 Ca 0.10 1.74 0.04 0.00 -2.89 0.00 0.00 54.13 53.13 1lfg s LEU 448 Cb 0.17 -3.54 -0.02 0.00 0.66 0.00 0.00 46.19 43.46 1lfg s LEU 448 CO 0.69 -0.78 0.15 0.35 -1.89 0.00 0.00 176.35 174.88 1lfg n THR 449 N 5.39 0.00 -0.01 3.68 -2.24 -1.26 -4.97 114.28 114.86 1lfg n THR 449 Ca 0.14 -2.19 -0.10 0.00 -2.27 0.00 0.00 64.05 59.62 1lfg n THR 449 Cb 0.45 0.84 -0.05 0.00 -2.10 0.00 0.00 70.33 69.47 1lfg n THR 449 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 175.07 174.25 1lfg h TRP 450 N 1.68 0.06 -1.06 4.78 -0.00 -1.80 -2.48 115.95 117.13 1lfg h TRP 450 Ca -0.28 0.01 0.30 0.00 -0.00 0.00 0.00 58.89 58.92 1lfg h TRP 450 Cb 1.11 -0.01 -0.05 0.00 -0.00 0.00 0.00 29.16 30.21 1lfg h TRP 450 CO 0.00 0.03 0.75 -0.91 -0.00 0.00 0.00 178.44 178.31 1lfg h ASN 451 N 0.09 0.09 -0.76 2.65 2.35 -1.90 -2.12 115.58 115.98 1lfg h ASN 451 Ca 0.05 0.02 -0.46 0.00 -0.55 0.00 0.00 56.30 55.36 1lfg h ASN 451 Cb 0.03 0.00 -0.42 0.00 0.05 0.00 0.00 38.32 37.98 1lfg h ASN 451 CO -0.06 0.02 -0.92 -1.54 -1.65 0.00 0.00 177.43 173.29 1lfg n SER 452 N -4.30 3.75 0.09 5.81 3.41 -0.96 -4.78 113.62 116.65 1lfg n SER 452 Ca 0.23 -3.20 -0.17 0.00 -0.26 0.00 0.00 58.87 55.47 1lfg n SER 452 Cb 1.07 -0.40 -0.14 0.00 -0.26 0.00 0.00 64.21 64.48 1lfg n SER 452 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 1lfg h VAL 453 N 3.24 1.36 -2.79 -3.33 3.04 -1.10 -3.43 116.25 113.24 1lfg h VAL 453 Ca 0.19 -2.94 -0.59 0.00 -1.01 0.00 0.00 66.70 62.36 1lfg h VAL 453 Cb 1.37 2.89 0.09 0.00 -2.01 0.00 0.00 31.29 33.64 1lfg h VAL 453 CO 0.59 0.86 0.49 0.29 -1.01 0.00 0.00 177.57 178.79 1lfg n LYS 454 N -3.52 1.91 -0.60 4.17 5.02 -1.26 -1.94 118.16 121.94 1lfg n LYS 454 Ca -0.12 0.67 0.00 0.00 -2.02 0.00 0.00 58.31 56.85 1lfg n LYS 454 Cb 1.04 -2.26 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 1lfg n LYS 454 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1lfg n GLY 455 N 1.59 1.20 0.00 0.72 0.00 -0.11 -4.97 105.19 103.62 1lfg n GLY 455 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1lfg n GLY 455 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1lfg n LYS 456 N -2.00 0.82 -3.76 1.61 4.01 -0.82 -2.93 118.16 115.09 1lfg n LYS 456 Ca 0.00 0.00 -0.35 0.00 -0.51 0.00 0.00 58.31 57.45 1lfg n LYS 456 Cb 0.00 0.00 -0.08 0.00 -0.51 0.00 0.00 35.03 34.44 1lfg n LYS 456 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1lfg s LYS 457 N -1.94 4.12 0.20 1.97 1.02 -1.26 -0.90 119.74 122.96 1lfg s LYS 457 Ca 0.00 -0.23 0.11 0.00 0.02 0.00 0.00 55.97 55.88 1lfg s LYS 457 Cb 0.00 -3.39 -0.04 0.00 -0.52 0.00 0.00 37.83 33.88 1lfg s LYS 457 CO 0.00 0.33 -0.22 -1.54 -0.92 0.00 0.00 175.35 173.00 1lfg s SER 458 N 0.27 3.55 -0.12 2.83 1.04 -0.66 0.11 113.70 120.71 1lfg s SER 458 Ca 0.08 -0.86 0.02 0.00 0.48 0.00 0.00 55.95 55.67 1lfg s SER 458 Cb -0.11 -0.31 0.02 0.00 0.10 0.00 0.00 66.02 65.71 1lfg s SER 458 CO -0.01 0.11 -0.16 0.00 0.98 0.00 0.00 173.24 174.16 1lfg s HIS 460 N 1.06 1.85 0.16 0.00 3.76 0.26 -1.97 115.29 120.41 1lfg s HIS 460 Ca -0.04 -0.41 -0.15 0.00 -0.15 0.00 0.00 55.06 54.31 1lfg s HIS 460 Cb -0.15 -1.03 0.07 0.00 1.11 0.00 0.00 32.58 32.58 1lfg s HIS 460 CO -0.03 0.20 1.78 1.79 -0.85 0.00 0.00 174.74 177.62 1lfg h THR 461 N 4.11 0.96 0.00 1.30 1.35 -1.73 -3.40 112.91 115.50 1lfg h THR 461 Ca -0.46 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.26 1lfg h THR 461 Cb 1.17 0.53 0.00 0.00 -1.73 0.00 0.00 68.15 68.13 1lfg h THR 461 CO 0.40 0.07 0.00 0.00 -0.25 0.00 0.00 175.52 175.74 1lfg n ALA 462 N -2.30 0.00 -1.88 6.62 0.00 -1.26 -0.67 120.51 121.02 1lfg n ALA 462 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.04 1lfg n ALA 462 Cb 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.53 1lfg n ALA 462 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1lfg s VAL 463 N -2.00 2.54 -0.01 0.00 0.11 -0.34 -3.22 120.40 117.48 1lfg s VAL 463 Ca 0.00 0.42 0.00 0.00 -2.93 0.00 0.00 61.98 59.47 1lfg s VAL 463 Cb 0.00 -3.27 0.00 0.00 -1.53 0.00 0.00 36.38 31.58 1lfg s VAL 463 CO 0.00 0.05 0.00 0.47 -3.33 0.00 0.00 175.10 172.29 1lfg n ASP 464 N 3.06 -3.04 -4.93 3.54 8.00 -1.26 -4.97 116.55 116.94 1lfg n ASP 464 Ca 0.10 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.33 1lfg n ASP 464 Cb 0.39 -0.56 -0.03 0.00 -0.02 0.00 0.00 41.12 40.90 1lfg n ASP 464 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1lfg s ARG 465 N -0.84 3.49 0.00 -1.24 0.52 -1.20 -3.97 118.95 115.71 1lfg s ARG 465 Ca 0.00 -0.44 0.00 0.00 -0.52 0.00 0.00 55.73 54.77 1lfg s ARG 465 Cb 0.00 -2.91 0.00 0.00 0.52 0.00 0.00 34.95 32.56 1lfg s ARG 465 CO 0.00 0.47 0.99 2.41 0.02 0.00 0.00 175.30 179.19 1lfg n THR 466 N -0.49 0.00 -0.19 0.02 -1.04 -1.26 -0.81 114.28 110.50 1lfg n THR 466 Ca -0.05 1.49 -0.08 0.00 -2.04 0.00 0.00 64.05 63.37 1lfg n THR 466 Cb 0.53 -2.44 0.02 0.00 -1.82 0.00 0.00 70.33 66.63 1lfg n THR 466 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1lfg h ALA 467 N -1.90 0.71 0.00 2.41 0.00 -1.90 -2.69 119.26 115.89 1lfg h ALA 467 Ca 0.00 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1lfg h ALA 467 Cb 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1lfg h ALA 467 CO 0.00 0.31 -0.26 0.78 0.00 0.00 0.00 179.25 180.08 1lfg h GLY 468 N 0.75 0.00 0.00 0.00 0.00 -1.64 -3.40 103.07 98.78 1lfg h GLY 468 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1lfg h GLY 468 CO -0.02 0.00 0.00 1.87 0.00 0.00 0.00 176.54 178.39 1lfg n TRP 469 N -3.49 -2.94 -0.20 5.60 -0.00 0.01 -4.20 117.44 112.22 1lfg n TRP 469 Ca -0.00 0.68 -0.01 0.00 -0.00 0.00 0.00 57.50 58.17 1lfg n TRP 469 Cb 0.42 1.33 0.07 0.00 -0.00 0.00 0.00 31.31 33.13 1lfg n TRP 469 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 177.69 176.78 1lfg h ASN 470 N 0.00 -0.44 0.60 5.87 2.35 -1.13 -1.91 115.58 120.91 1lfg h ASN 470 Ca 0.00 0.17 -0.03 0.00 -0.55 0.00 0.00 56.30 55.89 1lfg h ASN 470 Cb 0.00 0.33 0.01 0.00 0.05 0.00 0.00 38.32 38.70 1lfg h ASN 470 CO 0.00 -0.17 -0.29 0.40 -1.65 0.00 0.00 177.43 175.73 1lfg h ILE 471 N 0.04 0.00 0.05 2.81 2.04 -1.74 0.15 117.51 120.86 1lfg h ILE 471 Ca 0.29 -0.25 0.02 0.00 1.00 0.00 0.00 64.86 65.92 1lfg h ILE 471 Cb 0.46 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 1lfg h ILE 471 CO -0.57 0.00 -0.19 1.55 0.00 0.00 0.00 178.15 178.93 1lfg h PRO 472 N -1.06 -0.33 -0.53 2.37 0.13 -1.75 -1.33 132.00 129.51 1lfg h PRO 472 Ca -0.08 0.02 -0.11 0.00 -0.87 0.00 0.00 66.00 64.96 1lfg h PRO 472 Cb 0.62 0.07 -0.02 0.00 0.13 0.00 0.00 31.00 31.80 1lfg h PRO 472 CO 0.14 -0.22 -0.12 0.52 -0.23 0.00 0.00 178.00 178.09 1lfg h MET 473 N -0.34 1.01 0.21 0.86 2.86 -1.49 -2.58 114.93 115.45 1lfg h MET 473 Ca 0.04 -0.37 -0.01 0.00 -2.06 0.00 0.00 59.70 57.30 1lfg h MET 473 Cb 0.39 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.99 1lfg h MET 473 CO -0.15 1.06 -0.10 0.78 1.06 0.00 0.00 176.91 179.56 1lfg h GLY 474 N 0.94 -0.29 0.76 8.32 0.00 -0.56 0.19 103.07 112.42 1lfg h GLY 474 Ca 0.14 0.11 0.04 0.00 0.00 0.00 0.00 47.33 47.61 1lfg h GLY 474 CO 0.05 -0.11 0.24 1.41 0.00 0.00 0.00 176.54 178.13 1lfg h LEU 475 N -0.28 0.35 -0.98 3.11 3.38 -1.22 -2.03 115.31 117.62 1lfg h LEU 475 Ca -0.03 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1lfg h LEU 475 Cb 0.22 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1lfg h LEU 475 CO 0.05 0.24 0.15 -0.07 0.09 0.00 0.00 178.44 178.90 1lfg h LEU 476 N 0.47 0.83 -0.88 1.67 3.38 -1.40 -3.01 115.31 116.38 1lfg h LEU 476 Ca 0.20 -0.15 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 1lfg h LEU 476 Cb 0.11 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1lfg h LEU 476 CO -0.14 0.80 -0.21 0.15 0.09 0.00 0.00 178.44 179.13 1lfg h PHE 477 N 0.85 0.66 0.00 1.13 3.57 -0.29 -1.77 116.94 121.09 1lfg h PHE 477 Ca 0.19 -0.14 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1lfg h PHE 477 Cb 0.30 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 38.87 1lfg h PHE 477 CO 0.02 0.76 0.00 -1.71 -2.23 0.00 0.00 178.31 175.15 1lfg n ASN 478 N -4.13 0.59 0.05 0.41 5.15 -0.79 -0.42 115.26 116.11 1lfg n ASN 478 Ca 0.00 0.64 0.10 0.00 -0.60 0.00 0.00 54.58 54.72 1lfg n ASN 478 Cb 0.40 -0.77 -0.08 0.00 -0.53 0.00 0.00 39.78 38.80 1lfg n ASN 478 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1lfg n GLN 479 N -2.15 0.63 0.00 1.20 6.02 -0.67 -4.64 117.38 117.77 1lfg n GLN 479 Ca 0.02 -0.01 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 1lfg n GLN 479 Cb 0.22 -1.69 0.00 0.00 1.02 0.00 0.00 30.24 29.80 1lfg n GLN 479 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1lfg n THR 480 N -2.52 0.00 -1.80 5.09 -2.24 -1.18 -5.01 114.28 106.62 1lfg n THR 480 Ca -0.03 -0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.64 1lfg n THR 480 Cb 0.60 1.80 -0.03 0.00 -2.10 0.00 0.00 70.33 70.60 1lfg n THR 480 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lfg n GLY 481 N 0.00 0.34 3.81 3.38 0.00 0.44 -4.91 105.19 108.26 1lfg n GLY 481 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1lfg n GLY 481 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1lfg s SER 482 N -1.94 7.08 0.00 1.61 0.15 -1.26 -4.93 113.70 114.40 1lfg s SER 482 Ca 0.00 1.42 0.23 0.00 0.70 0.00 0.00 55.95 58.30 1lfg s SER 482 Cb 0.00 -2.42 0.08 0.00 -1.71 0.00 0.00 66.02 61.97 1lfg s SER 482 CO 0.00 0.06 1.16 0.00 1.20 0.00 0.00 173.24 175.66 1lfg n LYS 484 N 0.50 3.12 0.28 0.00 5.02 -1.26 -4.76 118.16 121.07 1lfg n LYS 484 Ca 0.11 -2.95 0.17 0.00 -2.02 0.00 0.00 58.31 53.61 1lfg n LYS 484 Cb 0.52 -3.18 0.94 0.00 -0.02 0.00 0.00 35.03 33.29 1lfg n LYS 484 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 1lfg h PHE 485 N 6.03 0.00 -0.09 2.13 0.04 -2.01 -1.31 116.94 121.73 1lfg h PHE 485 Ca 0.50 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.27 1lfg h PHE 485 Cb 0.65 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.80 1lfg h PHE 485 CO 1.39 0.00 0.00 -0.40 -0.60 0.00 0.00 178.31 178.70 1lfg n ASP 486 N -3.71 0.53 -0.27 2.17 5.75 -1.26 -3.00 116.55 116.76 1lfg n ASP 486 Ca -0.02 -1.89 0.04 0.00 -0.01 0.00 0.00 54.79 52.91 1lfg n ASP 486 Cb 0.14 -0.06 0.02 0.00 -1.03 0.00 0.00 41.12 40.19 1lfg n ASP 486 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1lfg n GLU 487 N -0.27 0.50 0.19 0.11 1.02 -0.49 -4.62 120.64 117.08 1lfg n GLU 487 Ca 0.06 -0.85 0.04 0.00 -0.02 0.00 0.00 57.16 56.39 1lfg n GLU 487 Cb 0.10 -1.11 0.45 0.00 -0.02 0.00 0.00 31.44 30.86 1lfg n GLU 487 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 1lfg h TYR 488 N 1.33 0.07 -3.91 -0.32 -1.99 -1.64 -3.45 116.97 107.06 1lfg h TYR 488 Ca 0.00 -0.01 -0.23 0.00 2.00 0.00 0.00 58.73 60.49 1lfg h TYR 488 Cb 0.30 -0.02 -0.24 0.00 2.00 0.00 0.00 36.73 38.77 1lfg h TYR 488 CO 0.00 0.26 -0.72 -0.06 -0.00 0.00 0.00 178.16 177.64 1lfg s PHE 489 N -4.60 0.35 0.11 4.88 0.08 -1.26 -0.94 117.98 116.60 1lfg s PHE 489 Ca -0.04 -0.34 -0.27 0.00 0.12 0.00 0.00 56.93 56.39 1lfg s PHE 489 Cb 0.15 -0.22 -0.08 0.00 -0.57 0.00 0.00 43.02 42.30 1lfg s PHE 489 CO 0.71 -0.09 1.63 0.66 -0.10 0.00 0.00 175.22 178.03 1lfg h SER 490 N 5.13 -0.79 -5.13 1.36 4.64 -0.89 -3.45 113.55 114.41 1lfg h SER 490 Ca -0.31 0.09 -0.13 0.00 -0.47 0.00 0.00 61.79 60.97 1lfg h SER 490 Cb 1.21 0.30 -0.17 0.00 -0.31 0.00 0.00 62.40 63.43 1lfg h SER 490 CO 0.44 -0.37 -0.62 -1.10 -0.87 0.00 0.00 176.83 174.32 1lfg s GLN 491 N -6.05 0.55 0.35 4.77 -0.21 -1.23 -4.93 119.66 112.92 1lfg s GLN 491 Ca -0.16 -0.93 -0.10 0.00 0.02 0.00 0.00 55.36 54.20 1lfg s GLN 491 Cb 0.08 0.20 0.02 0.00 1.00 0.00 0.00 33.01 34.32 1lfg s GLN 491 CO 0.65 -0.12 0.62 -1.12 -2.12 0.00 0.00 175.29 173.20 1lfg s SER 492 N -2.36 0.41 -0.34 5.90 0.01 -0.94 -1.66 113.70 114.72 1lfg s SER 492 Ca -0.02 -1.26 -0.01 0.00 1.31 0.00 0.00 55.95 55.97 1lfg s SER 492 Cb 0.01 0.74 0.11 0.00 0.21 0.00 0.00 66.02 67.09 1lfg s SER 492 CO -0.06 -1.45 0.15 0.00 0.41 0.00 0.00 173.24 172.28 1lfg s ALA 494 N 1.40 2.78 0.20 0.00 0.00 -0.58 0.91 121.76 126.46 1lfg s ALA 494 Ca 0.13 -3.25 -0.31 0.00 0.00 0.00 0.00 51.96 48.52 1lfg s ALA 494 Cb -0.19 -1.92 -0.15 0.00 0.00 0.00 0.00 23.12 20.85 1lfg s ALA 494 CO -0.18 -2.04 1.08 -2.30 0.00 0.00 0.00 175.76 172.31 1lfg n PRO 495 N 2.33 1.12 -0.18 0.00 -0.02 -1.26 -2.79 135.00 134.20 1lfg n PRO 495 Ca 0.24 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1lfg n PRO 495 Cb 0.41 -1.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 1lfg n PRO 495 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1lfg n GLY 496 N 1.80 0.91 3.66 -1.23 0.00 -0.16 -1.19 105.19 108.97 1lfg n GLY 496 Ca 0.14 -0.02 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 1lfg n GLY 496 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1lfg n SER 497 N 0.04 2.23 -4.67 1.61 7.64 -1.12 -4.89 113.62 114.46 1lfg n SER 497 Ca 0.00 -2.57 -0.43 0.00 1.01 0.00 0.00 58.87 56.88 1lfg n SER 497 Cb 0.00 -0.27 -0.02 0.00 -1.01 0.00 0.00 64.21 62.91 1lfg n SER 497 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1lfg s ASP 498 N -4.27 7.07 0.06 6.43 -1.08 -1.26 -4.89 116.67 118.73 1lfg s ASP 498 Ca 0.47 1.57 0.06 0.00 -0.52 0.00 0.00 52.55 54.13 1lfg s ASP 498 Cb -0.04 -2.54 0.31 0.00 -1.46 0.00 0.00 42.92 39.18 1lfg s ASP 498 CO 0.30 -0.65 1.19 -0.81 0.52 0.00 0.00 175.17 175.72 1lfg n PRO 499 N 6.05 0.03 0.02 4.34 -0.04 -1.26 -0.57 135.00 143.57 1lfg n PRO 499 Ca 0.12 0.49 0.11 0.00 -0.04 0.00 0.00 63.50 64.19 1lfg n PRO 499 Cb 0.46 -1.59 0.09 0.00 -0.04 0.00 0.00 33.50 32.42 1lfg n PRO 499 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1lfg n ALA 500 N -1.56 3.51 -1.84 0.55 0.00 -1.26 -4.81 120.51 115.10 1lfg n ALA 500 Ca 0.00 -0.39 -0.31 0.00 0.00 0.00 0.00 53.44 52.74 1lfg n ALA 500 Cb 0.03 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.46 1lfg n ALA 500 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1lfg s SER 501 N -3.62 6.24 0.31 0.00 1.04 0.26 -4.98 113.70 112.96 1lfg s SER 501 Ca 0.07 1.47 0.00 0.00 0.48 0.00 0.00 55.95 57.97 1lfg s SER 501 Cb 0.15 -2.48 0.51 0.00 0.10 0.00 0.00 66.02 64.30 1lfg s SER 501 CO 0.77 -0.86 1.91 0.78 0.98 0.00 0.00 173.24 176.82 1lfg h ASN 502 N -0.09 0.75 0.03 7.02 4.21 -1.88 -1.06 115.58 124.55 1lfg h ASN 502 Ca -0.45 -0.08 0.00 0.00 1.21 0.00 0.00 56.30 56.99 1lfg h ASN 502 Cb 1.19 -0.19 0.00 0.00 -1.12 0.00 0.00 38.32 38.20 1lfg h ASN 502 CO 0.61 0.65 0.00 0.18 -1.29 0.00 0.00 177.43 177.58 1lfg n LEU 503 N -4.35 0.04 0.00 1.61 4.77 -1.26 -0.52 117.00 117.28 1lfg n LEU 503 Ca 0.05 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 1lfg n LEU 503 Cb 0.14 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 1lfg n LEU 503 CO 0.38 -0.51 0.27 0.00 -1.33 0.00 0.00 177.39 176.20 1lfg h ALA 505 N 0.00 1.09 -0.03 0.00 0.00 0.06 -2.46 119.26 117.92 1lfg h ALA 505 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1lfg h ALA 505 Cb 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1lfg h ALA 505 CO 0.00 0.00 -0.02 1.28 0.00 0.00 0.00 179.25 180.51 1lfg n LEU 506 N -3.22 2.89 -4.77 0.00 4.77 0.44 -4.95 117.00 112.17 1lfg n LEU 506 Ca -0.03 -0.99 -0.38 0.00 -0.03 0.00 0.00 56.01 54.58 1lfg n LEU 506 Cb 0.09 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.14 1lfg n LEU 506 CO 0.22 0.49 0.76 0.00 -1.33 0.00 0.00 177.39 177.52 1lfg n ILE 508 N 0.49 0.00 -3.56 0.00 -5.35 -1.26 -4.82 119.36 104.87 1lfg n ILE 508 Ca 0.02 -0.42 0.00 0.00 -0.27 0.00 0.00 62.75 62.09 1lfg n ILE 508 Cb 0.47 1.17 -0.00 0.00 -1.74 0.00 0.00 39.64 39.54 1lfg n ILE 508 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1lfg n GLY 509 N 0.87 -1.98 3.47 3.28 0.00 -1.26 -4.58 105.19 104.99 1lfg n GLY 509 Ca 0.05 -1.38 -0.26 0.00 0.00 0.00 0.00 46.02 44.43 1lfg n GLY 509 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1lfg n ASP 510 N 0.15 0.11 0.24 1.61 5.68 0.15 -2.55 116.55 121.94 1lfg n ASP 510 Ca 0.00 -1.44 0.08 0.00 -0.50 0.00 0.00 54.79 52.93 1lfg n ASP 510 Cb 0.01 -0.91 0.44 0.00 -1.14 0.00 0.00 41.12 39.52 1lfg n ASP 510 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 1lfg h GLU 511 N 0.00 0.00 0.00 0.11 4.57 -1.88 0.27 114.58 117.65 1lfg h GLU 511 Ca -0.39 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.79 1lfg h GLU 511 Cb 1.07 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.66 1lfg h GLU 511 CO 0.27 0.00 -0.57 0.39 -1.18 0.00 0.00 179.01 177.92 1lfg n GLU 512 N -2.35 3.28 -0.35 1.92 -0.58 -1.26 -5.00 120.64 116.29 1lfg n GLU 512 Ca -0.01 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.72 1lfg n GLU 512 Cb 0.45 -1.02 0.00 0.00 -0.57 0.00 0.00 31.44 30.31 1lfg n GLU 512 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1lfg n GLY 513 N 1.29 0.80 3.07 0.62 0.00 0.96 -5.09 105.19 106.85 1lfg n GLY 513 Ca 0.02 -0.25 -0.17 0.00 0.00 0.00 0.00 46.02 45.62 1lfg n GLY 513 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1lfg n GLU 514 N -2.35 0.73 -1.79 1.61 -0.58 -1.26 -4.64 120.64 112.36 1lfg n GLU 514 Ca 0.00 -2.53 -0.19 0.00 -0.42 0.00 0.00 57.16 54.01 1lfg n GLU 514 Cb 0.00 -0.07 -0.06 0.00 -0.57 0.00 0.00 31.44 30.73 1lfg n GLU 514 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1lfg n ASN 515 N -2.32 -5.40 -4.72 1.62 3.02 -1.26 0.32 115.26 106.52 1lfg n ASN 515 Ca 0.09 0.34 -0.42 0.00 -0.03 0.00 0.00 54.58 54.56 1lfg n ASN 515 Cb 0.48 -4.56 -0.01 0.00 -0.61 0.00 0.00 39.78 35.08 1lfg n ASN 515 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1lfg n LYS 516 N -2.56 2.40 -1.30 3.52 4.01 -1.26 -2.40 118.16 120.57 1lfg n LYS 516 Ca -0.20 0.85 -0.12 0.00 -0.51 0.00 0.00 58.31 58.32 1lfg n LYS 516 Cb 0.65 -2.53 -0.05 0.00 -0.51 0.00 0.00 35.03 32.58 1lfg n LYS 516 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1lfg s VAL 518 N -1.98 3.78 -1.16 0.00 0.11 -1.01 -0.99 120.40 119.15 1lfg s VAL 518 Ca 0.00 1.29 -0.07 0.00 -2.93 0.00 0.00 61.98 60.27 1lfg s VAL 518 Cb 0.00 -3.63 -0.01 0.00 -1.53 0.00 0.00 36.38 31.21 1lfg s VAL 518 CO 0.00 -0.07 2.80 -0.81 -3.33 0.00 0.00 175.10 173.69 1lfg n PRO 519 N -0.30 3.69 -3.95 1.54 -0.04 -1.26 -4.55 135.00 130.13 1lfg n PRO 519 Ca 0.06 -2.57 -0.08 0.00 -0.04 0.00 0.00 63.50 60.86 1lfg n PRO 519 Cb 0.51 -2.55 -0.04 0.00 -0.04 0.00 0.00 33.50 31.37 1lfg n PRO 519 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1lfg s ASN 520 N 1.21 -0.15 0.00 3.54 2.20 -1.26 -4.59 114.94 115.89 1lfg s ASN 520 Ca 0.62 -0.83 0.00 0.00 -0.94 0.00 0.00 52.86 51.71 1lfg s ASN 520 Cb 0.22 0.63 0.00 0.00 -2.00 0.00 0.00 41.25 40.11 1lfg s ASN 520 CO -0.09 -1.21 0.55 -1.54 -2.94 0.00 0.00 177.10 171.88 1lfg n SER 521 N -0.41 0.00 0.18 3.54 3.41 -1.26 -1.35 113.62 117.73 1lfg n SER 521 Ca -0.02 0.14 0.13 0.00 -0.26 0.00 0.00 58.87 58.86 1lfg n SER 521 Cb 0.61 -0.14 0.33 0.00 -0.26 0.00 0.00 64.21 64.75 1lfg n SER 521 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1lfg h ASN 522 N 0.00 0.00 -3.58 4.04 2.35 -1.93 -3.39 115.58 113.08 1lfg h ASN 522 Ca 0.00 0.00 -0.63 0.00 -0.55 0.00 0.00 56.30 55.12 1lfg h ASN 522 Cb 0.13 0.00 -0.13 0.00 0.05 0.00 0.00 38.32 38.36 1lfg h ASN 522 CO 0.00 0.00 0.04 -0.70 -1.65 0.00 0.00 177.43 175.12 1lfg s GLU 523 N -3.23 3.85 0.48 0.81 2.56 -0.46 -1.92 118.70 120.78 1lfg s GLU 523 Ca 0.07 0.14 0.20 0.00 0.00 0.00 0.00 54.97 55.39 1lfg s GLU 523 Cb 0.08 -3.74 1.21 0.00 2.00 0.00 0.00 34.13 33.68 1lfg s GLU 523 CO 0.61 -0.54 1.97 0.00 -0.56 0.00 0.00 175.26 176.74 1lfg h ARG 524 N 8.25 0.21 -0.73 4.30 3.08 -1.70 -1.61 114.38 126.18 1lfg h ARG 524 Ca -0.28 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.76 1lfg h ARG 524 Cb 1.13 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.13 1lfg h ARG 524 CO 0.77 0.14 0.00 0.66 -1.07 0.00 0.00 179.97 180.47 1lfg n TYR 525 N -4.43 1.14 -3.10 3.04 4.01 -1.26 -4.31 117.16 112.24 1lfg n TYR 525 Ca 0.11 -0.40 -0.31 0.00 -0.16 0.00 0.00 57.90 57.13 1lfg n TYR 525 Cb 0.52 -0.31 -0.05 0.00 -0.31 0.00 0.00 39.34 39.20 1lfg n TYR 525 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1lfg s TYR 526 N -1.96 3.42 0.03 -0.72 5.04 -0.61 -3.29 117.35 119.26 1lfg s TYR 526 Ca 0.31 1.07 0.00 0.00 -2.44 0.00 0.00 57.07 56.01 1lfg s TYR 526 Cb 0.23 -2.44 0.00 0.00 0.35 0.00 0.00 41.96 40.10 1lfg s TYR 526 CO 0.10 0.06 0.00 0.41 -1.34 0.00 0.00 175.55 174.78 1lfg n GLY 527 N -0.67 -1.35 0.41 8.97 0.00 0.15 -2.04 105.19 110.67 1lfg n GLY 527 Ca 0.02 -1.13 -0.15 0.00 0.00 0.00 0.00 46.02 44.76 1lfg n GLY 527 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1lfg h TYR 528 N -0.11 -1.12 -0.73 1.61 0.05 -1.93 0.78 116.97 115.53 1lfg h TYR 528 Ca 0.00 0.00 0.05 0.00 0.05 0.00 0.00 58.73 58.83 1lfg h TYR 528 Cb 0.10 0.42 -0.05 0.00 1.01 0.00 0.00 36.73 38.22 1lfg h TYR 528 CO 0.00 -0.56 0.44 1.15 -1.05 0.00 0.00 178.16 178.14 1lfg h THR 529 N -0.87 1.05 -0.32 -2.88 2.02 -1.84 -1.90 112.91 108.18 1lfg h THR 529 Ca -0.06 -0.29 -0.14 0.00 0.77 0.00 0.00 66.41 66.69 1lfg h THR 529 Cb 0.73 0.13 -0.00 0.00 -1.74 0.00 0.00 68.15 67.27 1lfg h THR 529 CO -0.01 0.15 -0.36 1.23 0.37 0.00 0.00 175.52 176.90 1lfg h GLY 530 N 0.84 0.87 1.88 2.16 0.00 -1.31 -0.42 103.07 107.09 1lfg h GLY 530 Ca 0.31 -0.92 -0.09 0.00 0.00 0.00 0.00 47.33 46.63 1lfg h GLY 530 CO -0.15 0.83 -0.36 0.00 0.00 0.00 0.00 176.54 176.87 1lfg h ALA 531 N 0.72 1.28 -0.20 3.60 0.00 0.93 -1.43 119.26 124.16 1lfg h ALA 531 Ca 0.04 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 1lfg h ALA 531 Cb 0.95 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1lfg h ALA 531 CO 0.09 0.51 -0.01 0.35 0.00 0.00 0.00 179.25 180.19 1lfg h PHE 532 N 0.12 0.39 -0.87 0.00 3.57 -1.26 -2.68 116.94 116.20 1lfg h PHE 532 Ca 0.01 -0.07 0.15 0.00 3.53 0.00 0.00 57.97 61.60 1lfg h PHE 532 Cb 0.69 -0.10 -0.10 0.00 2.79 0.00 0.00 35.95 39.24 1lfg h PHE 532 CO 0.01 0.56 0.46 -0.09 -2.23 0.00 0.00 178.31 177.01 1lfg h ARG 533 N 0.10 0.62 -0.07 1.11 2.43 -0.80 0.10 114.38 117.88 1lfg h ARG 533 Ca 0.05 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1lfg h ARG 533 Cb 0.41 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.82 1lfg h ARG 533 CO 0.01 0.41 -0.01 0.00 -1.51 0.00 0.00 179.97 178.87 1lfg h LEU 535 N 0.09 -0.25 -2.83 0.00 5.85 -0.80 -0.96 115.31 116.41 1lfg h LEU 535 Ca 0.02 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1lfg h LEU 535 Cb 0.09 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 1lfg h LEU 535 CO 0.00 0.25 0.02 0.00 -0.34 0.00 0.00 178.44 178.37 1lfg h ALA 536 N -0.89 1.15 -0.70 1.25 0.00 -1.04 -0.33 119.26 118.71 1lfg h ALA 536 Ca -0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1lfg h ALA 536 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1lfg h ALA 536 CO 0.05 -0.02 0.00 0.39 0.00 0.00 0.00 179.25 179.67 1lfg n GLU 537 N -3.26 3.05 -1.35 0.00 1.02 -0.53 -4.95 120.64 114.61 1lfg n GLU 537 Ca -0.03 -2.70 -0.12 0.00 -0.02 0.00 0.00 57.16 54.29 1lfg n GLU 537 Cb 0.09 -1.68 -0.05 0.00 -0.02 0.00 0.00 31.44 29.77 1lfg n GLU 537 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1lfg n ASN 538 N 1.46 -5.45 0.01 1.62 3.02 -0.13 -4.87 115.26 110.91 1lfg n ASN 538 Ca 0.25 0.30 -0.13 0.00 -0.03 0.00 0.00 54.58 54.97 1lfg n ASN 538 Cb 0.71 -4.02 -0.09 0.00 -0.61 0.00 0.00 39.78 35.77 1lfg n ASN 538 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1lfg h ALA 539 N 0.00 -0.01 -1.18 5.41 0.00 -1.39 -3.46 119.26 118.64 1lfg h ALA 539 Ca -0.25 -0.18 -0.51 0.00 0.00 0.00 0.00 54.91 53.97 1lfg h ALA 539 Cb 1.12 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1lfg h ALA 539 CO 0.36 -0.33 -0.31 0.20 0.00 0.00 0.00 179.25 179.18 1lfg s GLY 540 N -2.92 2.11 -0.02 0.00 0.00 -0.94 -4.92 107.32 100.63 1lfg s GLY 540 Ca -0.15 -1.76 0.15 0.00 0.00 0.00 0.00 44.72 42.95 1lfg s GLY 540 CO 0.67 -1.73 0.38 1.22 0.00 0.00 0.00 173.10 173.63 1lfg n ASP 541 N -1.73 1.43 -3.80 1.64 8.00 0.30 -4.69 116.55 117.69 1lfg n ASP 541 Ca 0.05 -0.17 -0.12 0.00 0.71 0.00 0.00 54.79 55.26 1lfg n ASP 541 Cb 0.62 1.54 -0.11 0.00 -0.02 0.00 0.00 41.12 43.16 1lfg n ASP 541 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1lfg s VAL 542 N -2.90 0.03 -0.09 2.53 0.11 -1.05 -4.63 120.40 114.40 1lfg s VAL 542 Ca -0.03 -0.25 0.03 0.00 -2.93 0.00 0.00 61.98 58.80 1lfg s VAL 542 Cb 0.10 -0.41 0.01 0.00 -1.53 0.00 0.00 36.38 34.54 1lfg s VAL 542 CO 0.61 -0.14 -0.17 0.00 -3.33 0.00 0.00 175.10 172.07 1lfg s ALA 543 N -0.49 1.72 -0.54 1.54 0.00 -0.75 -1.01 121.76 122.23 1lfg s ALA 543 Ca -0.06 -0.71 -0.15 0.00 0.00 0.00 0.00 51.96 51.04 1lfg s ALA 543 Cb -0.04 -0.73 0.13 0.00 0.00 0.00 0.00 23.12 22.48 1lfg s ALA 543 CO 0.01 0.13 0.49 -0.06 0.00 0.00 0.00 175.76 176.33 1lfg s PHE 544 N 0.63 3.29 0.00 0.00 0.08 -0.83 -1.50 117.98 119.64 1lfg s PHE 544 Ca -0.14 -1.39 0.00 0.00 0.12 0.00 0.00 56.93 55.52 1lfg s PHE 544 Cb -0.16 -3.76 0.00 0.00 -0.57 0.00 0.00 43.02 38.53 1lfg s PHE 544 CO 0.04 -1.02 0.00 1.33 -0.10 0.00 0.00 175.22 175.48 1lfg n VAL 545 N 5.16 0.00 -4.17 -0.44 0.24 -0.96 -3.74 118.33 114.42 1lfg n VAL 545 Ca -0.12 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 61.95 1lfg n VAL 545 Cb 0.40 0.00 -0.06 0.00 -1.47 0.00 0.00 33.84 32.71 1lfg n VAL 545 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 1lfg s LYS 546 N -0.11 2.45 0.13 7.34 -2.85 -1.26 -0.73 119.74 124.72 1lfg s LYS 546 Ca 0.00 -1.39 -0.13 0.00 -1.00 0.00 0.00 55.97 53.44 1lfg s LYS 546 Cb 0.00 -2.25 -0.01 0.00 -2.06 0.00 0.00 37.83 33.51 1lfg s LYS 546 CO 0.00 0.27 1.57 0.38 0.10 0.00 0.00 175.35 177.68 1lfg h ASP 547 N 1.67 0.78 0.09 0.03 2.03 -1.90 -2.71 116.42 116.41 1lfg h ASP 547 Ca -0.45 -0.32 0.00 0.00 -0.73 0.00 0.00 57.03 55.53 1lfg h ASP 547 Cb 1.25 -0.21 0.00 0.00 -0.83 0.00 0.00 39.33 39.54 1lfg h ASP 547 CO 0.61 0.91 0.00 1.33 -1.03 0.00 0.00 179.24 181.06 1lfg n VAL 548 N -4.37 1.49 -0.16 4.15 0.24 -1.26 -2.63 118.33 115.79 1lfg n VAL 548 Ca -0.00 0.54 -0.07 0.00 -2.04 0.00 0.00 64.34 62.77 1lfg n VAL 548 Cb 0.31 -1.52 0.02 0.00 -1.47 0.00 0.00 33.84 31.18 1lfg n VAL 548 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1lfg h THR 549 N 0.00 1.13 0.38 3.34 2.02 -1.89 -1.31 112.91 116.57 1lfg h THR 549 Ca 0.00 -0.23 -0.02 0.00 0.77 0.00 0.00 66.41 66.93 1lfg h THR 549 Cb 0.05 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 66.87 1lfg h THR 549 CO 0.00 0.12 -0.18 0.58 0.37 0.00 0.00 175.52 176.41 1lfg h VAL 550 N 0.66 0.30 -0.56 3.16 2.07 -1.68 -2.87 116.25 117.34 1lfg h VAL 550 Ca 0.18 -0.68 0.05 0.00 0.82 0.00 0.00 66.70 67.07 1lfg h VAL 550 Cb -0.07 0.48 -0.07 0.00 -1.52 0.00 0.00 31.29 30.11 1lfg h VAL 550 CO -0.04 0.07 -0.34 -0.07 0.02 0.00 0.00 177.57 177.21 1lfg h LEU 551 N -1.04 -1.24 -1.80 2.57 4.07 -1.58 -0.40 115.31 115.89 1lfg h LEU 551 Ca -0.05 0.19 0.02 0.00 0.08 0.00 0.00 57.88 58.12 1lfg h LEU 551 Cb 0.50 0.55 -0.00 0.00 1.08 0.00 0.00 40.66 42.79 1lfg h LEU 551 CO 0.09 -0.14 0.42 1.56 -1.08 0.00 0.00 178.44 179.29 1lfg h GLN 552 N -0.01 0.00 0.00 1.13 4.20 -1.28 -2.73 115.11 116.42 1lfg h GLN 552 Ca 0.09 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 1lfg h GLN 552 Cb 0.24 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 1lfg h GLN 552 CO -0.53 0.00 -0.29 0.09 -0.67 0.00 0.00 178.83 177.43 1lfg n ASN 553 N -2.98 1.92 -4.12 1.46 3.02 -0.19 -3.83 115.26 110.54 1lfg n ASN 553 Ca -0.00 -3.40 -0.10 0.00 -0.03 0.00 0.00 54.58 51.05 1lfg n ASN 553 Cb 0.49 -0.47 -0.10 0.00 -0.61 0.00 0.00 39.78 39.10 1lfg n ASN 553 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1lfg s THR 554 N -2.85 0.11 -1.09 3.41 -4.23 -1.03 -4.75 115.64 105.21 1lfg s THR 554 Ca 0.34 -1.85 -0.06 0.00 -1.18 0.00 0.00 61.69 58.94 1lfg s THR 554 Cb 0.32 -1.99 0.01 0.00 1.34 0.00 0.00 72.50 72.17 1lfg s THR 554 CO -0.03 -0.48 0.82 0.47 -0.54 0.00 0.00 174.62 174.87 1lfg n ASP 555 N -0.09 -5.35 -3.43 3.99 8.00 0.25 -2.62 116.55 117.29 1lfg n ASP 555 Ca -0.06 -0.37 -0.18 0.00 0.71 0.00 0.00 54.79 54.89 1lfg n ASP 555 Cb 0.63 -4.01 0.07 0.00 -0.02 0.00 0.00 41.12 37.80 1lfg n ASP 555 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lfg n GLY 556 N -1.61 -0.59 0.01 0.44 0.00 -1.26 -4.89 105.19 97.30 1lfg n GLY 556 Ca -0.01 0.25 0.05 0.00 0.00 0.00 0.00 46.02 46.30 1lfg n GLY 556 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1lfg n ASN 557 N -3.13 0.51 -3.34 1.61 3.02 -1.08 -4.85 115.26 108.01 1lfg n ASN 557 Ca -0.22 -0.76 -0.12 0.00 -0.03 0.00 0.00 54.58 53.45 1lfg n ASN 557 Cb 0.65 0.98 -0.07 0.00 -0.61 0.00 0.00 39.78 40.73 1lfg n ASN 557 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1lfg s ASN 558 N -1.93 0.81 0.01 6.41 2.47 -1.25 -4.82 114.94 116.65 1lfg s ASN 558 Ca 0.04 -0.46 0.17 0.00 0.42 0.00 0.00 52.86 53.03 1lfg s ASN 558 Cb 0.08 0.90 0.73 0.00 -1.45 0.00 0.00 41.25 41.51 1lfg s ASN 558 CO 0.41 -0.36 1.55 0.59 -3.72 0.00 0.00 177.10 175.57 1lfg n ASN 559 N 5.34 0.04 -4.67 -4.21 4.13 -1.26 -2.19 115.26 112.44 1lfg n ASN 559 Ca -0.01 0.51 -0.40 0.00 1.68 0.00 0.00 54.58 56.36 1lfg n ASN 559 Cb 0.48 -0.52 0.02 0.00 -1.54 0.00 0.00 39.78 38.23 1lfg n ASN 559 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 1lfg n GLU 560 N -1.54 1.59 -0.23 3.52 2.13 -1.26 -4.28 120.64 120.58 1lfg n GLU 560 Ca 0.04 0.57 0.01 0.00 0.66 0.00 0.00 57.16 58.44 1lfg n GLU 560 Cb 0.20 -2.27 0.04 0.00 0.27 0.00 0.00 31.44 29.68 1lfg n GLU 560 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1lfg n ALA 561 N -0.58 -0.02 0.15 4.31 0.00 -1.26 0.62 120.51 123.73 1lfg n ALA 561 Ca 0.09 0.61 0.01 0.00 0.00 0.00 0.00 53.44 54.15 1lfg n ALA 561 Cb 0.41 -0.30 0.21 0.00 0.00 0.00 0.00 19.45 19.77 1lfg n ALA 561 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 1lfg h TRP 562 N 0.00 0.00 0.09 0.00 5.08 -1.93 -3.36 115.95 115.82 1lfg h TRP 562 Ca 0.23 0.00 -0.36 0.00 1.08 0.00 0.00 58.89 59.84 1lfg h TRP 562 Cb 0.38 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.51 1lfg h TRP 562 CO -0.51 0.54 -2.01 0.00 -1.28 0.00 0.00 178.44 175.17 1lfg n ALA 563 N -2.35 1.07 0.00 0.11 0.00 0.20 -4.73 120.51 114.81 1lfg n ALA 563 Ca -0.00 -0.70 0.00 0.00 0.00 0.00 0.00 53.44 52.73 1lfg n ALA 563 Cb 0.60 -0.63 0.00 0.00 0.00 0.00 0.00 19.45 19.42 1lfg n ALA 563 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1lfg n LYS 564 N -3.36 0.00 -0.30 0.00 2.85 0.15 -0.62 118.16 116.88 1lfg n LYS 564 Ca -0.31 0.00 0.04 0.00 -1.05 0.00 0.00 58.31 56.99 1lfg n LYS 564 Cb 1.05 0.00 0.16 0.00 -0.65 0.00 0.00 35.03 35.59 1lfg n LYS 564 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1lfg n ASP 565 N -3.31 2.50 -4.75 -5.58 8.00 -1.26 -4.02 116.55 108.13 1lfg n ASP 565 Ca 0.00 -2.23 -0.38 0.00 0.71 0.00 0.00 54.79 52.89 1lfg n ASP 565 Cb 0.00 -0.42 -0.06 0.00 -0.02 0.00 0.00 41.12 40.62 1lfg n ASP 565 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1lfg s LEU 566 N -1.12 4.35 -0.10 0.64 1.43 0.20 -4.99 118.68 119.10 1lfg s LEU 566 Ca 0.23 0.93 -0.01 0.00 -1.03 0.00 0.00 54.13 54.26 1lfg s LEU 566 Cb 0.15 -2.73 -0.03 0.00 0.03 0.00 0.00 46.19 43.62 1lfg s LEU 566 CO 0.10 0.09 -0.07 -0.54 0.23 0.00 0.00 176.35 176.17 1lfg s LYS 567 N 0.08 3.11 0.22 1.70 -0.14 -1.26 0.86 119.74 124.30 1lfg s LYS 567 Ca 0.27 -0.56 -0.11 0.00 -1.36 0.00 0.00 55.97 54.20 1lfg s LYS 567 Cb -0.16 -2.69 0.30 0.00 -1.68 0.00 0.00 37.83 33.60 1lfg s LYS 567 CO 0.13 0.48 1.63 1.25 -0.76 0.00 0.00 175.35 178.08 1lfg h LEU 568 N 5.88 -0.48 -1.16 3.17 5.85 -1.93 0.22 115.31 126.86 1lfg h LEU 568 Ca -0.40 0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.50 1lfg h LEU 568 Cb 1.18 0.36 0.00 0.00 0.37 0.00 0.00 40.66 42.57 1lfg h LEU 568 CO 0.56 -0.19 0.23 0.00 -0.34 0.00 0.00 178.44 178.70 1lfg h ALA 569 N 1.65 1.16 -0.00 1.25 0.00 -2.02 -1.53 119.26 119.76 1lfg h ALA 569 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1lfg h ALA 569 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1lfg h ALA 569 CO -0.64 -0.16 -0.05 -0.25 0.00 0.00 0.00 179.25 178.15 1lfg n ASP 570 N -2.20 0.08 -4.52 0.00 8.00 0.06 -4.82 116.55 113.16 1lfg n ASP 570 Ca -0.01 0.16 -0.28 0.00 0.71 0.00 0.00 54.79 55.38 1lfg n ASP 570 Cb 0.25 -0.34 -0.10 0.00 -0.02 0.00 0.00 41.12 40.91 1lfg n ASP 570 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1lfg s PHE 571 N -2.83 2.53 0.24 1.24 0.08 -0.58 -0.29 117.98 118.37 1lfg s PHE 571 Ca 0.19 -0.26 0.01 0.00 0.12 0.00 0.00 56.93 56.99 1lfg s PHE 571 Cb 0.19 -1.27 -0.04 0.00 -0.57 0.00 0.00 43.02 41.33 1lfg s PHE 571 CO 0.52 0.48 0.14 0.00 -0.10 0.00 0.00 175.22 176.26 1lfg s ALA 572 N -1.54 1.44 0.07 5.36 0.00 0.22 -4.39 121.76 122.91 1lfg s ALA 572 Ca 0.22 -1.78 0.05 0.00 0.00 0.00 0.00 51.96 50.45 1lfg s ALA 572 Cb -0.09 1.31 -0.04 0.00 0.00 0.00 0.00 23.12 24.30 1lfg s ALA 572 CO 0.13 -0.56 -0.05 -0.51 0.00 0.00 0.00 175.76 174.76 1lfg s LEU 573 N -3.24 3.24 -0.23 0.00 1.43 0.13 -1.35 118.68 118.65 1lfg s LEU 573 Ca 0.39 -0.23 -0.11 0.00 -1.03 0.00 0.00 54.13 53.14 1lfg s LEU 573 Cb 0.06 -1.96 -0.05 0.00 0.03 0.00 0.00 46.19 44.28 1lfg s LEU 573 CO 0.15 0.21 0.19 -0.76 0.23 0.00 0.00 176.35 176.37 1lfg s LEU 574 N -1.98 4.12 0.28 1.79 1.02 -0.73 -0.53 118.68 122.66 1lfg s LEU 574 Ca 0.21 0.16 0.06 0.00 0.02 0.00 0.00 54.13 54.59 1lfg s LEU 574 Cb -0.11 -2.16 -0.03 0.00 0.02 0.00 0.00 46.19 43.91 1lfg s LEU 574 CO 0.13 0.05 0.31 0.00 0.02 0.00 0.00 176.35 176.86 1lfg n LEU 576 N -1.36 0.00 -0.93 0.00 4.77 -1.26 -2.51 117.00 115.71 1lfg n LEU 576 Ca -0.06 0.39 0.12 0.00 -0.03 0.00 0.00 56.01 56.43 1lfg n LEU 576 Cb 0.58 -0.39 0.11 0.00 -2.33 0.00 0.00 43.42 41.39 1lfg n LEU 576 CO 0.43 -0.16 0.62 -0.90 -1.33 0.00 0.00 177.39 176.05 1lfg n ASP 577 N -1.39 2.92 0.00 -1.43 5.68 -1.26 -4.93 116.55 116.14 1lfg n ASP 577 Ca 0.06 -1.96 0.00 0.00 -0.50 0.00 0.00 54.79 52.39 1lfg n ASP 577 Cb 0.17 0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.17 1lfg n ASP 577 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1lfg n GLY 578 N 1.35 1.42 3.69 6.12 0.00 -1.04 -5.07 105.19 111.64 1lfg n GLY 578 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1lfg n GLY 578 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lfg s LYS 579 N -0.05 1.02 -0.02 1.61 3.01 -1.26 -4.54 119.74 119.52 1lfg s LYS 579 Ca 0.00 0.91 0.05 0.00 -1.01 0.00 0.00 55.97 55.92 1lfg s LYS 579 Cb 0.00 -1.77 -0.01 0.00 -1.01 0.00 0.00 37.83 35.03 1lfg s LYS 579 CO 0.00 -2.43 -0.16 1.03 0.51 0.00 0.00 175.35 174.30 1lfg s ARG 580 N -4.85 1.37 0.08 1.68 0.52 -1.25 -0.25 118.95 116.24 1lfg s ARG 580 Ca 0.64 -0.58 0.00 0.00 -0.52 0.00 0.00 55.73 55.27 1lfg s ARG 580 Cb -0.19 -1.30 -0.04 0.00 0.52 0.00 0.00 34.95 33.93 1lfg s ARG 580 CO 0.58 0.33 -0.04 0.15 0.02 0.00 0.00 175.30 176.35 1lfg s LYS 581 N -0.32 0.72 0.71 3.54 1.02 0.31 -4.93 119.74 120.81 1lfg s LYS 581 Ca 0.05 -1.28 -0.14 0.00 0.02 0.00 0.00 55.97 54.62 1lfg s LYS 581 Cb -0.07 0.06 0.03 0.00 -0.52 0.00 0.00 37.83 37.32 1lfg s LYS 581 CO -0.00 -0.09 1.12 -1.25 -0.92 0.00 0.00 175.35 174.21 1lfg s PRO 582 N -3.90 2.48 0.58 -1.68 0.04 -1.26 0.18 135.00 131.44 1lfg s PRO 582 Ca 0.10 1.39 0.28 0.00 0.04 0.00 0.00 61.00 62.81 1lfg s PRO 582 Cb 0.07 -1.91 1.62 0.00 0.04 0.00 0.00 34.50 34.32 1lfg s PRO 582 CO -0.07 -1.50 2.10 0.28 0.04 0.00 0.00 177.00 177.85 1lfg h VAL 583 N -0.41 0.53 0.00 -0.36 2.07 -1.90 -2.41 116.25 113.76 1lfg h VAL 583 Ca -0.46 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.06 1lfg h VAL 583 Cb 1.25 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 1lfg h VAL 583 CO 0.52 0.00 0.00 0.35 0.02 0.00 0.00 177.57 178.46 1lfg n THR 584 N -3.90 0.74 -1.26 2.57 -2.24 -1.26 -3.06 114.28 105.87 1lfg n THR 584 Ca 0.02 0.13 -0.05 0.00 -2.27 0.00 0.00 64.05 61.88 1lfg n THR 584 Cb 0.32 -0.92 0.22 0.00 -2.10 0.00 0.00 70.33 67.85 1lfg n THR 584 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1lfg n GLU 585 N -1.85 2.42 -0.27 -0.78 1.02 -0.91 -4.53 120.64 115.74 1lfg n GLU 585 Ca 0.04 -3.07 0.19 0.00 -0.02 0.00 0.00 57.16 54.30 1lfg n GLU 585 Cb 0.25 -1.95 0.50 0.00 -0.02 0.00 0.00 31.44 30.22 1lfg n GLU 585 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1lfg h ALA 586 N 1.41 2.17 -0.00 0.62 0.00 -1.68 0.32 119.26 122.10 1lfg h ALA 586 Ca 0.26 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1lfg h ALA 586 Cb 1.94 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.70 1lfg h ALA 586 CO 0.54 -0.48 0.01 -0.09 0.00 0.00 0.00 179.25 179.22 1lfg h ARG 587 N 0.44 0.00 -0.12 0.00 2.43 -1.88 -0.75 114.38 114.49 1lfg h ARG 587 Ca 0.50 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.67 1lfg h ARG 587 Cb 1.20 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 1lfg h ARG 587 CO -0.21 0.00 0.00 -1.13 -1.51 0.00 0.00 179.97 177.12 1lfg n SER 588 N -3.46 2.31 -3.14 -3.80 3.41 0.10 -4.80 113.62 104.24 1lfg n SER 588 Ca -0.03 -1.97 -0.22 0.00 -0.26 0.00 0.00 58.87 56.39 1lfg n SER 588 Cb 0.09 -0.08 -0.06 0.00 -0.26 0.00 0.00 64.21 63.90 1lfg n SER 588 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1lfg s HIS 590 N -0.96 0.59 0.03 0.00 -0.00 -1.15 -4.62 115.29 109.18 1lfg s HIS 590 Ca 0.35 -1.00 -0.18 0.00 -0.00 0.00 0.00 55.06 54.23 1lfg s HIS 590 Cb 0.18 -0.41 -0.23 0.00 -0.00 0.00 0.00 32.58 32.12 1lfg s HIS 590 CO -0.13 -0.32 1.14 -0.07 -0.00 0.00 0.00 174.74 175.37 1lfg h LEU 591 N 3.20 0.67 -7.29 5.38 3.38 -0.78 -3.45 115.31 116.43 1lfg h LEU 591 Ca -0.34 -0.75 0.29 0.00 0.09 0.00 0.00 57.88 57.17 1lfg h LEU 591 Cb 1.15 -0.21 -0.12 0.00 0.09 0.00 0.00 40.66 41.58 1lfg h LEU 591 CO 0.64 1.33 0.75 0.00 0.09 0.00 0.00 178.44 181.26 1lfg s ALA 592 N -3.27 -2.10 -0.15 1.53 0.00 -1.24 -5.01 121.76 111.52 1lfg s ALA 592 Ca -0.12 0.66 -0.16 0.00 0.00 0.00 0.00 51.96 52.34 1lfg s ALA 592 Cb 0.05 0.38 -0.04 0.00 0.00 0.00 0.00 23.12 23.50 1lfg s ALA 592 CO 0.86 -1.01 0.39 -1.64 0.00 0.00 0.00 175.76 174.35 1lfg s MET 593 N -2.61 4.29 -0.13 0.00 -1.94 -1.26 -0.26 119.30 117.40 1lfg s MET 593 Ca 0.13 0.27 -0.04 0.00 -1.71 0.00 0.00 55.69 54.34 1lfg s MET 593 Cb 0.03 -3.44 -0.03 0.00 2.01 0.00 0.00 34.83 33.40 1lfg s MET 593 CO -0.03 0.17 0.01 0.00 -0.01 0.00 0.00 175.02 175.16 1lfg s ALA 594 N 0.62 3.26 0.48 3.03 0.00 -0.54 -4.93 121.76 123.69 1lfg s ALA 594 Ca 0.21 -0.79 -0.23 0.00 0.00 0.00 0.00 51.96 51.15 1lfg s ALA 594 Cb -0.14 -1.61 -0.07 0.00 0.00 0.00 0.00 23.12 21.30 1lfg s ALA 594 CO 0.07 0.41 1.23 -1.25 0.00 0.00 0.00 175.76 176.22 1lfg s PRO 595 N -0.30 3.58 0.58 0.00 0.04 -1.26 -1.11 135.00 136.53 1lfg s PRO 595 Ca 0.07 1.94 -0.20 0.00 0.04 0.00 0.00 61.00 62.84 1lfg s PRO 595 Cb -0.12 -2.38 -0.03 0.00 0.04 0.00 0.00 34.50 32.00 1lfg s PRO 595 CO 0.02 -0.74 1.30 -0.80 0.04 0.00 0.00 177.00 176.81 1lfg s ASN 596 N -1.20 5.08 0.33 6.66 -0.87 -1.26 -4.49 114.94 119.19 1lfg s ASN 596 Ca 0.66 2.62 -0.29 0.00 -1.57 0.00 0.00 52.86 54.28 1lfg s ASN 596 Cb -0.33 -2.62 -0.11 0.00 -0.02 0.00 0.00 41.25 38.17 1lfg s ASN 596 CO 0.39 -1.68 1.53 1.41 -2.57 0.00 0.00 177.10 176.18 1lfg n HIS 597 N -1.39 2.87 -4.36 2.20 8.25 -1.26 -4.57 115.22 116.96 1lfg n HIS 597 Ca 0.13 0.36 -0.24 0.00 -0.26 0.00 0.00 57.72 57.70 1lfg n HIS 597 Cb 0.47 -2.56 -0.13 0.00 1.12 0.00 0.00 29.99 28.89 1lfg n HIS 597 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1lfg s ALA 598 N -0.54 1.73 -0.08 -1.41 0.00 -0.26 -0.43 121.76 120.77 1lfg s ALA 598 Ca 0.59 -1.17 -0.21 0.00 0.00 0.00 0.00 51.96 51.17 1lfg s ALA 598 Cb -0.49 -0.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 1lfg s ALA 598 CO 0.56 0.35 0.61 0.14 0.00 0.00 0.00 175.76 177.42 1lfg s VAL 599 N -1.07 5.09 0.18 0.00 -7.23 0.25 0.25 120.40 117.87 1lfg s VAL 599 Ca 0.06 1.24 0.09 0.00 -1.81 0.00 0.00 61.98 61.56 1lfg s VAL 599 Cb -0.10 -3.95 -0.04 0.00 0.56 0.00 0.00 36.38 32.85 1lfg s VAL 599 CO 0.03 0.29 -0.07 0.68 -0.31 0.00 0.00 175.10 175.72 1lfg s VAL 600 N 0.67 3.30 0.32 1.32 -7.23 -0.29 0.12 120.40 118.61 1lfg s VAL 600 Ca 0.33 -1.62 -0.06 0.00 -1.81 0.00 0.00 61.98 58.82 1lfg s VAL 600 Cb -0.17 -2.64 0.02 0.00 0.56 0.00 0.00 36.38 34.15 1lfg s VAL 600 CO 0.15 -0.12 0.52 -0.24 -0.31 0.00 0.00 175.10 175.10 1lfg n SER 601 N -0.02 -1.48 -4.86 4.85 2.88 0.49 -3.42 113.62 112.07 1lfg n SER 601 Ca -0.10 -2.54 -0.31 0.00 -1.33 0.00 0.00 58.87 54.58 1lfg n SER 601 Cb 0.55 2.61 -0.00 0.00 -0.75 0.00 0.00 64.21 66.62 1lfg n SER 601 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1lfg s ARG 602 N -2.47 3.68 0.36 -1.46 0.52 -1.26 -0.76 118.95 117.57 1lfg s ARG 602 Ca 0.21 0.84 0.03 0.00 -0.52 0.00 0.00 55.73 56.29 1lfg s ARG 602 Cb -0.02 -2.09 0.67 0.00 0.52 0.00 0.00 34.95 34.03 1lfg s ARG 602 CO 0.15 -0.50 2.01 0.52 0.02 0.00 0.00 175.30 177.50 1lfg h MET 603 N 0.10 0.79 0.00 3.54 2.86 -1.95 -2.95 114.93 117.33 1lfg h MET 603 Ca -0.45 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.14 1lfg h MET 603 Cb 1.19 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.67 1lfg h MET 603 CO 0.61 0.53 0.00 0.38 1.06 0.00 0.00 176.91 179.49 1lfg h ASP 604 N 0.82 0.00 0.00 1.22 2.03 -2.01 -3.26 116.42 115.23 1lfg h ASP 604 Ca 0.24 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.54 1lfg h ASP 604 Cb -0.03 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.47 1lfg h ASP 604 CO -0.06 0.00 -0.71 1.17 -1.03 0.00 0.00 179.24 178.61 1lfg n LYS 605 N -3.02 2.15 0.00 4.15 3.00 -1.11 -4.81 118.16 118.51 1lfg n LYS 605 Ca -0.02 -0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.28 1lfg n LYS 605 Cb 0.10 -1.19 0.00 0.00 0.00 0.00 0.00 35.03 33.94 1lfg n LYS 605 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1lfg n VAL 606 N -1.36 0.00 -0.30 3.15 0.31 -1.23 -0.52 118.33 118.37 1lfg n VAL 606 Ca 0.03 1.44 0.01 0.00 -0.01 0.00 0.00 64.34 65.81 1lfg n VAL 606 Cb 0.23 -1.93 0.20 0.00 -0.91 0.00 0.00 33.84 31.42 1lfg n VAL 606 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1lfg h GLU 607 N 0.00 1.11 -0.02 5.55 4.39 -1.87 -0.18 114.58 123.55 1lfg h GLU 607 Ca 0.00 -0.07 -0.17 0.00 0.34 0.00 0.00 59.36 59.46 1lfg h GLU 607 Cb 0.00 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 28.39 1lfg h GLU 607 CO 0.00 0.73 -0.75 -0.09 -1.16 0.00 0.00 179.01 177.75 1lfg h ARG 608 N 1.14 0.17 -0.63 2.33 9.65 -1.78 -3.12 114.38 122.13 1lfg h ARG 608 Ca 0.35 -0.15 -0.04 0.00 -1.10 0.00 0.00 59.98 59.04 1lfg h ARG 608 Cb -0.01 0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 28.57 1lfg h ARG 608 CO -0.10 0.84 0.24 1.25 2.80 0.00 0.00 179.97 185.00 1lfg h LEU 609 N 0.11 0.87 -0.41 3.80 5.85 -0.21 -2.14 115.31 123.18 1lfg h LEU 609 Ca -0.02 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.55 1lfg h LEU 609 Cb 1.32 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 42.09 1lfg h LEU 609 CO 0.11 0.81 0.22 0.50 -0.34 0.00 0.00 178.44 179.74 1lfg h LYS 610 N 0.88 0.43 -0.09 1.25 3.64 -1.04 -1.48 116.57 120.17 1lfg h LYS 610 Ca 0.21 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.53 1lfg h LYS 610 Cb 0.22 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1lfg h LYS 610 CO -0.02 0.29 -0.09 -0.56 -2.27 0.00 0.00 179.45 176.81 1lfg h GLN 611 N 0.45 0.21 -0.99 1.90 3.07 -1.48 -2.23 115.11 116.04 1lfg h GLN 611 Ca 0.17 -0.11 0.02 0.00 0.09 0.00 0.00 58.65 58.82 1lfg h GLN 611 Cb 0.04 0.00 -0.05 0.00 0.08 0.00 0.00 27.48 27.56 1lfg h GLN 611 CO -0.10 0.64 0.65 0.28 0.09 0.00 0.00 178.83 180.39 1lfg h VAL 612 N -0.21 1.21 -0.29 1.86 2.07 -1.37 -2.52 116.25 117.00 1lfg h VAL 612 Ca 0.01 -0.44 -0.04 0.00 0.82 0.00 0.00 66.70 67.05 1lfg h VAL 612 Cb 0.60 -0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 1lfg h VAL 612 CO 0.02 0.24 0.01 -0.07 0.02 0.00 0.00 177.57 177.79 1lfg h LEU 613 N 1.29 0.50 -0.21 2.57 3.38 -1.24 0.21 115.31 121.81 1lfg h LEU 613 Ca 0.38 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1lfg h LEU 613 Cb -0.08 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1lfg h LEU 613 CO -0.10 0.67 0.14 -0.07 0.09 0.00 0.00 178.44 179.17 1lfg h LEU 614 N 0.31 0.24 0.92 1.67 3.38 -1.39 -0.79 115.31 119.65 1lfg h LEU 614 Ca 0.08 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1lfg h LEU 614 Cb 0.41 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.11 1lfg h LEU 614 CO 0.01 0.18 -0.48 -0.74 0.09 0.00 0.00 178.44 177.51 1lfg h HIS 615 N 0.28 -1.26 -0.09 1.13 2.76 -1.46 -1.54 115.15 114.97 1lfg h HIS 615 Ca 0.08 -0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.25 1lfg h HIS 615 Cb -0.02 0.43 -0.00 0.00 1.55 0.00 0.00 27.41 29.36 1lfg h HIS 615 CO -0.06 -0.75 0.07 1.96 -1.30 0.00 0.00 177.93 177.84 1lfg h GLN 616 N -1.29 0.00 0.00 5.26 1.08 -0.48 -2.43 115.11 117.25 1lfg h GLN 616 Ca -0.13 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 56.96 1lfg h GLN 616 Cb 1.00 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.41 1lfg h GLN 616 CO 0.18 0.00 -0.87 -0.56 -0.95 0.00 0.00 178.83 176.63 1lfg h GLN 617 N 0.00 0.00 -0.18 1.46 3.07 -1.01 0.16 115.11 118.61 1lfg h GLN 617 Ca 0.04 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.75 1lfg h GLN 617 Cb 0.18 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.72 1lfg h GLN 617 CO -0.00 0.37 -0.03 0.00 0.09 0.00 0.00 178.83 179.26 1lfg h ALA 618 N 1.52 1.62 0.03 0.06 0.00 -0.78 1.25 119.26 122.96 1lfg h ALA 618 Ca -0.06 -0.14 -0.39 0.00 0.00 0.00 0.00 54.91 54.32 1lfg h ALA 618 Cb 1.42 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 19.06 1lfg h ALA 618 CO 0.05 0.28 -2.30 1.63 0.00 0.00 0.00 179.25 178.91 1lfg n LYS 619 N -4.36 0.66 -0.11 0.00 5.02 -1.14 -2.09 118.16 116.16 1lfg n LYS 619 Ca -0.00 0.22 0.04 0.00 -2.02 0.00 0.00 58.31 56.54 1lfg n LYS 619 Cb 0.20 -1.58 0.09 0.00 -0.02 0.00 0.00 35.03 33.73 1lfg n LYS 619 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1lfg n PHE 620 N -3.52 0.24 -0.25 2.13 3.72 0.57 0.38 117.46 120.74 1lfg n PHE 620 Ca -0.43 -0.60 -0.26 0.00 -0.05 0.00 0.00 57.45 56.11 1lfg n PHE 620 Cb 0.97 -0.08 0.26 0.00 -0.94 0.00 0.00 39.48 39.69 1lfg n PHE 620 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1lfg n GLY 621 N -0.28 -3.63 0.20 1.37 0.00 0.43 -0.15 105.19 103.13 1lfg n GLY 621 Ca 0.08 -1.17 -0.05 0.00 0.00 0.00 0.00 46.02 44.87 1lfg n GLY 621 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1lfg h ARG 622 N 0.00 0.50 -0.21 1.61 1.12 -1.79 -2.58 114.38 113.03 1lfg h ARG 622 Ca -0.34 -0.03 -0.13 0.00 -1.11 0.00 0.00 59.98 58.37 1lfg h ARG 622 Cb 1.15 -0.11 -0.08 0.00 -0.01 0.00 0.00 29.97 30.92 1lfg h ARG 622 CO 0.20 0.33 -0.35 -1.71 -3.11 0.00 0.00 179.97 175.34 1lfg n ASN 623 N -4.86 2.36 -4.76 -3.80 5.15 -1.26 -4.97 115.26 103.11 1lfg n ASN 623 Ca 0.04 -3.85 -0.39 0.00 -0.60 0.00 0.00 54.58 49.77 1lfg n ASN 623 Cb 0.11 -0.56 -0.06 0.00 -0.53 0.00 0.00 39.78 38.73 1lfg n ASN 623 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1lfg s GLY 624 N -2.99 3.04 0.19 8.20 0.00 -0.97 -4.97 107.32 109.80 1lfg s GLY 624 Ca 0.42 0.55 0.15 0.00 0.00 0.00 0.00 44.72 45.84 1lfg s GLY 624 CO -0.04 1.09 0.61 -1.14 0.00 0.00 0.00 173.10 173.62 1lfg n SER 625 N 1.39 0.06 -0.02 1.64 3.41 -0.89 0.09 113.62 119.30 1lfg n SER 625 Ca -0.02 0.49 0.00 0.00 -0.26 0.00 0.00 58.87 59.08 1lfg n SER 625 Cb 0.48 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 1lfg n SER 625 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1lfg n ASP 626 N -3.21 1.71 -4.45 4.04 9.92 0.16 -4.91 116.55 119.80 1lfg n ASP 626 Ca 0.16 -1.68 -0.36 0.00 -0.53 0.00 0.00 54.79 52.39 1lfg n ASP 626 Cb 0.67 -0.01 -0.12 0.00 -0.64 0.00 0.00 41.12 41.02 1lfg n ASP 626 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1lfg n PRO 628 N 4.53 3.12 -0.27 0.00 -0.05 -1.26 -4.55 135.00 136.51 1lfg n PRO 628 Ca -0.17 -3.03 -0.06 0.00 -0.05 0.00 0.00 63.50 60.20 1lfg n PRO 628 Cb 0.52 -2.01 0.06 0.00 -0.05 0.00 0.00 33.50 32.01 1lfg n PRO 628 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 175.50 175.01 1lfg h ASP 629 N 2.08 0.93 0.00 3.54 3.32 -1.72 -3.41 116.42 121.16 1lfg h ASP 629 Ca 0.16 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 1lfg h ASP 629 Cb 1.89 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 41.20 1lfg h ASP 629 CO 0.49 0.77 -0.83 1.17 -1.72 0.00 0.00 179.24 179.11 1lfg n LYS 630 N -4.45 0.03 -3.74 3.56 4.81 0.10 -5.11 118.16 113.36 1lfg n LYS 630 Ca 0.06 0.01 -0.13 0.00 -0.87 0.00 0.00 58.31 57.39 1lfg n LYS 630 Cb 0.10 -0.55 -0.10 0.00 0.02 0.00 0.00 35.03 34.50 1lfg n LYS 630 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 1lfg s PHE 631 N -2.03 -0.41 -0.20 5.64 5.36 -1.11 -5.06 117.98 120.16 1lfg s PHE 631 Ca -0.02 1.01 0.01 0.00 -0.96 0.00 0.00 56.93 56.98 1lfg s PHE 631 Cb 0.01 0.14 0.03 0.00 -0.34 0.00 0.00 43.02 42.86 1lfg s PHE 631 CO 0.03 -0.20 -0.18 0.00 -1.46 0.00 0.00 175.22 173.41 1lfg h LEU 633 N 7.91 -0.24 -2.82 0.00 3.38 -0.83 -3.03 115.31 119.67 1lfg h LEU 633 Ca -0.39 0.10 -0.20 0.00 0.09 0.00 0.00 57.88 57.47 1lfg h LEU 633 Cb 1.12 0.19 -0.12 0.00 0.09 0.00 0.00 40.66 41.94 1lfg h LEU 633 CO 0.59 -0.08 0.25 0.49 0.09 0.00 0.00 178.44 179.78 1lfg n PHE 634 N -5.24 1.39 -3.89 1.13 3.72 -1.26 -4.76 117.46 108.55 1lfg n PHE 634 Ca 0.02 -0.99 -0.11 0.00 -0.05 0.00 0.00 57.45 56.31 1lfg n PHE 634 Cb 0.20 -0.53 -0.13 0.00 -0.94 0.00 0.00 39.48 38.07 1lfg n PHE 634 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 1lfg s GLN 635 N -1.65 0.07 0.00 -1.08 2.00 -1.15 -4.34 119.66 113.51 1lfg s GLN 635 Ca 0.27 -0.13 0.00 0.00 -2.00 0.00 0.00 55.36 53.51 1lfg s GLN 635 Cb 0.23 0.02 0.00 0.00 0.80 0.00 0.00 33.01 34.06 1lfg s GLN 635 CO 0.06 -0.01 0.15 -1.13 -0.50 0.00 0.00 175.29 173.86 1lfg n SER 636 N 2.77 0.00 -3.15 6.67 3.41 -1.26 -4.88 113.62 117.18 1lfg n SER 636 Ca -0.15 -0.76 -0.06 0.00 -0.26 0.00 0.00 58.87 57.65 1lfg n SER 636 Cb 0.59 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.55 1lfg n SER 636 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1lfg n GLU 637 N 0.00 -0.50 0.00 4.33 0.00 -1.26 -2.28 120.64 120.93 1lfg n GLU 637 Ca 0.00 0.83 0.00 0.00 0.00 0.00 0.00 57.16 57.99 1lfg n GLU 637 Cb 0.38 -1.09 0.00 0.00 0.00 0.00 0.00 31.44 30.73 1lfg n GLU 637 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1lfg n THR 638 N 1.04 0.00 0.02 3.84 -2.24 -1.26 -4.83 114.28 110.84 1lfg n THR 638 Ca -0.01 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.68 1lfg n THR 638 Cb 0.51 0.00 -0.13 0.00 -2.10 0.00 0.00 70.33 68.61 1lfg n THR 638 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1lfg h LYS 639 N 1.45 0.01 -5.79 -0.78 1.79 -1.88 -3.43 116.57 107.94 1lfg h LYS 639 Ca 0.00 -0.02 -0.35 0.00 -2.18 0.00 0.00 60.65 58.10 1lfg h LYS 639 Cb 0.00 0.01 0.13 0.00 -1.58 0.00 0.00 32.23 30.79 1lfg h LYS 639 CO 0.00 0.74 -0.83 0.09 -1.08 0.00 0.00 179.45 178.37 1lfg n ASN 640 N -3.20 -3.34 -4.61 0.86 3.02 -1.26 -4.96 115.26 101.77 1lfg n ASN 640 Ca -0.10 -0.75 -0.40 0.00 -0.03 0.00 0.00 54.58 53.30 1lfg n ASN 640 Cb 1.00 -4.63 -0.07 0.00 -0.61 0.00 0.00 39.78 35.47 1lfg n ASN 640 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1lfg s LEU 641 N -6.21 4.09 0.00 3.41 1.02 -1.26 -4.42 118.68 115.31 1lfg s LEU 641 Ca 0.17 0.46 0.00 0.00 0.02 0.00 0.00 54.13 54.78 1lfg s LEU 641 Cb -0.03 -2.68 0.00 0.00 0.02 0.00 0.00 46.19 43.50 1lfg s LEU 641 CO 0.77 -0.33 0.00 0.18 0.02 0.00 0.00 176.35 176.99 1lfg n LEU 642 N 5.61 0.00 -4.30 1.79 4.77 -1.26 -4.76 117.00 118.85 1lfg n LEU 642 Ca -0.04 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.77 1lfg n LEU 642 Cb 0.49 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.49 1lfg n LEU 642 CO 0.42 0.00 -0.21 -0.36 -1.33 0.00 0.00 177.39 175.90 1lfg s PHE 643 N 0.00 1.52 0.15 -1.77 0.08 -1.26 -4.34 117.98 112.36 1lfg s PHE 643 Ca 0.00 -1.35 -0.28 0.00 0.12 0.00 0.00 56.93 55.42 1lfg s PHE 643 Cb 0.00 -0.80 -0.07 0.00 -0.57 0.00 0.00 43.02 41.57 1lfg s PHE 643 CO 0.00 -0.53 0.88 -0.80 -0.10 0.00 0.00 175.22 174.67 1lfg s ASN 644 N -3.32 7.47 0.59 1.36 0.01 -1.26 -4.45 114.94 115.33 1lfg s ASN 644 Ca 0.37 1.75 0.29 0.00 -0.71 0.00 0.00 52.86 54.55 1lfg s ASN 644 Cb 0.06 -2.55 1.61 0.00 0.41 0.00 0.00 41.25 40.77 1lfg s ASN 644 CO 0.16 0.08 2.04 0.44 -1.51 0.00 0.00 177.10 178.32 1lfg h ASP 645 N 4.85 0.00 -0.48 -1.22 3.32 -1.91 0.10 116.42 121.08 1lfg h ASP 645 Ca -0.45 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.49 1lfg h ASP 645 Cb 1.21 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.69 1lfg h ASP 645 CO 0.69 0.00 0.15 -0.46 -1.72 0.00 0.00 179.24 177.90 1lfg n ASN 646 N -3.78 3.97 -4.71 6.45 6.94 -1.26 -4.72 115.26 118.15 1lfg n ASN 646 Ca 0.03 -2.78 -0.42 0.00 -0.02 0.00 0.00 54.58 51.40 1lfg n ASN 646 Cb 0.42 -0.66 -0.03 0.00 -2.36 0.00 0.00 39.78 37.15 1lfg n ASN 646 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1lfg s THR 647 N -2.19 4.34 -0.10 5.53 2.01 0.02 -4.59 115.64 120.65 1lfg s THR 647 Ca 0.37 1.70 -0.18 0.00 0.31 0.00 0.00 61.69 63.90 1lfg s THR 647 Cb 0.29 -4.09 -0.27 0.00 0.01 0.00 0.00 72.50 68.44 1lfg s THR 647 CO 0.10 0.15 0.60 -0.08 -0.69 0.00 0.00 174.62 174.69 1lfg h GLU 648 N 6.65 0.23 -2.93 4.92 4.81 -0.63 -3.45 114.58 124.18 1lfg h GLU 648 Ca -0.42 -0.39 0.03 0.00 -0.13 0.00 0.00 59.36 58.45 1lfg h GLU 648 Cb 1.22 0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.72 1lfg h GLU 648 CO 0.78 1.19 0.29 0.00 -0.73 0.00 0.00 179.01 180.54 1lfg s LEU 650 N -3.04 3.86 0.37 0.00 1.43 -1.26 0.51 118.68 120.55 1lfg s LEU 650 Ca 0.14 -0.21 0.08 0.00 -1.03 0.00 0.00 54.13 53.11 1lfg s LEU 650 Cb -0.05 -2.03 -0.06 0.00 0.03 0.00 0.00 46.19 44.09 1lfg s LEU 650 CO 0.09 -0.09 0.05 0.00 0.23 0.00 0.00 176.35 176.64 1lfg s ALA 651 N 1.68 3.29 0.34 4.21 0.00 -0.15 -4.62 121.76 126.50 1lfg s ALA 651 Ca 0.06 -2.06 -0.26 0.00 0.00 0.00 0.00 51.96 49.70 1lfg s ALA 651 Cb -0.16 -0.27 -0.09 0.00 0.00 0.00 0.00 23.12 22.59 1lfg s ALA 651 CO 0.07 -0.03 1.00 1.03 0.00 0.00 0.00 175.76 177.84 1lfg s ARG 652 N -3.76 4.47 0.22 0.00 0.52 -0.92 -0.26 118.95 119.22 1lfg s ARG 652 Ca 0.36 1.47 0.26 0.00 -0.52 0.00 0.00 55.73 57.30 1lfg s ARG 652 Cb 0.03 -2.80 0.73 0.00 0.52 0.00 0.00 34.95 33.43 1lfg s ARG 652 CO 0.20 0.15 1.72 -0.07 0.02 0.00 0.00 175.30 177.32 1lfg h LEU 653 N 3.11 0.00 1.48 2.53 3.38 -1.90 -3.46 115.31 120.46 1lfg h LEU 653 Ca -0.47 -0.02 -0.38 0.00 0.09 0.00 0.00 57.88 57.09 1lfg h LEU 653 Cb 1.20 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.99 1lfg h LEU 653 CO 0.65 0.01 -0.55 1.41 0.09 0.00 0.00 178.44 180.05 1lfg n HIS 654 N -2.30 -1.56 0.00 1.13 8.25 -1.26 -2.53 115.22 116.94 1lfg n HIS 654 Ca 0.05 0.34 0.00 0.00 -0.26 0.00 0.00 57.72 57.85 1lfg n HIS 654 Cb 0.44 -4.14 0.00 0.00 1.12 0.00 0.00 29.99 27.41 1lfg n HIS 654 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1lfg n GLY 655 N -1.34 2.18 3.56 -1.41 0.00 -1.26 -4.98 105.19 101.94 1lfg n GLY 655 Ca -0.15 -0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 1lfg n GLY 655 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1lfg s LYS 656 N 0.00 3.83 -0.23 1.61 -2.85 -1.05 -4.69 119.74 116.36 1lfg s LYS 656 Ca 0.00 -1.70 0.13 0.00 -1.00 0.00 0.00 55.97 53.40 1lfg s LYS 656 Cb 0.00 -5.41 0.54 0.00 -2.06 0.00 0.00 37.83 30.89 1lfg s LYS 656 CO 0.00 -2.19 1.47 0.25 0.10 0.00 0.00 175.35 174.98 1lfg n THR 657 N 6.42 2.43 -4.15 3.79 -2.24 -1.26 -4.37 114.28 114.90 1lfg n THR 657 Ca 0.41 -2.15 -0.15 0.00 -2.27 0.00 0.00 64.05 59.88 1lfg n THR 657 Cb 0.48 -0.29 -0.12 0.00 -2.10 0.00 0.00 70.33 68.29 1lfg n THR 657 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1lfg s THR 658 N -2.99 0.68 0.31 4.28 -4.23 -1.26 -4.34 115.64 108.08 1lfg s THR 658 Ca 0.44 -0.92 0.07 0.00 -1.18 0.00 0.00 61.69 60.10 1lfg s THR 658 Cb 0.37 -0.68 0.30 0.00 1.34 0.00 0.00 72.50 73.83 1lfg s THR 658 CO 0.06 -0.20 1.73 0.10 -0.54 0.00 0.00 174.62 175.77 1lfg h TYR 659 N 4.86 0.90 -0.33 3.99 -0.00 -1.88 0.26 116.97 124.77 1lfg h TYR 659 Ca -0.35 0.04 -0.02 0.00 -0.00 0.00 0.00 58.73 58.39 1lfg h TYR 659 Cb 1.19 -0.25 -0.01 0.00 -0.00 0.00 0.00 36.73 37.66 1lfg h TYR 659 CO 0.58 0.06 0.12 0.93 -0.00 0.00 0.00 178.16 179.84 1lfg h GLU 660 N 0.55 0.51 -0.38 0.10 5.08 -1.95 -0.66 114.58 117.84 1lfg h GLU 660 Ca 0.60 -0.10 -0.09 0.00 -1.00 0.00 0.00 59.36 58.77 1lfg h GLU 660 Cb 1.12 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 1lfg h GLU 660 CO -0.48 0.53 -0.12 0.87 -1.00 0.00 0.00 179.01 178.81 1lfg h LYS 661 N 0.39 0.76 0.09 2.33 1.57 -1.63 -1.78 116.57 118.30 1lfg h LYS 661 Ca 0.11 -0.31 -0.00 0.00 -1.87 0.00 0.00 60.65 58.58 1lfg h LYS 661 Cb 0.22 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1lfg h LYS 661 CO -0.01 0.92 -0.04 -0.92 -0.57 0.00 0.00 179.45 178.83 1lfg h TYR 662 N 0.56 -0.11 -0.04 -1.35 3.20 -0.82 -3.29 116.97 115.12 1lfg h TYR 662 Ca 0.09 -0.00 -0.18 0.00 3.14 0.00 0.00 58.73 61.78 1lfg h TYR 662 Cb 0.65 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.95 1lfg h TYR 662 CO 0.05 0.19 -0.76 -0.07 -1.64 0.00 0.00 178.16 175.94 1lfg h LEU 663 N -0.42 0.35 0.00 2.82 3.38 -1.22 -3.49 115.31 116.73 1lfg h LEU 663 Ca -0.01 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1lfg h LEU 663 Cb 0.35 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1lfg h LEU 663 CO 0.02 0.98 0.00 0.61 0.09 0.00 0.00 178.44 180.14 1lfg n GLY 664 N 0.61 1.98 0.30 0.83 0.00 -0.67 -4.35 105.19 103.88 1lfg n GLY 664 Ca -0.04 -1.65 -0.04 0.00 0.00 0.00 0.00 46.02 44.30 1lfg n GLY 664 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1lfg h PRO 665 N 0.00 -0.12 0.27 1.61 0.13 -1.90 -1.18 132.00 130.81 1lfg h PRO 665 Ca 0.00 0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 1lfg h PRO 665 Cb 0.00 0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.16 1lfg h PRO 665 CO 0.00 -0.08 -0.13 1.96 -0.23 0.00 0.00 178.00 179.52 1lfg h GLN 666 N -0.12 -0.35 -0.30 0.86 7.50 -1.95 -1.17 115.11 119.57 1lfg h GLN 666 Ca 0.24 0.02 0.07 0.00 0.50 0.00 0.00 58.65 59.48 1lfg h GLN 666 Cb 0.51 0.08 -0.08 0.00 0.05 0.00 0.00 27.48 28.04 1lfg h GLN 666 CO -0.62 -0.19 -0.29 -0.92 -1.50 0.00 0.00 178.83 175.31 1lfg h TYR 667 N -0.43 -0.79 0.00 2.96 3.20 -1.60 -1.59 116.97 118.72 1lfg h TYR 667 Ca -0.04 0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 1lfg h TYR 667 Cb 0.33 0.39 -0.00 0.00 1.54 0.00 0.00 36.73 38.99 1lfg h TYR 667 CO -0.04 -0.36 -0.07 0.28 -1.64 0.00 0.00 178.16 176.33 1lfg h VAL 668 N -0.27 1.05 -0.28 1.81 2.07 -1.18 -1.22 116.25 118.23 1lfg h VAL 668 Ca 0.15 -0.25 -0.16 0.00 0.82 0.00 0.00 66.70 67.26 1lfg h VAL 668 Cb 0.51 1.14 -0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1lfg h VAL 668 CO -0.46 0.07 -0.44 0.00 0.02 0.00 0.00 177.57 176.76 1lfg h ALA 669 N 1.93 0.43 -0.19 1.67 0.00 -0.42 -2.79 119.26 119.90 1lfg h ALA 669 Ca -0.00 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1lfg h ALA 669 Cb 0.13 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1lfg h ALA 669 CO 0.01 0.57 0.07 0.78 0.00 0.00 0.00 179.25 180.67 1lfg h GLY 670 N 0.55 0.31 1.01 0.00 0.00 -0.34 -0.94 103.07 103.66 1lfg h GLY 670 Ca 0.02 -0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.18 1lfg h GLY 670 CO 0.10 0.17 0.47 -2.22 0.00 0.00 0.00 176.54 175.06 1lfg h ILE 671 N 0.14 1.21 -1.00 2.60 2.04 -1.36 -1.87 117.51 119.27 1lfg h ILE 671 Ca 0.06 -0.45 0.09 0.00 1.00 0.00 0.00 64.86 65.56 1lfg h ILE 671 Cb 0.21 0.13 -0.08 0.00 -0.74 0.00 0.00 36.82 36.34 1lfg h ILE 671 CO -0.00 0.22 0.64 0.74 0.00 0.00 0.00 178.15 179.74 1lfg h THR 672 N 1.05 1.01 -0.54 -0.27 2.02 -1.27 0.62 112.91 115.53 1lfg h THR 672 Ca 0.28 -0.37 -0.11 0.00 0.77 0.00 0.00 66.41 66.98 1lfg h THR 672 Cb -0.06 -0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.16 1lfg h THR 672 CO -0.05 0.20 -0.08 0.78 0.37 0.00 0.00 175.52 176.73 1lfg h ASN 673 N 1.08 0.99 -0.28 4.18 2.35 -0.47 -3.02 115.58 120.42 1lfg h ASN 673 Ca 0.46 -0.31 -0.05 0.00 -0.55 0.00 0.00 56.30 55.86 1lfg h ASN 673 Cb 0.32 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 1lfg h ASN 673 CO -0.22 1.09 0.00 -0.07 -1.65 0.00 0.00 177.43 176.58 1lfg h LEU 674 N 0.90 0.49 -1.74 1.61 3.38 -0.42 -2.85 115.31 116.68 1lfg h LEU 674 Ca 0.15 -0.31 0.19 0.00 0.09 0.00 0.00 57.88 58.00 1lfg h LEU 674 Cb 0.63 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.20 1lfg h LEU 674 CO 0.04 0.68 0.54 0.11 0.09 0.00 0.00 178.44 179.90 1lfg h LYS 675 N 0.29 0.23 0.00 1.13 1.79 0.20 0.51 116.57 120.72 1lfg h LYS 675 Ca 0.08 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 1lfg h LYS 675 Cb 0.43 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.03 1lfg h LYS 675 CO 0.01 0.15 0.00 0.87 -1.08 0.00 0.00 179.45 179.40 1lfg h LYS 676 N 0.23 0.00 0.00 3.15 1.57 -1.37 0.11 116.57 120.27 1lfg h LYS 676 Ca 0.39 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 59.04 1lfg h LYS 676 Cb 1.17 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.46 1lfg h LYS 676 CO -0.09 0.00 -0.62 0.00 -0.57 0.00 0.00 179.45 178.17 1lfg s SER 678 N -6.53 -0.04 0.39 0.00 1.04 0.39 -5.09 113.70 103.86 1lfg s SER 678 Ca 0.03 0.07 0.08 0.00 0.48 0.00 0.00 55.95 56.60 1lfg s SER 678 Cb 0.09 0.76 -0.02 0.00 0.10 0.00 0.00 66.02 66.95 1lfg s SER 678 CO 0.76 -0.01 0.40 0.42 0.98 0.00 0.00 173.24 175.79 1lfg s THR 679 N 0.75 3.04 0.37 2.02 -4.23 -1.19 -4.44 115.64 111.96 1lfg s THR 679 Ca -0.04 -1.26 0.07 0.00 -1.18 0.00 0.00 61.69 59.29 1lfg s THR 679 Cb -0.03 -3.07 -0.01 0.00 1.34 0.00 0.00 72.50 70.73 1lfg s THR 679 CO -0.11 -0.05 0.45 -0.94 -0.54 0.00 0.00 174.62 173.42 1lfg s SER 680 N -4.15 5.63 0.31 3.99 1.04 -1.26 -4.97 113.70 114.29 1lfg s SER 680 Ca 0.48 -0.38 0.05 0.00 0.48 0.00 0.00 55.95 56.57 1lfg s SER 680 Cb -0.06 -0.95 0.68 0.00 0.10 0.00 0.00 66.02 65.80 1lfg s SER 680 CO 0.29 -0.53 1.82 -0.65 0.98 0.00 0.00 173.24 175.15 1lfg h PRO 681 N 0.92 0.82 -0.47 4.02 0.11 -2.00 -1.20 132.00 134.20 1lfg h PRO 681 Ca -0.44 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.56 1lfg h PRO 681 Cb 1.26 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 1lfg h PRO 681 CO 0.53 0.54 0.05 1.25 -0.21 0.00 0.00 178.00 180.16 1lfg h LEU 682 N 0.84 0.77 -0.81 2.35 5.85 -1.97 0.30 115.31 122.64 1lfg h LEU 682 Ca 0.53 -0.27 -0.13 0.00 0.84 0.00 0.00 57.88 58.84 1lfg h LEU 682 Cb 0.72 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 1lfg h LEU 682 CO -0.30 0.85 -0.56 0.25 -0.34 0.00 0.00 178.44 178.33 1lfg h LEU 683 N 0.66 0.11 -0.32 2.25 5.85 -1.71 -1.52 115.31 120.62 1lfg h LEU 683 Ca 0.14 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.75 1lfg h LEU 683 Cb 0.42 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 1lfg h LEU 683 CO 0.01 0.65 -0.01 -0.33 -0.34 0.00 0.00 178.44 178.43 1lfg h GLU 684 N 0.07 0.58 0.34 1.25 5.08 -0.53 -0.49 114.58 120.88 1lfg h GLU 684 Ca -0.00 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.17 1lfg h GLU 684 Cb 1.02 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.19 1lfg h GLU 684 CO 0.08 0.71 -0.38 0.00 -1.00 0.00 0.00 179.01 178.42 1lfg h ALA 685 N 0.85 -0.79 0.00 3.43 0.00 -0.19 -2.37 119.26 120.18 1lfg h ALA 685 Ca 0.09 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1lfg h ALA 685 Cb 0.45 0.56 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 1lfg h ALA 685 CO 0.02 -0.99 -0.02 0.00 0.00 0.00 0.00 179.25 178.26 1lfg h GLU 687 N 0.00 0.87 0.23 0.00 3.07 -0.59 -2.67 114.58 115.49 1lfg h GLU 687 Ca -0.00 -0.36 -0.01 0.00 -0.50 0.00 0.00 59.36 58.49 1lfg h GLU 687 Cb 0.03 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 27.91 1lfg h GLU 687 CO 0.00 1.00 -0.15 0.35 -1.40 0.00 0.00 179.01 178.82 1lfg h PHE 688 N 0.75 -0.39 0.00 4.33 3.04 -0.88 -2.41 116.94 121.38 1lfg h PHE 688 Ca 0.10 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.05 1lfg h PHE 688 Cb 0.77 0.14 0.00 0.00 2.56 0.00 0.00 35.95 39.42 1lfg h PHE 688 CO 0.04 -0.23 0.00 1.28 -2.02 0.00 0.00 178.31 177.38 1lfg n LEU 689 N -5.27 0.00 -0.08 0.59 4.77 -0.49 -3.48 117.00 113.03 1lfg n LEU 689 Ca -0.09 0.40 -0.15 0.00 -0.03 0.00 0.00 56.01 56.14 1lfg n LEU 689 Cb 0.19 -0.40 -0.14 0.00 -2.33 0.00 0.00 43.42 40.74 1lfg n LEU 689 CO 0.33 -0.17 -1.08 0.54 -1.33 0.00 0.00 177.39 175.68 1lfg n ARG 690 N -1.40 0.68 0.00 3.23 5.12 -0.93 -5.07 116.66 118.28 1lfg n ARG 690 Ca 0.06 0.15 0.00 0.00 -1.93 0.00 0.00 57.85 56.13 1lfg n ARG 690 Cb 0.17 -1.60 0.00 0.00 -1.16 0.00 0.00 32.46 29.87 1lfg n ARG 690 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33