#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f9b s PRO 2 N 0.00 1.10 -0.04 0.00 0.02 -1.26 -5.08 135.00 129.75 1f9b s PRO 2 Ca 0.00 1.11 0.01 0.00 0.02 0.00 0.00 61.00 62.13 1f9b s PRO 2 Cb 0.00 -1.77 0.02 0.00 0.02 0.00 0.00 34.50 32.77 1f9b s PRO 2 CO 0.00 -2.43 -0.03 0.50 -0.33 0.00 0.00 177.00 174.71 1f9b s ARG 3 N -4.78 0.61 0.00 5.54 6.06 -1.26 -5.16 118.95 119.96 1f9b s ARG 3 Ca 0.65 -0.04 0.00 0.00 -2.50 0.00 0.00 55.73 53.83 1f9b s ARG 3 Cb -0.20 -0.68 0.00 0.00 0.06 0.00 0.00 34.95 34.13 1f9b s ARG 3 CO 0.58 -0.09 0.00 1.63 -2.50 0.00 0.00 175.30 174.92 1f9b n LYS 4 N 4.01 1.66 -4.03 5.12 4.76 -1.26 -5.01 118.16 123.41 1f9b n LYS 4 Ca -0.26 0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 54.90 1f9b n LYS 4 Cb 0.51 0.00 -0.05 0.00 -1.84 0.00 0.00 35.03 33.65 1f9b n LYS 4 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1f9b s SER 5 N -1.76 5.75 -0.19 4.39 1.04 -1.26 -4.73 113.70 116.94 1f9b s SER 5 Ca 0.00 0.00 -0.23 0.00 0.48 0.00 0.00 55.95 56.21 1f9b s SER 5 Cb 0.00 -1.59 -0.02 0.00 0.10 0.00 0.00 66.02 64.51 1f9b s SER 5 CO 0.00 0.11 0.71 -0.69 0.98 0.00 0.00 173.24 174.35 1f9b s VAL 6 N -1.61 4.96 -0.46 5.02 1.01 -1.01 -4.90 120.40 123.41 1f9b s VAL 6 Ca 0.31 1.37 -0.23 0.00 0.00 0.00 0.00 61.98 63.43 1f9b s VAL 6 Cb -0.11 -4.02 0.03 0.00 0.00 0.00 0.00 36.38 32.27 1f9b s VAL 6 CO 0.24 0.08 0.81 -0.13 0.00 0.00 0.00 175.10 176.10 1f9b s ARG 7 N 2.01 3.41 -0.11 2.72 0.52 -1.26 -1.68 118.95 124.56 1f9b s ARG 7 Ca 0.33 -0.09 -0.19 0.00 -0.52 0.00 0.00 55.73 55.25 1f9b s ARG 7 Cb -0.16 -3.95 -0.04 0.00 0.52 0.00 0.00 34.95 31.32 1f9b s ARG 7 CO 0.11 -1.16 0.52 -0.46 0.02 0.00 0.00 175.30 174.33 1f9b s TRP 8 N 3.40 3.53 0.03 -0.53 -0.11 0.01 -0.50 118.94 124.76 1f9b s TRP 8 Ca 0.31 0.97 -0.21 0.00 1.22 0.00 0.00 56.10 58.38 1f9b s TRP 8 Cb -0.12 -2.60 -0.06 0.00 -1.50 0.00 0.00 33.47 29.19 1f9b s TRP 8 CO 0.23 0.15 0.63 0.00 -4.62 0.00 0.00 176.95 173.34 1f9b s THR 10 N -0.38 2.52 -0.49 0.00 -4.23 -0.53 -4.83 115.64 107.71 1f9b s THR 10 Ca 0.32 -2.10 0.08 0.00 -1.18 0.00 0.00 61.69 58.82 1f9b s THR 10 Cb -0.19 -2.25 -0.07 0.00 1.34 0.00 0.00 72.50 71.32 1f9b s THR 10 CO 0.19 -0.21 0.41 2.30 -0.54 0.00 0.00 174.62 176.77 1f9b n ILE 11 N -0.06 0.00 -3.52 2.99 -5.35 -1.25 -0.98 119.36 111.19 1f9b n ILE 11 Ca -0.10 -0.32 -0.14 0.00 -0.27 0.00 0.00 62.75 61.91 1f9b n ILE 11 Cb 0.57 1.02 -0.05 0.00 -1.74 0.00 0.00 39.64 39.45 1f9b n ILE 11 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1f9b s SER 12 N -1.68 -0.52 0.22 7.28 1.04 -1.26 -4.17 113.70 114.62 1f9b s SER 12 Ca 0.04 0.23 -0.11 0.00 0.48 0.00 0.00 55.95 56.60 1f9b s SER 12 Cb 0.07 0.53 0.31 0.00 0.10 0.00 0.00 66.02 67.03 1f9b s SER 12 CO 0.32 -0.77 1.64 -0.65 0.98 0.00 0.00 173.24 174.76 1f9b h PRO 13 N 2.61 0.06 -0.68 4.02 0.11 -1.97 0.48 132.00 136.63 1f9b h PRO 13 Ca -0.31 -0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.88 1f9b h PRO 13 Cb 1.22 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.28 1f9b h PRO 13 CO 0.40 0.04 0.45 0.00 -0.21 0.00 0.00 178.00 178.68 1f9b h ALA 14 N 1.64 1.83 -0.21 -0.75 0.00 -1.97 -0.88 119.26 118.92 1f9b h ALA 14 Ca 0.34 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 55.06 1f9b h ALA 14 Cb 0.56 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1f9b h ALA 14 CO -0.62 0.04 -0.58 1.49 0.00 0.00 0.00 179.25 179.58 1f9b h GLU 15 N 0.61 0.68 0.21 0.00 4.81 -0.52 -2.65 114.58 117.72 1f9b h GLU 15 Ca 0.31 -0.45 -0.01 0.00 -0.13 0.00 0.00 59.36 59.08 1f9b h GLU 15 Cb 0.40 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1f9b h GLU 15 CO -0.10 1.06 -0.10 0.00 -0.73 0.00 0.00 179.01 179.14 1f9b h ALA 16 N 0.84 -0.28 -0.56 2.92 0.00 0.16 -1.46 119.26 120.88 1f9b h ALA 16 Ca 0.00 -0.06 0.11 0.00 0.00 0.00 0.00 54.91 54.97 1f9b h ALA 16 Cb 1.16 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 18.96 1f9b h ALA 16 CO 0.12 -0.65 -0.01 0.00 0.00 0.00 0.00 179.25 178.70 1f9b h ALA 17 N 0.52 0.53 -0.42 0.00 0.00 -1.24 0.24 119.26 118.88 1f9b h ALA 17 Ca -0.03 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1f9b h ALA 17 Cb 0.21 0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1f9b h ALA 17 CO 0.05 -0.40 0.23 -0.22 0.00 0.00 0.00 179.25 178.92 1f9b h LYS 18 N 0.10 0.59 -0.21 0.00 3.64 -1.31 -1.03 116.57 118.36 1f9b h LYS 18 Ca 0.29 -0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.65 1f9b h LYS 18 Cb 0.45 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.11 1f9b h LYS 18 CO -0.49 0.47 -0.10 0.00 -2.27 0.00 0.00 179.45 177.05 1f9b h ALA 20 N 1.09 1.27 -0.90 0.00 0.00 -0.29 1.07 119.26 121.50 1f9b h ALA 20 Ca 0.11 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1f9b h ALA 20 Cb 0.25 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1f9b h ALA 20 CO -0.26 0.01 0.53 -0.22 0.00 0.00 0.00 179.25 179.31 1f9b h LYS 21 N 0.73 1.22 -0.52 0.00 3.64 0.23 0.07 116.57 121.94 1f9b h LYS 21 Ca 0.44 -0.12 -0.11 0.00 -1.27 0.00 0.00 60.65 59.60 1f9b h LYS 21 Cb 0.53 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 1f9b h LYS 21 CO -0.31 0.86 -0.10 0.35 -2.27 0.00 0.00 179.45 177.99 1f9b h PHE 22 N 1.24 1.08 -0.14 1.91 3.57 0.29 -0.15 116.94 124.75 1f9b h PHE 22 Ca 0.32 -0.22 -0.13 0.00 3.53 0.00 0.00 57.97 61.47 1f9b h PHE 22 Cb -0.04 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.42 1f9b h PHE 22 CO 0.01 1.01 -0.49 0.37 -2.23 0.00 0.00 178.31 176.98 1f9b h GLN 23 N 0.87 0.36 0.37 1.11 4.15 -0.28 -0.99 115.11 120.69 1f9b h GLN 23 Ca 0.14 -0.20 -0.02 0.00 0.77 0.00 0.00 58.65 59.34 1f9b h GLN 23 Cb 0.65 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.36 1f9b h GLN 23 CO 0.05 0.77 -0.18 -0.09 -1.93 0.00 0.00 178.83 177.45 1f9b h ARG 24 N 0.29 -0.47 0.00 1.69 2.43 -0.70 -3.09 114.38 114.52 1f9b h ARG 24 Ca 0.01 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1f9b h ARG 24 Cb 0.96 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 1f9b h ARG 24 CO 0.08 -0.16 0.00 -0.91 -1.51 0.00 0.00 179.97 177.48 1f9b h ASN 25 N -0.87 0.00 -0.11 -3.80 4.21 -1.01 -2.50 115.58 111.50 1f9b h ASN 25 Ca -0.05 0.00 -0.10 0.00 1.21 0.00 0.00 56.30 57.36 1f9b h ASN 25 Cb 0.54 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.74 1f9b h ASN 25 CO 0.08 0.00 -0.33 -0.03 -1.29 0.00 0.00 177.43 175.87 1f9b h MET 26 N 0.00 0.42 0.00 0.81 4.05 -1.21 -2.95 114.93 116.04 1f9b h MET 26 Ca 0.00 -0.30 -0.07 0.00 -0.28 0.00 0.00 59.70 59.05 1f9b h MET 26 Cb 0.44 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.28 1f9b h MET 26 CO 0.00 0.92 -0.35 -0.22 0.23 0.00 0.00 176.91 177.49 1f9b h LYS 27 N -0.01 0.00 0.00 0.39 3.64 -1.45 -0.51 116.57 118.64 1f9b h LYS 27 Ca -0.01 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 1f9b h LYS 27 Cb 0.95 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.76 1f9b h LYS 27 CO 0.07 0.35 -0.06 -0.22 -2.27 0.00 0.00 179.45 177.31 1f9b h LYS 28 N 0.00 0.00 -0.05 1.90 3.64 -1.50 -2.79 116.57 117.77 1f9b h LYS 28 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1f9b h LYS 28 Cb 0.97 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 1f9b h LYS 28 CO 0.04 0.06 0.00 0.28 -2.27 0.00 0.00 179.45 177.57 1f9b n VAL 29 N -3.12 0.04 -3.60 2.00 0.31 -1.07 -4.98 118.33 107.91 1f9b n VAL 29 Ca 0.03 -0.52 -0.22 0.00 -0.01 0.00 0.00 64.34 63.63 1f9b n VAL 29 Cb 0.51 1.42 0.05 0.00 -0.91 0.00 0.00 33.84 34.90 1f9b n VAL 29 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1f9b n ARG 30 N 1.24 -3.93 -4.78 5.55 1.74 -0.80 -5.02 116.66 110.67 1f9b n ARG 30 Ca 0.13 0.65 -0.34 0.00 -0.77 0.00 0.00 57.85 57.53 1f9b n ARG 30 Cb 0.55 -5.16 -0.07 0.00 -1.02 0.00 0.00 32.46 26.76 1f9b n ARG 30 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1f9b s GLY 31 N -4.04 3.10 0.13 -0.13 0.00 -0.26 -5.03 107.32 101.09 1f9b s GLY 31 Ca 0.17 -0.10 -0.34 0.00 0.00 0.00 0.00 44.72 44.44 1f9b s GLY 31 CO 0.80 -2.21 1.13 -1.05 0.00 0.00 0.00 173.10 171.78 1f9b n PRO 32 N -1.30 0.86 -3.16 2.90 -0.02 -1.26 -4.49 135.00 128.53 1f9b n PRO 32 Ca -0.21 0.31 -0.33 0.00 -2.02 0.00 0.00 63.50 61.25 1f9b n PRO 32 Cb 0.67 -1.80 -0.06 0.00 -0.02 0.00 0.00 33.50 32.29 1f9b n PRO 32 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1f9b s SER 33 N 0.02 6.78 0.46 2.55 1.04 -1.26 -4.77 113.70 118.52 1f9b s SER 33 Ca 0.78 1.26 0.03 0.00 0.48 0.00 0.00 55.95 58.51 1f9b s SER 33 Cb -0.95 -2.36 -0.04 0.00 0.10 0.00 0.00 66.02 62.76 1f9b s SER 33 CO 0.52 -0.18 0.02 -0.69 0.98 0.00 0.00 173.24 173.90 1f9b s VAL 34 N -1.94 1.37 0.07 5.02 1.01 -1.26 -2.41 120.40 122.27 1f9b s VAL 34 Ca 0.53 -2.00 -0.11 0.00 0.00 0.00 0.00 61.98 60.40 1f9b s VAL 34 Cb -0.11 -2.48 0.01 0.00 0.00 0.00 0.00 36.38 33.80 1f9b s VAL 34 CO 0.18 0.00 0.24 -0.55 0.00 0.00 0.00 175.10 174.97 1f9b s SER 35 N -3.77 0.00 -0.15 3.32 0.15 -0.67 -4.83 113.70 107.75 1f9b s SER 35 Ca 0.19 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.39 1f9b s SER 35 Cb 0.05 0.35 0.03 0.00 -1.71 0.00 0.00 66.02 64.74 1f9b s SER 35 CO 0.10 -0.68 -0.11 0.00 1.20 0.00 0.00 173.24 173.75 1f9b s ILE 37 N 1.56 5.16 -0.22 0.00 -1.09 0.11 -4.97 121.20 121.75 1f9b s ILE 37 Ca 0.04 -0.30 0.01 0.00 -2.23 0.00 0.00 60.65 58.17 1f9b s ILE 37 Cb -0.13 -3.74 0.05 0.00 -1.58 0.00 0.00 42.46 37.05 1f9b s ILE 37 CO -0.09 -0.23 -0.07 -0.13 -1.23 0.00 0.00 174.94 173.18 1f9b s ARG 38 N -3.45 1.80 0.47 2.79 0.52 -1.26 -1.46 118.95 118.35 1f9b s ARG 38 Ca 0.40 -0.95 0.03 0.00 -0.52 0.00 0.00 55.73 54.68 1f9b s ARG 38 Cb -0.11 -2.54 -0.04 0.00 0.52 0.00 0.00 34.95 32.79 1f9b s ARG 38 CO 0.30 -0.53 0.01 0.15 0.02 0.00 0.00 175.30 175.24 1f9b s LYS 39 N 1.38 2.09 0.00 3.54 -0.14 -0.15 -4.97 119.74 121.49 1f9b s LYS 39 Ca -0.04 -2.28 0.16 0.00 -1.36 0.00 0.00 55.97 52.45 1f9b s LYS 39 Cb -0.18 -1.50 0.03 0.00 -1.68 0.00 0.00 37.83 34.49 1f9b s LYS 39 CO -0.07 -0.26 0.90 0.25 -0.76 0.00 0.00 175.35 175.41 1f9b n THR 40 N -1.13 0.00 -3.50 2.17 -2.24 -1.26 -3.82 114.28 104.49 1f9b n THR 40 Ca -0.13 -0.37 -0.10 0.00 -2.27 0.00 0.00 64.05 61.17 1f9b n THR 40 Cb 0.67 1.23 -0.02 0.00 -2.10 0.00 0.00 70.33 70.11 1f9b n THR 40 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1f9b s SER 41 N -1.79 -0.48 0.37 3.42 1.04 -1.26 -4.36 113.70 110.65 1f9b s SER 41 Ca 0.15 -0.10 0.06 0.00 0.48 0.00 0.00 55.95 56.54 1f9b s SER 41 Cb 0.13 0.58 0.73 0.00 0.10 0.00 0.00 66.02 67.56 1f9b s SER 41 CO 0.36 -0.96 1.97 0.28 0.98 0.00 0.00 173.24 175.87 1f9b h SER 42 N 2.00 0.48 -0.29 7.02 0.02 -1.94 -1.33 113.55 119.51 1f9b h SER 42 Ca -0.30 -0.05 -0.04 0.00 -0.84 0.00 0.00 61.79 60.56 1f9b h SER 42 Cb 1.29 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.68 1f9b h SER 42 CO 0.34 0.45 0.05 -0.26 -1.14 0.00 0.00 176.83 176.27 1f9b h PHE 43 N 0.53 0.59 -0.02 3.45 0.04 -1.96 -0.65 116.94 118.93 1f9b h PHE 43 Ca 0.13 -0.05 -0.13 0.00 2.80 0.00 0.00 57.97 60.72 1f9b h PHE 43 Cb 0.12 -0.18 -0.02 0.00 2.20 0.00 0.00 35.95 38.08 1f9b h PHE 43 CO 0.01 0.55 -0.58 0.93 -0.60 0.00 0.00 178.31 178.61 1f9b h GLU 44 N 0.56 0.05 -0.09 1.51 5.08 -1.66 -0.78 114.58 119.25 1f9b h GLU 44 Ca 0.12 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 58.28 1f9b h GLU 44 Cb 0.29 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1f9b h GLU 44 CO 0.00 0.62 -0.67 0.00 -1.00 0.00 0.00 179.01 177.97 1f9b h ILE 46 N 0.27 0.47 0.33 0.00 2.04 -0.73 1.77 117.51 121.66 1f9b h ILE 46 Ca -0.02 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.83 1f9b h ILE 46 Cb 1.22 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.77 1f9b h ILE 46 CO 0.11 0.00 -0.16 1.56 0.00 0.00 0.00 178.15 179.66 1f9b h GLN 47 N -0.47 -0.44 -0.77 2.37 4.20 -0.85 -1.25 115.11 117.89 1f9b h GLN 47 Ca 0.02 0.03 0.12 0.00 0.06 0.00 0.00 58.65 58.88 1f9b h GLN 47 Cb 0.47 0.10 -0.05 0.00 0.30 0.00 0.00 27.48 28.30 1f9b h GLN 47 CO -0.10 -0.29 0.51 0.00 -0.67 0.00 0.00 178.83 178.27 1f9b h ALA 48 N 0.22 1.92 -0.03 3.87 0.00 0.29 -1.61 119.26 123.91 1f9b h ALA 48 Ca -0.04 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1f9b h ALA 48 Cb 0.35 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1f9b h ALA 48 CO 0.07 -0.11 -0.19 0.82 0.00 0.00 0.00 179.25 179.84 1f9b h ILE 49 N 0.58 1.49 0.00 0.00 2.04 0.33 -1.04 117.51 120.90 1f9b h ILE 49 Ca 0.37 -1.72 -0.01 0.00 1.00 0.00 0.00 64.86 64.51 1f9b h ILE 49 Cb 0.64 2.52 -0.00 0.00 -0.74 0.00 0.00 36.82 39.24 1f9b h ILE 49 CO -0.14 0.47 -0.03 0.00 0.00 0.00 0.00 178.15 178.46 1f9b h ALA 50 N 0.36 1.77 -0.30 1.87 0.00 -0.76 -1.55 119.26 120.64 1f9b h ALA 50 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1f9b h ALA 50 Cb 0.87 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1f9b h ALA 50 CO 0.04 0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.32 1f9b n ALA 51 N -2.45 2.66 -2.74 0.00 0.00 -0.65 -4.91 120.51 112.42 1f9b n ALA 51 Ca -0.03 -0.65 -0.21 0.00 0.00 0.00 0.00 53.44 52.55 1f9b n ALA 51 Cb 0.11 -1.00 0.01 0.00 0.00 0.00 0.00 19.45 18.57 1f9b n ALA 51 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1f9b n ASN 52 N 0.39 -5.55 -0.06 0.00 5.15 -0.58 -4.87 115.26 109.74 1f9b n ASN 52 Ca 0.11 -0.13 -0.15 0.00 -0.60 0.00 0.00 54.58 53.81 1f9b n ASN 52 Cb 0.40 -4.57 -0.14 0.00 -0.53 0.00 0.00 39.78 34.94 1f9b n ASN 52 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1f9b n LYS 53 N -3.47 0.69 -3.84 1.20 0.00 -0.44 -4.99 118.16 107.31 1f9b n LYS 53 Ca -0.16 0.19 -0.21 0.00 0.00 0.00 0.00 58.31 58.13 1f9b n LYS 53 Cb 0.64 -1.64 -0.05 0.00 0.00 0.00 0.00 35.03 33.97 1f9b n LYS 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1f9b n ALA 54 N -2.91 0.35 0.00 3.14 0.00 -0.91 -4.97 120.51 115.22 1f9b n ALA 54 Ca -0.32 -1.57 0.00 0.00 0.00 0.00 0.00 53.44 51.55 1f9b n ALA 54 Cb 1.06 0.94 0.00 0.00 0.00 0.00 0.00 19.45 21.45 1f9b n ALA 54 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1f9b n ASP 55 N -1.41 1.76 -3.89 0.00 8.00 0.34 -4.61 116.55 116.75 1f9b n ASP 55 Ca -0.11 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.31 1f9b n ASP 55 Cb 0.45 0.16 -0.08 0.00 -0.02 0.00 0.00 41.12 41.64 1f9b n ASP 55 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1f9b s ALA 56 N -1.36 -0.12 -0.29 2.24 0.00 -1.07 -4.49 121.76 116.66 1f9b s ALA 56 Ca 0.00 -0.68 -0.21 0.00 0.00 0.00 0.00 51.96 51.07 1f9b s ALA 56 Cb 0.00 0.43 0.18 0.00 0.00 0.00 0.00 23.12 23.73 1f9b s ALA 56 CO 0.00 -0.47 1.24 0.14 0.00 0.00 0.00 175.76 176.67 1f9b s VAL 57 N -3.74 0.00 0.04 0.00 -7.23 -1.22 -2.11 120.40 106.14 1f9b s VAL 57 Ca 0.04 0.00 -0.30 0.00 -1.81 0.00 0.00 61.98 59.91 1f9b s VAL 57 Cb 0.05 -1.00 -0.04 0.00 0.56 0.00 0.00 36.38 35.95 1f9b s VAL 57 CO -0.10 0.00 0.96 -0.89 -0.31 0.00 0.00 175.10 174.76 1f9b s THR 58 N 0.53 4.74 0.13 5.32 2.01 -1.26 0.04 115.64 127.15 1f9b s THR 58 Ca 0.00 2.05 0.06 0.00 0.31 0.00 0.00 61.69 64.10 1f9b s THR 58 Cb -0.04 -4.31 -0.04 0.00 0.01 0.00 0.00 72.50 68.12 1f9b s THR 58 CO -0.12 0.22 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.14 1f9b s LEU 59 N 0.62 2.44 0.41 4.42 1.43 0.36 -4.92 118.68 123.44 1f9b s LEU 59 Ca 0.50 -0.87 -0.22 0.00 -1.03 0.00 0.00 54.13 52.51 1f9b s LEU 59 Cb -0.22 -0.50 -0.11 0.00 0.03 0.00 0.00 46.19 45.39 1f9b s LEU 59 CO 0.28 -0.19 0.95 -0.62 0.23 0.00 0.00 176.35 177.01 1f9b s ASP 60 N -2.67 7.00 0.26 2.29 2.15 -1.26 -1.41 116.67 123.03 1f9b s ASP 60 Ca 0.11 1.73 0.07 0.00 0.43 0.00 0.00 52.55 54.89 1f9b s ASP 60 Cb -0.03 -2.55 0.77 0.00 -0.30 0.00 0.00 42.92 40.81 1f9b s ASP 60 CO 0.03 -0.32 1.26 0.61 -0.17 0.00 0.00 175.17 176.58 1f9b n GLY 61 N -0.36 -0.93 0.28 2.66 0.00 -1.26 0.11 105.19 105.69 1f9b n GLY 61 Ca 0.06 0.74 0.01 0.00 0.00 0.00 0.00 46.02 46.83 1f9b n GLY 61 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1f9b h GLY 62 N 0.00 0.58 1.64 -0.02 0.00 -1.91 -1.76 103.07 101.60 1f9b h GLY 62 Ca 0.55 -0.31 -0.11 0.00 0.00 0.00 0.00 47.33 47.46 1f9b h GLY 62 CO -0.71 0.29 -0.77 1.41 0.00 0.00 0.00 176.54 176.76 1f9b h LEU 63 N 0.53 0.00 0.30 3.11 3.38 0.58 -3.00 115.31 120.20 1f9b h LEU 63 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1f9b h LEU 63 Cb 0.24 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1f9b h LEU 63 CO 0.00 0.46 -0.37 0.58 0.09 0.00 0.00 178.44 179.20 1f9b h VAL 64 N 0.00 0.23 -0.71 1.22 2.07 -0.67 0.33 116.25 118.72 1f9b h VAL 64 Ca -0.05 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.57 1f9b h VAL 64 Cb 1.39 0.23 -0.12 0.00 -1.52 0.00 0.00 31.29 31.28 1f9b h VAL 64 CO 0.05 0.00 -0.43 0.22 0.02 0.00 0.00 177.57 177.43 1f9b h TYR 65 N -0.72 -1.26 -0.42 1.57 3.20 -1.32 0.47 116.97 118.50 1f9b h TYR 65 Ca -0.01 0.09 -0.02 0.00 3.14 0.00 0.00 58.73 61.93 1f9b h TYR 65 Cb 0.67 0.65 -0.02 0.00 1.54 0.00 0.00 36.73 39.57 1f9b h TYR 65 CO -0.25 -0.41 0.16 0.93 -1.64 0.00 0.00 178.16 176.96 1f9b h GLU 66 N -0.15 0.59 0.00 1.82 4.39 -1.28 -2.37 114.58 117.60 1f9b h GLU 66 Ca 0.22 -0.08 -0.10 0.00 0.34 0.00 0.00 59.36 59.74 1f9b h GLU 66 Cb 0.55 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 1f9b h GLU 66 CO -0.78 0.50 -0.48 0.00 -1.16 0.00 0.00 179.01 177.09 1f9b h ALA 67 N 1.59 0.93 0.00 3.43 0.00 0.39 -2.57 119.26 123.02 1f9b h ALA 67 Ca 0.15 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1f9b h ALA 67 Cb 0.13 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1f9b h ALA 67 CO -0.01 0.60 0.00 0.41 0.00 0.00 0.00 179.25 180.25 1f9b n GLY 68 N 0.38 -1.51 3.60 0.00 0.00 -0.10 -1.15 105.19 106.41 1f9b n GLY 68 Ca -0.00 -0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 1f9b n GLY 68 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1f9b n LEU 69 N -2.08 1.86 0.00 0.99 4.77 -0.97 -3.99 117.00 117.58 1f9b n LEU 69 Ca 0.05 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 1f9b n LEU 69 Cb 0.34 -1.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.03 1f9b n LEU 69 CO 0.26 -2.55 0.18 1.57 -1.33 0.00 0.00 177.39 175.51 1f9b n HIS 70 N -4.39 0.00 -0.01 -1.77 -0.00 -1.26 -1.08 115.22 106.71 1f9b n HIS 70 Ca 0.09 0.00 0.22 0.00 -0.00 0.00 0.00 57.72 58.03 1f9b n HIS 70 Cb 0.53 0.00 0.53 0.00 -0.00 0.00 0.00 29.99 31.05 1f9b n HIS 70 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1f9b h PRO 71 N 0.00 0.00 0.00 1.57 0.13 -1.95 -2.57 132.00 129.18 1f9b h PRO 71 Ca 0.00 0.00 -0.43 0.00 -0.87 0.00 0.00 66.00 64.70 1f9b h PRO 71 Cb 0.00 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.06 1f9b h PRO 71 CO 0.00 0.00 -2.40 0.66 -0.23 0.00 0.00 178.00 176.03 1f9b n TYR 72 N -3.29 0.13 -3.97 1.56 4.01 -1.07 -5.03 117.16 109.51 1f9b n TYR 72 Ca 0.13 0.05 -0.26 0.00 -0.16 0.00 0.00 57.90 57.66 1f9b n TYR 72 Cb 1.07 -1.01 -0.02 0.00 -0.31 0.00 0.00 39.34 39.06 1f9b n TYR 72 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1f9b n LYS 73 N -4.14 -2.96 -2.47 -0.72 4.76 -0.24 -4.83 118.16 107.56 1f9b n LYS 73 Ca -0.51 0.38 -0.27 0.00 -2.87 0.00 0.00 58.31 55.04 1f9b n LYS 73 Cb 0.88 -4.40 0.02 0.00 -1.84 0.00 0.00 35.03 29.69 1f9b n LYS 73 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1f9b s LEU 74 N -6.98 3.41 0.01 -0.35 1.43 -0.30 -3.30 118.68 112.59 1f9b s LEU 74 Ca 0.03 0.84 0.01 0.00 -1.03 0.00 0.00 54.13 53.99 1f9b s LEU 74 Cb -0.01 -3.74 -0.01 0.00 0.03 0.00 0.00 46.19 42.46 1f9b s LEU 74 CO 0.90 -0.84 -0.04 0.00 0.23 0.00 0.00 176.35 176.60 1f9b s ARG 75 N -4.89 0.31 -0.29 1.70 1.70 0.53 -4.16 118.95 113.84 1f9b s ARG 75 Ca 0.51 -0.26 -0.29 0.00 -0.47 0.00 0.00 55.73 55.22 1f9b s ARG 75 Cb -0.10 -0.23 -0.01 0.00 -0.57 0.00 0.00 34.95 34.03 1f9b s ARG 75 CO 0.45 0.06 1.59 -1.25 -1.08 0.00 0.00 175.30 175.07 1f9b s PRO 76 N -0.43 3.65 -0.11 3.89 0.04 -1.26 -0.94 135.00 139.85 1f9b s PRO 76 Ca -0.02 1.42 -0.19 0.00 0.04 0.00 0.00 61.00 62.25 1f9b s PRO 76 Cb -0.03 -4.06 -0.27 0.00 0.04 0.00 0.00 34.50 30.18 1f9b s PRO 76 CO -0.00 -1.47 0.61 0.28 0.04 0.00 0.00 177.00 176.46 1f9b h VAL 77 N 6.36 1.19 -3.53 -0.36 2.07 -0.06 -3.43 116.25 118.48 1f9b h VAL 77 Ca -0.32 -2.40 -0.19 0.00 0.82 0.00 0.00 66.70 64.61 1f9b h VAL 77 Cb 1.14 2.82 -0.26 0.00 -1.52 0.00 0.00 31.29 33.48 1f9b h VAL 77 CO 1.03 0.65 -0.59 0.00 0.02 0.00 0.00 177.57 178.68 1f9b s ALA 78 N -2.43 -0.23 -0.19 1.67 0.00 -1.14 -0.30 121.76 119.14 1f9b s ALA 78 Ca -0.20 0.17 -0.07 0.00 0.00 0.00 0.00 51.96 51.86 1f9b s ALA 78 Cb 0.03 -0.11 -0.04 0.00 0.00 0.00 0.00 23.12 23.00 1f9b s ALA 78 CO 0.75 -0.08 0.06 0.00 0.00 0.00 0.00 175.76 176.49 1f9b s ALA 79 N -0.25 3.35 0.57 0.00 0.00 -0.61 0.17 121.76 125.00 1f9b s ALA 79 Ca -0.03 -0.78 -0.19 0.00 0.00 0.00 0.00 51.96 50.96 1f9b s ALA 79 Cb -0.02 -1.91 -0.04 0.00 0.00 0.00 0.00 23.12 21.15 1f9b s ALA 79 CO 0.00 0.12 1.16 -1.21 0.00 0.00 0.00 175.76 175.83 1f9b s GLU 80 N 0.48 3.15 0.04 0.00 2.02 -0.95 -1.47 118.70 121.97 1f9b s GLU 80 Ca 0.03 1.66 0.03 0.00 0.02 0.00 0.00 54.97 56.72 1f9b s GLU 80 Cb -0.13 -1.97 -0.04 0.00 0.10 0.00 0.00 34.13 32.09 1f9b s GLU 80 CO 0.01 -1.03 -0.03 0.08 0.02 0.00 0.00 175.26 174.31 1f9b s VAL 81 N -1.77 3.89 0.37 2.63 1.01 0.10 -4.58 120.40 122.05 1f9b s VAL 81 Ca 0.74 -0.83 0.04 0.00 0.00 0.00 0.00 61.98 61.92 1f9b s VAL 81 Cb -0.26 -2.76 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 1f9b s VAL 81 CO 0.31 0.28 0.12 -0.31 0.00 0.00 0.00 175.10 175.50 1f9b s TYR 82 N -1.14 1.78 0.00 5.22 2.02 0.38 -1.50 117.35 124.11 1f9b s TYR 82 Ca 0.21 -1.23 0.00 0.00 -0.37 0.00 0.00 57.07 55.68 1f9b s TYR 82 Cb -0.11 -1.12 0.00 0.00 -0.40 0.00 0.00 41.96 40.32 1f9b s TYR 82 CO 0.12 -0.28 0.54 0.00 -1.57 0.00 0.00 175.55 174.37 1f9b n GLN 83 N -0.79 0.00 0.00 -0.62 -0.00 -1.26 -2.78 117.38 111.93 1f9b n GLN 83 Ca -0.04 0.54 0.00 0.00 -0.00 0.00 0.00 57.00 57.50 1f9b n GLN 83 Cb 0.65 -0.98 0.00 0.00 -0.00 0.00 0.00 30.24 29.92 1f9b n GLN 83 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.06 179.47 1f9b n THR 84 N -1.40 0.00 -0.84 -0.39 -1.04 -1.26 -3.73 114.28 105.61 1f9b n THR 84 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1f9b n THR 84 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1f9b n THR 84 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 1f9b n ARG 85 N -2.00 0.00 0.00 -2.82 0.63 -1.26 -4.74 116.66 106.47 1f9b n ARG 85 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1f9b n ARG 85 Cb 0.00 -2.90 0.00 0.00 0.45 0.00 0.00 32.46 30.01 1f9b n ARG 85 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1f9b n GLY 86 N -2.00 2.74 3.79 5.14 0.00 -1.24 -5.12 105.19 108.49 1f9b n GLY 86 Ca 0.00 -0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 1f9b n GLY 86 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f9b s LYS 87 N 2.47 4.47 0.54 1.61 3.01 -1.26 -5.02 119.74 125.56 1f9b s LYS 87 Ca 0.00 1.05 -0.21 0.00 -1.01 0.00 0.00 55.97 55.80 1f9b s LYS 87 Cb 0.00 -3.23 -0.06 0.00 -1.01 0.00 0.00 37.83 33.53 1f9b s LYS 87 CO 0.00 0.57 1.14 -2.30 0.51 0.00 0.00 175.35 175.27 1f9b n PRO 88 N 1.55 1.33 -3.91 -1.68 -0.02 -1.26 -4.58 135.00 126.44 1f9b n PRO 88 Ca -0.06 0.49 -0.09 0.00 -2.02 0.00 0.00 63.50 61.82 1f9b n PRO 88 Cb 0.49 -2.31 -0.07 0.00 -0.02 0.00 0.00 33.50 31.59 1f9b n PRO 88 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1f9b s GLN 89 N -2.65 0.97 -0.35 -0.52 -0.21 -1.12 -4.93 119.66 110.85 1f9b s GLN 89 Ca 0.71 -1.06 0.07 0.00 0.02 0.00 0.00 55.36 55.11 1f9b s GLN 89 Cb -0.45 0.35 0.59 0.00 1.00 0.00 0.00 33.01 34.51 1f9b s GLN 89 CO 0.50 -0.33 1.68 0.25 -2.12 0.00 0.00 175.29 175.27 1f9b n THR 90 N -0.12 2.84 -4.25 -0.19 -2.24 -1.26 -0.47 114.28 108.59 1f9b n THR 90 Ca -0.12 -2.29 -0.14 0.00 -2.27 0.00 0.00 64.05 59.23 1f9b n THR 90 Cb 0.63 -0.38 -0.10 0.00 -2.10 0.00 0.00 70.33 68.37 1f9b n THR 90 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1f9b s ARG 91 N -3.23 1.27 -0.08 -0.78 1.81 -1.26 -0.66 118.95 116.02 1f9b s ARG 91 Ca 0.50 -1.67 -0.30 0.00 -1.72 0.00 0.00 55.73 52.54 1f9b s ARG 91 Cb 0.44 0.03 0.11 0.00 -0.45 0.00 0.00 34.95 35.08 1f9b s ARG 91 CO 0.06 -0.33 0.96 1.52 -0.68 0.00 0.00 175.30 176.82 1f9b s TYR 92 N -3.97 -0.33 -0.06 -0.53 1.13 -0.62 -4.73 117.35 108.25 1f9b s TYR 92 Ca 0.37 0.33 -0.20 0.00 -1.41 0.00 0.00 57.07 56.16 1f9b s TYR 92 Cb 0.07 0.51 -0.05 0.00 -1.10 0.00 0.00 41.96 41.39 1f9b s TYR 92 CO 0.12 -0.44 0.58 0.71 -2.51 0.00 0.00 175.55 174.00 1f9b s TYR 93 N -2.39 3.60 -0.00 -3.49 2.02 -1.26 -0.37 117.35 115.46 1f9b s TYR 93 Ca 0.03 1.11 -0.17 0.00 -0.37 0.00 0.00 57.07 57.67 1f9b s TYR 93 Cb -0.01 -2.63 -0.06 0.00 -0.40 0.00 0.00 41.96 38.87 1f9b s TYR 93 CO -0.05 0.24 0.47 0.00 -1.57 0.00 0.00 175.55 174.63 1f9b s ALA 94 N 0.28 3.63 0.24 3.71 0.00 0.70 -2.40 121.76 127.92 1f9b s ALA 94 Ca 0.31 -0.14 0.03 0.00 0.00 0.00 0.00 51.96 52.16 1f9b s ALA 94 Cb -0.17 -2.50 -0.05 0.00 0.00 0.00 0.00 23.12 20.39 1f9b s ALA 94 CO 0.15 0.37 0.02 0.14 0.00 0.00 0.00 175.76 176.44 1f9b s VAL 95 N -0.77 0.94 -0.19 0.00 -7.23 0.76 -1.70 120.40 112.22 1f9b s VAL 95 Ca 0.26 -2.02 0.01 0.00 -1.81 0.00 0.00 61.98 58.42 1f9b s VAL 95 Cb -0.17 -2.42 0.03 0.00 0.56 0.00 0.00 36.38 34.38 1f9b s VAL 95 CO 0.14 -0.25 -0.17 0.00 -0.31 0.00 0.00 175.10 174.51 1f9b s ALA 96 N -3.48 2.26 -0.12 1.32 0.00 -1.26 -2.06 121.76 118.42 1f9b s ALA 96 Ca 0.30 -1.25 -0.04 0.00 0.00 0.00 0.00 51.96 50.97 1f9b s ALA 96 Cb 0.06 -1.23 -0.04 0.00 0.00 0.00 0.00 23.12 21.92 1f9b s ALA 96 CO 0.10 -0.52 0.05 0.08 0.00 0.00 0.00 175.76 175.47 1f9b s VAL 97 N 1.30 4.71 0.11 0.00 1.01 0.13 -2.42 120.40 125.24 1f9b s VAL 97 Ca 0.02 -0.09 -0.04 0.00 0.00 0.00 0.00 61.98 61.88 1f9b s VAL 97 Cb -0.14 -3.03 -0.03 0.00 0.00 0.00 0.00 36.38 33.18 1f9b s VAL 97 CO -0.11 0.58 0.10 0.68 0.00 0.00 0.00 175.10 176.35 1f9b s VAL 98 N -0.64 0.14 0.36 2.92 -7.23 -0.18 0.03 120.40 115.79 1f9b s VAL 98 Ca 0.11 -1.64 -0.21 0.00 -1.81 0.00 0.00 61.98 58.43 1f9b s VAL 98 Cb -0.12 -1.71 -0.10 0.00 0.56 0.00 0.00 36.38 35.01 1f9b s VAL 98 CO 0.02 -0.62 0.88 -0.54 -0.31 0.00 0.00 175.10 174.53 1f9b s LYS 99 N -3.96 4.29 0.57 4.82 1.02 -1.26 -0.58 119.74 124.64 1f9b s LYS 99 Ca 0.14 1.07 -0.19 0.00 0.02 0.00 0.00 55.97 57.01 1f9b s LYS 99 Cb 0.06 -2.47 -0.05 0.00 -0.52 0.00 0.00 37.83 34.86 1f9b s LYS 99 CO -0.05 0.13 1.16 0.15 -0.92 0.00 0.00 175.35 175.83 1f9b s LYS 100 N -2.71 3.17 -0.68 1.68 1.02 -0.41 -3.55 119.74 118.27 1f9b s LYS 100 Ca 0.55 1.69 -0.01 0.00 0.02 0.00 0.00 55.97 58.22 1f9b s LYS 100 Cb -0.13 -1.97 0.00 0.00 -0.52 0.00 0.00 37.83 35.21 1f9b s LYS 100 CO 0.18 -1.02 0.09 0.41 -0.92 0.00 0.00 175.35 174.09 1f9b n GLY 101 N 0.27 0.09 0.00 -3.33 0.00 -1.26 -4.88 105.19 96.08 1f9b n GLY 101 Ca 0.12 -0.49 0.08 0.00 0.00 0.00 0.00 46.02 45.73 1f9b n GLY 101 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1f9b n SER 102 N 0.28 0.83 0.00 1.61 3.41 -1.23 -5.01 113.62 113.51 1f9b n SER 102 Ca -0.08 -0.77 0.00 0.00 -0.26 0.00 0.00 58.87 57.76 1f9b n SER 102 Cb 0.57 1.13 0.00 0.00 -0.26 0.00 0.00 64.21 65.64 1f9b n SER 102 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1f9b n GLY 103 N 1.42 0.61 3.56 5.00 0.00 -1.26 -4.97 105.19 109.55 1f9b n GLY 103 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 1f9b n GLY 103 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1f9b s PHE 104 N 0.00 1.56 0.48 1.61 -0.71 -1.26 -5.08 117.98 114.58 1f9b s PHE 104 Ca 0.00 1.24 0.01 0.00 -1.04 0.00 0.00 56.93 57.15 1f9b s PHE 104 Cb 0.00 -3.16 -0.00 0.00 -1.21 0.00 0.00 43.02 38.65 1f9b s PHE 104 CO 0.00 -3.50 0.05 1.04 -1.34 0.00 0.00 175.22 171.47 1f9b n GLN 105 N -4.66 0.70 -0.06 1.99 1.13 -1.26 -5.01 117.38 110.21 1f9b n GLN 105 Ca 0.05 -3.66 0.10 0.00 -1.94 0.00 0.00 57.00 51.55 1f9b n GLN 105 Cb 0.54 1.29 0.48 0.00 0.11 0.00 0.00 30.24 32.66 1f9b n GLN 105 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 1f9b h LEU 106 N 0.00 0.39 -3.09 1.08 5.85 -1.88 -0.10 115.31 117.55 1f9b h LEU 106 Ca -0.39 0.00 -0.28 0.00 0.84 0.00 0.00 57.88 58.05 1f9b h LEU 106 Cb 1.27 -0.08 -0.17 0.00 0.37 0.00 0.00 40.66 42.05 1f9b h LEU 106 CO 0.64 0.25 0.36 -0.46 -0.34 0.00 0.00 178.44 178.89 1f9b n ASN 107 N -4.47 3.42 -0.15 1.25 6.94 -1.26 -3.69 115.26 117.30 1f9b n ASN 107 Ca 0.08 -2.88 0.00 0.00 -0.02 0.00 0.00 54.58 51.76 1f9b n ASN 107 Cb 0.29 -0.69 0.00 0.00 -2.36 0.00 0.00 39.78 37.02 1f9b n ASN 107 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1f9b n GLN 108 N -0.40 0.00 0.25 -3.83 6.02 -0.05 -4.89 117.38 114.49 1f9b n GLN 108 Ca 0.33 -0.61 0.16 0.00 -0.01 0.00 0.00 57.00 56.87 1f9b n GLN 108 Cb 1.14 -0.47 0.88 0.00 1.02 0.00 0.00 30.24 32.81 1f9b n GLN 108 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1f9b h LEU 109 N 0.00 0.00 -8.59 1.08 3.38 -1.64 -3.44 115.31 106.10 1f9b h LEU 109 Ca 0.00 0.00 -0.73 0.00 0.09 0.00 0.00 57.88 57.24 1f9b h LEU 109 Cb 1.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 1f9b h LEU 109 CO 0.00 0.00 1.20 1.67 0.09 0.00 0.00 178.44 181.40 1f9b n GLN 110 N -2.64 0.74 -0.55 1.13 -0.06 -1.26 -0.59 117.38 114.14 1f9b n GLN 110 Ca -0.02 0.23 0.00 0.00 -2.00 0.00 0.00 57.00 55.21 1f9b n GLN 110 Cb 0.08 -2.04 0.00 0.00 -4.06 0.00 0.00 30.24 24.22 1f9b n GLN 110 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1f9b n GLY 111 N 5.99 0.72 3.92 1.69 0.00 0.01 -5.02 105.19 112.51 1f9b n GLY 111 Ca 0.40 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.16 1f9b n GLY 111 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f9b s VAL 112 N -2.01 5.00 0.02 1.61 1.01 0.24 -4.38 120.40 121.89 1f9b s VAL 112 Ca 0.00 -0.05 -0.19 0.00 0.00 0.00 0.00 61.98 61.73 1f9b s VAL 112 Cb 0.00 -3.83 -0.06 0.00 0.00 0.00 0.00 36.38 32.49 1f9b s VAL 112 CO 0.00 -0.61 0.56 -0.54 0.00 0.00 0.00 175.10 174.51 1f9b s LYS 113 N -4.27 4.23 0.02 2.72 1.02 -1.26 -1.77 119.74 120.43 1f9b s LYS 113 Ca 0.44 0.68 0.03 0.00 0.02 0.00 0.00 55.97 57.14 1f9b s LYS 113 Cb -0.10 -3.29 -0.01 0.00 -0.52 0.00 0.00 37.83 33.90 1f9b s LYS 113 CO 0.37 0.50 -0.09 -1.54 -0.92 0.00 0.00 175.35 173.67 1f9b s SER 114 N -0.59 1.02 -0.11 2.83 1.04 -0.99 -1.11 113.70 115.79 1f9b s SER 114 Ca 0.29 -0.34 -0.01 0.00 0.48 0.00 0.00 55.95 56.37 1f9b s SER 114 Cb -0.18 -0.05 -0.03 0.00 0.10 0.00 0.00 66.02 65.85 1f9b s SER 114 CO 0.17 -0.02 -0.05 0.00 0.98 0.00 0.00 173.24 174.32 1f9b s HIS 116 N -0.28 1.55 0.31 0.00 3.76 0.51 -1.99 115.29 119.15 1f9b s HIS 116 Ca 0.04 -0.38 0.02 0.00 -0.15 0.00 0.00 55.06 54.60 1f9b s HIS 116 Cb -0.13 -0.91 0.57 0.00 1.11 0.00 0.00 32.58 33.23 1f9b s HIS 116 CO 0.02 0.08 1.90 1.79 -0.85 0.00 0.00 174.74 177.69 1f9b h THR 117 N 4.37 1.02 0.00 1.30 1.35 -1.72 -3.39 112.91 115.85 1f9b h THR 117 Ca -0.41 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.11 1f9b h THR 117 Cb 1.17 -0.04 0.00 0.00 -1.73 0.00 0.00 68.15 67.55 1f9b h THR 117 CO 0.43 0.18 0.00 0.61 -0.25 0.00 0.00 175.52 176.49 1f9b n GLY 118 N -1.40 2.24 3.69 5.82 0.00 -1.26 -0.94 105.19 113.35 1f9b n GLY 118 Ca 0.15 -0.84 -0.42 0.00 0.00 0.00 0.00 46.02 44.90 1f9b n GLY 118 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1f9b s LEU 119 N 0.00 4.35 0.00 0.99 2.96 0.11 -3.14 118.68 123.95 1f9b s LEU 119 Ca 0.00 2.33 0.00 0.00 -0.22 0.00 0.00 54.13 56.24 1f9b s LEU 119 Cb 0.00 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.12 1f9b s LEU 119 CO 0.00 -0.78 0.00 0.61 -1.32 0.00 0.00 176.35 174.86 1f9b n GLY 120 N 3.77 1.03 3.85 7.98 0.00 -1.26 -4.98 105.19 115.58 1f9b n GLY 120 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 1f9b n GLY 120 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1f9b s ARG 121 N -0.52 3.98 0.01 1.61 0.52 -1.19 -4.31 118.95 119.05 1f9b s ARG 121 Ca 0.00 0.74 -0.01 0.00 -0.52 0.00 0.00 55.73 55.94 1f9b s ARG 121 Cb 0.00 -2.33 -0.00 0.00 0.52 0.00 0.00 34.95 33.13 1f9b s ARG 121 CO 0.00 0.02 1.02 0.77 0.02 0.00 0.00 175.30 177.13 1f9b h SER 122 N 1.77 -0.07 0.69 0.23 0.02 -1.92 -0.20 113.55 114.06 1f9b h SER 122 Ca -0.48 0.01 -0.21 0.00 -0.84 0.00 0.00 61.79 60.28 1f9b h SER 122 Cb 1.18 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.74 1f9b h SER 122 CO 0.64 -0.01 -0.94 0.00 -1.14 0.00 0.00 176.83 175.38 1f9b h ALA 123 N -1.19 0.46 0.00 3.77 0.00 -1.93 0.61 119.26 120.98 1f9b h ALA 123 Ca 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.14 1f9b h ALA 123 Cb 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1f9b h ALA 123 CO -0.02 0.99 -0.23 0.41 0.00 0.00 0.00 179.25 180.40 1f9b n GLY 124 N 1.03 -1.52 1.06 0.00 0.00 -1.20 -4.27 105.19 100.28 1f9b n GLY 124 Ca -0.03 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1f9b n GLY 124 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1f9b n TRP 125 N -1.94 -0.41 -0.33 1.61 -0.00 -0.22 -4.14 117.44 112.01 1f9b n TRP 125 Ca 0.05 0.00 0.08 0.00 -0.00 0.00 0.00 57.50 57.63 1f9b n TRP 125 Cb 0.40 0.27 0.19 0.00 -0.00 0.00 0.00 31.31 32.16 1f9b n TRP 125 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 177.69 176.78 1f9b h ASN 126 N 0.00 -0.67 -0.01 5.87 4.21 -1.18 -1.56 115.58 122.25 1f9b h ASN 126 Ca 0.00 0.27 -0.03 0.00 1.21 0.00 0.00 56.30 57.74 1f9b h ASN 126 Cb 0.00 0.52 0.00 0.00 -1.12 0.00 0.00 38.32 37.72 1f9b h ASN 126 CO 0.00 -0.31 -0.12 0.40 -1.29 0.00 0.00 177.43 176.11 1f9b h ILE 127 N 0.02 1.54 0.09 2.81 1.08 0.05 -3.01 117.51 120.09 1f9b h ILE 127 Ca 0.49 -1.77 -0.00 0.00 -0.39 0.00 0.00 64.86 63.19 1f9b h ILE 127 Cb 0.87 2.67 0.00 0.00 -3.07 0.00 0.00 36.82 37.29 1f9b h ILE 127 CO -0.91 0.47 -0.04 1.55 -0.69 0.00 0.00 178.15 178.53 1f9b h PRO 128 N -0.56 -0.12 -0.29 2.37 0.13 -1.63 -2.93 132.00 128.98 1f9b h PRO 128 Ca -0.01 0.01 0.07 0.00 -0.87 0.00 0.00 66.00 65.19 1f9b h PRO 128 Cb 0.84 0.03 -0.07 0.00 0.13 0.00 0.00 31.00 31.92 1f9b h PRO 128 CO 0.03 0.05 -0.22 0.82 -0.23 0.00 0.00 178.00 178.44 1f9b h ILE 129 N -0.26 0.41 -0.06 -3.56 1.08 -1.46 0.26 117.51 113.91 1f9b h ILE 129 Ca -0.01 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.47 1f9b h ILE 129 Cb 0.22 0.41 -0.00 0.00 -3.07 0.00 0.00 36.82 34.38 1f9b h ILE 129 CO 0.02 0.00 0.09 1.23 -0.69 0.00 0.00 178.15 178.80 1f9b h GLY 130 N -0.20 0.00 1.90 5.37 0.00 -1.53 0.17 103.07 108.77 1f9b h GLY 130 Ca 0.15 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.29 1f9b h GLY 130 CO -0.41 0.00 -0.87 -0.84 0.00 0.00 0.00 176.54 174.42 1f9b h THR 131 N 0.00 1.56 -0.72 4.70 2.02 -0.33 -3.25 112.91 116.89 1f9b h THR 131 Ca 0.03 -2.79 0.00 0.00 0.77 0.00 0.00 66.41 64.42 1f9b h THR 131 Cb 0.21 2.53 0.00 0.00 -1.74 0.00 0.00 68.15 69.16 1f9b h THR 131 CO -0.00 0.80 0.00 0.18 0.37 0.00 0.00 175.52 176.87 1f9b n LEU 132 N -3.59 3.83 -0.19 2.58 4.77 0.39 -4.51 117.00 120.28 1f9b n LEU 132 Ca -0.02 -1.91 -0.01 0.00 -0.03 0.00 0.00 56.01 54.03 1f9b n LEU 132 Cb 0.81 -0.48 0.09 0.00 -2.33 0.00 0.00 43.42 41.51 1f9b n LEU 132 CO 0.46 0.96 0.98 -0.09 -1.33 0.00 0.00 177.39 178.37 1f9b h ARG 133 N 4.18 0.39 0.00 3.23 2.43 -1.03 -1.14 114.38 122.44 1f9b h ARG 133 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1f9b h ARG 133 Cb 0.96 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.42 1f9b h ARG 133 CO 0.00 0.25 0.09 -1.35 -1.51 0.00 0.00 179.97 177.45 1f9b h PRO 134 N 0.40 0.00 -0.06 0.20 0.11 -1.85 -0.56 132.00 130.24 1f9b h PRO 134 Ca 0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.39 1f9b h PRO 134 Cb 0.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.42 1f9b h PRO 134 CO -0.27 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.18 1f9b n TYR 135 N -3.00 0.05 0.16 0.65 4.02 -0.48 -4.44 117.16 114.12 1f9b n TYR 135 Ca -0.03 -0.04 0.06 0.00 -0.01 0.00 0.00 57.90 57.88 1f9b n TYR 135 Cb 0.15 -0.00 0.07 0.00 -0.02 0.00 0.00 39.34 39.54 1f9b n TYR 135 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1f9b h LEU 136 N 2.95 0.00 -2.99 7.72 3.38 -0.52 -3.48 115.31 122.38 1f9b h LEU 136 Ca 0.00 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.70 1f9b h LEU 136 Cb 0.64 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.44 1f9b h LEU 136 CO 0.00 0.30 -0.63 0.59 0.09 0.00 0.00 178.44 178.79 1f9b n ASN 137 N -3.13 -6.23 -4.29 -0.43 5.03 -1.25 -4.95 115.26 100.01 1f9b n ASN 137 Ca 0.02 -0.63 -0.33 0.00 0.87 0.00 0.00 54.58 54.51 1f9b n ASN 137 Cb 0.66 -3.80 -0.15 0.00 -1.02 0.00 0.00 39.78 35.47 1f9b n ASN 137 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 1f9b s TRP 138 N -3.17 2.73 0.17 3.10 -0.00 -1.26 -5.02 118.94 115.49 1f9b s TRP 138 Ca 0.18 -0.90 -0.23 0.00 -0.00 0.00 0.00 56.10 55.14 1f9b s TRP 138 Cb -0.06 -1.82 0.06 0.00 -0.00 0.00 0.00 33.47 31.66 1f9b s TRP 138 CO 0.82 -0.36 1.58 1.15 -0.00 0.00 0.00 176.95 180.14 1f9b h THR 139 N 5.58 0.16 0.00 5.86 2.02 -1.92 -3.48 112.91 121.13 1f9b h THR 139 Ca -0.26 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.92 1f9b h THR 139 Cb 1.21 0.16 0.00 0.00 -1.74 0.00 0.00 68.15 67.79 1f9b h THR 139 CO 0.54 0.00 0.00 0.61 0.37 0.00 0.00 175.52 177.04 1f9b n GLY 140 N -1.42 0.89 0.34 2.16 0.00 -1.26 -4.66 105.19 101.23 1f9b n GLY 140 Ca 0.02 -1.85 0.09 0.00 0.00 0.00 0.00 46.02 44.27 1f9b n GLY 140 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1f9b h PRO 141 N 3.01 0.01 -1.09 1.61 0.13 -1.88 -2.25 132.00 131.54 1f9b h PRO 141 Ca 0.00 -0.00 0.30 0.00 -0.87 0.00 0.00 66.00 65.43 1f9b h PRO 141 Cb 0.00 -0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.02 1f9b h PRO 141 CO 0.00 0.01 0.70 -1.35 -0.23 0.00 0.00 178.00 177.13 1f9b h PRO 142 N 0.01 0.32 -5.37 1.56 0.11 -1.97 -3.37 132.00 123.30 1f9b h PRO 142 Ca 0.50 -0.02 -0.62 0.00 0.11 0.00 0.00 66.00 65.98 1f9b h PRO 142 Cb 0.90 -0.07 -0.13 0.00 0.11 0.00 0.00 31.00 31.80 1f9b h PRO 142 CO -0.93 0.21 0.01 -2.00 -0.21 0.00 0.00 178.00 175.08 1f9b s GLU 143 N -5.46 4.04 -0.01 1.05 2.12 -0.85 -5.03 118.70 114.56 1f9b s GLU 143 Ca -0.09 0.31 -0.36 0.00 0.36 0.00 0.00 54.97 55.20 1f9b s GLU 143 Cb 0.26 -3.67 -0.15 0.00 0.26 0.00 0.00 34.13 30.84 1f9b s GLU 143 CO 0.80 -0.39 1.60 -2.30 -0.54 0.00 0.00 175.26 174.44 1f9b n PRO 144 N 5.59 1.63 -0.26 4.30 -0.02 -1.26 -4.70 135.00 140.27 1f9b n PRO 144 Ca -0.04 0.59 0.21 0.00 -2.02 0.00 0.00 63.50 62.24 1f9b n PRO 144 Cb 0.50 -2.32 0.52 0.00 -0.02 0.00 0.00 33.50 32.18 1f9b n PRO 144 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1f9b h LEU 145 N 6.46 0.39 -1.92 2.45 5.85 -1.89 0.31 115.31 126.96 1f9b h LEU 145 Ca -0.47 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.28 1f9b h LEU 145 Cb 1.30 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.30 1f9b h LEU 145 CO 0.88 0.14 -0.09 1.56 -0.34 0.00 0.00 178.44 180.59 1f9b h GLN 146 N 0.38 0.00 -0.06 1.25 4.20 -2.00 -1.84 115.11 117.05 1f9b h GLN 146 Ca 0.50 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 59.09 1f9b h GLN 146 Cb 1.29 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.06 1f9b h GLN 146 CO -0.19 0.09 -0.49 0.87 -0.67 0.00 0.00 178.83 178.44 1f9b h LYS 147 N 0.00 0.15 0.07 1.46 1.57 -0.73 0.87 116.57 119.96 1f9b h LYS 147 Ca -0.00 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1f9b h LYS 147 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1f9b h LYS 147 CO 0.01 0.61 -0.03 0.00 -0.57 0.00 0.00 179.45 179.47 1f9b h ALA 148 N 1.38 -0.09 -0.71 3.86 0.00 -1.37 -3.08 119.26 119.25 1f9b h ALA 148 Ca 0.00 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 1f9b h ALA 148 Cb 0.91 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 1f9b h ALA 148 CO 0.07 -0.35 0.18 0.28 0.00 0.00 0.00 179.25 179.44 1f9b h VAL 149 N -0.50 1.26 -0.00 0.00 2.07 -1.42 -1.78 116.25 115.89 1f9b h VAL 149 Ca -0.01 -0.96 0.00 0.00 0.82 0.00 0.00 66.70 66.55 1f9b h VAL 149 Cb 0.43 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1f9b h VAL 149 CO 0.02 0.37 0.01 0.00 0.02 0.00 0.00 177.57 177.98 1f9b h ALA 150 N 1.09 1.08 0.01 1.67 0.00 -0.86 -1.03 119.26 121.21 1f9b h ALA 150 Ca 0.23 -0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.77 1f9b h ALA 150 Cb 0.36 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 1f9b h ALA 150 CO 0.00 -0.01 -2.26 0.09 0.00 0.00 0.00 179.25 177.08 1f9b n ASN 151 N -3.18 0.90 -0.04 0.00 3.02 -0.98 -4.52 115.26 110.47 1f9b n ASN 151 Ca -0.03 0.05 -0.16 0.00 -0.03 0.00 0.00 54.58 54.42 1f9b n ASN 151 Cb 0.08 0.25 -0.07 0.00 -0.61 0.00 0.00 39.78 39.42 1f9b n ASN 151 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1f9b h PHE 152 N 0.01 0.89 -3.15 3.10 3.57 -0.85 -3.43 116.94 117.07 1f9b h PHE 152 Ca -0.50 -0.37 -0.60 0.00 3.53 0.00 0.00 57.97 60.03 1f9b h PHE 152 Cb 2.09 -0.15 -0.08 0.00 2.79 0.00 0.00 35.95 40.60 1f9b h PHE 152 CO 0.02 1.16 -0.29 -0.06 -2.23 0.00 0.00 178.31 176.90 1f9b s PHE 153 N -3.84 3.55 0.40 0.41 0.08 -0.44 -0.81 117.98 117.34 1f9b s PHE 153 Ca -0.12 0.72 0.30 0.00 0.12 0.00 0.00 56.93 57.95 1f9b s PHE 153 Cb 0.07 -2.30 1.53 0.00 -0.57 0.00 0.00 43.02 41.75 1f9b s PHE 153 CO 0.86 0.39 2.09 0.66 -0.10 0.00 0.00 175.22 179.12 1f9b h SER 154 N 5.97 0.00 0.00 1.36 4.64 -1.55 -3.44 113.55 120.53 1f9b h SER 154 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1f9b h SER 154 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1f9b h SER 154 CO 0.70 0.10 0.00 0.00 -0.87 0.00 0.00 176.83 176.76 1f9b n ALA 155 N -2.24 0.00 -2.85 5.18 0.00 -1.26 -4.96 120.51 114.38 1f9b n ALA 155 Ca -0.02 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.31 1f9b n ALA 155 Cb 0.23 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.62 1f9b n ALA 155 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1f9b s SER 156 N 0.00 0.30 -0.34 0.00 0.01 0.67 -2.34 113.70 112.00 1f9b s SER 156 Ca 0.00 -1.22 0.02 0.00 1.31 0.00 0.00 55.95 56.05 1f9b s SER 156 Cb 0.00 0.56 0.10 0.00 0.21 0.00 0.00 66.02 66.89 1f9b s SER 156 CO 0.00 -1.12 0.09 0.00 0.41 0.00 0.00 173.24 172.62 1f9b s VAL 158 N 1.18 2.32 0.76 0.00 1.01 -0.40 -0.36 120.40 124.90 1f9b s VAL 158 Ca 0.11 -2.72 -0.14 0.00 0.00 0.00 0.00 61.98 59.23 1f9b s VAL 158 Cb -0.19 -2.67 0.05 0.00 0.00 0.00 0.00 36.38 33.58 1f9b s VAL 158 CO -0.16 -0.69 1.21 -2.84 0.00 0.00 0.00 175.10 172.62 1f9b s PRO 159 N 0.42 1.96 0.00 2.72 0.02 -1.26 -2.49 135.00 136.37 1f9b s PRO 159 Ca 0.14 1.76 0.00 0.00 0.02 0.00 0.00 61.00 62.92 1f9b s PRO 159 Cb -0.22 -1.81 0.00 0.00 0.02 0.00 0.00 34.50 32.49 1f9b s PRO 159 CO -0.05 -1.98 0.00 0.00 -0.33 0.00 0.00 177.00 174.64 1f9b s ALA 161 N -3.17 2.35 -1.33 0.00 0.00 -1.04 -4.91 121.76 113.67 1f9b s ALA 161 Ca 0.00 0.59 -0.16 0.00 0.00 0.00 0.00 51.96 52.39 1f9b s ALA 161 Cb 0.00 -3.35 0.08 0.00 0.00 0.00 0.00 23.12 19.85 1f9b s ALA 161 CO 0.00 -1.48 1.85 -3.47 0.00 0.00 0.00 175.76 172.66 1f9b n ASP 162 N -2.63 4.68 0.00 0.00 -0.08 -1.26 -4.82 116.55 112.44 1f9b n ASP 162 Ca 0.11 -2.92 0.02 0.00 -1.51 0.00 0.00 54.79 50.49 1f9b n ASP 162 Cb 0.52 -1.68 0.09 0.00 2.34 0.00 0.00 41.12 42.38 1f9b n ASP 162 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1f9b n GLY 163 N 4.70 -0.27 0.09 0.27 0.00 -1.26 0.14 105.19 108.85 1f9b n GLY 163 Ca 0.48 -0.02 -0.08 0.00 0.00 0.00 0.00 46.02 46.40 1f9b n GLY 163 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1f9b n LYS 164 N -1.17 0.65 -0.10 1.61 5.02 -1.26 -3.25 118.16 119.66 1f9b n LYS 164 Ca 0.02 0.19 -0.12 0.00 -2.02 0.00 0.00 58.31 56.38 1f9b n LYS 164 Cb 0.02 -1.71 -0.14 0.00 -0.02 0.00 0.00 35.03 33.18 1f9b n LYS 164 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1f9b n GLN 165 N -2.93 0.81 -2.89 1.97 6.02 -0.85 -4.66 117.38 114.85 1f9b n GLN 165 Ca -0.20 0.04 -0.26 0.00 -0.01 0.00 0.00 57.00 56.56 1f9b n GLN 165 Cb 1.05 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 30.79 1f9b n GLN 165 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1f9b n TYR 166 N -2.86 3.53 -0.39 1.08 4.01 0.12 -4.93 117.16 117.73 1f9b n TYR 166 Ca -0.35 -3.83 0.35 0.00 -0.16 0.00 0.00 57.90 53.91 1f9b n TYR 166 Cb 1.07 -0.42 0.68 0.00 -0.31 0.00 0.00 39.34 40.36 1f9b n TYR 166 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1f9b h PRO 167 N 2.92 0.11 0.00 -0.72 0.13 -1.73 0.30 132.00 133.01 1f9b h PRO 167 Ca 0.15 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.24 1f9b h PRO 167 Cb 0.62 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.72 1f9b h PRO 167 CO 0.79 0.07 -0.14 -0.97 -0.23 0.00 0.00 178.00 177.52 1f9b h ASN 168 N 0.12 0.00 1.06 1.44 -1.24 -1.88 -0.34 115.58 114.73 1f9b h ASN 168 Ca 0.66 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.67 1f9b h ASN 168 Cb 2.32 0.00 0.00 0.00 0.73 0.00 0.00 38.32 41.37 1f9b h ASN 168 CO -0.15 0.14 0.00 0.18 -1.29 0.00 0.00 177.43 176.31 1f9b n LEU 169 N -4.12 0.18 0.00 0.34 4.77 0.10 -0.24 117.00 118.05 1f9b n LEU 169 Ca -0.02 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.48 1f9b n LEU 169 Cb 0.22 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 1f9b n LEU 169 CO 0.34 -0.07 -0.15 0.00 -1.33 0.00 0.00 177.39 176.18 1f9b h ARG 171 N 0.00 0.29 0.00 0.00 2.43 -1.00 -0.25 114.38 115.85 1f9b h ARG 171 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1f9b h ARG 171 Cb 0.00 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 1f9b h ARG 171 CO 0.00 0.19 0.00 1.28 -1.51 0.00 0.00 179.97 179.93 1f9b n LEU 172 N -5.13 0.62 -4.75 3.80 4.77 -1.05 -4.84 117.00 110.43 1f9b n LEU 172 Ca 0.23 0.58 -0.41 0.00 -0.03 0.00 0.00 56.01 56.38 1f9b n LEU 172 Cb 0.72 -0.42 -0.02 0.00 -2.33 0.00 0.00 43.42 41.38 1f9b n LEU 172 CO 0.09 -0.25 1.23 0.00 -1.33 0.00 0.00 177.39 177.13 1f9b s ALA 174 N -0.03 3.51 -0.04 0.00 0.00 -1.26 -4.83 121.76 119.11 1f9b s ALA 174 Ca 0.63 -1.10 -0.29 0.00 0.00 0.00 0.00 51.96 51.19 1f9b s ALA 174 Cb -0.47 -2.46 0.11 0.00 0.00 0.00 0.00 23.12 20.29 1f9b s ALA 174 CO 0.48 -0.56 0.89 0.20 0.00 0.00 0.00 175.76 176.77 1f9b s GLY 175 N 1.75 -0.43 0.00 0.00 0.00 -1.26 -3.43 107.32 103.94 1f9b s GLY 175 Ca 0.07 1.25 0.00 0.00 0.00 0.00 0.00 44.72 46.04 1f9b s GLY 175 CO 0.11 0.52 0.00 -1.30 0.00 0.00 0.00 173.10 172.43 1f9b n THR 176 N 0.04 0.00 0.00 0.90 -2.24 -1.26 -4.40 114.28 107.32 1f9b n THR 176 Ca -0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1f9b n THR 176 Cb 0.61 -0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.35 1f9b n THR 176 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1f9b n GLU 177 N 0.00 0.00 -0.03 -0.78 -0.58 -1.26 -2.38 120.64 115.61 1f9b n GLU 177 Ca 0.00 0.38 0.13 0.00 -0.42 0.00 0.00 57.16 57.25 1f9b n GLU 177 Cb 0.00 -1.16 0.36 0.00 -0.57 0.00 0.00 31.44 30.07 1f9b n GLU 177 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1f9b n ALA 178 N -1.27 2.52 0.16 0.62 0.00 -1.26 -3.69 120.51 117.58 1f9b n ALA 178 Ca 0.00 -0.57 0.03 0.00 0.00 0.00 0.00 53.44 52.90 1f9b n ALA 178 Cb 0.00 -1.03 0.17 0.00 0.00 0.00 0.00 19.45 18.59 1f9b n ALA 178 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1f9b h ASP 179 N 3.16 0.00 -1.86 0.00 3.32 -1.89 -3.43 116.42 115.72 1f9b h ASP 179 Ca 0.00 0.00 -0.66 0.00 0.02 0.00 0.00 57.03 56.39 1f9b h ASP 179 Cb 0.68 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.25 1f9b h ASP 179 CO 0.00 0.49 0.97 1.17 -1.72 0.00 0.00 179.24 180.15 1f9b n LYS 180 N -3.41 1.75 -1.33 3.56 4.81 -1.00 -0.57 118.16 121.97 1f9b n LYS 180 Ca 0.01 0.64 -0.11 0.00 -0.87 0.00 0.00 58.31 57.98 1f9b n LYS 180 Cb 0.64 -2.41 -0.05 0.00 0.02 0.00 0.00 35.03 33.23 1f9b n LYS 180 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1f9b n ALA 182 N 1.21 1.23 -1.18 0.00 0.00 0.26 -2.00 120.51 120.02 1f9b n ALA 182 Ca -0.11 0.05 -0.28 0.00 0.00 0.00 0.00 53.44 53.10 1f9b n ALA 182 Cb 0.38 -2.32 0.06 0.00 0.00 0.00 0.00 19.45 17.56 1f9b n ALA 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1f9b n SER 184 N -0.35 -1.22 -0.19 0.00 3.41 -1.26 -4.46 113.62 109.54 1f9b n SER 184 Ca 0.49 -2.54 0.00 0.00 -0.26 0.00 0.00 58.87 56.56 1f9b n SER 184 Cb 0.61 2.24 0.00 0.00 -0.26 0.00 0.00 64.21 66.80 1f9b n SER 184 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1f9b n SER 185 N -1.68 0.21 -0.06 4.04 3.41 -1.26 -2.72 113.62 115.55 1f9b n SER 185 Ca -0.00 -1.09 -0.13 0.00 -0.26 0.00 0.00 58.87 57.39 1f9b n SER 185 Cb 0.49 -0.10 -0.01 0.00 -0.26 0.00 0.00 64.21 64.32 1f9b n SER 185 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1f9b h GLN 186 N 0.17 0.81 -5.59 4.33 1.08 -1.92 -3.39 115.11 110.59 1f9b h GLN 186 Ca 0.00 -0.50 -0.62 0.00 -1.45 0.00 0.00 58.65 56.08 1f9b h GLN 186 Cb 0.10 0.05 -0.13 0.00 -0.05 0.00 0.00 27.48 27.46 1f9b h GLN 186 CO 0.00 1.13 0.23 -2.00 -0.95 0.00 0.00 178.83 177.24 1f9b s GLU 187 N -4.13 3.72 0.58 1.46 2.56 -1.10 -4.84 118.70 116.95 1f9b s GLU 187 Ca -0.10 0.17 0.27 0.00 0.00 0.00 0.00 54.97 55.31 1f9b s GLU 187 Cb 0.11 -3.80 1.49 0.00 2.00 0.00 0.00 34.13 33.92 1f9b s GLU 187 CO 0.88 -0.77 1.82 -1.35 -0.56 0.00 0.00 175.26 175.28 1f9b h PRO 188 N 8.44 0.00 -0.21 4.30 0.11 -1.76 -0.29 132.00 142.59 1f9b h PRO 188 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1f9b h PRO 188 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1f9b h PRO 188 CO 0.86 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.31 1f9b n TYR 189 N -2.71 0.28 -2.71 0.65 4.01 -1.26 -4.09 117.16 111.33 1f9b n TYR 189 Ca -0.02 -0.14 -0.42 0.00 -0.16 0.00 0.00 57.90 57.16 1f9b n TYR 189 Cb 0.33 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.33 1f9b n TYR 189 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 1f9b s PHE 190 N -1.72 3.58 0.00 -0.72 2.19 -0.12 -2.19 117.98 118.99 1f9b s PHE 190 Ca 0.28 1.63 0.00 0.00 0.33 0.00 0.00 56.93 59.17 1f9b s PHE 190 Cb 0.15 -3.15 0.00 0.00 -1.31 0.00 0.00 43.02 38.71 1f9b s PHE 190 CO 0.22 -0.12 0.00 0.41 1.83 0.00 0.00 175.22 177.56 1f9b n GLY 191 N 3.01 -0.05 0.26 13.12 0.00 -0.12 -3.77 105.19 117.65 1f9b n GLY 191 Ca 0.07 -1.90 0.05 0.00 0.00 0.00 0.00 46.02 44.24 1f9b n GLY 191 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1f9b h TYR 192 N 0.00 0.30 0.11 1.61 0.05 -1.90 -0.52 116.97 116.60 1f9b h TYR 192 Ca 0.00 0.04 -0.27 0.00 0.05 0.00 0.00 58.73 58.56 1f9b h TYR 192 Cb 0.00 -0.02 0.01 0.00 1.01 0.00 0.00 36.73 37.73 1f9b h TYR 192 CO 0.00 -0.05 -1.18 0.77 -1.05 0.00 0.00 178.16 176.64 1f9b h SER 193 N 0.29 0.47 -0.51 3.88 0.02 -1.93 -2.58 113.55 113.19 1f9b h SER 193 Ca 0.40 -0.47 -0.07 0.00 -0.84 0.00 0.00 61.79 60.81 1f9b h SER 193 Cb 0.65 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.02 1f9b h SER 193 CO -0.48 1.34 0.04 1.23 -1.14 0.00 0.00 176.83 177.83 1f9b h GLY 194 N 1.45 0.94 1.67 -3.77 0.00 -1.50 0.42 103.07 102.28 1f9b h GLY 194 Ca -0.13 -0.66 -0.03 0.00 0.00 0.00 0.00 47.33 46.51 1f9b h GLY 194 CO 0.20 0.61 0.05 0.00 0.00 0.00 0.00 176.54 177.40 1f9b h ALA 195 N 0.96 1.55 -0.14 3.60 0.00 -0.62 -0.19 119.26 124.42 1f9b h ALA 195 Ca 0.15 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1f9b h ALA 195 Cb 0.46 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1f9b h ALA 195 CO 0.02 0.34 -0.21 0.35 0.00 0.00 0.00 179.25 179.74 1f9b h PHE 196 N 0.42 0.48 -0.63 0.00 3.57 -0.87 -3.01 116.94 116.91 1f9b h PHE 196 Ca 0.10 -0.16 -0.01 0.00 3.53 0.00 0.00 57.97 61.42 1f9b h PHE 196 Cb 0.20 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.81 1f9b h PHE 196 CO 0.01 0.83 0.35 0.87 -2.23 0.00 0.00 178.31 178.13 1f9b h LYS 197 N -0.01 0.87 -0.68 1.11 6.56 -0.65 -0.39 116.57 123.39 1f9b h LYS 197 Ca 0.01 -0.10 0.20 0.00 -1.06 0.00 0.00 60.65 59.70 1f9b h LYS 197 Cb 0.78 -0.17 -0.03 0.00 -0.57 0.00 0.00 32.23 32.25 1f9b h LYS 197 CO 0.05 0.66 0.49 0.00 -2.06 0.00 0.00 179.45 178.58 1f9b h LEU 199 N 0.01 -0.07 -2.56 0.00 5.85 -1.12 -1.08 115.31 116.34 1f9b h LEU 199 Ca 0.32 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.04 1f9b h LEU 199 Cb 1.28 0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.33 1f9b h LEU 199 CO -0.01 0.24 0.00 -0.08 -0.34 0.00 0.00 178.44 178.26 1f9b h GLU 200 N -0.66 0.00 -0.44 1.25 4.81 -0.50 0.12 114.58 119.16 1f9b h GLU 200 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1f9b h GLU 200 Cb 0.06 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1f9b h GLU 200 CO 0.01 0.00 0.00 0.09 -0.73 0.00 0.00 179.01 178.38 1f9b n ASN 201 N -2.86 2.67 -0.88 1.04 5.03 0.22 -4.95 115.26 115.53 1f9b n ASN 201 Ca -0.03 -1.95 -0.11 0.00 0.87 0.00 0.00 54.58 53.36 1f9b n ASN 201 Cb 0.06 -0.29 -0.05 0.00 -1.02 0.00 0.00 39.78 38.48 1f9b n ASN 201 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1f9b n GLY 202 N 1.31 1.25 0.08 7.41 0.00 0.41 -4.88 105.19 110.77 1f9b n GLY 202 Ca 0.17 -0.41 -0.11 0.00 0.00 0.00 0.00 46.02 45.68 1f9b n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f9b h ALA 203 N 0.00 0.47 -2.02 4.61 0.00 -1.61 -3.47 119.26 117.24 1f9b h ALA 203 Ca -0.23 -1.16 -0.51 0.00 0.00 0.00 0.00 54.91 53.01 1f9b h ALA 203 Cb 0.80 0.20 -0.14 0.00 0.00 0.00 0.00 17.79 18.64 1f9b h ALA 203 CO 0.34 1.33 -0.65 0.20 0.00 0.00 0.00 179.25 180.47 1f9b s GLY 204 N -4.93 1.97 -0.01 0.00 0.00 -0.46 -4.88 107.32 99.02 1f9b s GLY 204 Ca -0.04 -1.99 0.11 0.00 0.00 0.00 0.00 44.72 42.80 1f9b s GLY 204 CO 0.83 -1.87 0.38 1.22 0.00 0.00 0.00 173.10 173.66 1f9b n ASP 205 N -0.66 1.30 -3.81 1.64 8.00 -0.27 -4.54 116.55 118.22 1f9b n ASP 205 Ca -0.05 -0.44 -0.13 0.00 0.71 0.00 0.00 54.79 54.89 1f9b n ASP 205 Cb 0.64 1.23 -0.14 0.00 -0.02 0.00 0.00 41.12 42.84 1f9b n ASP 205 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1f9b s VAL 206 N -2.39 -0.02 -0.14 2.53 0.11 -1.19 -4.37 120.40 114.94 1f9b s VAL 206 Ca 0.01 0.06 0.01 0.00 -2.93 0.00 0.00 61.98 59.13 1f9b s VAL 206 Cb 0.08 -0.17 -0.00 0.00 -1.53 0.00 0.00 36.38 34.76 1f9b s VAL 206 CO 0.47 0.03 -0.18 0.00 -3.33 0.00 0.00 175.10 172.09 1f9b s ALA 207 N 0.42 2.42 -0.48 1.54 0.00 0.10 -1.35 121.76 124.41 1f9b s ALA 207 Ca -0.03 -1.00 -0.15 0.00 0.00 0.00 0.00 51.96 50.78 1f9b s ALA 207 Cb -0.04 -1.10 0.09 0.00 0.00 0.00 0.00 23.12 22.06 1f9b s ALA 207 CO -0.02 0.10 0.41 -0.06 0.00 0.00 0.00 175.76 176.19 1f9b s PHE 208 N 0.61 3.26 0.16 0.00 0.08 -0.84 0.22 117.98 121.46 1f9b s PHE 208 Ca -0.10 -1.06 0.01 0.00 0.12 0.00 0.00 56.93 55.91 1f9b s PHE 208 Cb -0.16 -3.29 -0.01 0.00 -0.57 0.00 0.00 43.02 38.99 1f9b s PHE 208 CO 0.03 -0.85 0.18 1.33 -0.10 0.00 0.00 175.22 175.81 1f9b n VAL 209 N 5.19 0.00 -1.84 -0.44 0.24 -0.88 -3.83 118.33 116.77 1f9b n VAL 209 Ca -0.13 -0.99 -0.31 0.00 -2.04 0.00 0.00 64.34 60.88 1f9b n VAL 209 Cb 0.43 0.54 0.02 0.00 -1.47 0.00 0.00 33.84 33.36 1f9b n VAL 209 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1f9b s LYS 210 N -2.50 3.32 0.47 7.34 2.20 -1.26 -0.17 119.74 129.14 1f9b s LYS 210 Ca 0.16 0.69 0.20 0.00 -0.36 0.00 0.00 55.97 56.66 1f9b s LYS 210 Cb 0.00 -2.05 1.18 0.00 -1.51 0.00 0.00 37.83 35.45 1f9b s LYS 210 CO 0.11 -0.75 2.01 0.38 -0.36 0.00 0.00 175.35 176.74 1f9b h ASP 211 N -0.45 0.00 0.71 1.43 3.04 -1.83 -3.07 116.42 116.24 1f9b h ASP 211 Ca -0.44 0.00 -0.26 0.00 -3.24 0.00 0.00 57.03 53.09 1f9b h ASP 211 Cb 1.21 0.00 -0.04 0.00 -1.04 0.00 0.00 39.33 39.46 1f9b h ASP 211 CO 0.62 0.17 -1.38 0.77 -2.04 0.00 0.00 179.24 177.39 1f9b h SER 212 N 0.00 0.05 -0.82 4.15 4.64 -1.94 -3.40 113.55 116.22 1f9b h SER 212 Ca -0.00 -0.07 0.13 0.00 -0.47 0.00 0.00 61.79 61.38 1f9b h SER 212 Cb 0.37 -0.01 -0.13 0.00 -0.31 0.00 0.00 62.40 62.31 1f9b h SER 212 CO 0.02 1.06 -0.31 0.41 -0.87 0.00 0.00 176.83 177.14 1f9b n THR 213 N -3.23 -0.42 -0.14 2.95 -1.04 -1.16 0.12 114.28 111.36 1f9b n THR 213 Ca -0.09 1.91 0.01 0.00 -2.04 0.00 0.00 64.05 63.83 1f9b n THR 213 Cb 1.00 -2.53 0.29 0.00 -1.82 0.00 0.00 70.33 67.27 1f9b n THR 213 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1f9b h VAL 214 N 0.00 1.17 0.00 12.58 2.07 -1.79 -1.52 116.25 128.76 1f9b h VAL 214 Ca 0.30 -0.38 -0.13 0.00 0.82 0.00 0.00 66.70 67.31 1f9b h VAL 214 Cb 0.50 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 1f9b h VAL 214 CO -0.81 0.18 -0.60 -0.26 0.02 0.00 0.00 177.57 176.09 1f9b h PHE 215 N 0.84 0.00 -0.01 1.57 -1.00 -0.58 -1.08 116.94 116.68 1f9b h PHE 215 Ca 0.22 0.00 -0.17 0.00 2.81 0.00 0.00 57.97 60.83 1f9b h PHE 215 Cb -0.03 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.51 1f9b h PHE 215 CO 0.00 0.60 -0.78 0.93 -1.61 0.00 0.00 178.31 177.46 1f9b h GLU 216 N 0.00 0.12 0.00 1.51 5.08 -0.31 -3.35 114.58 117.64 1f9b h GLU 216 Ca -0.01 -0.12 -0.33 0.00 -1.00 0.00 0.00 59.36 57.91 1f9b h GLU 216 Cb 1.39 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.61 1f9b h GLU 216 CO 0.08 0.84 -2.02 0.09 -1.00 0.00 0.00 179.01 177.00 1f9b n ASN 217 N -3.69 0.49 -3.97 1.42 3.02 -0.64 -4.69 115.26 107.20 1f9b n ASN 217 Ca -0.02 0.23 -0.31 0.00 -0.03 0.00 0.00 54.58 54.45 1f9b n ASN 217 Cb 0.74 0.41 -0.12 0.00 -0.61 0.00 0.00 39.78 40.20 1f9b n ASN 217 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1f9b s LEU 218 N -5.83 4.83 0.17 3.41 1.43 -0.41 -4.93 118.68 117.35 1f9b s LEU 218 Ca -0.07 -3.47 0.18 0.00 -1.03 0.00 0.00 54.13 49.74 1f9b s LEU 218 Cb 0.07 -1.70 0.81 0.00 0.03 0.00 0.00 46.19 45.40 1f9b s LEU 218 CO 0.83 -0.18 1.56 -2.65 0.23 0.00 0.00 176.35 176.14 1f9b n PRO 219 N 2.54 0.11 -3.69 1.29 -0.02 -1.26 -4.54 135.00 129.44 1f9b n PRO 219 Ca 0.14 0.43 -0.39 0.00 -2.02 0.00 0.00 63.50 61.66 1f9b n PRO 219 Cb 0.35 -1.75 -0.12 0.00 -0.02 0.00 0.00 33.50 31.96 1f9b n PRO 219 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1f9b s ASP 220 N -3.74 5.44 0.54 2.55 1.01 -1.26 -4.98 116.67 116.23 1f9b s ASP 220 Ca 0.03 -0.84 0.33 0.00 0.71 0.00 0.00 52.55 52.78 1f9b s ASP 220 Cb 0.08 -1.95 1.14 0.00 1.01 0.00 0.00 42.92 43.20 1f9b s ASP 220 CO 0.28 -0.28 1.29 1.21 0.21 0.00 0.00 175.17 177.88 1f9b n GLU 221 N 4.92 0.01 -0.12 8.23 2.13 -1.26 0.76 120.64 135.30 1f9b n GLU 221 Ca -0.13 0.96 -0.13 0.00 0.66 0.00 0.00 57.16 58.52 1f9b n GLU 221 Cb 0.47 -2.32 -0.02 0.00 0.27 0.00 0.00 31.44 29.84 1f9b n GLU 221 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1f9b h ALA 222 N 0.65 0.56 -0.50 4.31 0.00 -1.94 -2.89 119.26 119.46 1f9b h ALA 222 Ca 0.62 -0.43 0.01 0.00 0.00 0.00 0.00 54.91 55.12 1f9b h ALA 222 Cb 3.02 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 20.65 1f9b h ALA 222 CO -0.01 0.62 0.31 0.93 0.00 0.00 0.00 179.25 181.10 1f9b h GLU 223 N 0.72 0.62 0.00 0.00 4.39 -0.00 -2.96 114.58 117.34 1f9b h GLU 223 Ca 0.07 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.70 1f9b h GLU 223 Cb 0.90 -0.14 -0.00 0.00 -0.10 0.00 0.00 28.75 29.41 1f9b h GLU 223 CO 0.08 0.41 -0.16 0.00 -1.16 0.00 0.00 179.01 178.18 1f9b h ARG 224 N 0.63 0.00 0.00 2.33 3.08 -1.56 -2.67 114.38 116.19 1f9b h ARG 224 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.24 1f9b h ARG 224 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.02 1f9b h ARG 224 CO -0.06 0.16 0.00 -0.25 -1.07 0.00 0.00 179.97 178.75 1f9b n ASP 225 N -4.34 0.00 -0.10 7.04 9.92 -1.10 -0.77 116.55 127.20 1f9b n ASP 225 Ca -0.03 0.48 0.15 0.00 -0.53 0.00 0.00 54.79 54.86 1f9b n ASP 225 Cb 0.23 -0.49 0.70 0.00 -0.64 0.00 0.00 41.12 40.92 1f9b n ASP 225 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1f9b n LYS 226 N -1.49 0.77 -4.46 -1.24 5.02 -1.01 -4.88 118.16 110.87 1f9b n LYS 226 Ca 0.04 -0.20 -0.23 0.00 -2.02 0.00 0.00 58.31 55.90 1f9b n LYS 226 Cb 0.17 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.58 1f9b n LYS 226 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1f9b s TYR 227 N -2.37 2.14 0.31 2.13 1.51 0.05 -1.29 117.35 119.84 1f9b s TYR 227 Ca 0.33 -0.53 -0.07 0.00 -1.01 0.00 0.00 57.07 55.79 1f9b s TYR 227 Cb 0.21 -1.12 0.00 0.00 -0.11 0.00 0.00 41.96 40.94 1f9b s TYR 227 CO 0.44 0.50 0.50 -1.21 -1.11 0.00 0.00 175.55 174.67 1f9b s GLU 228 N -3.62 1.81 0.04 -0.62 2.02 0.25 -4.21 118.70 114.36 1f9b s GLU 228 Ca 0.29 -1.55 0.06 0.00 0.02 0.00 0.00 54.97 53.79 1f9b s GLU 228 Cb 0.00 0.47 -0.02 0.00 0.10 0.00 0.00 34.13 34.68 1f9b s GLU 228 CO 0.13 -0.76 -0.18 -0.51 0.02 0.00 0.00 175.26 173.96 1f9b s LEU 229 N -3.14 2.16 -0.24 1.80 1.43 -0.70 -1.01 118.68 118.97 1f9b s LEU 229 Ca 0.26 -0.48 -0.17 0.00 -1.03 0.00 0.00 54.13 52.71 1f9b s LEU 229 Cb -0.01 -0.83 -0.03 0.00 0.03 0.00 0.00 46.19 45.35 1f9b s LEU 229 CO 0.15 0.12 0.48 -0.76 0.23 0.00 0.00 176.35 176.57 1f9b s LEU 230 N -1.10 4.08 -0.01 1.79 1.43 -1.01 -2.40 118.68 121.46 1f9b s LEU 230 Ca 0.05 0.52 -0.09 0.00 -1.03 0.00 0.00 54.13 53.58 1f9b s LEU 230 Cb -0.08 -2.62 -0.05 0.00 0.03 0.00 0.00 46.19 43.47 1f9b s LEU 230 CO 0.01 -0.22 0.30 0.00 0.23 0.00 0.00 176.35 176.67 1f9b n PRO 232 N 1.45 0.00 -0.66 0.00 -0.04 -1.26 -0.04 135.00 134.45 1f9b n PRO 232 Ca -0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 1f9b n PRO 232 Cb 0.53 -1.30 0.22 0.00 -0.04 0.00 0.00 33.50 32.90 1f9b n PRO 232 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1f9b n ASP 233 N -0.76 2.97 -3.92 3.54 5.75 -1.26 -4.98 116.55 117.89 1f9b n ASP 233 Ca 0.00 -3.48 -0.33 0.00 -0.01 0.00 0.00 54.79 50.96 1f9b n ASP 233 Cb 0.00 -0.60 0.01 0.00 -1.03 0.00 0.00 41.12 39.50 1f9b n ASP 233 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1f9b n ASN 234 N -0.93 -2.92 -3.48 -1.12 3.02 0.94 -4.98 115.26 105.78 1f9b n ASN 234 Ca 0.29 -1.11 -0.15 0.00 -0.03 0.00 0.00 54.58 53.58 1f9b n ASN 234 Cb 0.98 -2.71 -0.06 0.00 -0.61 0.00 0.00 39.78 37.38 1f9b n ASN 234 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1f9b s THR 235 N -3.72 0.00 -0.03 3.41 -4.23 -1.20 -4.86 115.64 105.01 1f9b s THR 235 Ca 0.29 -1.76 0.05 0.00 -1.18 0.00 0.00 61.69 59.10 1f9b s THR 235 Cb -0.13 -2.54 -0.01 0.00 1.34 0.00 0.00 72.50 71.16 1f9b s THR 235 CO 0.91 0.00 -0.19 -0.13 -0.54 0.00 0.00 174.62 174.67 1f9b s ARG 236 N -3.41 1.71 0.04 3.99 0.52 -1.26 -1.11 118.95 119.43 1f9b s ARG 236 Ca 0.34 -0.67 0.01 0.00 -0.52 0.00 0.00 55.73 54.90 1f9b s ARG 236 Cb 0.01 -1.56 -0.03 0.00 0.52 0.00 0.00 34.95 33.90 1f9b s ARG 236 CO 0.20 0.34 -0.06 0.15 0.02 0.00 0.00 175.30 175.95 1f9b s LYS 237 N -0.22 0.49 0.51 3.54 1.02 -1.01 -4.97 119.74 119.09 1f9b s LYS 237 Ca 0.02 -0.78 -0.19 0.00 0.02 0.00 0.00 55.97 55.03 1f9b s LYS 237 Cb -0.10 -0.12 -0.11 0.00 -0.52 0.00 0.00 37.83 36.98 1f9b s LYS 237 CO 0.01 0.00 0.40 -0.35 -0.92 0.00 0.00 175.35 174.49 1f9b n PRO 238 N 1.30 0.43 0.22 -1.68 -0.04 -1.26 -1.72 135.00 132.25 1f9b n PRO 238 Ca -0.22 0.16 0.18 0.00 -0.04 0.00 0.00 63.50 63.58 1f9b n PRO 238 Cb 0.56 -1.51 0.81 0.00 -0.04 0.00 0.00 33.50 33.32 1f9b n PRO 238 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 1f9b h VAL 239 N 0.36 0.22 0.00 0.52 -1.51 -1.85 0.94 116.25 114.93 1f9b h VAL 239 Ca -0.43 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.04 1f9b h VAL 239 Cb 1.41 0.70 0.00 0.00 -2.13 0.00 0.00 31.29 31.27 1f9b h VAL 239 CO 0.47 0.00 0.00 -0.90 -1.23 0.00 0.00 177.57 175.91 1f9b n ASP 240 N -3.37 0.00 -1.88 4.19 5.68 -1.26 -3.92 116.55 115.98 1f9b n ASP 240 Ca 0.02 -0.36 -0.15 0.00 -0.50 0.00 0.00 54.79 53.80 1f9b n ASP 240 Cb 0.45 -0.19 0.16 0.00 -1.14 0.00 0.00 41.12 40.40 1f9b n ASP 240 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1f9b n ALA 241 N -1.19 4.68 0.23 2.12 0.00 0.32 -4.63 120.51 122.05 1f9b n ALA 241 Ca 0.15 -2.10 0.14 0.00 0.00 0.00 0.00 53.44 51.64 1f9b n ALA 241 Cb 0.17 -1.31 0.80 0.00 0.00 0.00 0.00 19.45 19.12 1f9b n ALA 241 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1f9b h PHE 242 N 1.10 0.00 0.00 0.00 -0.00 -1.79 0.67 116.94 116.92 1f9b h PHE 242 Ca 0.42 0.00 -0.03 0.00 -0.00 0.00 0.00 57.97 58.35 1f9b h PHE 242 Cb 2.32 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 38.26 1f9b h PHE 242 CO 1.16 0.00 -0.16 0.87 -0.00 0.00 0.00 178.31 180.19 1f9b h LYS 243 N 0.00 0.00 0.00 6.09 1.57 -1.94 -3.16 116.57 119.12 1f9b h LYS 243 Ca 0.05 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.52 1f9b h LYS 243 Cb 0.24 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.50 1f9b h LYS 243 CO -0.00 0.16 -2.15 0.39 -0.57 0.00 0.00 179.45 177.28 1f9b n GLU 244 N -3.39 1.18 -3.34 3.15 4.71 0.18 -4.76 120.64 118.36 1f9b n GLU 244 Ca -0.00 0.01 -0.30 0.00 -0.01 0.00 0.00 57.16 56.85 1f9b n GLU 244 Cb 0.35 -1.43 -0.06 0.00 -1.01 0.00 0.00 31.44 29.29 1f9b n GLU 244 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1f9b s HIS 246 N -2.54 1.32 0.07 0.00 -3.43 -1.24 -4.68 115.29 104.79 1f9b s HIS 246 Ca 0.38 -0.60 -0.06 0.00 -0.80 0.00 0.00 55.06 53.98 1f9b s HIS 246 Cb 0.13 -0.69 -0.28 0.00 -1.43 0.00 0.00 32.58 30.31 1f9b s HIS 246 CO 0.01 0.11 1.14 -0.07 -2.00 0.00 0.00 174.74 173.93 1f9b h LEU 247 N 3.41 0.49 -7.14 5.38 3.38 -1.64 -3.41 115.31 115.77 1f9b h LEU 247 Ca -0.39 -0.51 0.26 0.00 0.09 0.00 0.00 57.88 57.34 1f9b h LEU 247 Cb 1.19 -0.16 -0.15 0.00 0.09 0.00 0.00 40.66 41.64 1f9b h LEU 247 CO 0.53 1.39 0.76 0.00 0.09 0.00 0.00 178.44 181.21 1f9b s ALA 248 N -2.70 -2.08 -0.35 1.53 0.00 -1.25 -5.02 121.76 111.89 1f9b s ALA 248 Ca -0.05 1.08 -0.02 0.00 0.00 0.00 0.00 51.96 52.96 1f9b s ALA 248 Cb 0.07 0.18 0.07 0.00 0.00 0.00 0.00 23.12 23.44 1f9b s ALA 248 CO 0.89 -0.82 0.09 0.50 0.00 0.00 0.00 175.76 176.42 1f9b s ARG 249 N -2.56 2.25 0.54 0.00 3.52 -1.26 -0.21 118.95 121.23 1f9b s ARG 249 Ca 0.11 -1.49 0.06 0.00 -0.13 0.00 0.00 55.73 54.28 1f9b s ARG 249 Cb 0.01 -3.37 0.06 0.00 -1.56 0.00 0.00 34.95 30.09 1f9b s ARG 249 CO -0.04 -0.81 0.74 0.14 -0.81 0.00 0.00 175.30 174.53 1f9b s VAL 250 N 1.21 2.52 0.31 7.11 -7.23 0.50 -4.87 120.40 119.96 1f9b s VAL 250 Ca 0.01 -0.88 -0.10 0.00 -1.81 0.00 0.00 61.98 59.20 1f9b s VAL 250 Cb -0.21 -2.64 -0.07 0.00 0.56 0.00 0.00 36.38 34.02 1f9b s VAL 250 CO -0.02 0.00 0.65 -2.16 -0.31 0.00 0.00 175.10 173.26 1f9b s PRO 251 N -4.65 3.80 1.10 4.82 0.04 -1.26 -1.60 135.00 137.25 1f9b s PRO 251 Ca 0.59 0.35 -0.12 0.00 0.04 0.00 0.00 61.00 61.86 1f9b s PRO 251 Cb -0.08 -2.53 0.25 0.00 0.04 0.00 0.00 34.50 32.18 1f9b s PRO 251 CO 0.38 0.16 1.06 -1.54 0.04 0.00 0.00 177.00 177.09 1f9b s SER 252 N -2.76 1.42 0.94 6.66 1.04 0.17 -4.20 113.70 116.97 1f9b s SER 252 Ca 0.49 1.73 -0.12 0.00 0.48 0.00 0.00 55.95 58.53 1f9b s SER 252 Cb -0.11 -2.40 0.15 0.00 0.10 0.00 0.00 66.02 63.77 1f9b s SER 252 CO 0.25 -3.96 1.10 -1.00 0.98 0.00 0.00 173.24 170.61 1f9b s HIS 253 N -2.49 2.28 0.01 5.02 0.09 -1.26 -4.18 115.29 114.77 1f9b s HIS 253 Ca 0.68 1.06 -0.25 0.00 -0.00 0.00 0.00 55.06 56.55 1f9b s HIS 253 Cb -0.25 -3.24 0.06 0.00 -0.00 0.00 0.00 32.58 29.15 1f9b s HIS 253 CO 0.63 -2.59 0.56 0.00 -0.00 0.00 0.00 174.74 173.34 1f9b s ALA 254 N -3.02 -1.45 -0.09 -1.40 0.00 -0.50 -2.24 121.76 113.07 1f9b s ALA 254 Ca 0.64 0.82 -0.28 0.00 0.00 0.00 0.00 51.96 53.13 1f9b s ALA 254 Cb -0.17 0.25 -0.02 0.00 0.00 0.00 0.00 23.12 23.18 1f9b s ALA 254 CO 0.56 -0.45 0.94 0.08 0.00 0.00 0.00 175.76 176.90 1f9b s VAL 255 N -1.98 4.84 0.30 0.00 1.01 0.13 -0.49 120.40 124.21 1f9b s VAL 255 Ca -0.08 1.93 0.06 0.00 0.00 0.00 0.00 61.98 63.90 1f9b s VAL 255 Cb -0.01 -4.26 -0.02 0.00 0.00 0.00 0.00 36.38 32.09 1f9b s VAL 255 CO 0.02 0.07 0.36 0.68 0.00 0.00 0.00 175.10 176.23 1f9b s VAL 256 N 1.69 4.29 0.29 2.92 -7.23 0.11 0.68 120.40 123.15 1f9b s VAL 256 Ca 0.47 -1.14 -0.18 0.00 -1.81 0.00 0.00 61.98 59.31 1f9b s VAL 256 Cb -0.19 -3.47 0.02 0.00 0.56 0.00 0.00 36.38 33.31 1f9b s VAL 256 CO 0.19 -0.23 0.68 0.00 -0.31 0.00 0.00 175.10 175.44 1f9b s ALA 257 N -2.15 -0.92 0.61 1.32 0.00 -0.11 -3.37 121.76 117.13 1f9b s ALA 257 Ca 0.40 -0.51 -0.17 0.00 0.00 0.00 0.00 51.96 51.68 1f9b s ALA 257 Cb -0.08 0.87 -0.02 0.00 0.00 0.00 0.00 23.12 23.88 1f9b s ALA 257 CO 0.29 -0.99 1.11 1.03 0.00 0.00 0.00 175.76 177.20 1f9b s ARG 258 N -3.65 3.05 0.23 0.00 0.52 -1.26 -0.35 118.95 117.49 1f9b s ARG 258 Ca 0.14 1.46 0.02 0.00 -0.52 0.00 0.00 55.73 56.84 1f9b s ARG 258 Cb -0.05 -1.98 0.24 0.00 0.52 0.00 0.00 34.95 33.68 1f9b s ARG 258 CO 0.08 -1.07 1.56 0.77 0.02 0.00 0.00 175.30 176.67 1f9b h SER 259 N 0.50 0.37 -3.34 0.23 0.02 -1.88 -3.34 113.55 106.12 1f9b h SER 259 Ca -0.48 -0.20 -0.64 0.00 -0.84 0.00 0.00 61.79 59.63 1f9b h SER 259 Cb 1.25 -0.11 -0.33 0.00 0.14 0.00 0.00 62.40 63.35 1f9b h SER 259 CO 0.55 0.86 -0.86 -0.69 -1.14 0.00 0.00 176.83 175.55 1f9b s VAL 260 N -3.88 1.85 -1.36 2.27 1.01 -1.26 -4.74 120.40 114.29 1f9b s VAL 260 Ca -0.05 -0.89 -0.01 0.00 0.00 0.00 0.00 61.98 61.03 1f9b s VAL 260 Cb 0.12 -1.62 0.01 0.00 0.00 0.00 0.00 36.38 34.89 1f9b s VAL 260 CO 0.81 0.51 0.60 0.47 0.00 0.00 0.00 175.10 177.49 1f9b n ASP 261 N 3.67 -0.98 -0.23 3.32 9.92 -1.26 -4.87 116.55 126.12 1f9b n ASP 261 Ca -0.20 -0.90 0.12 0.00 -0.53 0.00 0.00 54.79 53.29 1f9b n ASP 261 Cb 0.52 -3.63 0.29 0.00 -0.64 0.00 0.00 41.12 37.66 1f9b n ASP 261 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1f9b n GLY 262 N -1.74 -0.64 2.71 0.44 0.00 -1.25 -4.89 105.19 99.82 1f9b n GLY 262 Ca -0.29 -0.44 -0.12 0.00 0.00 0.00 0.00 46.02 45.18 1f9b n GLY 262 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f9b n ARG 263 N -0.74 -4.23 -0.14 1.61 1.74 -1.26 -4.51 116.66 109.12 1f9b n ARG 263 Ca 0.10 0.60 -0.09 0.00 -0.77 0.00 0.00 57.85 57.70 1f9b n ARG 263 Cb 0.36 -4.83 -0.00 0.00 -1.02 0.00 0.00 32.46 26.97 1f9b n ARG 263 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1f9b h GLU 264 N -1.26 0.61 -0.18 5.56 5.08 -1.92 -2.73 114.58 119.75 1f9b h GLU 264 Ca -0.42 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 57.82 1f9b h GLU 264 Cb 1.24 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 1f9b h GLU 264 CO 0.35 0.54 -0.03 0.38 -1.00 0.00 0.00 179.01 179.25 1f9b h ASP 265 N 0.54 0.23 0.32 1.42 3.04 -1.99 -0.59 116.42 119.40 1f9b h ASP 265 Ca 0.14 -0.03 -0.02 0.00 -3.24 0.00 0.00 57.03 53.89 1f9b h ASP 265 Cb 0.14 -0.06 0.00 0.00 -1.04 0.00 0.00 39.33 38.37 1f9b h ASP 265 CO -0.02 0.31 -0.16 -0.07 -2.04 0.00 0.00 179.24 177.26 1f9b h LEU 266 N 0.25 -0.37 0.65 0.15 4.07 -1.87 -1.21 115.31 116.98 1f9b h LEU 266 Ca 0.06 -0.14 -0.02 0.00 0.08 0.00 0.00 57.88 57.86 1f9b h LEU 266 Cb 0.22 0.10 -0.01 0.00 1.08 0.00 0.00 40.66 42.04 1f9b h LEU 266 CO 0.01 -0.06 -0.48 0.40 -1.08 0.00 0.00 178.44 177.23 1f9b h ILE 267 N -0.70 0.04 -0.89 1.22 2.04 -1.32 -1.67 117.51 116.24 1f9b h ILE 267 Ca -0.04 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.01 1f9b h ILE 267 Cb 0.48 0.04 -0.11 0.00 -0.74 0.00 0.00 36.82 36.49 1f9b h ILE 267 CO 0.07 0.00 0.43 -0.25 0.00 0.00 0.00 178.15 178.40 1f9b h TRP 268 N -1.09 0.74 -0.35 1.37 2.91 -1.16 0.57 115.95 118.93 1f9b h TRP 268 Ca -0.08 0.04 -0.04 0.00 1.13 0.00 0.00 58.89 59.94 1f9b h TRP 268 Cb 0.90 -0.19 -0.02 0.00 -0.51 0.00 0.00 29.16 29.35 1f9b h TRP 268 CO -0.17 0.07 0.06 0.87 -1.03 0.00 0.00 178.44 178.24 1f9b h LYS 269 N 0.52 0.52 0.46 2.65 1.57 -0.91 0.12 116.57 121.50 1f9b h LYS 269 Ca 0.52 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 59.19 1f9b h LYS 269 Cb 0.89 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.12 1f9b h LYS 269 CO -0.45 0.50 -0.22 1.25 -0.57 0.00 0.00 179.45 179.96 1f9b h LEU 270 N 0.51 -0.52 -1.13 2.94 5.85 0.10 -2.59 115.31 120.47 1f9b h LEU 270 Ca 0.12 0.02 0.12 0.00 0.84 0.00 0.00 57.88 58.98 1f9b h LEU 270 Cb 0.24 0.14 -0.08 0.00 0.37 0.00 0.00 40.66 41.33 1f9b h LEU 270 CO 0.00 -0.32 0.60 -0.07 -0.34 0.00 0.00 178.44 178.32 1f9b h LEU 271 N -0.74 0.82 -0.00 2.25 3.38 -1.12 0.86 115.31 120.75 1f9b h LEU 271 Ca -0.06 0.04 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1f9b h LEU 271 Cb 0.48 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1f9b h LEU 271 CO 0.10 0.44 -0.05 -0.74 0.09 0.00 0.00 178.44 178.29 1f9b h HIS 272 N 0.88 -0.11 -0.75 1.13 2.76 -0.96 0.26 115.15 118.36 1f9b h HIS 272 Ca 0.46 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.61 1f9b h HIS 272 Cb 0.54 0.05 -0.04 0.00 1.55 0.00 0.00 27.41 29.51 1f9b h HIS 272 CO -0.00 -0.07 0.37 0.00 -1.30 0.00 0.00 177.93 176.92 1f9b h ARG 273 N -0.08 1.06 -0.52 5.26 2.47 -0.88 -1.99 114.38 119.70 1f9b h ARG 273 Ca 0.02 -0.14 -0.06 0.00 -1.26 0.00 0.00 59.98 58.53 1f9b h ARG 273 Cb 0.11 -0.20 -0.02 0.00 -1.65 0.00 0.00 29.97 28.20 1f9b h ARG 273 CO -0.05 0.81 0.06 0.00 0.56 0.00 0.00 179.97 181.35 1f9b h ALA 274 N 1.34 1.13 -0.22 0.04 0.00 0.12 0.22 119.26 121.90 1f9b h ALA 274 Ca 0.26 -0.24 -0.20 0.00 0.00 0.00 0.00 54.91 54.73 1f9b h ALA 274 Cb 0.09 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.68 1f9b h ALA 274 CO -0.03 0.57 -0.65 1.96 0.00 0.00 0.00 179.25 181.09 1f9b h GLN 275 N 0.79 0.84 -0.55 0.00 4.20 -0.06 0.28 115.11 120.61 1f9b h GLN 275 Ca 0.16 -0.60 -0.07 0.00 0.06 0.00 0.00 58.65 58.21 1f9b h GLN 275 Cb 0.39 0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.24 1f9b h GLN 275 CO 0.01 1.22 0.09 1.49 -0.67 0.00 0.00 178.83 180.97 1f9b h GLU 276 N 0.60 0.91 0.11 1.46 4.81 -1.20 -1.35 114.58 119.92 1f9b h GLU 276 Ca -0.02 -0.25 -0.35 0.00 -0.13 0.00 0.00 59.36 58.62 1f9b h GLU 276 Cb 1.27 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.52 1f9b h GLU 276 CO 0.14 0.88 -1.90 1.49 -0.73 0.00 0.00 179.01 178.89 1f9b h GLU 277 N 0.80 0.23 0.00 1.92 4.57 -0.54 -3.41 114.58 118.15 1f9b h GLU 277 Ca 0.17 -0.39 0.00 0.00 -1.18 0.00 0.00 59.36 57.95 1f9b h GLU 277 Cb 0.41 0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.15 1f9b h GLU 277 CO 0.01 1.09 -0.01 1.19 -1.18 0.00 0.00 179.01 180.11 1f9b n PHE 278 N -3.41 0.00 0.00 0.92 3.72 0.96 -3.61 117.46 116.04 1f9b n PHE 278 Ca -0.28 -0.61 0.00 0.00 -0.05 0.00 0.00 57.45 56.51 1f9b n PHE 278 Cb 1.05 -0.08 0.00 0.00 -0.94 0.00 0.00 39.48 39.51 1f9b n PHE 278 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1f9b n GLY 279 N -0.74 -1.92 3.68 1.37 0.00 -0.51 -1.16 105.19 105.91 1f9b n GLY 279 Ca 0.05 -1.18 -0.48 0.00 0.00 0.00 0.00 46.02 44.40 1f9b n GLY 279 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f9b n ARG 280 N 0.00 2.19 -1.42 1.61 5.12 -1.26 -3.16 116.66 119.74 1f9b n ARG 280 Ca 0.00 0.80 0.00 0.00 -1.93 0.00 0.00 57.85 56.72 1f9b n ARG 280 Cb 0.00 -2.64 0.00 0.00 -1.16 0.00 0.00 32.46 28.66 1f9b n ARG 280 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1f9b n ASN 281 N 6.36 -0.39 -0.05 0.55 5.15 -1.26 -4.70 115.26 120.92 1f9b n ASN 281 Ca 0.22 0.19 -0.15 0.00 -0.60 0.00 0.00 54.58 54.25 1f9b n ASN 281 Cb 0.30 -0.58 -0.07 0.00 -0.53 0.00 0.00 39.78 38.89 1f9b n ASN 281 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 1f9b h LYS 282 N 0.00 0.51 0.00 1.20 1.79 -1.81 -3.47 116.57 114.78 1f9b h LYS 282 Ca 0.00 -0.35 -0.38 0.00 -2.18 0.00 0.00 60.65 57.74 1f9b h LYS 282 Cb 0.39 0.05 -0.07 0.00 -1.58 0.00 0.00 32.23 31.02 1f9b h LYS 282 CO 0.00 0.97 -0.28 0.45 -1.08 0.00 0.00 179.45 179.51 1f9b n SER 283 N -4.32 2.50 0.00 0.86 2.88 -1.24 -4.97 113.62 109.34 1f9b n SER 283 Ca -0.07 -2.31 0.00 0.00 -1.33 0.00 0.00 58.87 55.17 1f9b n SER 283 Cb 0.52 0.29 0.00 0.00 -0.75 0.00 0.00 64.21 64.27 1f9b n SER 283 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1f9b n SER 284 N -1.29 0.00 0.27 -3.46 3.41 -1.26 -4.83 113.62 106.47 1f9b n SER 284 Ca -0.11 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.64 1f9b n SER 284 Cb 0.38 0.00 0.79 0.00 -0.26 0.00 0.00 64.21 65.11 1f9b n SER 284 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1f9b h ALA 285 N 0.00 1.35 -1.13 7.33 0.00 -1.97 -3.43 119.26 121.40 1f9b h ALA 285 Ca 0.00 -0.08 0.18 0.00 0.00 0.00 0.00 54.91 55.02 1f9b h ALA 285 Cb 0.00 -0.01 -0.32 0.00 0.00 0.00 0.00 17.79 17.45 1f9b h ALA 285 CO 0.00 0.10 0.82 0.12 0.00 0.00 0.00 179.25 180.29 1f9b s PHE 286 N -4.32 -0.10 -0.15 0.00 5.36 -1.26 -5.02 117.98 112.48 1f9b s PHE 286 Ca -0.03 0.25 0.01 0.00 -0.96 0.00 0.00 56.93 56.20 1f9b s PHE 286 Cb 0.14 0.42 0.02 0.00 -0.34 0.00 0.00 43.02 43.25 1f9b s PHE 286 CO 0.57 -0.05 -0.19 -0.65 -1.46 0.00 0.00 175.22 173.44 1f9b s GLN 287 N 0.18 2.76 0.06 10.12 1.11 -1.26 -4.62 119.66 128.01 1f9b s GLN 287 Ca 0.05 -0.75 -0.29 0.00 0.01 0.00 0.00 55.36 54.38 1f9b s GLN 287 Cb -0.05 -2.34 -0.18 0.00 -1.01 0.00 0.00 33.01 29.43 1f9b s GLN 287 CO -0.14 -0.13 1.58 1.25 0.01 0.00 0.00 175.29 177.85 1f9b h LEU 288 N 7.70 -0.52 -4.16 2.90 5.85 -1.40 -3.20 115.31 122.49 1f9b h LEU 288 Ca -0.38 -0.01 -0.44 0.00 0.84 0.00 0.00 57.88 57.89 1f9b h LEU 288 Cb 1.16 0.13 -0.16 0.00 0.37 0.00 0.00 40.66 42.16 1f9b h LEU 288 CO 0.57 -0.32 0.39 0.49 -0.34 0.00 0.00 178.44 179.23 1f9b n PHE 289 N -5.33 1.57 -3.96 1.25 3.72 -1.26 -4.70 117.46 108.75 1f9b n PHE 289 Ca -0.11 -1.96 -0.09 0.00 -0.05 0.00 0.00 57.45 55.23 1f9b n PHE 289 Cb 0.27 -1.25 -0.11 0.00 -0.94 0.00 0.00 39.48 37.46 1f9b n PHE 289 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1f9b s LYS 290 N -1.73 0.34 0.31 -1.08 -0.14 -1.21 -1.61 119.74 114.62 1f9b s LYS 290 Ca 0.50 -0.58 0.06 0.00 -1.36 0.00 0.00 55.97 54.59 1f9b s LYS 290 Cb 0.34 0.13 -0.03 0.00 -1.68 0.00 0.00 37.83 36.58 1f9b s LYS 290 CO -0.14 -0.06 0.25 -1.12 -0.76 0.00 0.00 175.35 173.52 1f9b s SER 291 N -1.46 1.50 0.44 2.83 0.01 -1.26 -4.89 113.70 110.86 1f9b s SER 291 Ca -0.16 -1.70 -0.21 0.00 1.31 0.00 0.00 55.95 55.19 1f9b s SER 291 Cb -0.09 0.53 -0.10 0.00 0.21 0.00 0.00 66.02 66.57 1f9b s SER 291 CO -0.01 -1.03 0.99 0.42 0.41 0.00 0.00 173.24 174.02 1f9b s THR 292 N -3.54 4.12 0.37 1.44 -4.23 -1.25 -4.97 115.64 107.58 1f9b s THR 292 Ca 0.40 1.38 0.05 0.00 -1.18 0.00 0.00 61.69 62.34 1f9b s THR 292 Cb 0.03 -3.59 0.22 0.00 1.34 0.00 0.00 72.50 70.51 1f9b s THR 292 CO 0.25 -0.23 1.98 -0.65 -0.54 0.00 0.00 174.62 175.43 1f9b h PRO 293 N 1.94 0.60 0.08 3.99 0.11 -2.02 -3.13 132.00 133.57 1f9b h PRO 293 Ca -0.49 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.56 1f9b h PRO 293 Cb 1.20 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 1f9b h PRO 293 CO 0.61 0.47 -0.23 1.05 -0.21 0.00 0.00 178.00 179.69 1f9b h GLU 294 N 0.60 -0.33 -5.50 1.05 9.09 -2.03 -3.41 114.58 114.04 1f9b h GLU 294 Ca 0.15 0.02 -0.67 0.00 0.05 0.00 0.00 59.36 58.92 1f9b h GLU 294 Cb 0.08 0.08 -0.28 0.00 -1.65 0.00 0.00 28.75 26.98 1f9b h GLU 294 CO -0.02 -0.22 -0.79 -1.21 0.05 0.00 0.00 179.01 176.82 1f9b s GLU 295 N -4.21 3.17 0.54 1.06 8.01 -1.18 -5.08 118.70 121.01 1f9b s GLU 295 Ca -0.07 -0.73 0.06 0.00 0.01 0.00 0.00 54.97 54.24 1f9b s GLU 295 Cb 0.03 -2.52 0.06 0.00 -4.31 0.00 0.00 34.13 27.39 1f9b s GLU 295 CO 0.26 0.27 0.74 -0.65 0.01 0.00 0.00 175.26 175.90 1f9b s GLN 296 N 0.17 2.43 -1.27 1.61 -1.52 -1.26 -3.85 119.66 115.98 1f9b s GLN 296 Ca -0.09 -1.31 -0.22 0.00 -1.95 0.00 0.00 55.36 51.80 1f9b s GLN 296 Cb -0.15 -2.62 0.02 0.00 -0.22 0.00 0.00 33.01 30.04 1f9b s GLN 296 CO 0.05 -0.73 0.58 -0.25 -0.25 0.00 0.00 175.29 174.70 1f9b n ASP 297 N -2.21 -3.23 -4.85 5.90 8.00 -1.26 -4.92 116.55 113.98 1f9b n ASP 297 Ca 0.12 -1.18 -0.34 0.00 0.71 0.00 0.00 54.79 54.09 1f9b n ASP 297 Cb 0.60 -2.31 -0.06 0.00 -0.02 0.00 0.00 41.12 39.33 1f9b n ASP 297 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1f9b s LEU 298 N -7.12 4.27 0.00 0.64 1.43 -1.26 -4.69 118.68 111.94 1f9b s LEU 298 Ca 0.35 1.14 0.00 0.00 -1.03 0.00 0.00 54.13 54.59 1f9b s LEU 298 Cb -0.17 -3.52 0.00 0.00 0.03 0.00 0.00 46.19 42.53 1f9b s LEU 298 CO 0.94 0.01 0.00 0.18 0.23 0.00 0.00 176.35 177.71 1f9b n LEU 299 N 0.44 0.00 0.00 1.79 4.77 -1.26 -4.64 117.00 118.10 1f9b n LEU 299 Ca -0.02 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.82 1f9b n LEU 299 Cb 0.52 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.67 1f9b n LEU 299 CO 0.43 0.00 0.32 0.49 -1.33 0.00 0.00 177.39 177.30 1f9b n PHE 300 N 0.00 -2.92 -2.75 -1.77 3.72 -1.26 -4.89 117.46 107.59 1f9b n PHE 300 Ca 0.00 -1.20 -0.43 0.00 -0.05 0.00 0.00 57.45 55.77 1f9b n PHE 300 Cb 0.00 -0.43 -0.03 0.00 -0.94 0.00 0.00 39.48 38.08 1f9b n PHE 300 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1f9b s LYS 301 N -3.98 3.95 0.16 -1.08 2.47 -1.26 -4.49 119.74 115.51 1f9b s LYS 301 Ca 0.41 0.78 -0.34 0.00 -1.56 0.00 0.00 55.97 55.27 1f9b s LYS 301 Cb -0.03 -3.77 -0.15 0.00 -1.46 0.00 0.00 37.83 32.43 1f9b s LYS 301 CO 0.27 -0.90 1.37 -0.25 0.16 0.00 0.00 175.35 176.00 1f9b n ASP 302 N 6.75 2.16 -1.50 1.43 8.00 -1.26 -2.38 116.55 129.75 1f9b n ASP 302 Ca 0.09 1.12 -0.11 0.00 0.71 0.00 0.00 54.79 56.60 1f9b n ASP 302 Cb 0.48 -1.30 0.01 0.00 -0.02 0.00 0.00 41.12 40.28 1f9b n ASP 302 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1f9b n SER 303 N 2.54 -3.72 -4.88 -2.24 7.64 -0.64 -5.02 113.62 107.31 1f9b n SER 303 Ca 0.16 -0.10 -0.30 0.00 1.01 0.00 0.00 58.87 59.63 1f9b n SER 303 Cb 0.25 -2.73 -0.04 0.00 -1.01 0.00 0.00 64.21 60.69 1f9b n SER 303 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1f9b s ALA 304 N -2.75 3.42 -0.26 -0.43 0.00 -1.00 -4.55 121.76 116.19 1f9b s ALA 304 Ca 0.11 -0.25 0.19 0.00 0.00 0.00 0.00 51.96 52.00 1f9b s ALA 304 Cb -0.05 -2.61 0.13 0.00 0.00 0.00 0.00 23.12 20.60 1f9b s ALA 304 CO 0.13 0.13 1.40 -0.07 0.00 0.00 0.00 175.76 177.35 1f9b h LEU 305 N 1.58 0.00 0.00 0.00 3.38 -1.59 -3.45 115.31 115.23 1f9b h LEU 305 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1f9b h LEU 305 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1f9b h LEU 305 CO 0.65 0.29 0.00 0.61 0.09 0.00 0.00 178.44 180.08 1f9b n GLY 306 N 1.19 -0.13 3.32 0.83 0.00 -1.26 -4.67 105.19 104.48 1f9b n GLY 306 Ca 0.01 -1.16 -0.17 0.00 0.00 0.00 0.00 46.02 44.70 1f9b n GLY 306 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1f9b s PHE 307 N -3.51 1.57 -0.04 1.61 0.40 -1.26 0.03 117.98 116.78 1f9b s PHE 307 Ca 0.00 -0.71 0.03 0.00 -0.60 0.00 0.00 56.93 55.65 1f9b s PHE 307 Cb 0.00 -0.80 0.00 0.00 0.51 0.00 0.00 43.02 42.73 1f9b s PHE 307 CO 0.00 0.19 -0.11 0.14 0.70 0.00 0.00 175.22 176.14 1f9b s VAL 308 N -3.17 0.98 0.19 -0.44 -7.23 -0.54 -4.92 120.40 105.28 1f9b s VAL 308 Ca 0.22 -0.45 -0.30 0.00 -1.81 0.00 0.00 61.98 59.64 1f9b s VAL 308 Cb 0.02 -0.87 -0.09 0.00 0.56 0.00 0.00 36.38 36.00 1f9b s VAL 308 CO 0.06 0.30 1.35 -0.60 -0.31 0.00 0.00 175.10 175.89 1f9b s ARG 309 N 0.26 4.36 -0.24 4.82 3.52 -1.26 -1.57 118.95 128.83 1f9b s ARG 309 Ca -0.05 2.10 -0.20 0.00 -0.13 0.00 0.00 55.73 57.45 1f9b s ARG 309 Cb -0.11 -3.19 -0.02 0.00 -1.56 0.00 0.00 34.95 30.07 1f9b s ARG 309 CO 0.01 -0.32 0.60 0.42 -0.81 0.00 0.00 175.30 175.20 1f9b s ILE 310 N 0.31 5.02 0.95 4.11 1.01 0.59 -4.91 121.20 128.28 1f9b s ILE 310 Ca 0.59 1.07 -0.15 0.00 0.00 0.00 0.00 60.65 62.16 1f9b s ILE 310 Cb -0.37 -3.90 -0.07 0.00 0.01 0.00 0.00 42.46 38.12 1f9b s ILE 310 CO 0.37 0.07 -0.24 -2.65 0.00 0.00 0.00 174.94 172.49 1f9b n PRO 311 N 5.47 -0.10 0.02 2.79 -0.02 -1.26 -4.86 135.00 137.04 1f9b n PRO 311 Ca -0.02 -0.01 -0.06 0.00 -2.02 0.00 0.00 63.50 61.39 1f9b n PRO 311 Cb 0.49 -1.38 0.12 0.00 -0.02 0.00 0.00 33.50 32.71 1f9b n PRO 311 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1f9b h SER 312 N -1.16 0.50 -0.74 2.55 0.02 -1.96 -3.30 113.55 109.47 1f9b h SER 312 Ca -0.44 -0.24 -0.05 0.00 -0.84 0.00 0.00 61.79 60.23 1f9b h SER 312 Cb 1.30 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.67 1f9b h SER 312 CO 0.29 0.89 0.27 -0.61 -1.14 0.00 0.00 176.83 176.53 1f9b h GLN 313 N 0.38 1.13 -6.15 3.45 4.15 -1.92 -3.44 115.11 112.70 1f9b h GLN 313 Ca 0.03 -0.22 -0.72 0.00 0.77 0.00 0.00 58.65 58.50 1f9b h GLN 313 Cb 0.95 -0.17 0.01 0.00 0.21 0.00 0.00 27.48 28.48 1f9b h GLN 313 CO 0.08 0.94 0.96 -0.89 -1.93 0.00 0.00 178.83 177.99 1f9b n ILE 314 N -4.30 0.34 -3.82 2.39 5.41 -1.25 -4.99 119.36 113.14 1f9b n ILE 314 Ca 0.06 -0.07 -0.24 0.00 1.00 0.00 0.00 62.75 63.50 1f9b n ILE 314 Cb 0.20 -1.32 -0.02 0.00 -0.71 0.00 0.00 39.64 37.79 1f9b n ILE 314 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 176.55 178.06 1f9b s ASP 315 N 3.84 4.72 0.27 4.38 -4.77 -1.26 -4.69 116.67 119.16 1f9b s ASP 315 Ca 0.99 -1.08 -0.00 0.00 -3.30 0.00 0.00 52.55 49.16 1f9b s ASP 315 Cb -1.02 0.01 0.53 0.00 -1.09 0.00 0.00 42.92 41.35 1f9b s ASP 315 CO 0.64 -0.90 1.79 0.77 0.70 0.00 0.00 175.17 178.17 1f9b h SER 316 N 0.92 0.70 -0.82 2.11 4.64 -1.94 0.32 113.55 119.48 1f9b h SER 316 Ca -0.39 0.07 -0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1f9b h SER 316 Cb 1.28 -0.06 -0.04 0.00 -0.31 0.00 0.00 62.40 63.28 1f9b h SER 316 CO 0.59 0.34 0.50 1.23 -0.87 0.00 0.00 176.83 178.62 1f9b h GLY 317 N 0.78 1.19 1.95 -0.77 0.00 -1.95 -0.07 103.07 104.20 1f9b h GLY 317 Ca 0.47 -0.49 -0.19 0.00 0.00 0.00 0.00 47.33 47.12 1f9b h GLY 317 CO -0.31 0.48 -0.89 1.41 0.00 0.00 0.00 176.54 177.22 1f9b h LEU 318 N 1.13 0.06 -0.13 3.11 3.38 -1.56 -2.72 115.31 118.59 1f9b h LEU 318 Ca 0.30 -0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.23 1f9b h LEU 318 Cb -0.05 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1f9b h LEU 318 CO -0.06 0.92 0.00 0.22 0.09 0.00 0.00 178.44 179.61 1f9b h TYR 319 N 0.02 0.00 0.00 1.13 3.20 0.60 -3.21 116.97 118.71 1f9b h TYR 319 Ca -0.02 0.01 -0.25 0.00 3.14 0.00 0.00 58.73 61.61 1f9b h TYR 319 Cb 1.56 0.02 0.01 0.00 1.54 0.00 0.00 36.73 39.86 1f9b h TYR 319 CO 0.01 -0.01 -1.01 -0.07 -1.64 0.00 0.00 178.16 175.44 1f9b h LEU 320 N 0.05 0.76 0.00 2.82 3.38 -1.09 -3.48 115.31 117.75 1f9b h LEU 320 Ca 0.06 -0.61 0.00 0.00 0.09 0.00 0.00 57.88 57.42 1f9b h LEU 320 Cb 0.06 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1f9b h LEU 320 CO -0.09 1.41 0.00 0.61 0.09 0.00 0.00 178.44 180.46 1f9b n GLY 321 N 1.03 0.84 0.34 0.83 0.00 -1.03 -4.17 105.19 103.03 1f9b n GLY 321 Ca -0.09 -1.90 -0.12 0.00 0.00 0.00 0.00 46.02 43.90 1f9b n GLY 321 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f9b h ALA 322 N 0.00 -1.08 -0.84 4.61 0.00 -1.62 -2.66 119.26 117.68 1f9b h ALA 322 Ca 0.00 -0.14 0.13 0.00 0.00 0.00 0.00 54.91 54.90 1f9b h ALA 322 Cb 0.00 0.51 -0.14 0.00 0.00 0.00 0.00 17.79 18.16 1f9b h ALA 322 CO 0.00 -1.07 -0.39 -0.91 0.00 0.00 0.00 179.25 176.88 1f9b h ASN 323 N -0.72 -1.39 -0.42 0.00 4.21 -1.88 0.66 115.58 116.04 1f9b h ASN 323 Ca -0.05 0.28 -0.10 0.00 1.21 0.00 0.00 56.30 57.63 1f9b h ASN 323 Cb 0.60 0.71 -0.02 0.00 -1.12 0.00 0.00 38.32 38.49 1f9b h ASN 323 CO 0.01 -0.29 -0.12 0.22 -1.29 0.00 0.00 177.43 175.96 1f9b h TYR 324 N -0.07 0.97 -0.30 1.19 5.03 -1.71 -2.98 116.97 119.11 1f9b h TYR 324 Ca 0.29 -0.19 -0.09 0.00 2.58 0.00 0.00 58.73 61.32 1f9b h TYR 324 Cb 0.57 -0.25 -0.01 0.00 1.55 0.00 0.00 36.73 38.60 1f9b h TYR 324 CO -0.80 0.94 -0.17 -0.07 -1.32 0.00 0.00 178.16 176.75 1f9b h LEU 325 N 0.79 0.66 0.19 2.82 3.38 -0.83 -1.44 115.31 120.87 1f9b h LEU 325 Ca 0.13 -0.42 0.01 0.00 0.09 0.00 0.00 57.88 57.69 1f9b h LEU 325 Cb 0.63 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 1f9b h LEU 325 CO 0.04 0.94 -0.41 0.71 0.09 0.00 0.00 178.44 179.80 1f9b h THR 326 N 0.39 0.16 -0.49 0.22 1.35 -0.87 0.24 112.91 113.91 1f9b h THR 326 Ca 0.06 0.00 0.07 0.00 -0.55 0.00 0.00 66.41 66.00 1f9b h THR 326 Cb 0.70 0.16 -0.06 0.00 -1.73 0.00 0.00 68.15 67.22 1f9b h THR 326 CO 0.05 0.00 0.16 0.00 -0.25 0.00 0.00 175.52 175.47 1f9b h ALA 327 N -0.24 0.59 0.08 6.62 0.00 -1.46 1.15 119.26 126.01 1f9b h ALA 327 Ca 0.01 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1f9b h ALA 327 Cb 0.69 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1f9b h ALA 327 CO -0.20 -0.24 -0.04 1.15 0.00 0.00 0.00 179.25 179.92 1f9b h THR 328 N 0.32 1.09 -0.20 0.00 2.02 -1.07 -2.06 112.91 113.01 1f9b h THR 328 Ca 0.24 -0.61 0.06 0.00 0.77 0.00 0.00 66.41 66.86 1f9b h THR 328 Cb 0.27 1.48 -0.01 0.00 -1.74 0.00 0.00 68.15 68.16 1f9b h THR 328 CO -0.26 0.15 0.21 1.56 0.37 0.00 0.00 175.52 177.54 1f9b h GLN 329 N -0.39 0.00 0.00 6.66 4.20 0.44 -0.58 115.11 125.44 1f9b h GLN 329 Ca -0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1f9b h GLN 329 Cb 0.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.11 1f9b h GLN 329 CO 0.02 0.00 0.00 0.09 -0.67 0.00 0.00 178.83 178.27 1f9b n ASN 330 N -3.86 0.00 -1.02 1.46 5.03 0.39 -1.83 115.26 115.43 1f9b n ASN 330 Ca 0.02 0.14 0.12 0.00 0.87 0.00 0.00 54.58 55.72 1f9b n ASN 330 Cb 0.33 -0.37 0.24 0.00 -1.02 0.00 0.00 39.78 38.97 1f9b n ASN 330 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1f9b n LEU 331 N -1.37 3.07 -0.14 3.41 4.77 -0.23 -3.97 117.00 122.55 1f9b n LEU 331 Ca 0.10 -1.30 0.05 0.00 -0.03 0.00 0.00 56.01 54.83 1f9b n LEU 331 Cb 0.24 -0.21 0.07 0.00 -2.33 0.00 0.00 43.42 41.19 1f9b n LEU 331 CO 0.21 0.65 0.46 -2.11 -1.33 0.00 0.00 177.39 175.27 1f9b n ARG 332 N 1.25 1.23 -4.35 3.23 0.00 -0.76 -4.90 116.66 112.36 1f9b n ARG 332 Ca 0.18 -1.86 -0.18 0.00 -0.00 0.00 0.00 57.85 55.99 1f9b n ARG 332 Cb 0.55 -1.11 -0.10 0.00 -0.00 0.00 0.00 32.46 31.80 1f9b n ARG 332 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 1f9b s GLU 333 N -1.66 1.33 0.45 2.89 2.02 -1.16 -4.83 118.70 117.74 1f9b s GLU 333 Ca 0.16 -1.59 -0.20 0.00 0.02 0.00 0.00 54.97 53.36 1f9b s GLU 333 Cb 0.14 -1.12 -0.10 0.00 0.10 0.00 0.00 34.13 33.15 1f9b s GLU 333 CO 0.02 0.18 0.95 0.95 0.02 0.00 0.00 175.26 177.38 1f9b s THR 334 N -2.97 4.43 0.32 3.63 -4.23 -1.26 -4.33 115.64 111.23 1f9b s THR 334 Ca 0.23 1.41 0.09 0.00 -1.18 0.00 0.00 61.69 62.23 1f9b s THR 334 Cb -0.01 -3.63 0.32 0.00 1.34 0.00 0.00 72.50 70.52 1f9b s THR 334 CO 0.07 -0.40 1.77 0.00 -0.54 0.00 0.00 174.62 175.52 1f9b h ALA 335 N 1.68 1.79 0.00 3.99 0.00 -1.93 0.36 119.26 125.16 1f9b h ALA 335 Ca -0.48 0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.39 1f9b h ALA 335 Cb 1.18 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 1f9b h ALA 335 CO 0.61 -0.18 -0.56 0.00 0.00 0.00 0.00 179.25 179.12 1f9b h ALA 336 N 1.66 1.00 -0.28 0.00 0.00 -1.95 -2.47 119.26 117.23 1f9b h ALA 336 Ca 0.59 -0.51 -0.15 0.00 0.00 0.00 0.00 54.91 54.84 1f9b h ALA 336 Cb 1.05 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 1f9b h ALA 336 CO -0.38 0.70 -0.42 0.93 0.00 0.00 0.00 179.25 180.09 1f9b h GLU 337 N 0.00 0.77 0.62 0.00 5.08 -0.72 -2.91 114.58 117.42 1f9b h GLU 337 Ca -0.01 -0.46 -0.03 0.00 -1.00 0.00 0.00 59.36 57.87 1f9b h GLU 337 Cb 1.04 0.04 0.01 0.00 0.50 0.00 0.00 28.75 30.33 1f9b h GLU 337 CO 0.07 1.09 -0.30 0.28 -1.00 0.00 0.00 179.01 179.15 1f9b h VAL 338 N 0.52 0.00 -0.26 3.13 2.07 -1.10 -2.68 116.25 117.93 1f9b h VAL 338 Ca 0.03 -0.08 0.07 0.00 0.82 0.00 0.00 66.70 67.54 1f9b h VAL 338 Cb 1.01 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1f9b h VAL 338 CO 0.10 0.00 0.25 0.00 0.02 0.00 0.00 177.57 177.93 1f9b h ALA 339 N -1.53 1.98 0.24 1.67 0.00 -1.58 -2.25 119.26 117.78 1f9b h ALA 339 Ca -0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1f9b h ALA 339 Cb 0.64 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1f9b h ALA 339 CO 0.14 -0.38 -0.12 0.00 0.00 0.00 0.00 179.25 178.89 1f9b h ALA 340 N 1.75 -0.32 -0.71 0.00 0.00 -1.39 -3.07 119.26 115.50 1f9b h ALA 340 Ca 0.12 -0.18 0.11 0.00 0.00 0.00 0.00 54.91 54.97 1f9b h ALA 340 Cb 0.62 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.49 1f9b h ALA 340 CO -0.00 -0.52 0.47 -0.09 0.00 0.00 0.00 179.25 179.12 1f9b h ARG 341 N -0.66 0.51 0.00 0.00 9.65 -1.08 -1.14 114.38 121.67 1f9b h ARG 341 Ca -0.03 -0.03 -0.05 0.00 -1.10 0.00 0.00 59.98 58.77 1f9b h ARG 341 Cb 0.46 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.92 1f9b h ARG 341 CO 0.05 0.34 -0.23 0.00 2.80 0.00 0.00 179.97 182.93 1f9b h ARG 342 N 0.52 0.00 0.00 0.20 3.08 -1.40 -3.30 114.38 113.48 1f9b h ARG 342 Ca 0.34 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 60.08 1f9b h ARG 342 Cb 0.60 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.60 1f9b h ARG 342 CO -0.11 0.23 -1.86 0.39 -1.07 0.00 0.00 179.97 177.54 1f9b n GLU 343 N -3.45 0.65 -0.35 0.04 1.02 -0.48 -4.94 120.64 113.13 1f9b n GLU 343 Ca -0.00 0.23 -0.05 0.00 -0.02 0.00 0.00 57.16 57.31 1f9b n GLU 343 Cb 0.41 -1.73 0.04 0.00 -0.02 0.00 0.00 31.44 30.14 1f9b n GLU 343 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1f9b n ARG 344 N -2.98 -0.27 -3.58 3.49 1.85 -0.89 -4.99 116.66 109.29 1f9b n ARG 344 Ca -0.21 -0.38 -0.15 0.00 -1.00 0.00 0.00 57.85 56.12 1f9b n ARG 344 Cb 1.08 -0.25 -0.13 0.00 -1.05 0.00 0.00 32.46 32.10 1f9b n ARG 344 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1f9b s VAL 345 N -1.53 -0.39 -0.27 8.89 1.01 -0.95 -4.99 120.40 122.16 1f9b s VAL 345 Ca 0.14 0.12 -0.19 0.00 0.00 0.00 0.00 61.98 62.05 1f9b s VAL 345 Cb -0.00 -0.55 -0.02 0.00 0.00 0.00 0.00 36.38 35.81 1f9b s VAL 345 CO 0.10 -0.01 0.56 -0.69 0.00 0.00 0.00 175.10 175.06 1f9b s VAL 346 N 2.39 5.02 0.02 2.92 1.01 -1.26 -1.40 120.40 129.11 1f9b s VAL 346 Ca 0.04 0.89 -0.10 0.00 0.00 0.00 0.00 61.98 62.82 1f9b s VAL 346 Cb -0.14 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.30 1f9b s VAL 346 CO -0.10 0.01 0.34 0.86 0.00 0.00 0.00 175.10 176.20 1f9b s TRP 347 N 2.42 3.62 -0.41 5.22 -0.11 0.15 0.84 118.94 130.67 1f9b s TRP 347 Ca 0.23 0.76 -0.13 0.00 1.22 0.00 0.00 56.10 58.18 1f9b s TRP 347 Cb -0.15 -2.12 0.04 0.00 -1.50 0.00 0.00 33.47 29.73 1f9b s TRP 347 CO 0.10 0.60 0.27 0.00 -4.62 0.00 0.00 176.95 173.30 1f9b s ALA 349 N 1.60 3.43 -0.76 0.00 0.00 0.17 -4.78 121.76 121.41 1f9b s ALA 349 Ca 0.03 -0.03 -0.18 0.00 0.00 0.00 0.00 51.96 51.78 1f9b s ALA 349 Cb -0.20 -2.77 0.13 0.00 0.00 0.00 0.00 23.12 20.27 1f9b s ALA 349 CO 0.07 0.01 0.90 0.08 0.00 0.00 0.00 175.76 176.82 1f9b s VAL 350 N 0.49 4.86 0.00 0.00 1.01 -1.26 -2.19 120.40 123.30 1f9b s VAL 350 Ca 0.31 -1.37 0.00 0.00 0.00 0.00 0.00 61.98 60.92 1f9b s VAL 350 Cb -0.17 -4.62 0.00 0.00 0.00 0.00 0.00 36.38 31.60 1f9b s VAL 350 CO 0.15 -1.29 0.00 0.61 0.00 0.00 0.00 175.10 174.57 1f9b n GLY 351 N 5.14 0.12 0.39 4.51 0.00 0.33 -4.46 105.19 111.22 1f9b n GLY 351 Ca 0.07 -1.72 -0.05 0.00 0.00 0.00 0.00 46.02 44.32 1f9b n GLY 351 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1f9b h PRO 352 N 0.00 -0.06 -0.09 1.61 0.13 -1.92 -1.56 132.00 130.11 1f9b h PRO 352 Ca 0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.10 1f9b h PRO 352 Cb 0.00 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.14 1f9b h PRO 352 CO 0.00 -0.04 -0.10 0.93 -0.23 0.00 0.00 178.00 178.56 1f9b h GLU 353 N -0.06 0.13 0.14 0.86 5.08 -1.98 -2.61 114.58 116.14 1f9b h GLU 353 Ca 0.26 -0.02 -0.28 0.00 -1.00 0.00 0.00 59.36 58.32 1f9b h GLU 353 Cb 0.55 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.78 1f9b h GLU 353 CO -0.89 0.23 -1.28 0.93 -1.00 0.00 0.00 179.01 177.00 1f9b h GLU 354 N 0.12 0.30 -0.86 2.33 5.08 -1.53 -3.16 114.58 116.87 1f9b h GLU 354 Ca 0.03 -0.51 -0.01 0.00 -1.00 0.00 0.00 59.36 57.87 1f9b h GLU 354 Cb 0.25 0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.65 1f9b h GLU 354 CO 0.01 1.24 0.51 1.49 -1.00 0.00 0.00 179.01 181.26 1f9b h GLU 355 N 0.08 1.18 0.30 2.33 4.81 -1.08 0.12 114.58 122.31 1f9b h GLU 355 Ca -0.15 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 58.95 1f9b h GLU 355 Cb 2.00 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 31.14 1f9b h GLU 355 CO 0.21 0.83 -0.14 0.00 -0.73 0.00 0.00 179.01 179.18 1f9b h ARG 356 N 1.19 -0.38 -0.82 1.92 3.08 -1.54 0.17 114.38 118.00 1f9b h ARG 356 Ca 0.31 0.03 0.13 0.00 0.07 0.00 0.00 59.98 60.51 1f9b h ARG 356 Cb -0.03 0.09 -0.09 0.00 0.08 0.00 0.00 29.97 30.02 1f9b h ARG 356 CO -0.06 -0.12 0.42 -0.22 -1.07 0.00 0.00 179.97 178.92 1f9b h LYS 357 N -0.61 0.62 -0.32 0.04 3.64 -1.45 0.47 116.57 118.96 1f9b h LYS 357 Ca -0.04 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.32 1f9b h LYS 357 Cb 0.44 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 1f9b h LYS 357 CO 0.07 0.41 0.18 0.00 -2.27 0.00 0.00 179.45 177.83 1f9b h LYS 359 N 0.36 0.85 -0.35 0.00 1.79 0.29 0.75 116.57 120.26 1f9b h LYS 359 Ca 0.13 -0.05 -0.08 0.00 -2.18 0.00 0.00 60.65 58.46 1f9b h LYS 359 Cb 0.02 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 30.46 1f9b h LYS 359 CO -0.07 0.56 -0.10 1.96 -1.08 0.00 0.00 179.45 180.72 1f9b h GLN 360 N 0.87 0.69 0.00 3.15 4.20 0.00 -1.76 115.11 122.26 1f9b h GLN 360 Ca 0.48 -0.27 -0.04 0.00 0.06 0.00 0.00 58.65 58.88 1f9b h GLN 360 Cb 0.53 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.27 1f9b h GLN 360 CO -0.29 0.86 -0.17 2.35 -0.67 0.00 0.00 178.83 180.91 1f9b h TRP 361 N 0.48 0.00 0.55 2.96 7.01 0.23 -1.70 115.95 125.48 1f9b h TRP 361 Ca 0.09 0.00 -0.03 0.00 2.11 0.00 0.00 58.89 61.06 1f9b h TRP 361 Cb 0.62 0.00 0.01 0.00 -2.10 0.00 0.00 29.16 27.68 1f9b h TRP 361 CO 0.05 0.17 -0.26 1.03 -2.79 0.00 0.00 178.44 176.64 1f9b h SER 362 N 0.00 -0.62 -0.17 2.65 0.87 0.81 -2.89 113.55 114.20 1f9b h SER 362 Ca -0.00 0.02 0.04 0.00 -1.23 0.00 0.00 61.79 60.62 1f9b h SER 362 Cb 0.34 0.16 -0.07 0.00 -0.44 0.00 0.00 62.40 62.39 1f9b h SER 362 CO 0.02 -0.22 -0.45 0.44 -0.53 0.00 0.00 176.83 176.10 1f9b h ASP 363 N -1.20 -1.42 -0.06 6.23 3.32 -1.12 -0.86 116.42 121.31 1f9b h ASP 363 Ca -0.08 0.19 0.02 0.00 0.02 0.00 0.00 57.03 57.18 1f9b h ASP 363 Cb 0.57 0.58 -0.00 0.00 0.22 0.00 0.00 39.33 40.69 1f9b h ASP 363 CO 0.12 -0.43 0.21 0.58 -1.72 0.00 0.00 179.24 178.01 1f9b h VAL 364 N -0.49 0.13 -0.02 -1.35 2.07 -1.42 0.65 116.25 115.82 1f9b h VAL 364 Ca 0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.60 1f9b h VAL 364 Cb 0.63 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 1f9b h VAL 364 CO -0.43 0.00 -0.07 -1.54 0.02 0.00 0.00 177.57 175.55 1f9b n SER 365 N -3.20 2.21 -3.29 0.57 3.41 -0.35 -4.93 113.62 108.04 1f9b n SER 365 Ca -0.01 -1.69 -0.18 0.00 -0.26 0.00 0.00 58.87 56.73 1f9b n SER 365 Cb 0.29 0.06 0.08 0.00 -0.26 0.00 0.00 64.21 64.38 1f9b n SER 365 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1f9b n ASN 366 N 0.64 -3.66 -2.39 4.04 5.15 0.22 -3.11 115.26 116.16 1f9b n ASN 366 Ca 0.15 -0.54 -0.18 0.00 -0.60 0.00 0.00 54.58 53.41 1f9b n ASN 366 Cb 0.48 -4.74 -0.01 0.00 -0.53 0.00 0.00 39.78 34.98 1f9b n ASN 366 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1f9b n ARG 367 N -4.20 -1.88 0.18 1.20 1.74 -1.10 -4.83 116.66 107.77 1f9b n ARG 367 Ca -0.16 0.86 0.06 0.00 -0.77 0.00 0.00 57.85 57.84 1f9b n ARG 367 Cb 0.62 -5.49 0.24 0.00 -1.02 0.00 0.00 32.46 26.81 1f9b n ARG 367 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1f9b h LYS 368 N 0.00 0.00 -5.49 5.56 1.57 -1.80 -3.43 116.57 112.98 1f9b h LYS 368 Ca -0.42 0.00 -0.63 0.00 -1.87 0.00 0.00 60.65 57.74 1f9b h LYS 368 Cb 1.30 0.00 -0.32 0.00 0.08 0.00 0.00 32.23 33.29 1f9b h LYS 368 CO 0.49 0.35 -0.86 0.08 -0.57 0.00 0.00 179.45 178.95 1f9b s VAL 369 N -3.33 1.76 0.29 0.50 1.01 -1.26 -2.23 120.40 117.14 1f9b s VAL 369 Ca 0.02 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.15 1f9b s VAL 369 Cb 0.09 -1.51 -0.06 0.00 0.00 0.00 0.00 36.38 34.90 1f9b s VAL 369 CO 0.69 0.49 0.04 0.00 0.00 0.00 0.00 175.10 176.33 1f9b s ALA 370 N 0.09 2.16 0.22 5.51 0.00 -0.49 -4.26 121.76 124.99 1f9b s ALA 370 Ca -0.08 -1.96 0.09 0.00 0.00 0.00 0.00 51.96 50.01 1f9b s ALA 370 Cb -0.14 0.65 -0.05 0.00 0.00 0.00 0.00 23.12 23.58 1f9b s ALA 370 CO 0.04 -0.30 -0.17 0.00 0.00 0.00 0.00 175.76 175.33 1f9b s ALA 372 N -2.58 -0.02 0.05 0.00 0.00 0.36 -4.87 121.76 114.70 1f9b s ALA 372 Ca 0.24 -0.47 -0.00 0.00 0.00 0.00 0.00 51.96 51.73 1f9b s ALA 372 Cb -0.03 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.20 1f9b s ALA 372 CO 0.10 -0.20 -0.04 -1.54 0.00 0.00 0.00 175.76 174.08 1f9b s SER 373 N -1.56 0.52 0.15 0.00 1.04 -1.26 0.42 113.70 113.01 1f9b s SER 373 Ca -0.14 -0.81 -0.11 0.00 0.48 0.00 0.00 55.95 55.37 1f9b s SER 373 Cb -0.08 0.14 0.00 0.00 0.10 0.00 0.00 66.02 66.19 1f9b s SER 373 CO -0.01 -0.46 0.32 0.00 0.98 0.00 0.00 173.24 174.07 1f9b s ALA 374 N -2.94 -0.33 -0.52 5.32 0.00 -0.93 -4.94 121.76 117.42 1f9b s ALA 374 Ca -0.01 -0.61 0.24 0.00 0.00 0.00 0.00 51.96 51.58 1f9b s ALA 374 Cb 0.01 0.75 0.44 0.00 0.00 0.00 0.00 23.12 24.33 1f9b s ALA 374 CO -0.06 -0.64 1.57 0.77 0.00 0.00 0.00 175.76 177.40 1f9b h SER 375 N 2.51 0.00 -5.18 0.00 0.02 -1.93 0.95 113.55 109.92 1f9b h SER 375 Ca -0.32 -0.02 -0.13 0.00 -0.84 0.00 0.00 61.79 60.48 1f9b h SER 375 Cb 1.23 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 63.61 1f9b h SER 375 CO 0.48 0.01 -0.68 0.42 -1.14 0.00 0.00 176.83 175.91 1f9b s THR 376 N -3.19 0.19 0.45 -2.27 -4.23 -1.26 -4.59 115.64 100.75 1f9b s THR 376 Ca 0.07 -1.60 0.21 0.00 -1.18 0.00 0.00 61.69 59.20 1f9b s THR 376 Cb 0.08 -1.22 0.24 0.00 1.34 0.00 0.00 72.50 72.95 1f9b s THR 376 CO 0.67 -0.88 2.05 0.74 -0.54 0.00 0.00 174.62 176.66 1f9b h THR 377 N 3.51 0.85 -0.13 3.99 2.02 -1.91 -2.17 112.91 119.07 1f9b h THR 377 Ca -0.34 -0.52 -0.23 0.00 0.77 0.00 0.00 66.41 66.10 1f9b h THR 377 Cb 1.16 1.30 0.01 0.00 -1.74 0.00 0.00 68.15 68.88 1f9b h THR 377 CO 0.60 0.14 -0.81 -0.33 0.37 0.00 0.00 175.52 175.49 1f9b h GLU 378 N 0.00 0.75 -0.31 6.66 4.39 -1.98 -2.74 114.58 121.35 1f9b h GLU 378 Ca -0.00 -0.63 -0.01 0.00 0.34 0.00 0.00 59.36 59.06 1f9b h GLU 378 Cb 0.29 0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 1f9b h GLU 378 CO 0.02 1.24 0.16 0.93 -1.16 0.00 0.00 179.01 180.20 1f9b h GLU 379 N 0.50 0.41 -0.33 2.33 5.08 -1.82 -1.05 114.58 119.71 1f9b h GLU 379 Ca -0.06 -0.04 -0.16 0.00 -1.00 0.00 0.00 59.36 58.10 1f9b h GLU 379 Cb 1.44 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.60 1f9b h GLU 379 CO 0.16 0.31 -0.42 0.00 -1.00 0.00 0.00 179.01 178.07 1f9b h ILE 381 N 0.65 1.21 -0.11 0.00 2.04 -1.10 0.23 117.51 120.43 1f9b h ILE 381 Ca 0.04 -0.73 0.01 0.00 1.00 0.00 0.00 64.86 65.18 1f9b h ILE 381 Cb 1.01 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 1f9b h ILE 381 CO 0.10 0.28 0.01 0.00 0.00 0.00 0.00 178.15 178.54 1f9b h ALA 382 N 1.39 0.10 -0.54 1.87 0.00 -1.00 0.21 119.26 121.29 1f9b h ALA 382 Ca 0.18 0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.20 1f9b h ALA 382 Cb 0.23 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.99 1f9b h ALA 382 CO -0.01 -0.45 0.18 -0.07 0.00 0.00 0.00 179.25 178.90 1f9b h LEU 383 N 0.05 0.16 -1.14 0.00 3.38 -0.45 0.23 115.31 117.54 1f9b h LEU 383 Ca 0.05 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1f9b h LEU 383 Cb 0.05 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 1f9b h LEU 383 CO -0.07 0.11 0.42 0.58 0.09 0.00 0.00 178.44 179.57 1f9b h VAL 384 N 0.35 1.21 -0.04 1.22 2.07 -0.11 0.11 116.25 121.07 1f9b h VAL 384 Ca 0.27 -0.51 -0.19 0.00 0.82 0.00 0.00 66.70 67.09 1f9b h VAL 384 Cb 0.32 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1f9b h VAL 384 CO -0.29 0.23 -0.78 -0.07 0.02 0.00 0.00 177.57 176.68 1f9b h LEU 385 N 1.03 0.39 -0.98 2.57 3.38 0.52 -2.95 115.31 119.27 1f9b h LEU 385 Ca 0.26 -0.27 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1f9b h LEU 385 Cb -0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1f9b h LEU 385 CO -0.05 1.03 -0.41 0.11 0.09 0.00 0.00 178.44 179.21 1f9b h LYS 386 N 0.20 0.00 0.00 1.13 1.57 -0.30 -2.86 116.57 116.31 1f9b h LYS 386 Ca -0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1f9b h LYS 386 Cb 1.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.68 1f9b h LYS 386 CO 0.13 0.41 0.00 0.41 -0.57 0.00 0.00 179.45 179.83 1f9b n GLY 387 N 0.13 1.00 0.56 3.86 0.00 -0.30 -3.88 105.19 106.56 1f9b n GLY 387 Ca -0.01 -0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.14 1f9b n GLY 387 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1f9b n GLU 388 N -2.00 1.63 -3.81 1.61 1.02 0.23 -4.90 120.64 114.43 1f9b n GLU 388 Ca 0.00 -1.14 -0.11 0.00 -0.02 0.00 0.00 57.16 55.90 1f9b n GLU 388 Cb 0.00 -1.48 -0.08 0.00 -0.02 0.00 0.00 31.44 29.87 1f9b n GLU 388 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1f9b s ALA 389 N -2.15 -0.48 -0.17 0.62 0.00 -1.17 -4.88 121.76 113.52 1f9b s ALA 389 Ca 0.30 -0.20 0.16 0.00 0.00 0.00 0.00 51.96 52.22 1f9b s ALA 389 Cb 0.20 0.32 -0.22 0.00 0.00 0.00 0.00 23.12 23.42 1f9b s ALA 389 CO 0.39 -0.40 0.07 -0.25 0.00 0.00 0.00 175.76 175.57 1f9b n ASP 390 N 0.55 0.66 -3.31 0.00 8.00 0.25 -4.38 116.55 118.32 1f9b n ASP 390 Ca -0.18 0.00 -0.05 0.00 0.71 0.00 0.00 54.79 55.27 1f9b n ASP 390 Cb 0.60 0.97 0.01 0.00 -0.02 0.00 0.00 41.12 42.68 1f9b n ASP 390 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1f9b s ALA 391 N -2.46 -1.36 -0.20 2.24 0.00 -1.03 -4.29 121.76 114.66 1f9b s ALA 391 Ca -0.09 -0.39 -0.29 0.00 0.00 0.00 0.00 51.96 51.19 1f9b s ALA 391 Cb 0.05 0.73 0.14 0.00 0.00 0.00 0.00 23.12 24.04 1f9b s ALA 391 CO 0.72 -1.04 1.06 -0.48 0.00 0.00 0.00 175.76 176.02 1f9b s LEU 392 N -3.24 -0.34 -0.11 0.00 0.05 -1.21 -1.18 118.68 112.64 1f9b s LEU 392 Ca 0.19 0.44 -0.26 0.00 0.05 0.00 0.00 54.13 54.55 1f9b s LEU 392 Cb -0.03 1.76 -0.02 0.00 -2.05 0.00 0.00 46.19 45.84 1f9b s LEU 392 CO 0.07 -0.26 0.84 0.21 -0.55 0.00 0.00 176.35 176.66 1f9b s ASN 393 N -0.79 7.07 0.21 1.48 2.47 -1.26 -2.48 114.94 121.63 1f9b s ASN 393 Ca 0.01 1.30 0.11 0.00 0.42 0.00 0.00 52.86 54.70 1f9b s ASN 393 Cb -0.02 -2.47 -0.05 0.00 -1.45 0.00 0.00 41.25 37.26 1f9b s ASN 393 CO -0.02 -0.31 -0.22 -0.76 -3.72 0.00 0.00 177.10 172.08 1f9b s LEU 394 N 1.58 2.47 0.43 3.21 1.43 -0.13 -4.91 118.68 122.76 1f9b s LEU 394 Ca 0.42 -0.91 -0.21 0.00 -1.03 0.00 0.00 54.13 52.40 1f9b s LEU 394 Cb -0.18 -1.09 -0.11 0.00 0.03 0.00 0.00 46.19 44.84 1f9b s LEU 394 CO 0.17 0.07 0.95 -0.62 0.23 0.00 0.00 176.35 177.15 1f9b s ASP 395 N -2.87 6.92 0.49 2.29 2.15 -1.26 -0.85 116.67 123.54 1f9b s ASP 395 Ca 0.22 1.67 0.39 0.00 0.43 0.00 0.00 52.55 55.26 1f9b s ASP 395 Cb -0.07 -2.53 1.56 0.00 -0.30 0.00 0.00 42.92 41.58 1f9b s ASP 395 CO 0.10 -0.37 1.62 1.23 -0.17 0.00 0.00 175.17 177.58 1f9b h GLY 396 N 1.86 0.69 0.86 2.66 0.00 -1.80 0.44 103.07 107.78 1f9b h GLY 396 Ca -0.49 -0.06 -0.11 0.00 0.00 0.00 0.00 47.33 46.67 1f9b h GLY 396 CO 0.61 -0.22 -0.31 -1.33 0.00 0.00 0.00 176.54 175.29 1f9b h GLY 397 N 0.04 0.58 1.66 4.60 0.00 -1.91 -3.13 103.07 104.91 1f9b h GLY 397 Ca 0.85 -0.67 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1f9b h GLY 397 CO -0.23 0.60 -0.18 0.69 0.00 0.00 0.00 176.54 177.42 1f9b n PHE 398 N -4.35 0.10 -0.26 5.60 3.72 0.14 -2.85 117.46 119.56 1f9b n PHE 398 Ca -0.06 0.03 -0.07 0.00 -0.05 0.00 0.00 57.45 57.30 1f9b n PHE 398 Cb 0.48 -0.47 0.05 0.00 -0.94 0.00 0.00 39.48 38.60 1f9b n PHE 398 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 1f9b h ILE 399 N 0.00 1.25 0.11 4.37 2.04 -1.11 -0.88 117.51 123.30 1f9b h ILE 399 Ca 0.00 -0.83 0.02 0.00 1.00 0.00 0.00 64.86 65.05 1f9b h ILE 399 Cb 0.53 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 37.01 1f9b h ILE 399 CO 0.00 0.33 -0.33 0.22 0.00 0.00 0.00 178.15 178.37 1f9b h TYR 400 N 1.05 -0.91 -0.49 1.37 3.20 -1.51 1.06 116.97 120.74 1f9b h TYR 400 Ca 0.24 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.13 1f9b h TYR 400 Cb 0.25 0.39 -0.02 0.00 1.54 0.00 0.00 36.73 38.88 1f9b h TYR 400 CO 0.02 -0.44 0.32 0.28 -1.64 0.00 0.00 178.16 176.70 1f9b h VAL 401 N -0.55 1.13 -0.20 1.81 2.07 -1.53 0.18 116.25 119.16 1f9b h VAL 401 Ca 0.03 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 1f9b h VAL 401 Cb 0.59 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1f9b h VAL 401 CO -0.20 0.13 0.12 0.00 0.02 0.00 0.00 177.57 177.63 1f9b h ALA 402 N 1.17 0.25 -0.31 1.67 0.00 -0.84 -1.40 119.26 119.81 1f9b h ALA 402 Ca 0.18 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.07 1f9b h ALA 402 Cb -0.07 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1f9b h ALA 402 CO -0.04 -0.23 0.21 0.78 0.00 0.00 0.00 179.25 179.96 1f9b h GLY 403 N 0.23 0.35 2.00 0.00 0.00 0.16 0.37 103.07 106.18 1f9b h GLY 403 Ca 0.07 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1f9b h GLY 403 CO -0.01 0.11 0.00 0.50 0.00 0.00 0.00 176.54 177.14 1f9b h LYS 404 N 0.32 0.00 -0.33 4.80 1.79 0.36 -3.12 116.57 120.39 1f9b h LYS 404 Ca 0.13 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.60 1f9b h LYS 404 Cb 0.11 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.76 1f9b h LYS 404 CO -0.03 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 178.34 1f9b n GLY 406 N 1.28 0.79 3.89 0.00 0.00 -0.98 -4.98 105.19 105.18 1f9b n GLY 406 Ca 0.17 -0.19 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 1f9b n GLY 406 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1f9b s LEU 407 N 0.00 4.31 0.07 0.99 1.43 -0.53 -4.63 118.68 120.31 1f9b s LEU 407 Ca 0.00 0.65 0.08 0.00 -1.03 0.00 0.00 54.13 53.83 1f9b s LEU 407 Cb 0.00 -3.12 -0.03 0.00 0.03 0.00 0.00 46.19 43.06 1f9b s LEU 407 CO 0.00 0.12 -0.19 0.68 0.23 0.00 0.00 176.35 177.18 1f9b s VAL 408 N -1.53 2.70 -0.07 -1.59 -7.23 -0.20 -3.85 120.40 108.64 1f9b s VAL 408 Ca 0.37 -1.32 -0.29 0.00 -1.81 0.00 0.00 61.98 58.92 1f9b s VAL 408 Cb -0.13 -2.16 -0.02 0.00 0.56 0.00 0.00 36.38 34.63 1f9b s VAL 408 CO 0.21 0.27 0.99 -2.16 -0.31 0.00 0.00 175.10 174.10 1f9b s PRO 409 N -1.63 4.46 -0.02 4.82 0.04 -1.26 -1.81 135.00 139.61 1f9b s PRO 409 Ca 0.15 1.38 -0.01 0.00 0.04 0.00 0.00 61.00 62.57 1f9b s PRO 409 Cb -0.10 -3.51 -0.00 0.00 0.04 0.00 0.00 34.50 30.92 1f9b s PRO 409 CO 0.06 -0.22 -0.01 0.28 0.04 0.00 0.00 177.00 177.15 1f9b h VAL 410 N 5.00 0.00 -3.84 -0.36 2.07 -1.32 -3.47 116.25 114.33 1f9b h VAL 410 Ca -0.34 -0.15 -0.32 0.00 0.82 0.00 0.00 66.70 66.71 1f9b h VAL 410 Cb 1.17 0.00 -0.19 0.00 -1.52 0.00 0.00 31.29 30.75 1f9b h VAL 410 CO 0.82 0.00 -0.74 -0.76 0.02 0.00 0.00 177.57 176.91 1f9b s LEU 411 N -4.86 2.35 0.02 2.57 1.43 -1.25 -4.58 118.68 114.36 1f9b s LEU 411 Ca -0.01 -0.72 0.06 0.00 -1.03 0.00 0.00 54.13 52.43 1f9b s LEU 411 Cb 0.00 -0.29 -0.03 0.00 0.03 0.00 0.00 46.19 45.90 1f9b s LEU 411 CO 0.02 -0.23 -0.14 0.00 0.23 0.00 0.00 176.35 176.23 1f9b s ALA 412 N -2.01 2.72 0.08 4.21 0.00 -0.37 0.12 121.76 126.51 1f9b s ALA 412 Ca 0.00 -1.12 -0.31 0.00 0.00 0.00 0.00 51.96 50.53 1f9b s ALA 412 Cb -0.06 -0.87 -0.08 0.00 0.00 0.00 0.00 23.12 22.11 1f9b s ALA 412 CO 0.00 0.58 1.56 -1.21 0.00 0.00 0.00 175.76 176.70 1f9b s GLU 413 N -1.36 4.23 -0.31 0.00 2.02 -0.84 0.02 118.70 122.46 1f9b s GLU 413 Ca 0.15 2.24 0.02 0.00 0.02 0.00 0.00 54.97 57.40 1f9b s GLU 413 Cb -0.11 -3.49 0.08 0.00 0.10 0.00 0.00 34.13 30.72 1f9b s GLU 413 CO 0.05 -0.65 -0.00 1.21 0.02 0.00 0.00 175.26 175.89 1f9b s ASN 414 N 1.97 4.72 0.88 -0.19 3.84 -1.06 -4.70 114.94 120.39 1f9b s ASN 414 Ca 0.70 -1.71 -0.10 0.00 0.21 0.00 0.00 52.86 51.96 1f9b s ASN 414 Cb -0.39 -1.63 0.12 0.00 -0.55 0.00 0.00 41.25 38.80 1f9b s ASN 414 CO 0.31 -0.30 1.13 0.00 -2.79 0.00 0.00 177.10 175.44 1f9b s GLN 415 N 1.06 1.35 -0.09 0.43 0.00 -1.26 -0.52 119.66 120.63 1f9b s GLN 415 Ca 0.00 1.41 -0.30 0.00 -0.00 0.00 0.00 55.36 56.47 1f9b s GLN 415 Cb -0.20 -1.78 -0.36 0.00 0.00 0.00 0.00 33.01 30.68 1f9b s GLN 415 CO -0.05 -2.36 1.63 1.63 0.00 0.00 0.00 175.29 176.14 1f9b n LYS 416 N -4.03 0.11 -0.24 9.60 5.02 0.29 -4.51 118.16 124.40 1f9b n LYS 416 Ca 0.11 -1.08 -0.31 0.00 -2.02 0.00 0.00 58.31 55.01 1f9b n LYS 416 Cb 0.52 -2.58 0.30 0.00 -0.02 0.00 0.00 35.03 33.25 1f9b n LYS 416 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1f9b s SER 417 N 6.92 -1.57 -0.24 4.39 0.01 -1.26 -5.03 113.70 116.92 1f9b s SER 417 Ca 0.69 0.85 -0.01 0.00 1.31 0.00 0.00 55.95 58.79 1f9b s SER 417 Cb 0.14 -1.19 0.07 0.00 0.21 0.00 0.00 66.02 65.25 1f9b s SER 417 CO 0.33 -5.67 0.01 -1.10 0.41 0.00 0.00 173.24 167.22 1f9b s GLN 418 N -5.07 1.08 0.00 12.44 1.11 -1.26 -4.81 119.66 123.15 1f9b s GLN 418 Ca 0.68 -0.84 0.00 0.00 0.01 0.00 0.00 55.36 55.22 1f9b s GLN 418 Cb -0.13 -2.32 0.00 0.00 -1.01 0.00 0.00 33.01 29.55 1f9b s GLN 418 CO 0.58 -0.70 0.00 0.09 0.01 0.00 0.00 175.29 175.26 1f9b n ASN 419 N 4.83 0.00 -3.22 5.90 3.02 -1.26 -5.07 115.26 119.46 1f9b n ASN 419 Ca -0.08 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.45 1f9b n ASN 419 Cb 0.45 0.20 -0.02 0.00 -0.61 0.00 0.00 39.78 39.80 1f9b n ASN 419 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1f9b s SER 420 N 0.80 -1.02 -0.63 6.41 1.04 -1.26 -5.07 113.70 113.96 1f9b s SER 420 Ca 0.00 -0.59 -0.04 0.00 0.48 0.00 0.00 55.95 55.80 1f9b s SER 420 Cb 0.00 1.72 -0.05 0.00 0.10 0.00 0.00 66.02 67.78 1f9b s SER 420 CO 0.00 -0.23 1.91 0.59 0.98 0.00 0.00 173.24 176.48 1f9b n ASN 421 N 4.75 3.78 0.00 7.02 3.02 -1.26 -4.49 115.26 128.08 1f9b n ASN 421 Ca 0.08 -2.21 0.00 0.00 -0.03 0.00 0.00 54.58 52.42 1f9b n ASN 421 Cb 0.54 -0.93 0.00 0.00 -0.61 0.00 0.00 39.78 38.78 1f9b n ASN 421 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1f9b n ALA 422 N 4.10 0.00 0.68 5.41 0.00 -1.26 -4.89 120.51 124.54 1f9b n ALA 422 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.78 1f9b n ALA 422 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.61 1f9b n ALA 422 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1f9b n PRO 423 N 0.00 0.39 -0.29 0.00 -0.04 -1.26 -3.47 135.00 130.33 1f9b n PRO 423 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1f9b n PRO 423 Cb 0.00 -1.05 0.13 0.00 -0.04 0.00 0.00 33.50 32.54 1f9b n PRO 423 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1f9b h ASP 424 N 0.16 0.75 -0.28 3.54 5.19 -1.90 -3.34 116.42 120.53 1f9b h ASP 424 Ca 0.00 0.02 0.03 0.00 -0.62 0.00 0.00 57.03 56.46 1f9b h ASP 424 Cb 0.05 -0.13 -0.03 0.00 0.18 0.00 0.00 39.33 39.39 1f9b h ASP 424 CO 0.00 0.48 -0.17 0.00 -3.12 0.00 0.00 179.24 176.43 1f9b h VAL 426 N 0.00 0.00 0.00 0.00 2.07 -1.84 -1.23 116.25 115.25 1f9b h VAL 426 Ca 0.05 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.57 1f9b h VAL 426 Cb 0.12 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1f9b h VAL 426 CO -0.27 0.00 0.00 1.41 0.02 0.00 0.00 177.57 178.73 1f9b n HIS 427 N -2.49 0.00 -2.23 1.57 8.25 0.50 -1.72 115.22 119.10 1f9b n HIS 427 Ca -0.02 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.02 1f9b n HIS 427 Cb 0.08 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.16 1f9b n HIS 427 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 1f9b s ARG 428 N -0.17 4.36 0.15 -0.41 3.52 0.61 -4.92 118.95 122.09 1f9b s ARG 428 Ca 0.00 2.00 -0.31 0.00 -0.13 0.00 0.00 55.73 57.29 1f9b s ARG 428 Cb 0.00 -3.26 -0.11 0.00 -1.56 0.00 0.00 34.95 30.02 1f9b s ARG 428 CO 0.00 -0.36 1.79 -2.14 -0.81 0.00 0.00 175.30 173.78 1f9b s PRO 429 N 0.87 4.14 0.50 5.12 0.02 -1.26 -4.79 135.00 139.60 1f9b s PRO 429 Ca 0.62 2.59 -0.23 0.00 0.02 0.00 0.00 61.00 63.99 1f9b s PRO 429 Cb -0.35 -3.45 -0.06 0.00 0.02 0.00 0.00 34.50 30.65 1f9b s PRO 429 CO 0.31 -0.81 1.41 -2.30 -0.33 0.00 0.00 177.00 175.28 1f9b n PRO 430 N 5.21 1.99 0.00 5.54 -0.02 -1.26 -4.93 135.00 141.52 1f9b n PRO 430 Ca 0.17 0.72 0.02 0.00 -2.02 0.00 0.00 63.50 62.39 1f9b n PRO 430 Cb 0.37 -2.62 -0.01 0.00 -0.02 0.00 0.00 33.50 31.22 1f9b n PRO 430 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1f9b n GLU 431 N -0.64 4.37 -0.11 -0.52 0.28 -1.26 -5.09 120.64 117.67 1f9b n GLU 431 Ca 0.08 -0.17 0.01 0.00 -0.16 0.00 0.00 57.16 56.92 1f9b n GLU 431 Cb 0.43 -0.77 -0.00 0.00 1.43 0.00 0.00 31.44 32.53 1f9b n GLU 431 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1f9b n GLY 432 N 0.89 -1.52 3.20 -1.84 0.00 -1.26 -4.97 105.19 99.69 1f9b n GLY 432 Ca 0.01 -1.50 -0.16 0.00 0.00 0.00 0.00 46.02 44.37 1f9b n GLY 432 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1f9b s TYR 433 N -1.39 1.19 -0.22 1.61 -0.85 -1.12 -4.96 117.35 111.61 1f9b s TYR 433 Ca 0.00 -0.60 -0.17 0.00 -0.52 0.00 0.00 57.07 55.79 1f9b s TYR 433 Cb 0.00 -0.64 -0.03 0.00 0.38 0.00 0.00 41.96 41.66 1f9b s TYR 433 CO 0.00 0.06 0.45 -0.51 -1.52 0.00 0.00 175.55 174.03 1f9b s LEU 434 N -2.37 4.11 0.24 -3.49 1.43 -1.26 -1.46 118.68 115.88 1f9b s LEU 434 Ca 0.06 0.52 -0.30 0.00 -1.03 0.00 0.00 54.13 53.38 1f9b s LEU 434 Cb -0.04 -2.58 -0.09 0.00 0.03 0.00 0.00 46.19 43.51 1f9b s LEU 434 CO 0.01 -0.16 0.98 0.00 0.23 0.00 0.00 176.35 177.41 1f9b s ALA 435 N 1.72 3.35 0.20 4.21 0.00 -0.39 -2.04 121.76 128.80 1f9b s ALA 435 Ca 0.20 0.68 -0.00 0.00 0.00 0.00 0.00 51.96 52.84 1f9b s ALA 435 Cb -0.15 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.68 1f9b s ALA 435 CO 0.09 0.11 0.09 0.14 0.00 0.00 0.00 175.76 176.19 1f9b s VAL 436 N -1.09 0.26 -0.25 0.00 -7.23 0.66 -1.94 120.40 110.80 1f9b s VAL 436 Ca 0.42 -1.98 -0.07 0.00 -1.81 0.00 0.00 61.98 58.54 1f9b s VAL 436 Cb -0.27 -2.40 -0.02 0.00 0.56 0.00 0.00 36.38 34.25 1f9b s VAL 436 CO 0.34 -0.15 0.06 0.00 -0.31 0.00 0.00 175.10 175.03 1f9b s ALA 437 N -3.97 3.10 -0.08 1.32 0.00 -1.26 -0.99 121.76 119.89 1f9b s ALA 437 Ca 0.34 -1.18 0.03 0.00 0.00 0.00 0.00 51.96 51.15 1f9b s ALA 437 Cb 0.07 -2.04 -0.02 0.00 0.00 0.00 0.00 23.12 21.13 1f9b s ALA 437 CO 0.09 -0.54 -0.18 0.08 0.00 0.00 0.00 175.76 175.21 1f9b s VAL 438 N 1.58 2.68 0.06 0.00 1.01 0.26 -0.31 120.40 125.69 1f9b s VAL 438 Ca 0.06 -0.83 -0.04 0.00 0.00 0.00 0.00 61.98 61.17 1f9b s VAL 438 Cb -0.15 -2.05 -0.02 0.00 0.00 0.00 0.00 36.38 34.15 1f9b s VAL 438 CO 0.03 0.56 0.05 0.68 0.00 0.00 0.00 175.10 176.42 1f9b s VAL 439 N -0.18 0.19 0.44 2.92 -7.23 -0.43 -1.29 120.40 114.81 1f9b s VAL 439 Ca -0.01 -1.55 -0.23 0.00 -1.81 0.00 0.00 61.98 58.37 1f9b s VAL 439 Cb -0.13 -1.43 -0.08 0.00 0.56 0.00 0.00 36.38 35.29 1f9b s VAL 439 CO 0.03 -0.86 1.09 -0.13 -0.31 0.00 0.00 175.10 174.92 1f9b s ARG 440 N -3.86 3.94 0.20 4.82 0.52 -1.26 -1.29 118.95 122.02 1f9b s ARG 440 Ca 0.06 1.57 -0.12 0.00 -0.52 0.00 0.00 55.73 56.73 1f9b s ARG 440 Cb 0.07 -2.40 0.24 0.00 0.52 0.00 0.00 34.95 33.37 1f9b s ARG 440 CO -0.10 -0.35 1.70 -0.22 0.02 0.00 0.00 175.30 176.35 1f9b h LYS 441 N 2.14 0.22 0.00 3.54 1.63 -0.40 -3.11 116.57 120.59 1f9b h LYS 441 Ca -0.49 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.30 1f9b h LYS 441 Cb 1.23 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.81 1f9b h LYS 441 CO 0.61 0.14 0.00 0.45 -3.45 0.00 0.00 179.45 177.20 1f9b n SER 442 N -5.14 0.00 -4.58 4.20 2.88 -1.26 -2.83 113.62 106.88 1f9b n SER 442 Ca 0.07 0.96 -0.17 0.00 -1.33 0.00 0.00 58.87 58.40 1f9b n SER 442 Cb 0.29 -0.48 -0.10 0.00 -0.75 0.00 0.00 64.21 63.16 1f9b n SER 442 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1f9b s ASP 443 N -3.00 3.73 0.05 -3.46 1.11 -1.18 -4.49 116.67 109.43 1f9b s ASP 443 Ca 0.00 -1.06 0.26 0.00 0.18 0.00 0.00 52.55 51.93 1f9b s ASP 443 Cb 0.00 -2.59 0.64 0.00 1.07 0.00 0.00 42.92 42.04 1f9b s ASP 443 CO 0.00 -4.44 1.52 0.00 1.18 0.00 0.00 175.17 173.44 1f9b n ALA 444 N 18.72 3.04 0.07 5.23 0.00 -1.13 -3.44 120.51 142.99 1f9b n ALA 444 Ca 0.42 -0.25 -0.01 0.00 0.00 0.00 0.00 53.44 53.60 1f9b n ALA 444 Cb 0.47 -1.23 0.25 0.00 0.00 0.00 0.00 19.45 18.94 1f9b n ALA 444 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1f9b h ASP 445 N 0.00 0.34 -2.90 0.00 5.19 -1.89 -3.44 116.42 113.72 1f9b h ASP 445 Ca 0.00 -0.11 -0.53 0.00 -0.62 0.00 0.00 57.03 55.77 1f9b h ASP 445 Cb 0.58 -0.09 0.02 0.00 0.18 0.00 0.00 39.33 40.02 1f9b h ASP 445 CO 0.00 0.61 0.82 -0.22 -3.12 0.00 0.00 179.24 177.33 1f9b s LEU 446 N -8.55 4.36 0.19 1.55 2.96 -1.22 -4.99 118.68 112.97 1f9b s LEU 446 Ca -0.06 2.36 0.00 0.00 -0.22 0.00 0.00 54.13 56.21 1f9b s LEU 446 Cb 0.14 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 43.21 1f9b s LEU 446 CO 0.77 -0.73 0.07 0.28 -1.32 0.00 0.00 176.35 175.42 1f9b s THR 447 N 1.61 0.34 0.30 3.68 -1.32 -1.26 -5.02 115.64 113.96 1f9b s THR 447 Ca 0.67 -1.97 0.01 0.00 -1.21 0.00 0.00 61.69 59.19 1f9b s THR 447 Cb -0.37 -2.31 0.28 0.00 -1.51 0.00 0.00 72.50 68.59 1f9b s THR 447 CO 0.30 -0.25 1.90 -0.25 -2.21 0.00 0.00 174.62 174.10 1f9b h TRP 448 N 2.65 1.07 -0.02 9.09 2.91 -1.82 -1.26 115.95 128.56 1f9b h TRP 448 Ca -0.36 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.68 1f9b h TRP 448 Cb 1.22 -0.35 0.00 0.00 -0.51 0.00 0.00 29.16 29.52 1f9b h TRP 448 CO 0.45 0.53 0.00 0.09 -1.03 0.00 0.00 178.44 178.48 1f9b n ASN 449 N -4.51 0.13 -0.21 2.65 4.13 -1.26 -3.15 115.26 113.05 1f9b n ASN 449 Ca 0.15 -1.86 0.05 0.00 1.68 0.00 0.00 54.58 54.60 1f9b n ASN 449 Cb 0.23 -0.01 0.08 0.00 -1.54 0.00 0.00 39.78 38.53 1f9b n ASN 449 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1f9b n SER 450 N -0.50 1.42 0.18 6.41 3.41 -0.48 -4.79 113.62 119.28 1f9b n SER 450 Ca 0.04 -2.54 0.02 0.00 -0.26 0.00 0.00 58.87 56.13 1f9b n SER 450 Cb 0.04 -0.30 0.34 0.00 -0.26 0.00 0.00 64.21 64.03 1f9b n SER 450 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1f9b h LEU 451 N 0.00 0.00 -8.60 1.04 3.38 -1.57 -3.44 115.31 106.12 1f9b h LEU 451 Ca 0.00 0.00 -0.71 0.00 0.09 0.00 0.00 57.88 57.26 1f9b h LEU 451 Cb 1.10 0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.92 1f9b h LEU 451 CO 0.00 0.40 -0.17 -0.24 0.09 0.00 0.00 178.44 178.52 1f9b n SER 452 N -4.03 -0.49 -0.93 -0.43 2.88 -1.26 -0.28 113.62 109.07 1f9b n SER 452 Ca -0.02 1.10 -0.12 0.00 -1.33 0.00 0.00 58.87 58.50 1f9b n SER 452 Cb 0.43 -0.89 -0.05 0.00 -0.75 0.00 0.00 64.21 62.95 1f9b n SER 452 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1f9b n GLY 453 N 1.63 1.10 3.98 0.46 0.00 0.13 -4.91 105.19 107.58 1f9b n GLY 453 Ca 0.18 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.00 1f9b n GLY 453 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f9b s LYS 454 N -2.93 3.01 0.20 1.61 -0.14 0.61 -4.00 119.74 118.10 1f9b s LYS 454 Ca 0.00 -0.89 -0.24 0.00 -1.36 0.00 0.00 55.97 53.48 1f9b s LYS 454 Cb 0.00 -2.72 -0.08 0.00 -1.68 0.00 0.00 37.83 33.35 1f9b s LYS 454 CO 0.00 -0.14 0.78 0.15 -0.76 0.00 0.00 175.35 175.38 1f9b s LYS 455 N -4.35 4.49 0.05 1.68 1.02 -1.26 -1.82 119.74 119.54 1f9b s LYS 455 Ca 0.48 1.10 0.07 0.00 0.02 0.00 0.00 55.97 57.64 1f9b s LYS 455 Cb -0.10 -3.11 -0.02 0.00 -0.52 0.00 0.00 37.83 34.08 1f9b s LYS 455 CO 0.34 0.50 -0.18 -1.54 -0.92 0.00 0.00 175.35 173.54 1f9b s SER 456 N -1.33 2.20 -0.21 2.83 1.04 -0.54 -1.25 113.70 116.45 1f9b s SER 456 Ca 0.39 -0.51 -0.03 0.00 0.48 0.00 0.00 55.95 56.28 1f9b s SER 456 Cb -0.21 -0.17 -0.01 0.00 0.10 0.00 0.00 66.02 65.73 1f9b s SER 456 CO 0.25 0.11 -0.05 0.00 0.98 0.00 0.00 173.24 174.52 1f9b s HIS 458 N 1.31 1.83 0.47 0.00 3.76 0.55 -2.33 115.29 120.87 1f9b s HIS 458 Ca 0.04 -0.53 0.19 0.00 -0.15 0.00 0.00 55.06 54.60 1f9b s HIS 458 Cb -0.14 -1.23 1.17 0.00 1.11 0.00 0.00 32.58 33.49 1f9b s HIS 458 CO -0.02 -0.18 1.96 1.79 -0.85 0.00 0.00 174.74 177.44 1f9b h THR 459 N 5.23 0.80 0.00 1.30 1.35 -1.79 -3.38 112.91 116.42 1f9b h THR 459 Ca -0.32 -0.09 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 1f9b h THR 459 Cb 1.17 0.51 0.00 0.00 -1.73 0.00 0.00 68.15 68.10 1f9b h THR 459 CO 0.48 0.05 0.00 0.61 -0.25 0.00 0.00 175.52 176.41 1f9b n GLY 460 N -1.56 2.89 3.81 5.82 0.00 -1.26 -2.85 105.19 112.04 1f9b n GLY 460 Ca 0.12 -1.00 -0.36 0.00 0.00 0.00 0.00 46.02 44.77 1f9b n GLY 460 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1f9b s VAL 461 N -2.00 4.43 0.00 1.61 -7.23 -1.03 -3.62 120.40 112.55 1f9b s VAL 461 Ca 0.00 1.47 0.00 0.00 -1.81 0.00 0.00 61.98 61.64 1f9b s VAL 461 Cb 0.00 -3.87 0.00 0.00 0.56 0.00 0.00 36.38 33.07 1f9b s VAL 461 CO 0.00 0.09 0.00 0.61 -0.31 0.00 0.00 175.10 175.49 1f9b n GLY 462 N 0.43 3.15 3.84 2.32 0.00 -1.26 -5.00 105.19 108.67 1f9b n GLY 462 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 1f9b n GLY 462 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1f9b s ARG 463 N -0.43 4.07 0.00 1.61 0.52 -1.24 -4.29 118.95 119.18 1f9b s ARG 463 Ca 0.00 0.81 0.00 0.00 -0.52 0.00 0.00 55.73 56.02 1f9b s ARG 463 Cb 0.00 -2.34 0.00 0.00 0.52 0.00 0.00 34.95 33.13 1f9b s ARG 463 CO 0.00 0.08 0.70 2.41 0.02 0.00 0.00 175.30 178.52 1f9b n THR 464 N -0.50 0.00 -0.27 0.02 -1.04 -1.26 -1.19 114.28 110.05 1f9b n THR 464 Ca 0.05 1.19 0.04 0.00 -2.04 0.00 0.00 64.05 63.29 1f9b n THR 464 Cb 0.53 -2.17 0.13 0.00 -1.82 0.00 0.00 70.33 67.00 1f9b n THR 464 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1f9b h ALA 465 N -2.00 0.66 -3.00 2.41 0.00 -1.96 -1.76 119.26 113.61 1f9b h ALA 465 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1f9b h ALA 465 Cb 0.00 0.51 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1f9b h ALA 465 CO 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 179.25 178.82 1f9b n ALA 466 N -3.12 0.00 0.00 0.00 0.00 -1.26 -4.44 120.51 111.69 1f9b n ALA 466 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1f9b n ALA 466 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 1f9b n ALA 466 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1f9b n TRP 467 N 0.00 0.00 -0.22 0.00 -0.00 -1.18 -2.43 117.44 113.61 1f9b n TRP 467 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 57.50 57.51 1f9b n TRP 467 Cb 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 31.31 31.41 1f9b n TRP 467 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 177.69 176.78 1f9b h ASN 468 N 0.00 -0.46 -0.13 5.87 2.35 -1.25 0.10 115.58 122.05 1f9b h ASN 468 Ca 0.00 0.18 -0.12 0.00 -0.55 0.00 0.00 56.30 55.81 1f9b h ASN 468 Cb 0.00 0.35 0.00 0.00 0.05 0.00 0.00 38.32 38.73 1f9b h ASN 468 CO 0.00 -0.18 -0.39 0.40 -1.65 0.00 0.00 177.43 175.61 1f9b h ILE 469 N 0.05 1.36 0.05 2.81 1.08 -0.96 -1.83 117.51 120.07 1f9b h ILE 469 Ca 0.34 -1.68 -0.00 0.00 -0.39 0.00 0.00 64.86 63.12 1f9b h ILE 469 Cb 0.54 2.08 0.00 0.00 -3.07 0.00 0.00 36.82 36.37 1f9b h ILE 469 CO -0.63 0.50 -0.02 1.55 -0.69 0.00 0.00 178.15 178.86 1f9b h PRO 470 N 0.10 -0.06 -0.63 2.37 0.13 -1.63 -2.90 132.00 129.39 1f9b h PRO 470 Ca -0.01 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 65.27 1f9b h PRO 470 Cb 1.01 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.12 1f9b h PRO 470 CO 0.08 0.54 0.43 0.52 -0.23 0.00 0.00 178.00 179.35 1f9b h MET 471 N -0.91 0.20 -0.36 0.86 2.86 -0.94 0.43 114.93 117.07 1f9b h MET 471 Ca -0.01 -0.01 -0.15 0.00 -2.06 0.00 0.00 59.70 57.47 1f9b h MET 471 Cb 0.63 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.24 1f9b h MET 471 CO 0.01 0.13 -0.36 0.78 1.06 0.00 0.00 176.91 178.54 1f9b h GLY 472 N 0.21 0.92 0.88 8.32 0.00 -1.41 -1.28 103.07 110.71 1f9b h GLY 472 Ca 0.30 -0.91 -0.11 0.00 0.00 0.00 0.00 47.33 46.61 1f9b h GLY 472 CO -0.06 0.82 -0.30 1.41 0.00 0.00 0.00 176.54 178.41 1f9b h LEU 473 N 0.70 0.61 -0.44 3.11 3.38 -0.02 -3.13 115.31 119.53 1f9b h LEU 473 Ca 0.06 -0.52 -0.08 0.00 0.09 0.00 0.00 57.88 57.43 1f9b h LEU 473 Cb 0.93 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 1f9b h LEU 473 CO 0.09 1.01 -0.03 -0.07 0.09 0.00 0.00 178.44 179.52 1f9b h LEU 474 N 0.23 0.79 -2.46 1.67 3.38 -1.04 -2.57 115.31 115.32 1f9b h LEU 474 Ca 0.02 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.67 1f9b h LEU 474 Cb 0.88 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 1f9b h LEU 474 CO 0.07 0.93 0.17 0.15 0.09 0.00 0.00 178.44 179.85 1f9b h PHE 475 N 0.64 0.00 0.07 1.13 3.57 -1.26 0.22 116.94 121.30 1f9b h PHE 475 Ca 0.12 0.00 -0.26 0.00 3.53 0.00 0.00 57.97 61.36 1f9b h PHE 475 Cb 0.54 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.27 1f9b h PHE 475 CO 0.04 0.00 -1.31 -0.97 -2.23 0.00 0.00 178.31 173.84 1f9b h ASN 476 N 0.00 0.22 0.69 0.41 -1.24 -1.40 -2.68 115.58 111.58 1f9b h ASN 476 Ca 0.02 -0.27 -0.23 0.00 0.71 0.00 0.00 56.30 56.53 1f9b h ASN 476 Cb 0.36 -0.07 -0.04 0.00 0.73 0.00 0.00 38.32 39.30 1f9b h ASN 476 CO -0.00 1.22 -1.45 1.56 -1.29 0.00 0.00 177.43 177.48 1f9b h GLN 477 N 0.04 0.00 0.00 6.67 7.50 -0.59 -3.38 115.11 125.35 1f9b h GLN 477 Ca -0.15 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.00 1f9b h GLN 477 Cb 1.92 0.00 0.00 0.00 0.05 0.00 0.00 27.48 29.45 1f9b h GLN 477 CO 0.15 0.48 -1.73 0.25 -1.50 0.00 0.00 178.83 176.49 1f9b n THR 478 N -3.04 0.09 -1.42 -0.54 -2.24 0.22 -5.00 114.28 102.35 1f9b n THR 478 Ca -0.11 -0.45 -0.14 0.00 -2.27 0.00 0.00 64.05 61.08 1f9b n THR 478 Cb 0.95 0.06 -0.06 0.00 -2.10 0.00 0.00 70.33 69.17 1f9b n THR 478 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f9b n GLY 479 N 1.28 1.43 3.30 3.38 0.00 -1.01 -4.97 105.19 108.59 1f9b n GLY 479 Ca -0.02 -0.11 -0.25 0.00 0.00 0.00 0.00 46.02 45.63 1f9b n GLY 479 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1f9b s SER 480 N -2.64 2.69 0.00 1.61 0.15 -1.26 -5.01 113.70 109.24 1f9b s SER 480 Ca 0.00 -0.67 0.26 0.00 0.70 0.00 0.00 55.95 56.25 1f9b s SER 480 Cb 0.00 -0.17 0.70 0.00 -1.71 0.00 0.00 66.02 64.84 1f9b s SER 480 CO 0.00 0.10 1.53 0.00 1.20 0.00 0.00 173.24 176.08 1f9b s LYS 482 N -2.39 3.36 0.22 0.00 1.02 -1.26 -4.71 119.74 115.99 1f9b s LYS 482 Ca 0.26 -1.43 0.08 0.00 0.02 0.00 0.00 55.97 54.90 1f9b s LYS 482 Cb 0.19 -5.38 0.18 0.00 -0.52 0.00 0.00 37.83 32.31 1f9b s LYS 482 CO 0.49 -2.83 1.51 0.74 -0.92 0.00 0.00 175.35 174.34 1f9b h PHE 483 N 8.96 0.05 0.00 3.18 0.04 -2.02 -3.16 116.94 123.98 1f9b h PHE 483 Ca 0.30 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 61.05 1f9b h PHE 483 Cb 0.93 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.07 1f9b h PHE 483 CO 1.32 0.75 0.00 -0.40 -0.60 0.00 0.00 178.31 179.38 1f9b n ASP 484 N -3.69 0.00 -0.03 2.17 5.75 -1.26 -3.22 116.55 116.26 1f9b n ASP 484 Ca -0.01 -0.13 0.07 0.00 -0.01 0.00 0.00 54.79 54.71 1f9b n ASP 484 Cb 0.71 -0.25 -0.07 0.00 -1.03 0.00 0.00 41.12 40.47 1f9b n ASP 484 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1f9b n LYS 485 N -1.25 2.22 -0.03 0.11 5.02 -1.20 -4.52 118.16 118.52 1f9b n LYS 485 Ca 0.12 -0.07 -0.15 0.00 -2.02 0.00 0.00 58.31 56.18 1f9b n LYS 485 Cb 0.17 -1.18 -0.11 0.00 -0.02 0.00 0.00 35.03 33.89 1f9b n LYS 485 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 1f9b h PHE 486 N 0.16 0.33 -3.16 2.13 3.04 -1.65 -3.43 116.94 114.36 1f9b h PHE 486 Ca 0.00 -0.16 -0.59 0.00 3.98 0.00 0.00 57.97 61.20 1f9b h PHE 486 Cb 0.35 -0.04 -0.06 0.00 2.56 0.00 0.00 35.95 38.76 1f9b h PHE 486 CO 0.00 0.92 -0.17 -0.06 -2.02 0.00 0.00 178.31 176.98 1f9b s PHE 487 N -3.37 3.65 0.17 0.41 0.08 -1.26 0.20 117.98 117.86 1f9b s PHE 487 Ca -0.15 0.96 -0.16 0.00 0.12 0.00 0.00 56.93 57.70 1f9b s PHE 487 Cb 0.02 -2.40 0.12 0.00 -0.57 0.00 0.00 43.02 40.19 1f9b s PHE 487 CO 0.75 0.46 1.70 0.66 -0.10 0.00 0.00 175.22 178.69 1f9b h SER 488 N 5.48 -0.14 -5.09 1.36 4.64 -1.49 -3.45 113.55 114.86 1f9b h SER 488 Ca -0.47 0.09 -0.08 0.00 -0.47 0.00 0.00 61.79 60.86 1f9b h SER 488 Cb 1.20 0.16 -0.15 0.00 -0.31 0.00 0.00 62.40 63.30 1f9b h SER 488 CO 0.67 -0.04 -0.21 -1.10 -0.87 0.00 0.00 176.83 175.28 1f9b s GLN 489 N -6.18 0.91 0.27 4.77 -0.21 -1.26 -4.96 119.66 113.01 1f9b s GLN 489 Ca -0.13 -0.69 -0.20 0.00 0.02 0.00 0.00 55.36 54.36 1f9b s GLN 489 Cb 0.14 0.39 0.02 0.00 1.00 0.00 0.00 33.01 34.56 1f9b s GLN 489 CO 0.71 -0.32 0.67 -1.12 -2.12 0.00 0.00 175.29 173.12 1f9b s SER 490 N -2.52 -0.24 -0.13 5.90 0.01 -0.54 -1.46 113.70 114.71 1f9b s SER 490 Ca 0.00 -0.64 -0.00 0.00 1.31 0.00 0.00 55.95 56.62 1f9b s SER 490 Cb 0.02 0.70 0.03 0.00 0.21 0.00 0.00 66.02 66.97 1f9b s SER 490 CO -0.08 -1.30 -0.08 0.00 0.41 0.00 0.00 173.24 172.19 1f9b s ALA 492 N 1.66 -0.57 0.38 0.00 0.00 -0.64 -0.33 121.76 122.25 1f9b s ALA 492 Ca 0.04 -0.89 -0.26 0.00 0.00 0.00 0.00 51.96 50.85 1f9b s ALA 492 Cb -0.13 -2.10 -0.11 0.00 0.00 0.00 0.00 23.12 20.77 1f9b s ALA 492 CO -0.08 -2.14 1.19 -2.30 0.00 0.00 0.00 175.76 172.42 1f9b n PRO 493 N 4.26 1.79 0.00 0.00 -0.02 -1.26 -2.78 135.00 136.99 1f9b n PRO 493 Ca 0.11 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1f9b n PRO 493 Cb 0.46 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 1f9b n PRO 493 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1f9b n GLY 494 N 0.93 0.28 1.83 -1.23 0.00 0.20 -2.47 105.19 104.74 1f9b n GLY 494 Ca 0.07 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.94 1f9b n GLY 494 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f9b n ALA 495 N -1.76 -1.16 -2.29 4.61 0.00 -1.12 -4.94 120.51 113.85 1f9b n ALA 495 Ca 0.00 -0.84 -0.43 0.00 0.00 0.00 0.00 53.44 52.18 1f9b n ALA 495 Cb 0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 19.45 19.38 1f9b n ALA 495 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1f9b s ASP 496 N -3.22 6.86 0.54 0.00 2.15 -1.26 -4.89 116.67 116.86 1f9b s ASP 496 Ca 0.36 1.88 0.34 0.00 0.43 0.00 0.00 52.55 55.56 1f9b s ASP 496 Cb -0.02 -2.54 1.51 0.00 -0.30 0.00 0.00 42.92 41.58 1f9b s ASP 496 CO 0.26 -0.80 1.84 1.55 -0.17 0.00 0.00 175.17 177.85 1f9b h PRO 497 N 8.55 0.00 -0.01 4.34 0.13 -1.92 -0.58 132.00 142.50 1f9b h PRO 497 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1f9b h PRO 497 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1f9b h PRO 497 CO 0.96 0.00 -0.05 1.04 -0.23 0.00 0.00 178.00 179.72 1f9b n GLN 498 N -4.17 1.31 -2.93 0.86 6.02 -1.26 -4.75 117.38 112.46 1f9b n GLN 498 Ca 0.22 -0.64 -0.21 0.00 -0.01 0.00 0.00 57.00 56.36 1f9b n GLN 498 Cb 1.11 -1.49 0.02 0.00 1.02 0.00 0.00 30.24 30.90 1f9b n GLN 498 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1f9b s SER 499 N -2.14 5.62 0.49 1.08 1.04 -0.23 -4.98 113.70 114.58 1f9b s SER 499 Ca 0.36 0.01 0.15 0.00 0.48 0.00 0.00 55.95 56.95 1f9b s SER 499 Cb 0.21 -1.12 1.16 0.00 0.10 0.00 0.00 66.02 66.37 1f9b s SER 499 CO 0.39 -0.84 2.09 0.28 0.98 0.00 0.00 173.24 176.14 1f9b h SER 500 N 0.38 0.02 -0.09 7.02 0.02 -1.87 -0.96 113.55 118.07 1f9b h SER 500 Ca -0.44 -0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.54 1f9b h SER 500 Cb 1.27 -0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.81 1f9b h SER 500 CO 0.53 0.08 0.10 -0.07 -1.14 0.00 0.00 176.83 176.33 1f9b h LEU 501 N 0.02 0.00 -2.37 5.07 3.38 -1.85 -1.15 115.31 118.40 1f9b h LEU 501 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1f9b h LEU 501 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1f9b h LEU 501 CO 0.01 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.54 1f9b h ALA 503 N 3.46 0.00 -0.00 0.00 0.00 -0.53 -3.03 119.26 119.17 1f9b h ALA 503 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1f9b h ALA 503 Cb 0.84 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1f9b h ALA 503 CO 0.00 -0.51 -0.03 1.28 0.00 0.00 0.00 179.25 179.99 1f9b n LEU 504 N -5.13 0.03 -4.40 0.00 4.77 -0.51 -4.87 117.00 106.89 1f9b n LEU 504 Ca -0.06 0.45 -0.29 0.00 -0.03 0.00 0.00 56.01 56.08 1f9b n LEU 504 Cb 0.06 -0.47 0.25 0.00 -2.33 0.00 0.00 43.42 40.93 1f9b n LEU 504 CO 0.31 0.01 0.22 0.00 -1.33 0.00 0.00 177.39 176.60 1f9b n VAL 506 N -4.94 0.00 -3.88 0.00 0.31 -1.26 -4.91 118.33 103.66 1f9b n VAL 506 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 1f9b n VAL 506 Cb 0.56 -0.01 0.00 0.00 -0.91 0.00 0.00 33.84 33.48 1f9b n VAL 506 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1f9b n GLY 507 N 0.46 -1.81 0.00 2.92 0.00 -1.26 -4.55 105.19 100.95 1f9b n GLY 507 Ca 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.63 1f9b n GLY 507 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1f9b n ASN 508 N 0.50 -0.05 -0.15 1.61 0.23 -0.06 -1.63 115.26 115.70 1f9b n ASN 508 Ca 0.00 -0.36 -0.09 0.00 -0.53 0.00 0.00 54.58 53.61 1f9b n ASN 508 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 1f9b n ASN 508 CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 1f9b h ASN 509 N -0.05 0.61 -0.51 0.53 2.35 -1.88 -2.70 115.58 113.94 1f9b h ASN 509 Ca 0.00 -0.16 -0.26 0.00 -0.55 0.00 0.00 56.30 55.33 1f9b h ASN 509 Cb 0.00 -0.16 -0.15 0.00 0.05 0.00 0.00 38.32 38.06 1f9b h ASN 509 CO 0.00 0.60 0.33 -0.62 -1.65 0.00 0.00 177.43 176.09 1f9b n GLU 510 N -4.61 1.69 -2.38 0.81 1.02 -1.26 -4.88 120.64 111.01 1f9b n GLU 510 Ca 0.01 -1.55 -0.16 0.00 -0.02 0.00 0.00 57.16 55.44 1f9b n GLU 510 Cb 0.14 -1.61 -0.01 0.00 -0.02 0.00 0.00 31.44 29.93 1f9b n GLU 510 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1f9b n ASN 511 N -0.32 -4.76 -4.91 1.62 3.02 -1.02 -5.00 115.26 103.88 1f9b n ASN 511 Ca 0.30 0.12 -0.24 0.00 -0.03 0.00 0.00 54.58 54.73 1f9b n ASN 511 Cb 1.09 -4.01 -0.03 0.00 -0.61 0.00 0.00 39.78 36.22 1f9b n ASN 511 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1f9b s GLU 512 N -4.97 3.28 -0.83 3.52 0.41 -1.26 -4.60 118.70 114.25 1f9b s GLU 512 Ca 0.00 -0.76 -0.01 0.00 -0.41 0.00 0.00 54.97 53.79 1f9b s GLU 512 Cb 0.00 -2.83 -0.01 0.00 -1.78 0.00 0.00 34.13 29.51 1f9b s GLU 512 CO 0.00 0.47 0.70 0.09 -0.49 0.00 0.00 175.26 176.02 1f9b n ASN 513 N -0.90 -2.58 -4.74 -0.19 5.03 -1.26 -0.98 115.26 109.63 1f9b n ASN 513 Ca -0.08 -0.45 -0.41 0.00 0.87 0.00 0.00 54.58 54.51 1f9b n ASN 513 Cb 0.56 -3.78 -0.04 0.00 -1.02 0.00 0.00 39.78 35.50 1f9b n ASN 513 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 1f9b s LYS 514 N -4.79 4.60 0.00 3.52 2.20 -1.26 -3.17 119.74 120.84 1f9b s LYS 514 Ca 0.05 1.75 0.00 0.00 -0.36 0.00 0.00 55.97 57.42 1f9b s LYS 514 Cb -0.01 -3.25 0.00 0.00 -1.51 0.00 0.00 37.83 33.06 1f9b s LYS 514 CO 0.52 0.10 0.00 0.00 -0.36 0.00 0.00 175.35 175.60 1f9b s MET 516 N -0.45 4.17 -1.49 0.00 1.75 -1.19 0.61 119.30 122.70 1f9b s MET 516 Ca 0.00 2.48 -0.13 0.00 -1.25 0.00 0.00 55.69 56.79 1f9b s MET 516 Cb 0.00 -3.06 -0.02 0.00 2.84 0.00 0.00 34.83 34.59 1f9b s MET 516 CO 0.00 -0.56 2.50 -0.35 -0.65 0.00 0.00 175.02 175.96 1f9b n PRO 517 N 2.36 3.12 -3.88 4.11 -0.04 -1.26 -4.41 135.00 135.01 1f9b n PRO 517 Ca 0.08 -2.40 -0.05 0.00 -0.04 0.00 0.00 63.50 61.10 1f9b n PRO 517 Cb 0.38 -3.07 0.02 0.00 -0.04 0.00 0.00 33.50 30.80 1f9b n PRO 517 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1f9b s ASN 518 N 2.86 0.03 0.58 3.54 2.20 -1.26 -4.61 114.94 118.28 1f9b s ASN 518 Ca 0.56 -0.84 0.28 0.00 -0.94 0.00 0.00 52.86 51.92 1f9b s ASN 518 Cb 0.15 0.60 1.67 0.00 -2.00 0.00 0.00 41.25 41.67 1f9b s ASN 518 CO -0.07 -1.20 2.14 0.77 -2.94 0.00 0.00 177.10 175.80 1f9b h SER 519 N 2.00 0.00 -0.26 3.54 4.64 -1.88 -1.64 113.55 119.94 1f9b h SER 519 Ca -0.29 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.10 1f9b h SER 519 Cb 1.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 1f9b h SER 519 CO 0.39 0.00 0.23 -0.33 -0.87 0.00 0.00 176.83 176.25 1f9b h GLU 520 N 0.00 0.00 -5.42 4.77 4.39 -1.94 -3.33 114.58 113.05 1f9b h GLU 520 Ca 0.06 0.00 -0.62 0.00 0.34 0.00 0.00 59.36 59.14 1f9b h GLU 520 Cb 0.34 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 28.86 1f9b h GLU 520 CO -0.00 0.00 0.08 -2.00 -1.16 0.00 0.00 179.01 175.93 1f9b s GLU 521 N -4.80 3.85 0.59 2.33 2.56 -0.62 -0.88 118.70 121.73 1f9b s GLU 521 Ca -0.05 0.19 0.32 0.00 0.00 0.00 0.00 54.97 55.43 1f9b s GLU 521 Cb 0.17 -3.74 1.86 0.00 2.00 0.00 0.00 34.13 34.42 1f9b s GLU 521 CO 0.62 -0.56 2.24 0.00 -0.56 0.00 0.00 175.26 176.99 1f9b h ARG 522 N 8.24 0.00 -0.22 4.30 3.08 -1.42 -1.10 114.38 127.26 1f9b h ARG 522 Ca -0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.78 1f9b h ARG 522 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.17 1f9b h ARG 522 CO 0.78 0.03 0.00 0.66 -1.07 0.00 0.00 179.97 180.37 1f9b n TYR 523 N -3.64 0.27 -2.43 3.04 4.02 -1.26 -4.13 117.16 113.03 1f9b n TYR 523 Ca -0.03 -0.14 -0.33 0.00 -0.01 0.00 0.00 57.90 57.40 1f9b n TYR 523 Cb 0.12 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.41 1f9b n TYR 523 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 1f9b s TYR 524 N -1.73 3.12 0.02 -0.72 5.04 -0.42 -2.43 117.35 120.23 1f9b s TYR 524 Ca 0.34 1.55 0.00 0.00 -2.44 0.00 0.00 57.07 56.52 1f9b s TYR 524 Cb 0.19 -2.97 0.00 0.00 0.35 0.00 0.00 41.96 39.53 1f9b s TYR 524 CO 0.28 -0.72 0.00 0.41 -1.34 0.00 0.00 175.55 174.18 1f9b n GLY 525 N -0.72 -1.33 0.27 8.97 0.00 -1.13 -1.74 105.19 109.51 1f9b n GLY 525 Ca 0.08 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.59 1f9b n GLY 525 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1f9b h TYR 526 N -0.08 0.53 0.50 1.61 0.05 -1.91 0.40 116.97 118.07 1f9b h TYR 526 Ca 0.00 -0.04 -0.02 0.00 0.05 0.00 0.00 58.73 58.71 1f9b h TYR 526 Cb 0.08 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 37.67 1f9b h TYR 526 CO -0.20 0.51 -0.24 1.15 -1.05 0.00 0.00 178.16 178.32 1f9b h THR 527 N 0.50 0.00 -0.83 -2.88 2.02 -1.88 -2.55 112.91 107.29 1f9b h THR 527 Ca 0.11 -0.24 0.10 0.00 0.77 0.00 0.00 66.41 67.15 1f9b h THR 527 Cb 0.28 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 66.64 1f9b h THR 527 CO 0.01 0.00 0.54 1.23 0.37 0.00 0.00 175.52 177.66 1f9b h GLY 528 N -0.92 1.12 2.00 2.16 0.00 -1.14 0.17 103.07 106.46 1f9b h GLY 528 Ca -0.07 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 46.92 1f9b h GLY 528 CO 0.11 0.18 -0.11 0.00 0.00 0.00 0.00 176.54 176.73 1f9b h ALA 529 N 1.59 1.04 0.18 3.60 0.00 0.14 0.40 119.26 126.20 1f9b h ALA 529 Ca 0.38 -0.10 -0.35 0.00 0.00 0.00 0.00 54.91 54.85 1f9b h ALA 529 Cb 0.45 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.23 1f9b h ALA 529 CO -0.15 0.13 -1.77 0.35 0.00 0.00 0.00 179.25 177.81 1f9b h PHE 530 N 0.00 0.68 -0.08 0.00 3.57 -0.33 -3.31 116.94 117.47 1f9b h PHE 530 Ca -0.00 -0.50 0.03 0.00 3.53 0.00 0.00 57.97 61.03 1f9b h PHE 530 Cb 0.59 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.27 1f9b h PHE 530 CO 0.00 1.69 -0.08 -0.09 -2.23 0.00 0.00 178.31 177.60 1f9b h ARG 531 N 0.08 -0.10 -1.35 1.11 2.43 -0.50 0.27 114.38 116.31 1f9b h ARG 531 Ca -0.35 0.01 0.44 0.00 -0.81 0.00 0.00 59.98 59.26 1f9b h ARG 531 Cb 2.07 0.02 -0.13 0.00 -0.42 0.00 0.00 29.97 31.52 1f9b h ARG 531 CO 0.16 -0.07 0.87 0.00 -1.51 0.00 0.00 179.97 179.43 1f9b h LEU 533 N 0.08 0.12 0.31 0.00 5.85 -1.11 -1.53 115.31 119.03 1f9b h LEU 533 Ca 0.83 -0.98 0.00 0.00 0.84 0.00 0.00 57.88 58.57 1f9b h LEU 533 Cb 2.63 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 43.60 1f9b h LEU 533 CO -0.40 1.11 -0.32 0.00 -0.34 0.00 0.00 178.44 178.48 1f9b h ALA 534 N 0.01 -0.68 0.00 1.25 0.00 0.23 -1.17 119.26 118.90 1f9b h ALA 534 Ca -0.04 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1f9b h ALA 534 Cb 1.17 0.47 0.00 0.00 0.00 0.00 0.00 17.79 19.42 1f9b h ALA 534 CO 0.03 -0.92 0.00 0.39 0.00 0.00 0.00 179.25 178.76 1f9b n GLU 535 N -5.44 0.33 -2.94 0.00 1.02 -0.06 -4.79 120.64 108.78 1f9b n GLU 535 Ca -0.09 0.00 -0.19 0.00 -0.02 0.00 0.00 57.16 56.86 1f9b n GLU 535 Cb 0.34 -1.09 0.00 0.00 -0.02 0.00 0.00 31.44 30.67 1f9b n GLU 535 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1f9b n LYS 536 N -0.07 -3.14 0.08 3.49 5.02 -0.44 -4.85 118.16 118.24 1f9b n LYS 536 Ca 0.00 0.59 0.12 0.00 -2.02 0.00 0.00 58.31 57.00 1f9b n LYS 536 Cb 0.04 -5.28 0.14 0.00 -0.02 0.00 0.00 35.03 29.91 1f9b n LYS 536 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1f9b h ALA 537 N 0.99 0.59 -2.65 7.82 0.00 -1.49 -3.48 119.26 121.05 1f9b h ALA 537 Ca -0.39 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.41 1f9b h ALA 537 Cb 1.27 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.94 1f9b h ALA 537 CO 0.46 0.00 -0.33 0.20 0.00 0.00 0.00 179.25 179.58 1f9b s GLY 538 N -3.85 0.56 -0.07 0.00 0.00 -1.01 -4.90 107.32 98.06 1f9b s GLY 538 Ca 0.05 -0.96 0.19 0.00 0.00 0.00 0.00 44.72 44.00 1f9b s GLY 538 CO 0.73 -0.87 0.33 1.22 0.00 0.00 0.00 173.10 174.51 1f9b n ASP 539 N -0.23 0.46 -3.76 1.64 8.00 -0.38 -4.56 116.55 117.72 1f9b n ASP 539 Ca -0.06 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.29 1f9b n ASP 539 Cb 0.63 1.64 -0.16 0.00 -0.02 0.00 0.00 41.12 43.21 1f9b n ASP 539 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1f9b s VAL 540 N -3.12 -0.07 -0.12 2.53 0.11 -1.02 -4.58 120.40 114.14 1f9b s VAL 540 Ca -0.08 0.24 0.01 0.00 -2.93 0.00 0.00 61.98 59.22 1f9b s VAL 540 Cb 0.11 -0.11 -0.01 0.00 -1.53 0.00 0.00 36.38 34.83 1f9b s VAL 540 CO 0.81 0.10 -0.15 0.00 -3.33 0.00 0.00 175.10 172.52 1f9b s ALA 541 N 1.21 2.54 -0.46 1.54 0.00 -0.41 -0.39 121.76 125.79 1f9b s ALA 541 Ca -0.08 -0.91 -0.16 0.00 0.00 0.00 0.00 51.96 50.82 1f9b s ALA 541 Cb -0.13 -1.12 0.06 0.00 0.00 0.00 0.00 23.12 21.93 1f9b s ALA 541 CO -0.03 0.28 0.39 -0.06 0.00 0.00 0.00 175.76 176.33 1f9b s PHE 542 N 0.28 3.23 0.30 0.00 0.08 -0.99 -0.57 117.98 120.31 1f9b s PHE 542 Ca -0.11 -0.82 -0.03 0.00 0.12 0.00 0.00 56.93 56.09 1f9b s PHE 542 Cb -0.16 -3.05 -0.01 0.00 -0.57 0.00 0.00 43.02 39.23 1f9b s PHE 542 CO 0.06 -0.76 0.41 0.14 -0.10 0.00 0.00 175.22 174.96 1f9b s VAL 543 N 1.71 0.00 0.44 -0.44 -7.23 -0.16 -4.01 120.40 110.71 1f9b s VAL 543 Ca 0.05 -1.66 -0.12 0.00 -1.81 0.00 0.00 61.98 58.44 1f9b s VAL 543 Cb -0.23 -2.53 -0.07 0.00 0.56 0.00 0.00 36.38 34.12 1f9b s VAL 543 CO 0.08 0.00 0.83 -1.59 -0.31 0.00 0.00 175.10 174.11 1f9b s LYS 544 N -3.43 3.80 0.18 4.82 -2.85 -1.26 0.24 119.74 121.25 1f9b s LYS 544 Ca 0.31 0.58 -0.16 0.00 -1.00 0.00 0.00 55.97 55.69 1f9b s LYS 544 Cb 0.01 -2.32 0.14 0.00 -2.06 0.00 0.00 37.83 33.60 1f9b s LYS 544 CO 0.18 -0.11 1.64 0.38 0.10 0.00 0.00 175.35 177.54 1f9b h ASP 545 N 1.09 -0.54 -0.30 0.03 2.03 -1.74 -1.10 116.42 115.88 1f9b h ASP 545 Ca -0.47 0.15 0.09 0.00 -0.73 0.00 0.00 57.03 56.07 1f9b h ASP 545 Cb 1.19 0.33 -0.01 0.00 -0.83 0.00 0.00 39.33 40.01 1f9b h ASP 545 CO 0.63 -0.19 0.37 0.58 -1.03 0.00 0.00 179.24 179.60 1f9b h VAL 546 N -0.04 0.35 -0.73 4.15 2.07 -1.93 -2.35 116.25 117.77 1f9b h VAL 546 Ca 0.23 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.69 1f9b h VAL 546 Cb 0.39 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1f9b h VAL 546 CO -0.51 0.00 0.21 0.74 0.02 0.00 0.00 177.57 178.03 1f9b h THR 547 N 0.00 1.26 0.32 2.57 2.02 -1.58 0.31 112.91 117.81 1f9b h THR 547 Ca 0.14 -0.93 -0.02 0.00 0.77 0.00 0.00 66.41 66.38 1f9b h THR 547 Cb 0.87 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 1f9b h THR 547 CO -0.00 0.36 -0.15 0.58 0.37 0.00 0.00 175.52 176.68 1f9b h VAL 548 N 1.09 0.68 -0.90 3.16 2.07 -1.56 -3.10 116.25 117.69 1f9b h VAL 548 Ca 0.23 -0.55 0.22 0.00 0.82 0.00 0.00 66.70 67.42 1f9b h VAL 548 Cb 0.32 0.96 -0.12 0.00 -1.52 0.00 0.00 31.29 30.93 1f9b h VAL 548 CO -0.00 0.11 0.41 -0.07 0.02 0.00 0.00 177.57 178.03 1f9b h LEU 549 N -0.74 0.37 -0.10 2.57 3.38 -1.45 0.25 115.31 119.59 1f9b h LEU 549 Ca -0.04 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1f9b h LEU 549 Cb 0.50 0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1f9b h LEU 549 CO 0.07 0.02 -0.01 0.00 0.09 0.00 0.00 178.44 178.61 1f9b n GLN 550 N -5.02 0.86 -0.03 1.13 6.02 0.06 -3.89 117.38 116.52 1f9b n GLN 550 Ca 0.22 -0.10 0.02 0.00 -0.01 0.00 0.00 57.00 57.13 1f9b n GLN 550 Cb 0.65 -1.50 0.03 0.00 1.02 0.00 0.00 30.24 30.44 1f9b n GLN 550 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1f9b n ASN 551 N -0.98 1.84 -4.52 1.08 3.02 0.06 -4.11 115.26 111.66 1f9b n ASN 551 Ca 0.20 -2.14 -0.27 0.00 -0.03 0.00 0.00 54.58 52.34 1f9b n ASN 551 Cb 0.18 -0.10 -0.10 0.00 -0.61 0.00 0.00 39.78 39.16 1f9b n ASN 551 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1f9b s THR 552 N -1.28 1.32 -1.32 3.41 -4.23 -1.12 -4.54 115.64 107.88 1f9b s THR 552 Ca 0.07 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.54 1f9b s THR 552 Cb 0.06 -2.63 0.02 0.00 1.34 0.00 0.00 72.50 71.29 1f9b s THR 552 CO 0.01 0.00 0.96 0.47 -0.54 0.00 0.00 174.62 175.52 1f9b n ASP 553 N -1.02 -3.24 0.00 3.99 8.00 0.32 -2.76 116.55 121.85 1f9b n ASP 553 Ca -0.08 -0.68 0.00 0.00 0.71 0.00 0.00 54.79 54.74 1f9b n ASP 553 Cb 0.67 -4.64 0.00 0.00 -0.02 0.00 0.00 41.12 37.13 1f9b n ASP 553 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1f9b n GLY 554 N -1.54 0.07 0.34 0.44 0.00 -1.11 -4.81 105.19 98.58 1f9b n GLY 554 Ca -0.17 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 1f9b n GLY 554 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1f9b h LYS 555 N 0.19 1.20 -5.14 1.61 1.57 -1.81 -3.37 116.57 110.82 1f9b h LYS 555 Ca 0.00 -0.18 -0.63 0.00 -1.87 0.00 0.00 60.65 57.97 1f9b h LYS 555 Cb 0.20 -0.21 -0.18 0.00 0.08 0.00 0.00 32.23 32.13 1f9b h LYS 555 CO 0.00 0.93 -0.57 1.21 -0.57 0.00 0.00 179.45 180.45 1f9b s ASN 556 N -6.28 5.60 0.00 0.86 3.04 -1.26 -4.97 114.94 111.93 1f9b s ASN 556 Ca -0.13 0.01 0.21 0.00 0.04 0.00 0.00 52.86 52.99 1f9b s ASN 556 Cb 0.16 -1.98 0.60 0.00 -1.54 0.00 0.00 41.25 38.48 1f9b s ASN 556 CO 0.83 0.09 1.50 -1.54 -3.04 0.00 0.00 177.10 174.94 1f9b n SER 557 N 4.10 3.81 -4.69 -4.21 3.41 -1.26 -2.00 113.62 112.77 1f9b n SER 557 Ca -0.16 -2.00 -0.42 0.00 -0.26 0.00 0.00 58.87 56.03 1f9b n SER 557 Cb 0.52 -0.45 -0.03 0.00 -0.26 0.00 0.00 64.21 63.99 1f9b n SER 557 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1f9b s GLU 558 N -1.00 4.28 0.00 4.33 2.02 -1.26 -4.59 118.70 122.48 1f9b s GLU 558 Ca 0.45 2.02 0.00 0.00 0.02 0.00 0.00 54.97 57.46 1f9b s GLU 558 Cb 0.24 -3.53 0.00 0.00 0.10 0.00 0.00 34.13 30.94 1f9b s GLU 558 CO 0.31 -0.57 0.00 -2.30 0.02 0.00 0.00 175.26 172.72 1f9b n PRO 559 N 5.17 0.00 -0.06 0.39 -0.02 -1.26 0.82 135.00 140.04 1f9b n PRO 559 Ca 0.13 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.65 1f9b n PRO 559 Cb 0.43 0.00 0.39 0.00 -0.02 0.00 0.00 33.50 34.30 1f9b n PRO 559 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 1f9b h TRP 560 N 0.00 0.61 0.00 6.00 5.08 -1.97 -3.32 115.95 122.35 1f9b h TRP 560 Ca 0.00 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.98 1f9b h TRP 560 Cb 0.00 -0.21 0.00 0.00 -3.00 0.00 0.00 29.16 25.95 1f9b h TRP 560 CO 0.00 0.38 0.00 0.00 -1.28 0.00 0.00 178.44 177.54 1f9b n ALA 561 N -2.46 -0.01 0.00 0.11 0.00 0.24 -4.70 120.51 113.68 1f9b n ALA 561 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1f9b n ALA 561 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.52 1f9b n ALA 561 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1f9b n LYS 562 N -0.85 0.00 0.00 0.00 4.81 -0.85 0.90 118.16 122.18 1f9b n LYS 562 Ca 0.00 0.00 0.10 0.00 -0.87 0.00 0.00 58.31 57.54 1f9b n LYS 562 Cb 0.00 0.00 0.58 0.00 0.02 0.00 0.00 35.03 35.63 1f9b n LYS 562 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1f9b n ASP 563 N 0.00 0.00 -4.77 3.14 8.00 -1.26 -2.74 116.55 118.92 1f9b n ASP 563 Ca 0.00 -1.05 -0.37 0.00 0.71 0.00 0.00 54.79 54.07 1f9b n ASP 563 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1f9b n ASP 563 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1f9b s LEU 564 N -1.73 3.99 -0.03 0.64 1.43 0.26 -4.87 118.68 118.37 1f9b s LEU 564 Ca 0.29 2.42 0.02 0.00 -1.03 0.00 0.00 54.13 55.84 1f9b s LEU 564 Cb 0.13 -4.23 0.00 0.00 0.03 0.00 0.00 46.19 42.13 1f9b s LEU 564 CO 0.22 -1.05 -0.09 -0.54 0.23 0.00 0.00 176.35 175.12 1f9b s LYS 565 N -2.72 0.96 0.03 1.70 1.02 -1.26 0.12 119.74 119.59 1f9b s LYS 565 Ca 0.65 -0.29 0.03 0.00 0.02 0.00 0.00 55.97 56.38 1f9b s LYS 565 Cb -0.32 -0.90 0.16 0.00 -0.52 0.00 0.00 37.83 36.26 1f9b s LYS 565 CO 0.38 0.10 1.10 1.04 -0.92 0.00 0.00 175.35 177.05 1f9b n GLN 566 N 3.35 0.01 0.09 1.68 6.02 -1.26 -1.56 117.38 125.70 1f9b n GLN 566 Ca -0.19 0.50 -0.17 0.00 -0.01 0.00 0.00 57.00 57.13 1f9b n GLN 566 Cb 0.54 -1.55 -0.14 0.00 1.02 0.00 0.00 30.24 30.11 1f9b n GLN 566 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1f9b h GLU 567 N 0.00 0.28 0.00 -1.09 4.39 -2.02 -3.24 114.58 112.90 1f9b h GLU 567 Ca 0.00 -0.49 0.00 0.00 0.34 0.00 0.00 59.36 59.21 1f9b h GLU 567 Cb 0.02 0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1f9b h GLU 567 CO 0.00 1.19 0.00 -0.44 -1.16 0.00 0.00 179.01 178.60 1f9b h ASP 568 N 0.08 0.00 -3.69 1.42 3.32 -1.72 -3.43 116.42 112.39 1f9b h ASP 568 Ca -0.20 0.00 -0.68 0.00 0.02 0.00 0.00 57.03 56.17 1f9b h ASP 568 Cb 2.01 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 41.37 1f9b h ASP 568 CO 0.19 0.00 -0.71 -0.36 -1.72 0.00 0.00 179.24 176.64 1f9b s PHE 569 N -3.75 2.86 0.14 4.55 0.08 -1.22 0.34 117.98 120.98 1f9b s PHE 569 Ca -0.03 -0.05 0.01 0.00 0.12 0.00 0.00 56.93 56.99 1f9b s PHE 569 Cb 0.09 -1.63 -0.04 0.00 -0.57 0.00 0.00 43.02 40.87 1f9b s PHE 569 CO 0.31 0.33 -0.01 -1.21 -0.10 0.00 0.00 175.22 174.54 1f9b s GLU 570 N -1.19 0.98 0.13 0.44 2.02 -0.41 -3.47 118.70 117.20 1f9b s GLU 570 Ca 0.15 -1.45 0.07 0.00 0.02 0.00 0.00 54.97 53.76 1f9b s GLU 570 Cb -0.11 -0.16 -0.04 0.00 0.10 0.00 0.00 34.13 33.92 1f9b s GLU 570 CO 0.05 -0.11 -0.04 -0.51 0.02 0.00 0.00 175.26 174.67 1f9b s LEU 571 N -3.11 3.24 -0.39 1.80 1.43 -0.38 -1.31 118.68 119.95 1f9b s LEU 571 Ca 0.20 -0.36 -0.15 0.00 -1.03 0.00 0.00 54.13 52.79 1f9b s LEU 571 Cb 0.06 -1.96 0.01 0.00 0.03 0.00 0.00 46.19 44.34 1f9b s LEU 571 CO 0.00 0.14 0.30 -0.76 0.23 0.00 0.00 176.35 176.27 1f9b s LEU 572 N -2.55 4.93 0.24 1.79 1.43 0.58 -2.77 118.68 122.33 1f9b s LEU 572 Ca 0.25 -0.75 -0.22 0.00 -1.03 0.00 0.00 54.13 52.38 1f9b s LEU 572 Cb -0.10 -2.19 -0.09 0.00 0.03 0.00 0.00 46.19 43.84 1f9b s LEU 572 CO 0.17 -0.41 0.79 0.00 0.23 0.00 0.00 176.35 177.13 1f9b h LEU 574 N 3.54 0.00 -3.64 0.00 3.38 -1.87 -1.92 115.31 114.79 1f9b h LEU 574 Ca -0.47 0.00 -0.43 0.00 0.09 0.00 0.00 57.88 57.07 1f9b h LEU 574 Cb 1.20 0.00 -0.25 0.00 0.09 0.00 0.00 40.66 41.69 1f9b h LEU 574 CO 0.65 0.00 0.55 -0.90 0.09 0.00 0.00 178.44 178.83 1f9b n ASP 575 N -3.22 3.71 0.00 -0.43 5.75 -1.26 -4.89 116.55 116.21 1f9b n ASP 575 Ca 0.00 -3.32 0.00 0.00 -0.01 0.00 0.00 54.79 51.46 1f9b n ASP 575 Cb 0.39 -0.78 0.00 0.00 -1.03 0.00 0.00 41.12 39.69 1f9b n ASP 575 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1f9b n GLY 576 N -0.84 2.81 3.52 6.12 0.00 -0.72 -5.02 105.19 111.06 1f9b n GLY 576 Ca 0.49 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.21 1f9b n GLY 576 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1f9b s THR 577 N -1.08 1.58 -0.11 2.61 2.01 -1.25 -4.47 115.64 114.92 1f9b s THR 577 Ca 0.00 0.00 -0.04 0.00 0.31 0.00 0.00 61.69 61.96 1f9b s THR 577 Cb 0.00 -2.36 0.06 0.00 0.01 0.00 0.00 72.50 70.21 1f9b s THR 577 CO 0.00 0.00 0.23 -0.13 -0.69 0.00 0.00 174.62 174.03 1f9b s ARG 578 N -5.21 0.12 0.26 4.92 0.52 -1.26 -1.66 118.95 116.64 1f9b s ARG 578 Ca 0.70 0.68 0.10 0.00 -0.52 0.00 0.00 55.73 56.69 1f9b s ARG 578 Cb -0.13 -0.10 -0.05 0.00 0.52 0.00 0.00 34.95 35.19 1f9b s ARG 578 CO 0.57 -0.28 -0.17 0.15 0.02 0.00 0.00 175.30 175.59 1f9b s LYS 579 N 2.30 1.58 0.97 3.54 -0.14 -1.11 -4.95 119.74 121.93 1f9b s LYS 579 Ca 0.01 -1.73 -0.11 0.00 -1.36 0.00 0.00 55.97 52.78 1f9b s LYS 579 Cb -0.12 -1.56 0.18 0.00 -1.68 0.00 0.00 37.83 34.65 1f9b s LYS 579 CO -0.08 0.27 1.10 -2.14 -0.76 0.00 0.00 175.35 173.74 1f9b s PRO 580 N -3.56 0.58 0.33 -1.68 0.02 -1.26 -1.25 135.00 128.18 1f9b s PRO 580 Ca 0.28 1.20 0.23 0.00 0.02 0.00 0.00 61.00 62.72 1f9b s PRO 580 Cb -0.03 -1.70 1.21 0.00 0.02 0.00 0.00 34.50 34.00 1f9b s PRO 580 CO 0.13 -2.82 1.69 0.28 -0.33 0.00 0.00 177.00 175.95 1f9b n VAL 581 N -4.33 0.99 1.10 3.83 0.31 -1.23 -0.73 118.33 118.28 1f9b n VAL 581 Ca 0.08 0.72 0.14 0.00 -0.01 0.00 0.00 64.34 65.27 1f9b n VAL 581 Cb 0.53 -1.72 0.65 0.00 -0.91 0.00 0.00 33.84 32.39 1f9b n VAL 581 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1f9b n ALA 582 N -1.79 2.34 0.32 3.52 0.00 -1.26 -3.66 120.51 119.98 1f9b n ALA 582 Ca -0.01 -0.11 0.10 0.00 0.00 0.00 0.00 53.44 53.42 1f9b n ALA 582 Cb 0.04 -1.46 0.26 0.00 0.00 0.00 0.00 19.45 18.30 1f9b n ALA 582 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1f9b n GLU 583 N -1.44 2.31 -0.52 0.00 -0.58 0.09 -4.65 120.64 115.86 1f9b n GLU 583 Ca 0.09 -2.01 0.42 0.00 -0.42 0.00 0.00 57.16 55.24 1f9b n GLU 583 Cb 0.30 -1.46 0.71 0.00 -0.57 0.00 0.00 31.44 30.43 1f9b n GLU 583 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1f9b h ALA 584 N 4.17 3.13 -0.73 0.62 0.00 -1.75 0.07 119.26 124.78 1f9b h ALA 584 Ca 0.00 0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.05 1f9b h ALA 584 Cb 0.79 0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.71 1f9b h ALA 584 CO 0.00 -1.72 0.48 0.93 0.00 0.00 0.00 179.25 178.94 1f9b h GLU 585 N 0.05 0.63 -0.23 0.00 4.39 -1.93 -1.58 114.58 115.91 1f9b h GLU 585 Ca 0.84 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 60.50 1f9b h GLU 585 Cb 2.93 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 31.44 1f9b h GLU 585 CO -0.26 0.42 0.00 0.43 -1.16 0.00 0.00 179.01 178.44 1f9b n SER 586 N -4.49 2.82 -3.03 1.42 7.64 -0.02 -4.74 113.62 113.22 1f9b n SER 586 Ca 0.12 -1.83 -0.18 0.00 1.01 0.00 0.00 58.87 57.99 1f9b n SER 586 Cb 0.32 -0.15 -0.03 0.00 -1.01 0.00 0.00 64.21 63.34 1f9b n SER 586 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1f9b s HIS 588 N -0.40 0.94 0.01 0.00 -0.00 -1.15 -4.50 115.29 110.18 1f9b s HIS 588 Ca 0.34 -1.17 0.02 0.00 -0.00 0.00 0.00 55.06 54.24 1f9b s HIS 588 Cb 0.18 -0.53 -0.25 0.00 -0.00 0.00 0.00 32.58 31.97 1f9b s HIS 588 CO -0.16 -0.43 0.87 -0.07 -0.00 0.00 0.00 174.74 174.94 1f9b h LEU 589 N 2.83 0.24 -7.53 5.38 3.38 -1.71 -3.42 115.31 114.49 1f9b h LEU 589 Ca -0.35 -0.36 0.30 0.00 0.09 0.00 0.00 57.88 57.56 1f9b h LEU 589 Cb 1.20 -0.08 -0.09 0.00 0.09 0.00 0.00 40.66 41.77 1f9b h LEU 589 CO 0.60 1.30 0.80 0.00 0.09 0.00 0.00 178.44 181.23 1f9b s ALA 590 N -2.63 -2.19 -0.28 1.53 0.00 -1.24 -5.03 121.76 111.93 1f9b s ALA 590 Ca -0.07 0.36 -0.01 0.00 0.00 0.00 0.00 51.96 52.25 1f9b s ALA 590 Cb 0.08 0.57 0.05 0.00 0.00 0.00 0.00 23.12 23.81 1f9b s ALA 590 CO 0.84 -1.08 -0.04 0.50 0.00 0.00 0.00 175.76 175.98 1f9b s ARG 591 N -2.35 2.45 0.27 0.00 6.06 -1.26 -1.26 118.95 122.85 1f9b s ARG 591 Ca 0.19 -1.24 0.04 0.00 -2.50 0.00 0.00 55.73 52.22 1f9b s ARG 591 Cb 0.02 -3.07 -0.03 0.00 0.06 0.00 0.00 34.95 31.93 1f9b s ARG 591 CO -0.02 -0.57 0.41 0.00 -2.50 0.00 0.00 175.30 172.62 1f9b s ALA 592 N 1.23 3.90 0.36 6.12 0.00 -0.54 -4.93 121.76 127.90 1f9b s ALA 592 Ca -0.05 -1.18 -0.26 0.00 0.00 0.00 0.00 51.96 50.47 1f9b s ALA 592 Cb -0.19 -1.81 -0.09 0.00 0.00 0.00 0.00 23.12 21.03 1f9b s ALA 592 CO -0.03 0.17 1.07 -2.14 0.00 0.00 0.00 175.76 174.83 1f9b s PRO 593 N -4.06 4.31 0.64 0.00 0.02 -1.26 -2.81 135.00 131.84 1f9b s PRO 593 Ca 0.36 1.62 -0.17 0.00 0.02 0.00 0.00 61.00 62.83 1f9b s PRO 593 Cb -0.09 -2.75 -0.01 0.00 0.02 0.00 0.00 34.50 31.67 1f9b s PRO 593 CO 0.31 -0.04 1.18 -0.80 -0.33 0.00 0.00 177.00 177.32 1f9b s ASN 594 N -1.33 4.95 1.05 2.53 -0.87 -1.26 -4.25 114.94 115.76 1f9b s ASN 594 Ca 0.54 2.28 -0.13 0.00 -1.57 0.00 0.00 52.86 53.97 1f9b s ASN 594 Cb -0.26 -2.58 0.16 0.00 -0.02 0.00 0.00 41.25 38.55 1f9b s ASN 594 CO 0.32 -1.75 0.70 1.41 -2.57 0.00 0.00 177.10 175.22 1f9b n HIS 595 N -2.05 -0.80 -3.60 2.20 8.25 -1.26 -4.56 115.22 113.40 1f9b n HIS 595 Ca 0.13 0.13 -0.14 0.00 -0.26 0.00 0.00 57.72 57.58 1f9b n HIS 595 Cb 0.50 -1.76 -0.06 0.00 1.12 0.00 0.00 29.99 29.79 1f9b n HIS 595 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1f9b s ALA 596 N -2.43 -1.24 0.33 -1.41 0.00 -0.03 -1.98 121.76 115.00 1f9b s ALA 596 Ca 0.63 0.54 -0.26 0.00 0.00 0.00 0.00 51.96 52.87 1f9b s ALA 596 Cb -0.21 0.35 -0.10 0.00 0.00 0.00 0.00 23.12 23.16 1f9b s ALA 596 CO 0.64 -0.48 0.95 0.08 0.00 0.00 0.00 175.76 176.95 1f9b s VAL 597 N -2.37 4.21 0.05 0.00 1.01 0.12 -0.95 120.40 122.46 1f9b s VAL 597 Ca -0.06 1.78 0.02 0.00 0.00 0.00 0.00 61.98 63.72 1f9b s VAL 597 Cb -0.01 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 1f9b s VAL 597 CO -0.01 0.10 -0.06 0.68 0.00 0.00 0.00 175.10 175.80 1f9b s VAL 598 N -1.67 0.47 0.39 2.92 -7.23 -1.04 -0.79 120.40 113.46 1f9b s VAL 598 Ca 0.51 -1.24 -0.15 0.00 -1.81 0.00 0.00 61.98 59.29 1f9b s VAL 598 Cb -0.18 -0.79 0.05 0.00 0.56 0.00 0.00 36.38 36.03 1f9b s VAL 598 CO 0.23 -0.52 0.79 -0.94 -0.31 0.00 0.00 175.10 174.34 1f9b s SER 599 N -1.89 0.03 0.67 4.85 1.04 -0.75 -3.36 113.70 114.30 1f9b s SER 599 Ca -0.06 -1.17 -0.15 0.00 0.48 0.00 0.00 55.95 55.05 1f9b s SER 599 Cb -0.06 0.85 0.01 0.00 0.10 0.00 0.00 66.02 66.92 1f9b s SER 599 CO -0.01 -1.69 1.11 -1.10 0.98 0.00 0.00 173.24 172.53 1f9b s GLN 600 N -2.29 2.72 0.09 4.02 -1.52 -1.26 -1.03 119.66 120.39 1f9b s GLN 600 Ca 0.16 1.38 0.14 0.00 -1.95 0.00 0.00 55.36 55.09 1f9b s GLN 600 Cb -0.05 -1.94 0.61 0.00 -0.22 0.00 0.00 33.01 31.41 1f9b s GLN 600 CO 0.12 -1.31 1.43 -1.13 -0.25 0.00 0.00 175.29 174.14 1f9b n SER 601 N -2.54 0.21 0.24 5.90 3.41 -1.26 -2.36 113.62 117.21 1f9b n SER 601 Ca 0.10 0.57 -0.15 0.00 -0.26 0.00 0.00 58.87 59.13 1f9b n SER 601 Cb 0.52 -0.61 -0.08 0.00 -0.26 0.00 0.00 64.21 63.78 1f9b n SER 601 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1f9b h ASP 602 N 0.00 -0.49 0.05 4.04 3.58 -1.98 -3.33 116.42 118.30 1f9b h ASP 602 Ca 0.00 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.39 1f9b h ASP 602 Cb 0.19 0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.36 1f9b h ASP 602 CO 0.00 -0.24 -0.49 0.54 -2.88 0.00 0.00 179.24 176.17 1f9b n ARG 603 N -5.28 0.97 -0.31 0.28 5.12 -1.10 -4.60 116.66 111.74 1f9b n ARG 603 Ca -0.11 -0.76 0.21 0.00 -1.93 0.00 0.00 57.85 55.26 1f9b n ARG 603 Cb 0.28 -1.48 0.49 0.00 -1.16 0.00 0.00 32.46 30.58 1f9b n ARG 603 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1f9b h ALA 604 N 3.72 2.17 0.06 7.54 0.00 -1.58 0.58 119.26 131.75 1f9b h ALA 604 Ca 0.00 0.05 -0.24 0.00 0.00 0.00 0.00 54.91 54.72 1f9b h ALA 604 Cb 0.67 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1f9b h ALA 604 CO 0.00 -0.54 -1.15 0.37 0.00 0.00 0.00 179.25 177.93 1f9b h GLN 605 N 0.44 0.12 -0.00 0.00 4.15 -1.83 -0.16 115.11 117.83 1f9b h GLN 605 Ca 0.56 -0.20 -0.00 0.00 0.77 0.00 0.00 58.65 59.78 1f9b h GLN 605 Cb 1.35 0.08 0.00 0.00 0.21 0.00 0.00 27.48 29.12 1f9b h GLN 605 CO -0.27 1.07 -0.00 1.25 -1.93 0.00 0.00 178.83 178.95 1f9b h HIS 606 N 0.03 0.00 -1.01 3.99 2.76 -1.71 -2.72 115.15 116.50 1f9b h HIS 606 Ca -0.08 -0.00 0.23 0.00 -2.20 0.00 0.00 60.37 58.32 1f9b h HIS 606 Cb 1.87 -0.00 -0.12 0.00 1.55 0.00 0.00 27.41 30.71 1f9b h HIS 606 CO 0.03 0.67 0.60 1.25 -1.30 0.00 0.00 177.93 179.18 1f9b h LEU 607 N -0.67 0.71 -0.54 0.26 7.12 0.11 0.24 115.31 122.54 1f9b h LEU 607 Ca -0.00 0.12 -0.15 0.00 0.13 0.00 0.00 57.88 57.99 1f9b h LEU 607 Cb 0.67 0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 40.80 1f9b h LEU 607 CO 0.00 0.15 -0.43 0.50 -0.13 0.00 0.00 178.44 178.53 1f9b h LYS 608 N 0.63 0.70 0.79 1.25 3.64 -1.00 -2.86 116.57 119.72 1f9b h LYS 608 Ca 0.63 -0.38 -0.04 0.00 -1.27 0.00 0.00 60.65 59.59 1f9b h LYS 608 Cb 1.14 0.02 0.01 0.00 -0.41 0.00 0.00 32.23 32.98 1f9b h LYS 608 CO -0.45 0.99 -0.38 -0.22 -2.27 0.00 0.00 179.45 177.12 1f9b h LYS 609 N 0.57 -1.03 -0.93 1.90 3.64 -0.22 -2.46 116.57 118.04 1f9b h LYS 609 Ca 0.04 0.07 0.16 0.00 -1.27 0.00 0.00 60.65 59.65 1f9b h LYS 609 Cb 0.97 0.23 -0.08 0.00 -0.41 0.00 0.00 32.23 32.95 1f9b h LYS 609 CO 0.09 -0.68 0.59 0.28 -2.27 0.00 0.00 179.45 177.46 1f9b h VAL 610 N -1.23 0.80 -0.27 2.00 2.07 -1.46 -2.03 116.25 116.12 1f9b h VAL 610 Ca -0.11 -0.24 -0.09 0.00 0.82 0.00 0.00 66.70 67.08 1f9b h VAL 610 Cb 0.82 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1f9b h VAL 610 CO 0.18 0.13 -0.20 -0.07 0.02 0.00 0.00 177.57 177.62 1f9b h LEU 611 N 0.70 0.50 -0.59 2.57 3.38 -1.41 -0.18 115.31 120.28 1f9b h LEU 611 Ca 0.48 -0.15 -0.15 0.00 0.09 0.00 0.00 57.88 58.15 1f9b h LEU 611 Cb 0.80 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1f9b h LEU 611 CO -0.24 0.71 -0.54 -0.26 0.09 0.00 0.00 178.44 178.20 1f9b h PHE 612 N 0.45 0.58 0.20 1.13 0.04 -0.88 -1.64 116.94 116.82 1f9b h PHE 612 Ca 0.07 -0.20 -0.01 0.00 2.80 0.00 0.00 57.97 60.63 1f9b h PHE 612 Cb 0.61 -0.11 0.00 0.00 2.20 0.00 0.00 35.95 38.65 1f9b h PHE 612 CO 0.02 0.90 -0.09 -0.07 -0.60 0.00 0.00 178.31 178.47 1f9b h LEU 613 N 0.36 -0.22 -0.99 1.54 3.38 -1.32 -2.33 115.31 115.72 1f9b h LEU 613 Ca 0.01 0.01 0.31 0.00 0.09 0.00 0.00 57.88 58.30 1f9b h LEU 613 Cb 1.06 0.06 -0.18 0.00 0.09 0.00 0.00 40.66 41.69 1f9b h LEU 613 CO 0.10 -0.10 0.18 1.56 0.09 0.00 0.00 178.44 180.26 1f9b h GLN 614 N -0.38 0.01 0.00 1.13 1.08 -1.11 0.77 115.11 116.62 1f9b h GLN 614 Ca -0.03 -0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 1f9b h GLN 614 Cb 0.20 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.63 1f9b h GLN 614 CO 0.04 0.01 0.00 0.00 -0.95 0.00 0.00 178.83 177.93 1f9b n GLN 615 N -5.42 0.12 0.03 1.46 10.64 -0.62 -1.57 117.38 122.02 1f9b n GLN 615 Ca 0.28 0.16 -0.04 0.00 -1.83 0.00 0.00 57.00 55.56 1f9b n GLN 615 Cb 0.91 -1.66 -0.10 0.00 -0.86 0.00 0.00 30.24 28.54 1f9b n GLN 615 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.06 174.79 1f9b h ASP 616 N 0.00 0.00 0.01 2.61 3.32 0.11 0.24 116.42 122.71 1f9b h ASP 616 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1f9b h ASP 616 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1f9b h ASP 616 CO 0.00 0.81 -0.08 -0.61 -1.72 0.00 0.00 179.24 177.63 1f9b h GLN 617 N 0.00 0.02 -0.03 3.56 4.15 -1.30 -3.37 115.11 118.14 1f9b h GLN 617 Ca -0.17 -0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.22 1f9b h GLN 617 Cb 1.76 0.01 -0.00 0.00 0.21 0.00 0.00 27.48 29.46 1f9b h GLN 617 CO 0.08 1.01 -0.06 1.19 -1.93 0.00 0.00 178.83 179.12 1f9b n PHE 618 N -4.58 0.12 -0.25 3.99 3.72 -0.61 -2.88 117.46 116.97 1f9b n PHE 618 Ca -0.11 -1.05 0.00 0.00 -0.05 0.00 0.00 57.45 56.24 1f9b n PHE 618 Cb 0.51 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.86 1f9b n PHE 618 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1f9b n GLY 619 N -1.30 -0.20 0.33 1.37 0.00 0.07 -0.57 105.19 104.90 1f9b n GLY 619 Ca 0.17 -1.67 0.18 0.00 0.00 0.00 0.00 46.02 44.71 1f9b n GLY 619 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1f9b h GLY 620 N 0.00 0.00 -2.04 -0.02 0.00 -1.61 -0.75 103.07 98.65 1f9b h GLY 620 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 1f9b h GLY 620 CO 0.00 0.00 -0.77 0.70 0.00 0.00 0.00 176.54 176.47 1f9b n ASN 621 N -3.52 1.27 -4.71 0.19 5.03 -1.26 -5.08 115.26 107.18 1f9b n ASN 621 Ca -0.00 -2.76 -0.42 0.00 0.87 0.00 0.00 54.58 52.27 1f9b n ASN 621 Cb 0.27 -0.39 -0.03 0.00 -1.02 0.00 0.00 39.78 38.61 1f9b n ASN 621 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1f9b s GLY 622 N -2.45 1.87 0.24 7.41 0.00 -0.29 -4.89 107.32 109.21 1f9b s GLY 622 Ca 0.34 1.08 -0.05 0.00 0.00 0.00 0.00 44.72 46.09 1f9b s GLY 622 CO -0.12 2.47 1.73 -2.55 0.00 0.00 0.00 173.10 174.63 1f9b h PRO 623 N 7.26 0.40 -0.76 2.90 0.11 -1.69 0.15 132.00 140.37 1f9b h PRO 623 Ca -0.41 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.63 1f9b h PRO 623 Cb 1.20 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 1f9b h PRO 623 CO 0.89 0.26 0.05 -0.25 -0.21 0.00 0.00 178.00 178.74 1f9b n ASP 624 N -5.02 4.09 0.00 -2.05 8.00 -1.14 -4.54 116.55 115.88 1f9b n ASP 624 Ca 0.13 -2.68 0.00 0.00 0.71 0.00 0.00 54.79 52.95 1f9b n ASP 624 Cb 0.39 -0.64 0.00 0.00 -0.02 0.00 0.00 41.12 40.85 1f9b n ASP 624 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1f9b h PRO 626 N 0.00 0.88 0.00 0.00 0.11 -1.82 -3.09 132.00 128.08 1f9b h PRO 626 Ca 0.00 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1f9b h PRO 626 Cb 0.00 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 30.91 1f9b h PRO 626 CO 0.00 0.58 0.00 0.41 -0.21 0.00 0.00 178.00 178.78 1f9b n GLY 627 N -1.34 -0.56 0.03 -0.55 0.00 -1.23 -4.58 105.19 96.96 1f9b n GLY 627 Ca 0.17 0.06 0.01 0.00 0.00 0.00 0.00 46.02 46.25 1f9b n GLY 627 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1f9b n LYS 628 N -0.08 1.10 -3.64 1.61 2.85 0.17 -5.05 118.16 115.11 1f9b n LYS 628 Ca 0.00 -0.07 -0.10 0.00 -1.05 0.00 0.00 58.31 57.09 1f9b n LYS 628 Cb 0.00 -1.33 -0.07 0.00 -0.65 0.00 0.00 35.03 32.98 1f9b n LYS 628 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 177.40 177.47 1f9b s PHE 629 N -2.67 -0.71 -0.30 5.58 5.36 -0.72 -5.05 117.98 119.49 1f9b s PHE 629 Ca -0.06 1.61 0.03 0.00 -0.96 0.00 0.00 56.93 57.55 1f9b s PHE 629 Cb 0.07 0.37 0.08 0.00 -0.34 0.00 0.00 43.02 43.20 1f9b s PHE 629 CO 0.56 -0.34 -0.00 0.00 -1.46 0.00 0.00 175.22 173.97 1f9b h LEU 631 N 7.77 0.61 -3.28 0.00 5.85 -1.15 -2.66 115.31 122.46 1f9b h LEU 631 Ca -0.12 0.04 -0.33 0.00 0.84 0.00 0.00 57.88 58.31 1f9b h LEU 631 Cb 1.03 -0.08 -0.19 0.00 0.37 0.00 0.00 40.66 41.79 1f9b h LEU 631 CO 0.48 0.38 0.42 0.49 -0.34 0.00 0.00 178.44 179.87 1f9b n PHE 632 N -4.76 1.93 -3.94 1.25 3.72 -1.26 -4.76 117.46 109.64 1f9b n PHE 632 Ca 0.10 -1.44 -0.10 0.00 -0.05 0.00 0.00 57.45 55.97 1f9b n PHE 632 Cb 0.21 -0.73 -0.12 0.00 -0.94 0.00 0.00 39.48 37.90 1f9b n PHE 632 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1f9b s LYS 633 N -2.09 0.21 -0.10 -1.08 3.01 -1.00 -4.12 119.74 114.56 1f9b s LYS 633 Ca 0.36 -0.41 0.04 0.00 -1.01 0.00 0.00 55.97 54.95 1f9b s LYS 633 Cb 0.30 0.07 0.13 0.00 -1.01 0.00 0.00 37.83 37.32 1f9b s LYS 633 CO 0.06 -0.03 1.08 -1.13 0.51 0.00 0.00 175.35 175.83 1f9b n SER 634 N 2.09 -1.03 -3.55 2.83 3.41 -1.26 -4.85 113.62 111.25 1f9b n SER 634 Ca -0.20 -1.88 -0.21 0.00 -0.26 0.00 0.00 58.87 56.32 1f9b n SER 634 Cb 0.57 0.39 0.05 0.00 -0.26 0.00 0.00 64.21 64.96 1f9b n SER 634 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1f9b n GLU 635 N -0.48 -4.11 -0.28 4.33 1.02 -1.26 -2.89 120.64 116.98 1f9b n GLU 635 Ca -0.22 0.69 0.00 0.00 -0.02 0.00 0.00 57.16 57.62 1f9b n GLU 635 Cb 0.71 -5.29 0.00 0.00 -0.02 0.00 0.00 31.44 26.84 1f9b n GLU 635 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1f9b n THR 636 N -4.00 0.00 1.78 2.62 -2.24 -1.26 -4.78 114.28 106.39 1f9b n THR 636 Ca -0.22 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.71 1f9b n THR 636 Cb 0.65 -0.22 0.86 0.00 -2.10 0.00 0.00 70.33 69.53 1f9b n THR 636 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1f9b n LYS 637 N -2.00 0.83 -4.06 -0.78 5.02 -1.14 -4.83 118.16 111.20 1f9b n LYS 637 Ca 0.00 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.97 1f9b n LYS 637 Cb 0.00 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.50 1f9b n LYS 637 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1f9b n ASN 638 N -1.07 -3.26 -4.75 4.39 3.02 -1.26 -4.94 115.26 107.39 1f9b n ASN 638 Ca 0.21 -0.92 -0.41 0.00 -0.03 0.00 0.00 54.58 53.43 1f9b n ASN 638 Cb 0.13 -3.24 -0.04 0.00 -0.61 0.00 0.00 39.78 36.02 1f9b n ASN 638 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1f9b s LEU 639 N -7.20 4.54 0.00 3.41 1.43 -1.26 -4.21 118.68 115.39 1f9b s LEU 639 Ca 0.57 2.17 0.00 0.00 -1.03 0.00 0.00 54.13 55.84 1f9b s LEU 639 Cb -0.30 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.30 1f9b s LEU 639 CO 0.88 -0.14 0.00 0.18 0.23 0.00 0.00 176.35 177.50 1f9b n LEU 640 N 1.70 0.00 -4.22 1.79 4.77 -1.26 -4.67 117.00 115.10 1f9b n LEU 640 Ca 0.00 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.86 1f9b n LEU 640 Cb 0.46 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.44 1f9b n LEU 640 CO 0.54 0.00 -0.26 -0.36 -1.33 0.00 0.00 177.39 175.97 1f9b s PHE 641 N 0.00 1.19 0.51 -1.77 0.40 -1.26 -4.49 117.98 112.56 1f9b s PHE 641 Ca 0.00 -1.28 -0.19 0.00 -0.60 0.00 0.00 56.93 54.86 1f9b s PHE 641 Cb 0.00 -0.63 -0.07 0.00 0.51 0.00 0.00 43.02 42.82 1f9b s PHE 641 CO 0.00 -0.51 1.05 -0.80 0.70 0.00 0.00 175.22 175.66 1f9b s ASN 642 N -3.17 6.17 0.00 1.36 0.01 -1.26 -4.61 114.94 113.44 1f9b s ASN 642 Ca 0.35 1.93 0.23 0.00 -0.71 0.00 0.00 52.86 54.65 1f9b s ASN 642 Cb 0.07 -2.56 1.08 0.00 0.41 0.00 0.00 41.25 40.26 1f9b s ASN 642 CO 0.10 -0.90 1.73 0.47 -1.51 0.00 0.00 177.10 176.99 1f9b n ASP 643 N -1.20 0.00 -1.04 -1.22 8.00 -1.26 -2.56 116.55 117.28 1f9b n ASP 643 Ca 0.09 0.13 0.08 0.00 0.71 0.00 0.00 54.79 55.81 1f9b n ASP 643 Cb 0.52 -0.35 0.25 0.00 -0.02 0.00 0.00 41.12 41.52 1f9b n ASP 643 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1f9b n ASN 644 N -1.35 3.68 -4.69 -2.24 6.94 -1.26 -4.75 115.26 111.59 1f9b n ASN 644 Ca 0.09 -2.23 -0.42 0.00 -0.02 0.00 0.00 54.58 51.99 1f9b n ASN 644 Cb 0.21 -0.41 -0.03 0.00 -2.36 0.00 0.00 39.78 37.19 1f9b n ASN 644 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1f9b s THR 645 N -1.43 3.63 -0.07 5.53 2.01 -1.06 -0.54 115.64 123.70 1f9b s THR 645 Ca 0.37 1.03 -0.16 0.00 0.31 0.00 0.00 61.69 63.24 1f9b s THR 645 Cb 0.22 -3.66 -0.29 0.00 0.01 0.00 0.00 72.50 68.78 1f9b s THR 645 CO 0.21 0.00 0.68 -0.08 -0.69 0.00 0.00 174.62 174.74 1f9b h GLU 646 N 7.82 0.31 0.00 4.92 4.81 -1.03 -3.43 114.58 127.98 1f9b h GLU 646 Ca -0.39 -0.53 0.01 0.00 -0.13 0.00 0.00 59.36 58.33 1f9b h GLU 646 Cb 1.18 0.20 -0.00 0.00 0.63 0.00 0.00 28.75 30.76 1f9b h GLU 646 CO 0.90 1.25 0.09 0.00 -0.73 0.00 0.00 179.01 180.52 1f9b s LEU 648 N 0.00 3.41 0.65 0.00 1.43 -1.26 -2.57 118.68 120.34 1f9b s LEU 648 Ca 0.04 -1.10 -0.02 0.00 -1.03 0.00 0.00 54.13 52.02 1f9b s LEU 648 Cb -0.01 -1.64 0.07 0.00 0.03 0.00 0.00 46.19 44.64 1f9b s LEU 648 CO 0.02 -0.18 0.92 0.00 0.23 0.00 0.00 176.35 177.34 1f9b s ALA 649 N 1.25 3.60 0.57 4.21 0.00 0.10 -4.70 121.76 126.80 1f9b s ALA 649 Ca -0.03 -1.34 -0.14 0.00 0.00 0.00 0.00 51.96 50.45 1f9b s ALA 649 Cb -0.18 -2.21 -0.06 0.00 0.00 0.00 0.00 23.12 20.67 1f9b s ALA 649 CO -0.04 -1.15 1.01 -1.21 0.00 0.00 0.00 175.76 174.38 1f9b s GLU 650 N -5.03 3.71 0.00 0.00 0.41 -0.70 -1.23 118.70 115.86 1f9b s GLU 650 Ca 0.61 0.90 0.20 0.00 -0.41 0.00 0.00 54.97 56.27 1f9b s GLU 650 Cb -0.09 -2.10 1.09 0.00 -1.78 0.00 0.00 34.13 31.26 1f9b s GLU 650 CO 0.42 -0.47 1.71 1.28 -0.49 0.00 0.00 175.26 177.71 1f9b n LEU 651 N -2.13 0.28 -3.51 1.80 4.77 -1.26 -4.71 117.00 112.23 1f9b n LEU 651 Ca 0.07 -0.11 -0.25 0.00 -0.03 0.00 0.00 56.01 55.68 1f9b n LEU 651 Cb 0.54 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.61 1f9b n LEU 651 CO 0.51 0.06 -0.03 0.00 -1.33 0.00 0.00 177.39 176.60 1f9b n GLN 652 N -0.61 -3.49 0.00 3.23 1.13 -1.26 -1.54 117.38 114.84 1f9b n GLN 652 Ca 0.15 0.47 0.00 0.00 -1.94 0.00 0.00 57.00 55.67 1f9b n GLN 652 Cb 0.11 -5.19 0.00 0.00 0.11 0.00 0.00 30.24 25.27 1f9b n GLN 652 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1f9b n GLY 653 N -1.23 3.09 3.56 1.08 0.00 -1.26 -4.99 105.19 105.44 1f9b n GLY 653 Ca 0.00 -0.91 -0.13 0.00 0.00 0.00 0.00 46.02 44.98 1f9b n GLY 653 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1f9b n LYS 654 N 0.00 0.44 0.00 1.61 4.76 -0.59 -4.73 118.16 119.65 1f9b n LYS 654 Ca 0.00 -1.07 0.11 0.00 -2.87 0.00 0.00 58.31 54.47 1f9b n LYS 654 Cb 0.00 -3.76 -0.03 0.00 -1.84 0.00 0.00 35.03 29.41 1f9b n LYS 654 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1f9b n THR 655 N 8.88 0.00 -4.40 -0.18 -2.24 -1.26 -4.54 114.28 110.53 1f9b n THR 655 Ca 0.45 -0.01 -0.28 0.00 -2.27 0.00 0.00 64.05 61.95 1f9b n THR 655 Cb 0.44 0.83 -0.12 0.00 -2.10 0.00 0.00 70.33 69.38 1f9b n THR 655 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1f9b s THR 656 N -2.98 2.29 0.45 4.28 -4.23 -1.26 -4.34 115.64 109.85 1f9b s THR 656 Ca 0.09 -1.91 0.21 0.00 -1.18 0.00 0.00 61.69 58.91 1f9b s THR 656 Cb 0.16 -2.06 0.40 0.00 1.34 0.00 0.00 72.50 72.35 1f9b s THR 656 CO 0.82 -0.03 1.87 0.10 -0.54 0.00 0.00 174.62 176.84 1f9b h TYR 657 N 3.51 0.40 0.21 3.99 -0.00 -1.92 0.03 116.97 123.19 1f9b h TYR 657 Ca -0.48 0.01 -0.01 0.00 0.00 0.00 0.00 58.73 58.25 1f9b h TYR 657 Cb 1.19 -0.12 0.00 0.00 0.00 0.00 0.00 36.73 37.80 1f9b h TYR 657 CO 0.65 0.10 -0.10 0.93 -0.00 0.00 0.00 178.16 179.74 1f9b h GLU 658 N 0.30 -0.28 -0.61 0.10 5.08 -1.95 -0.78 114.58 116.43 1f9b h GLU 658 Ca 0.45 0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.76 1f9b h GLU 658 Cb 1.27 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.56 1f9b h GLU 658 CO -0.13 -0.08 0.14 1.96 -1.00 0.00 0.00 179.01 179.90 1f9b h GLN 659 N -0.43 0.99 0.05 2.33 4.20 -1.55 -1.57 115.11 119.13 1f9b h GLN 659 Ca -0.03 -0.24 -0.00 0.00 0.06 0.00 0.00 58.65 58.44 1f9b h GLN 659 Cb 0.33 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1f9b h GLN 659 CO 0.05 0.90 -0.02 -0.92 -0.67 0.00 0.00 178.83 178.17 1f9b h TYR 660 N 0.90 -0.06 0.00 2.96 3.20 -0.96 -3.19 116.97 119.82 1f9b h TYR 660 Ca 0.19 -0.00 -0.15 0.00 3.14 0.00 0.00 58.73 61.91 1f9b h TYR 660 Cb 0.37 0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.63 1f9b h TYR 660 CO 0.03 0.21 -0.70 -0.07 -1.64 0.00 0.00 178.16 175.99 1f9b h LEU 661 N -0.34 0.00 0.00 2.82 3.38 -1.23 -3.47 115.31 116.47 1f9b h LEU 661 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1f9b h LEU 661 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1f9b h LEU 661 CO 0.01 0.70 0.00 0.61 0.09 0.00 0.00 178.44 179.85 1f9b n GLY 662 N 0.74 0.41 0.13 0.83 0.00 -0.59 -4.57 105.19 102.14 1f9b n GLY 662 Ca -0.00 -1.66 -0.05 0.00 0.00 0.00 0.00 46.02 44.31 1f9b n GLY 662 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1f9b h SER 663 N 0.00 -0.36 0.00 1.61 4.64 -1.89 -2.78 113.55 114.77 1f9b h SER 663 Ca 0.00 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1f9b h SER 663 Cb 0.00 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1f9b h SER 663 CO 0.00 -0.17 0.00 -1.84 -0.87 0.00 0.00 176.83 173.95 1f9b n GLU 664 N -3.09 0.00 -0.33 4.77 -0.00 -1.26 -0.41 120.64 120.32 1f9b n GLU 664 Ca -0.03 0.53 0.26 0.00 -0.00 0.00 0.00 57.16 57.92 1f9b n GLU 664 Cb 0.12 -0.94 0.50 0.00 -0.00 0.00 0.00 31.44 31.12 1f9b n GLU 664 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.13 176.21 1f9b h TYR 665 N 0.00 0.72 -0.46 -1.84 3.20 -1.81 1.31 116.97 118.09 1f9b h TYR 665 Ca 0.00 0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.85 1f9b h TYR 665 Cb 0.00 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.10 1f9b h TYR 665 CO -0.23 -0.37 0.04 0.28 -1.64 0.00 0.00 178.16 176.24 1f9b h VAL 666 N 0.11 1.25 -0.16 1.81 2.07 -0.62 0.16 116.25 120.87 1f9b h VAL 666 Ca 0.77 -0.97 -0.11 0.00 0.82 0.00 0.00 66.70 67.21 1f9b h VAL 666 Cb 1.89 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.63 1f9b h VAL 666 CO -0.73 0.34 -0.38 0.74 0.02 0.00 0.00 177.57 177.55 1f9b h THR 667 N 0.64 1.30 -0.21 2.57 2.02 0.41 -1.44 112.91 118.20 1f9b h THR 667 Ca 0.14 -1.48 -0.10 0.00 0.77 0.00 0.00 66.41 65.74 1f9b h THR 667 Cb 0.44 1.59 -0.01 0.00 -1.74 0.00 0.00 68.15 68.43 1f9b h THR 667 CO 0.02 0.45 -0.28 -1.28 0.37 0.00 0.00 175.52 174.80 1f9b h SER 668 N 0.30 0.42 1.05 4.18 0.87 0.98 -0.78 113.55 120.57 1f9b h SER 668 Ca 0.03 -0.15 -0.14 0.00 -1.23 0.00 0.00 61.79 60.30 1f9b h SER 668 Cb 0.81 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.63 1f9b h SER 668 CO 0.06 0.70 -0.67 0.40 -0.53 0.00 0.00 176.83 176.79 1f9b h ILE 669 N 0.37 1.26 -0.01 2.23 2.04 -0.22 -2.78 117.51 120.40 1f9b h ILE 669 Ca 0.05 -2.49 -0.25 0.00 1.00 0.00 0.00 64.86 63.17 1f9b h ILE 669 Cb 0.69 2.43 0.02 0.00 -0.74 0.00 0.00 36.82 39.22 1f9b h ILE 669 CO 0.05 0.66 -0.96 0.71 0.00 0.00 0.00 178.15 178.61 1f9b h THR 670 N 0.00 1.30 -0.47 -0.27 1.35 -0.87 -2.93 112.91 111.03 1f9b h THR 670 Ca -0.01 -2.20 0.08 0.00 -0.55 0.00 0.00 66.41 63.73 1f9b h THR 670 Cb 1.38 2.39 -0.06 0.00 -1.73 0.00 0.00 68.15 70.13 1f9b h THR 670 CO 0.09 0.68 0.10 0.78 -0.25 0.00 0.00 175.52 176.91 1f9b h ASN 671 N 0.32 0.02 -0.43 5.36 4.21 -1.10 -0.39 115.58 123.57 1f9b h ASN 671 Ca -0.12 0.08 -0.02 0.00 1.21 0.00 0.00 56.30 57.45 1f9b h ASN 671 Cb 1.62 0.11 -0.02 0.00 -1.12 0.00 0.00 38.32 38.91 1f9b h ASN 671 CO 0.19 0.04 0.21 -0.07 -1.29 0.00 0.00 177.43 176.51 1f9b h LEU 672 N 0.24 0.60 -2.77 1.61 3.38 -1.54 -2.59 115.31 114.23 1f9b h LEU 672 Ca 0.23 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1f9b h LEU 672 Cb 0.30 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1f9b h LEU 672 CO -0.30 0.53 0.06 0.03 0.09 0.00 0.00 178.44 178.84 1f9b h ARG 673 N 0.67 0.00 -0.52 1.13 3.08 -0.86 -1.68 114.38 116.19 1f9b h ARG 673 Ca 0.17 0.00 0.14 0.00 0.07 0.00 0.00 59.98 60.35 1f9b h ARG 673 Cb 0.10 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 1f9b h ARG 673 CO -0.02 0.00 0.37 -0.09 -1.07 0.00 0.00 179.97 179.16 1f9b h ARG 674 N 0.00 0.09 0.00 0.04 2.43 -1.41 -3.13 114.38 112.40 1f9b h ARG 674 Ca 0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1f9b h ARG 674 Cb 0.12 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1f9b h ARG 674 CO -0.00 0.06 0.00 0.00 -1.51 0.00 0.00 179.97 178.52 1f9b s SER 676 N -2.83 3.86 0.37 0.00 0.15 -1.18 -5.11 113.70 108.95 1f9b s SER 676 Ca 0.00 -0.48 0.04 0.00 0.70 0.00 0.00 55.95 56.21 1f9b s SER 676 Cb 0.00 -0.59 -0.05 0.00 -1.71 0.00 0.00 66.02 63.67 1f9b s SER 676 CO 0.00 0.22 0.07 -0.55 1.20 0.00 0.00 173.24 174.18 1f9b s SER 677 N -1.77 2.74 0.05 5.45 0.15 -1.26 -4.06 113.70 115.01 1f9b s SER 677 Ca 0.16 -1.49 0.07 0.00 0.70 0.00 0.00 55.95 55.40 1f9b s SER 677 Cb -0.11 0.12 -0.03 0.00 -1.71 0.00 0.00 66.02 64.30 1f9b s SER 677 CO 0.08 -0.71 -0.20 -0.94 1.20 0.00 0.00 173.24 172.67 1f9b s SER 678 N -3.57 2.34 0.45 5.45 1.04 -1.26 -5.04 113.70 113.10 1f9b s SER 678 Ca 0.30 -0.54 0.18 0.00 0.48 0.00 0.00 55.95 56.37 1f9b s SER 678 Cb 0.06 -0.17 1.13 0.00 0.10 0.00 0.00 66.02 67.14 1f9b s SER 678 CO 0.14 0.12 1.94 1.55 0.98 0.00 0.00 173.24 177.97 1f9b h PRO 679 N 4.73 0.31 0.11 4.02 0.13 -2.02 -1.99 132.00 137.29 1f9b h PRO 679 Ca -0.42 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.68 1f9b h PRO 679 Cb 1.17 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1f9b h PRO 679 CO 0.43 0.21 -0.05 1.25 -0.23 0.00 0.00 178.00 179.60 1f9b h LEU 680 N 0.32 -0.13 -1.65 1.56 6.46 -1.98 -1.73 115.31 118.16 1f9b h LEU 680 Ca 0.34 -0.38 0.27 0.00 -0.12 0.00 0.00 57.88 57.99 1f9b h LEU 680 Cb 0.89 0.03 -0.07 0.00 -0.73 0.00 0.00 40.66 40.78 1f9b h LEU 680 CO -0.09 0.34 0.69 0.25 -0.62 0.00 0.00 178.44 179.01 1f9b h LEU 681 N -0.64 0.26 0.02 2.25 5.85 -1.74 0.55 115.31 121.86 1f9b h LEU 681 Ca -0.02 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 1f9b h LEU 681 Cb 0.50 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.53 1f9b h LEU 681 CO 0.03 0.07 -0.01 -0.33 -0.34 0.00 0.00 178.44 177.85 1f9b h GLU 682 N 0.24 -0.02 -0.91 1.25 5.08 -1.35 -2.89 114.58 115.97 1f9b h GLU 682 Ca 0.53 0.00 0.20 0.00 -1.00 0.00 0.00 59.36 59.09 1f9b h GLU 682 Cb 1.63 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.82 1f9b h GLU 682 CO -0.16 0.69 0.60 0.00 -1.00 0.00 0.00 179.01 179.14 1f9b h ALA 683 N -0.20 2.15 0.00 3.43 0.00 -0.64 0.24 119.26 124.24 1f9b h ALA 683 Ca -0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1f9b h ALA 683 Cb 0.72 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1f9b h ALA 683 CO 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 179.25 178.81 1f9b h ALA 685 N 2.24 0.32 0.17 0.00 0.00 -0.30 -2.54 119.26 119.16 1f9b h ALA 685 Ca 0.00 -0.75 -0.01 0.00 0.00 0.00 0.00 54.91 54.15 1f9b h ALA 685 Cb 0.75 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1f9b h ALA 685 CO 0.00 0.87 -0.08 0.35 0.00 0.00 0.00 179.25 180.38 1f9b h PHE 686 N 0.17 -0.21 -0.42 0.00 3.57 -1.38 -3.24 116.94 115.43 1f9b h PHE 686 Ca -0.09 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.49 1f9b h PHE 686 Cb 1.66 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 40.45 1f9b h PHE 686 CO 0.06 0.20 0.29 -0.07 -2.23 0.00 0.00 178.31 176.55 1f9b h LEU 687 N -0.90 0.16 -4.05 0.59 3.38 -1.40 -2.61 115.31 110.48 1f9b h LEU 687 Ca -0.02 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.34 1f9b h LEU 687 Cb 0.50 -0.03 -0.38 0.00 0.09 0.00 0.00 40.66 40.84 1f9b h LEU 687 CO 0.04 0.10 -0.20 0.54 0.09 0.00 0.00 178.44 179.01 1f9b n ARG 688 N -4.46 3.27 0.00 1.13 5.12 -0.96 -5.07 116.66 115.70 1f9b n ARG 688 Ca 0.06 -3.95 0.00 0.00 -1.93 0.00 0.00 57.85 52.04 1f9b n ARG 688 Cb 0.36 -2.28 0.00 0.00 -1.16 0.00 0.00 32.46 29.39 1f9b n ARG 688 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70