#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g18 n THR 4 N 0.00 0.74 -0.05 0.00 -2.24 -1.26 -4.92 114.28 106.55 1g18 n THR 4 Ca 0.00 0.25 -0.16 0.00 -2.27 0.00 0.00 64.05 61.87 1g18 n THR 4 Cb 0.00 -1.22 -0.06 0.00 -2.10 0.00 0.00 70.33 66.94 1g18 n THR 4 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1g18 h PRO 5 N 0.00 0.73 0.00 -0.78 0.11 -2.07 -3.19 132.00 126.81 1g18 h PRO 5 Ca 0.00 -0.53 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1g18 h PRO 5 Cb 0.00 0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.20 1g18 h PRO 5 CO 0.00 1.15 0.28 0.38 -0.21 0.00 0.00 178.00 179.61 1g18 h ASP 6 N 0.45 0.00 -0.12 -2.05 3.04 -1.99 0.49 116.42 116.23 1g18 h ASP 6 Ca -0.02 0.00 -0.12 0.00 -3.24 0.00 0.00 57.03 53.65 1g18 h ASP 6 Cb 1.21 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.50 1g18 h ASP 6 CO 0.12 0.00 -0.38 0.03 -2.04 0.00 0.00 179.24 176.98 1g18 h ARG 7 N 0.00 0.48 0.00 4.15 3.08 -1.91 -0.51 114.38 119.67 1g18 h ARG 7 Ca 0.00 -0.35 0.00 0.00 0.07 0.00 0.00 59.98 59.70 1g18 h ARG 7 Cb 0.56 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.67 1g18 h ARG 7 CO 0.00 0.97 0.00 1.49 -1.07 0.00 0.00 179.97 181.36 1g18 h GLU 8 N 0.07 0.00 0.00 0.04 4.57 -0.17 0.16 114.58 119.25 1g18 h GLU 8 Ca -0.01 0.00 -0.27 0.00 -1.18 0.00 0.00 59.36 57.89 1g18 h GLU 8 Cb 1.00 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.54 1g18 h GLU 8 CO 0.08 0.00 -1.61 -0.22 -1.18 0.00 0.00 179.01 176.08 1g18 h LYS 9 N 0.00 0.00 -0.01 1.92 3.64 -1.23 -2.74 116.57 118.16 1g18 h LYS 9 Ca 0.00 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.20 1g18 h LYS 9 Cb 0.36 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1g18 h LYS 9 CO 0.00 0.52 -0.82 0.00 -2.27 0.00 0.00 179.45 176.89 1g18 h ALA 10 N 1.03 0.61 -0.13 5.00 0.00 -0.13 -3.00 119.26 122.65 1g18 h ALA 10 Ca -0.25 -0.70 -0.20 0.00 0.00 0.00 0.00 54.91 53.77 1g18 h ALA 10 Cb 1.96 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.66 1g18 h ALA 10 CO 0.08 0.91 -0.73 1.25 0.00 0.00 0.00 179.25 180.76 1g18 h LEU 11 N 0.09 0.71 -1.36 0.00 5.85 -0.82 -1.55 115.31 118.23 1g18 h LEU 11 Ca -0.03 -0.45 -0.03 0.00 0.84 0.00 0.00 57.88 58.21 1g18 h LEU 11 Cb 1.42 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.22 1g18 h LEU 11 CO 0.12 1.22 0.10 -0.08 -0.34 0.00 0.00 178.44 179.46 1g18 h GLU 12 N 0.42 0.53 -0.05 1.25 4.81 -1.45 -0.98 114.58 119.11 1g18 h GLU 12 Ca -0.03 -0.08 -0.20 0.00 -0.13 0.00 0.00 59.36 58.91 1g18 h GLU 12 Cb 1.32 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 30.62 1g18 h GLU 12 CO 0.14 0.48 -0.76 -0.07 -0.73 0.00 0.00 179.01 178.06 1g18 h LEU 13 N 0.53 0.76 -0.06 1.64 3.38 -1.44 -2.57 115.31 117.54 1g18 h LEU 13 Ca 0.13 -0.71 0.04 0.00 0.09 0.00 0.00 57.88 57.43 1g18 h LEU 13 Cb 0.18 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 40.64 1g18 h LEU 13 CO -0.01 1.35 -0.41 0.00 0.09 0.00 0.00 178.44 179.47 1g18 h ALA 14 N 0.42 -0.62 -0.95 1.53 0.00 -0.41 0.27 119.26 119.51 1g18 h ALA 14 Ca -0.08 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.86 1g18 h ALA 14 Cb 1.43 0.75 -0.06 0.00 0.00 0.00 0.00 17.79 19.91 1g18 h ALA 14 CO 0.15 -0.93 0.61 0.28 0.00 0.00 0.00 179.25 179.36 1g18 h VAL 15 N -0.53 1.10 -0.31 0.00 2.07 -1.28 -1.70 116.25 115.60 1g18 h VAL 15 Ca 0.06 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.19 1g18 h VAL 15 Cb 0.63 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 1g18 h VAL 15 CO -0.35 0.21 0.18 0.00 0.02 0.00 0.00 177.57 177.63 1g18 h ALA 16 N 1.42 0.40 -0.08 1.67 0.00 -0.87 0.01 119.26 121.80 1g18 h ALA 16 Ca 0.40 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.29 1g18 h ALA 16 Cb 0.11 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 1g18 h ALA 16 CO -0.15 -0.09 -0.25 1.96 0.00 0.00 0.00 179.25 180.72 1g18 h GLN 17 N 0.39 -0.33 0.75 0.00 7.50 0.26 -1.98 115.11 121.70 1g18 h GLN 17 Ca 0.11 0.02 -0.04 0.00 0.50 0.00 0.00 58.65 59.25 1g18 h GLN 17 Cb 0.04 0.07 0.01 0.00 0.05 0.00 0.00 27.48 27.65 1g18 h GLN 17 CO -0.02 -0.22 -0.36 0.82 -1.50 0.00 0.00 178.83 177.55 1g18 h ILE 18 N -0.34 0.00 -1.25 2.54 2.04 -1.14 -2.82 117.51 116.54 1g18 h ILE 18 Ca 0.09 -0.03 0.40 0.00 1.00 0.00 0.00 64.86 66.31 1g18 h ILE 18 Cb 0.46 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.42 1g18 h ILE 18 CO -0.28 0.00 0.80 -0.08 0.00 0.00 0.00 178.15 178.59 1g18 h GLU 19 N -1.04 0.14 0.04 2.37 4.81 -0.99 0.60 114.58 120.52 1g18 h GLU 19 Ca -0.10 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.12 1g18 h GLU 19 Cb 0.77 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.12 1g18 h GLU 19 CO 0.17 0.09 -0.02 0.87 -0.73 0.00 0.00 179.01 179.39 1g18 h LYS 20 N 0.15 -0.06 0.00 1.92 1.57 -1.12 -0.86 116.57 118.18 1g18 h LYS 20 Ca 0.78 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.56 1g18 h LYS 20 Cb 2.33 0.01 0.00 0.00 0.08 0.00 0.00 32.23 34.66 1g18 h LYS 20 CO -0.41 0.06 -0.96 -1.13 -0.57 0.00 0.00 179.45 176.43 1g18 n SER 21 N -5.07 0.63 -0.02 0.86 3.41 0.17 -4.33 113.62 109.27 1g18 n SER 21 Ca -0.08 -0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 1g18 n SER 21 Cb 0.09 0.68 0.00 0.00 -0.26 0.00 0.00 64.21 64.73 1g18 n SER 21 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1g18 n TYR 22 N -2.01 0.00 0.00 7.33 4.01 0.82 -5.11 117.16 122.20 1g18 n TYR 22 Ca 0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.76 1g18 n TYR 22 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.47 1g18 n TYR 22 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1g18 n GLY 23 N 0.17 2.54 0.29 2.72 0.00 -0.33 -4.61 105.19 105.98 1g18 n GLY 23 Ca 0.00 -1.96 0.08 0.00 0.00 0.00 0.00 46.02 44.15 1g18 n GLY 23 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1g18 h LYS 24 N 0.00 0.22 -1.03 1.61 1.79 -1.91 -2.03 116.57 115.23 1g18 h LYS 24 Ca 0.00 -0.01 -0.48 0.00 -2.18 0.00 0.00 60.65 57.98 1g18 h LYS 24 Cb 0.00 -0.05 -0.27 0.00 -1.58 0.00 0.00 32.23 30.34 1g18 h LYS 24 CO 0.00 0.14 0.61 0.41 -1.08 0.00 0.00 179.45 179.53 1g18 n GLY 25 N -1.37 4.41 0.14 3.86 0.00 -1.24 -4.49 105.19 106.50 1g18 n GLY 25 Ca 0.17 -1.15 -0.05 0.00 0.00 0.00 0.00 46.02 44.99 1g18 n GLY 25 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1g18 h SER 26 N 1.06 0.17 -3.52 1.61 0.02 -1.62 -3.44 113.55 107.83 1g18 h SER 26 Ca 0.55 -0.11 -0.28 0.00 -0.84 0.00 0.00 61.79 61.11 1g18 h SER 26 Cb 2.28 -0.05 -0.33 0.00 0.14 0.00 0.00 62.40 64.44 1g18 h SER 26 CO 1.04 0.80 -0.70 -0.69 -1.14 0.00 0.00 176.83 176.15 1g18 s VAL 27 N -3.55 -0.05 0.14 2.27 1.01 -1.26 -5.03 120.40 113.94 1g18 s VAL 27 Ca -0.03 0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.11 1g18 s VAL 27 Cb 0.12 -0.11 -0.03 0.00 0.00 0.00 0.00 36.38 36.35 1g18 s VAL 27 CO 0.79 0.08 0.14 -0.04 0.00 0.00 0.00 175.10 176.07 1g18 s MET 28 N 1.00 1.02 -0.11 2.72 1.00 -1.26 -5.04 119.30 118.63 1g18 s MET 28 Ca -0.08 -1.36 -0.01 0.00 0.00 0.00 0.00 55.69 54.24 1g18 s MET 28 Cb -0.11 0.29 -0.03 0.00 0.00 0.00 0.00 34.83 34.98 1g18 s MET 28 CO -0.03 -0.32 -0.05 1.03 0.00 0.00 0.00 175.02 175.64 1g18 s ARG 29 N -4.02 3.18 0.47 2.03 0.52 -1.26 -4.99 118.95 114.87 1g18 s ARG 29 Ca 0.22 -0.52 0.31 0.00 -0.52 0.00 0.00 55.73 55.22 1g18 s ARG 29 Cb 0.06 -2.75 1.69 0.00 0.52 0.00 0.00 34.95 34.47 1g18 s ARG 29 CO 0.02 0.48 1.95 -0.07 0.02 0.00 0.00 175.30 177.69 1g18 h LEU 30 N 5.89 0.00 0.00 2.53 3.38 -1.98 -2.12 115.31 123.01 1g18 h LEU 30 Ca -0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1g18 h LEU 30 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1g18 h LEU 30 CO 0.57 0.00 -1.01 0.61 0.09 0.00 0.00 178.44 178.70 1g18 n GLY 31 N -1.21 -1.38 3.68 0.83 0.00 -1.26 -4.87 105.19 100.97 1g18 n GLY 31 Ca -0.02 -0.28 -0.49 0.00 0.00 0.00 0.00 46.02 45.23 1g18 n GLY 31 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1g18 n ASP 32 N -2.44 3.15 -0.07 1.61 8.00 -0.80 -4.85 116.55 121.16 1g18 n ASP 32 Ca 0.01 1.02 0.14 0.00 0.71 0.00 0.00 54.79 56.66 1g18 n ASP 32 Cb 0.51 -1.35 0.59 0.00 -0.02 0.00 0.00 41.12 40.86 1g18 n ASP 32 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1g18 n GLU 33 N 5.47 0.46 -0.36 -1.24 0.28 -1.26 -4.57 120.64 119.42 1g18 n GLU 33 Ca 0.21 -0.14 -0.12 0.00 -0.16 0.00 0.00 57.16 56.95 1g18 n GLU 33 Cb 0.27 -1.50 0.01 0.00 1.43 0.00 0.00 31.44 31.65 1g18 n GLU 33 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1g18 n ALA 34 N -1.15 -2.94 -0.88 -1.84 0.00 -1.26 -4.90 120.51 107.54 1g18 n ALA 34 Ca 0.12 -0.15 0.07 0.00 0.00 0.00 0.00 53.44 53.49 1g18 n ALA 34 Cb 0.29 -0.41 -0.03 0.00 0.00 0.00 0.00 19.45 19.29 1g18 n ALA 34 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1g18 n ARG 35 N 0.70 -1.30 0.00 0.00 -4.01 -1.26 -4.96 116.66 105.84 1g18 n ARG 35 Ca 0.01 1.03 0.00 0.00 -1.04 0.00 0.00 57.85 57.85 1g18 n ARG 35 Cb 0.17 -1.84 0.00 0.00 -3.04 0.00 0.00 32.46 27.76 1g18 n ARG 35 CO 0.00 0.00 0.00 0.94 -3.04 0.00 0.00 177.63 175.53 1g18 n GLN 36 N -3.29 0.00 -1.01 2.89 7.27 -1.26 -4.91 117.38 117.07 1g18 n GLN 36 Ca -0.03 0.00 -0.17 0.00 0.07 0.00 0.00 57.00 56.87 1g18 n GLN 36 Cb 0.40 0.00 0.13 0.00 2.41 0.00 0.00 30.24 33.17 1g18 n GLN 36 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 1g18 n PRO 37 N 0.00 -1.09 0.01 3.69 -0.04 -1.26 -5.00 135.00 131.31 1g18 n PRO 37 Ca 0.00 -1.17 0.11 0.00 -0.04 0.00 0.00 63.50 62.40 1g18 n PRO 37 Cb 0.00 -0.84 -0.12 0.00 -0.04 0.00 0.00 33.50 32.50 1g18 n PRO 37 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1g18 n ILE 38 N -3.26 0.11 -3.28 0.52 -6.64 -1.26 -4.83 119.36 100.72 1g18 n ILE 38 Ca 0.10 -0.43 -0.44 0.00 -1.77 0.00 0.00 62.75 60.21 1g18 n ILE 38 Cb 0.34 0.08 -0.07 0.00 -1.44 0.00 0.00 39.64 38.54 1g18 n ILE 38 CO 0.00 0.00 0.00 -0.94 -1.77 0.00 0.00 176.55 173.84 1g18 s SER 39 N -4.42 6.19 -0.29 7.28 1.04 -1.26 -5.02 113.70 117.21 1g18 s SER 39 Ca -0.04 -1.03 -0.12 0.00 0.48 0.00 0.00 55.95 55.24 1g18 s SER 39 Cb 0.14 -2.24 0.12 0.00 0.10 0.00 0.00 66.02 64.14 1g18 s SER 39 CO 0.88 -0.74 0.69 -0.69 0.98 0.00 0.00 173.24 174.35 1g18 s VAL 40 N 2.16 -0.70 -0.37 5.02 1.01 -1.26 -4.15 120.40 122.11 1g18 s VAL 40 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 61.98 61.86 1g18 s VAL 40 Cb -0.21 -1.00 0.01 0.00 0.00 0.00 0.00 36.38 35.18 1g18 s VAL 40 CO 0.10 0.00 0.72 -0.63 0.00 0.00 0.00 175.10 175.29 1g18 s ILE 41 N 2.52 4.79 0.71 2.22 1.01 -1.13 -4.80 121.20 126.52 1g18 s ILE 41 Ca -0.07 0.68 -0.16 0.00 0.00 0.00 0.00 60.65 61.10 1g18 s ILE 41 Cb -0.10 -4.17 0.03 0.00 0.01 0.00 0.00 42.46 38.23 1g18 s ILE 41 CO -0.19 -0.43 1.25 -2.84 0.00 0.00 0.00 174.94 172.74 1g18 s PRO 42 N 2.95 2.21 0.05 2.79 0.02 -1.26 -0.22 135.00 141.54 1g18 s PRO 42 Ca 0.28 1.92 0.15 0.00 0.02 0.00 0.00 61.00 63.37 1g18 s PRO 42 Cb -0.14 -1.82 -0.15 0.00 0.02 0.00 0.00 34.50 32.41 1g18 s PRO 42 CO 0.17 -1.83 0.84 1.79 -0.33 0.00 0.00 177.00 177.64 1g18 h THR 43 N -0.02 0.68 0.00 0.99 1.35 -1.92 -3.42 112.91 110.57 1g18 h THR 43 Ca -0.49 -2.29 0.00 0.00 -0.55 0.00 0.00 66.41 63.08 1g18 h THR 43 Cb 1.32 2.21 0.00 0.00 -1.73 0.00 0.00 68.15 69.95 1g18 h THR 43 CO 0.50 0.39 0.00 0.61 -0.25 0.00 0.00 175.52 176.77 1g18 n GLY 44 N 1.43 1.47 2.99 5.82 0.00 -1.26 -4.35 105.19 111.29 1g18 n GLY 44 Ca -0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.62 1g18 n GLY 44 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1g18 s SER 45 N -1.47 2.52 0.46 1.61 1.04 -1.26 -4.27 113.70 112.34 1g18 s SER 45 Ca 0.00 -0.43 0.22 0.00 0.48 0.00 0.00 55.95 56.22 1g18 s SER 45 Cb 0.00 -1.08 1.22 0.00 0.10 0.00 0.00 66.02 66.26 1g18 s SER 45 CO 0.00 -0.07 1.87 -0.29 0.98 0.00 0.00 173.24 175.73 1g18 h ILE 46 N 6.08 0.65 0.59 -1.02 6.09 -1.91 0.20 117.51 128.19 1g18 h ILE 46 Ca -0.36 -0.09 -0.03 0.00 -1.37 0.00 0.00 64.86 63.02 1g18 h ILE 46 Cb 1.14 0.36 0.01 0.00 0.47 0.00 0.00 36.82 38.79 1g18 h ILE 46 CO 0.49 0.05 -0.28 0.00 -3.07 0.00 0.00 178.15 175.34 1g18 h ALA 47 N 1.61 -0.79 -0.47 0.18 0.00 -1.91 0.00 119.26 117.88 1g18 h ALA 47 Ca 0.44 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 1g18 h ALA 47 Cb 1.31 0.30 -0.02 0.00 0.00 0.00 0.00 17.79 19.38 1g18 h ALA 47 CO -0.12 -0.89 0.19 1.25 0.00 0.00 0.00 179.25 179.67 1g18 h LEU 48 N -0.89 0.61 0.20 0.00 6.46 -1.75 0.28 115.31 120.23 1g18 h LEU 48 Ca -0.08 -0.07 0.01 0.00 -0.12 0.00 0.00 57.88 57.62 1g18 h LEU 48 Cb 0.64 -0.16 -0.04 0.00 -0.73 0.00 0.00 40.66 40.38 1g18 h LEU 48 CO 0.13 0.55 -0.36 0.44 -0.62 0.00 0.00 178.44 178.58 1g18 h ASP 49 N 0.67 -1.04 1.46 1.25 3.32 -0.54 -0.49 116.42 121.04 1g18 h ASP 49 Ca 0.16 0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.31 1g18 h ASP 49 Cb 0.14 0.38 -0.00 0.00 0.22 0.00 0.00 39.33 40.06 1g18 h ASP 49 CO -0.02 -0.47 -0.04 -0.37 -1.72 0.00 0.00 179.24 176.63 1g18 h VAL 50 N -0.65 0.08 0.00 -1.35 -1.51 -0.57 -2.24 116.25 110.00 1g18 h VAL 50 Ca 0.01 -0.84 0.00 0.00 -1.23 0.00 0.00 66.70 64.64 1g18 h VAL 50 Cb 0.64 1.78 0.00 0.00 -2.13 0.00 0.00 31.29 31.58 1g18 h VAL 50 CO -0.16 0.04 0.00 0.00 -1.23 0.00 0.00 177.57 176.21 1g18 n ALA 51 N -2.11 1.87 0.71 5.19 0.00 0.96 -0.24 120.51 126.89 1g18 n ALA 51 Ca 0.02 0.04 0.12 0.00 0.00 0.00 0.00 53.44 53.62 1g18 n ALA 51 Cb 0.43 -1.41 0.16 0.00 0.00 0.00 0.00 19.45 18.63 1g18 n ALA 51 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1g18 n LEU 52 N -2.21 0.62 0.00 0.00 4.77 -0.25 -4.55 117.00 115.37 1g18 n LEU 52 Ca 0.03 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 1g18 n LEU 52 Cb 0.29 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1g18 n LEU 52 CO 0.23 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.93 1g18 n GLY 53 N 1.40 1.41 0.00 -0.72 0.00 0.67 -4.54 105.19 103.41 1g18 n GLY 53 Ca 0.04 -0.01 0.04 0.00 0.00 0.00 0.00 46.02 46.09 1g18 n GLY 53 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1g18 n ILE 54 N 0.00 0.00 -1.32 -0.61 3.06 -1.26 -4.85 119.36 114.38 1g18 n ILE 54 Ca 0.00 0.00 -0.11 0.00 -2.50 0.00 0.00 62.75 60.14 1g18 n ILE 54 Cb 0.00 -0.42 -0.05 0.00 0.54 0.00 0.00 39.64 39.71 1g18 n ILE 54 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1g18 n GLY 55 N 0.14 1.21 0.00 4.50 0.00 -0.94 -4.84 105.19 105.25 1g18 n GLY 55 Ca 0.06 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.70 1g18 n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g18 n GLY 56 N -1.32 -1.12 3.87 -0.02 0.00 -1.20 -4.60 105.19 100.81 1g18 n GLY 56 Ca -0.11 -1.09 -0.30 0.00 0.00 0.00 0.00 46.02 44.52 1g18 n GLY 56 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1g18 s LEU 57 N 0.00 3.73 -0.01 0.99 1.43 0.70 -4.80 118.68 120.71 1g18 s LEU 57 Ca 0.00 1.21 -0.21 0.00 -1.03 0.00 0.00 54.13 54.10 1g18 s LEU 57 Cb 0.00 -4.12 -0.05 0.00 0.03 0.00 0.00 46.19 42.04 1g18 s LEU 57 CO 0.00 -0.49 0.62 -2.16 0.23 0.00 0.00 176.35 174.55 1g18 s PRO 58 N -4.09 4.35 0.80 1.29 0.04 -1.26 -2.82 135.00 133.30 1g18 s PRO 58 Ca 0.52 0.77 -0.12 0.00 0.04 0.00 0.00 61.00 62.22 1g18 s PRO 58 Cb -0.10 -3.36 0.07 0.00 0.04 0.00 0.00 34.50 31.15 1g18 s PRO 58 CO 0.34 0.33 1.12 1.03 0.04 0.00 0.00 177.00 179.86 1g18 s ARG 59 N -0.06 2.10 -1.59 4.56 0.52 -1.26 -3.92 118.95 119.29 1g18 s ARG 59 Ca 0.32 0.45 0.00 0.00 -0.52 0.00 0.00 55.73 55.98 1g18 s ARG 59 Cb -0.18 -1.94 0.00 0.00 0.52 0.00 0.00 34.95 33.35 1g18 s ARG 59 CO 0.18 -1.57 0.00 0.41 0.02 0.00 0.00 175.30 174.34 1g18 n GLY 60 N -2.55 0.30 3.10 -3.53 0.00 -1.17 -4.91 105.19 96.44 1g18 n GLY 60 Ca 0.07 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.01 1g18 n GLY 60 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1g18 s ARG 61 N -4.44 0.64 -0.23 1.61 0.52 -1.22 -3.18 118.95 112.64 1g18 s ARG 61 Ca 0.00 -1.23 -0.10 0.00 -0.52 0.00 0.00 55.73 53.88 1g18 s ARG 61 Cb 0.00 0.15 -0.05 0.00 0.52 0.00 0.00 34.95 35.57 1g18 s ARG 61 CO 0.00 -0.10 0.14 0.54 0.02 0.00 0.00 175.30 175.90 1g18 s VAL 62 N -3.85 5.17 0.12 3.52 0.11 -1.26 -1.70 120.40 122.52 1g18 s VAL 62 Ca 0.07 0.11 0.05 0.00 -2.93 0.00 0.00 61.98 59.29 1g18 s VAL 62 Cb 0.07 -3.40 -0.04 0.00 -1.53 0.00 0.00 36.38 31.48 1g18 s VAL 62 CO -0.09 0.36 0.02 -0.63 -3.33 0.00 0.00 175.10 171.43 1g18 s ILE 63 N 1.06 4.03 -0.10 7.04 1.09 0.21 -1.77 121.20 132.75 1g18 s ILE 63 Ca 0.07 -1.11 -0.00 0.00 -1.10 0.00 0.00 60.65 58.51 1g18 s ILE 63 Cb -0.14 -2.97 0.02 0.00 -1.06 0.00 0.00 42.46 38.32 1g18 s ILE 63 CO 0.04 0.03 -0.08 -0.70 -0.10 0.00 0.00 174.94 174.13 1g18 s GLU 64 N -2.59 1.53 -0.29 2.79 2.12 -0.48 -0.48 118.70 121.29 1g18 s GLU 64 Ca 0.27 -0.27 -0.04 0.00 0.36 0.00 0.00 54.97 55.29 1g18 s GLU 64 Cb -0.11 -1.54 0.03 0.00 0.26 0.00 0.00 34.13 32.77 1g18 s GLU 64 CO 0.19 -0.22 0.03 0.42 -0.54 0.00 0.00 175.26 175.14 1g18 s ILE 65 N 1.55 3.38 0.11 -3.70 1.01 -0.60 0.72 121.20 123.67 1g18 s ILE 65 Ca 0.02 -1.05 0.11 0.00 0.00 0.00 0.00 60.65 59.73 1g18 s ILE 65 Cb -0.13 -2.82 -0.04 0.00 0.01 0.00 0.00 42.46 39.48 1g18 s ILE 65 CO -0.06 0.01 -0.27 -0.72 0.00 0.00 0.00 174.94 173.90 1g18 s TYR 66 N 1.37 2.32 -0.26 3.97 -0.85 0.83 -2.05 117.35 122.68 1g18 s TYR 66 Ca -0.01 -0.39 0.00 0.00 -0.52 0.00 0.00 57.07 56.15 1g18 s TYR 66 Cb -0.18 -1.29 0.00 0.00 0.38 0.00 0.00 41.96 40.87 1g18 s TYR 66 CO -0.00 0.29 0.00 0.41 -1.52 0.00 0.00 175.55 174.73 1g18 n GLY 67 N 1.12 -1.20 3.78 5.49 0.00 -1.24 -1.93 105.19 111.22 1g18 n GLY 67 Ca -0.18 -0.97 -0.32 0.00 0.00 0.00 0.00 46.02 44.56 1g18 n GLY 67 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1g18 s PRO 68 N -1.43 2.63 0.76 1.61 0.02 -1.26 -1.25 135.00 136.08 1g18 s PRO 68 Ca 0.00 1.16 -0.15 0.00 0.02 0.00 0.00 61.00 62.03 1g18 s PRO 68 Cb 0.00 -1.94 0.03 0.00 0.02 0.00 0.00 34.50 32.60 1g18 s PRO 68 CO 0.00 -1.35 0.99 0.39 -0.33 0.00 0.00 177.00 176.70 1g18 n GLU 69 N -3.07 0.38 -3.28 5.54 1.02 -1.26 -3.77 120.64 116.21 1g18 n GLU 69 Ca 0.09 0.19 -0.36 0.00 -0.02 0.00 0.00 57.16 57.06 1g18 n GLU 69 Cb 0.53 -2.25 0.04 0.00 -0.02 0.00 0.00 31.44 29.73 1g18 n GLU 69 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1g18 n SER 70 N -2.06 -4.89 0.00 1.62 7.64 -1.26 -4.97 113.62 109.69 1g18 n SER 70 Ca 0.13 -0.17 0.00 0.00 1.01 0.00 0.00 58.87 59.84 1g18 n SER 70 Cb 0.50 -1.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.27 1g18 n SER 70 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1g18 n SER 71 N -0.12 0.00 0.00 6.43 3.41 -1.25 -4.71 113.62 117.39 1g18 n SER 71 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.52 1g18 n SER 71 Cb 0.62 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.58 1g18 n SER 71 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1g18 n GLY 72 N 1.45 0.53 0.00 5.00 0.00 -1.26 -4.27 105.19 106.64 1g18 n GLY 72 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1g18 n GLY 72 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1g18 n LYS 73 N 0.00 0.00 -0.29 1.61 5.02 -1.26 0.12 118.16 123.36 1g18 n LYS 73 Ca 0.00 0.00 0.22 0.00 -2.02 0.00 0.00 58.31 56.51 1g18 n LYS 73 Cb 0.00 -0.10 0.41 0.00 -0.02 0.00 0.00 35.03 35.32 1g18 n LYS 73 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1g18 n THR 74 N 0.00 -0.37 0.28 -0.18 -1.04 -1.26 0.12 114.28 111.83 1g18 n THR 74 Ca 0.00 1.83 -0.17 0.00 -2.04 0.00 0.00 64.05 63.68 1g18 n THR 74 Cb 0.00 -2.85 -0.08 0.00 -1.82 0.00 0.00 70.33 65.58 1g18 n THR 74 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1g18 h THR 75 N 0.00 0.24 -0.73 12.58 2.02 -0.74 1.52 112.91 127.80 1g18 h THR 75 Ca 0.65 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.99 1g18 h THR 75 Cb 1.59 0.24 -0.11 0.00 -1.74 0.00 0.00 68.15 68.14 1g18 h THR 75 CO -0.74 0.00 0.18 0.58 0.37 0.00 0.00 175.52 175.91 1g18 h VAL 76 N -0.84 0.53 0.57 3.16 2.07 0.22 0.36 116.25 122.32 1g18 h VAL 76 Ca -0.05 -0.09 -0.03 0.00 0.82 0.00 0.00 66.70 67.35 1g18 h VAL 76 Cb 0.72 0.23 0.01 0.00 -1.52 0.00 0.00 31.29 30.72 1g18 h VAL 76 CO -0.00 0.05 -0.27 0.00 0.02 0.00 0.00 177.57 177.36 1g18 h ALA 77 N 1.60 -0.76 0.00 1.67 0.00 0.14 0.25 119.26 122.16 1g18 h ALA 77 Ca 0.41 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1g18 h ALA 77 Cb 0.69 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1g18 h ALA 77 CO -0.50 -0.92 -0.01 -0.07 0.00 0.00 0.00 179.25 177.75 1g18 h LEU 78 N -0.79 0.00 -0.12 0.00 3.38 0.30 0.46 115.31 118.54 1g18 h LEU 78 Ca -0.08 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 1g18 h LEU 78 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 1g18 h LEU 78 CO 0.13 0.01 -0.33 0.45 0.09 0.00 0.00 178.44 178.80 1g18 h HIS 79 N 0.00 0.56 0.00 1.13 3.86 0.77 0.24 115.15 121.71 1g18 h HIS 79 Ca -0.00 -0.22 -0.02 0.00 -1.16 0.00 0.00 60.37 58.97 1g18 h HIS 79 Cb 0.04 -0.10 -0.00 0.00 1.06 0.00 0.00 27.41 28.41 1g18 h HIS 79 CO 0.00 0.94 -0.10 0.00 0.86 0.00 0.00 177.93 179.63 1g18 h ALA 80 N 0.51 1.37 -0.03 2.45 0.00 0.24 -1.25 119.26 122.55 1g18 h ALA 80 Ca -0.01 -0.09 -0.16 0.00 0.00 0.00 0.00 54.91 54.65 1g18 h ALA 80 Cb 0.94 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.73 1g18 h ALA 80 CO 0.07 0.12 -0.62 0.28 0.00 0.00 0.00 179.25 179.11 1g18 h VAL 81 N 0.00 1.39 0.00 0.00 2.07 0.29 -2.83 116.25 117.18 1g18 h VAL 81 Ca -0.00 -2.02 -0.03 0.00 0.82 0.00 0.00 66.70 65.47 1g18 h VAL 81 Cb 0.26 2.45 -0.00 0.00 -1.52 0.00 0.00 31.29 32.48 1g18 h VAL 81 CO 0.01 0.60 -0.15 0.00 0.02 0.00 0.00 177.57 178.05 1g18 h ALA 82 N 0.38 1.31 0.12 1.67 0.00 0.60 -2.72 119.26 120.61 1g18 h ALA 82 Ca -0.07 -0.14 -0.28 0.00 0.00 0.00 0.00 54.91 54.43 1g18 h ALA 82 Cb 1.30 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 1g18 h ALA 82 CO 0.12 0.19 -1.42 -0.91 0.00 0.00 0.00 179.25 177.23 1g18 h ASN 83 N 0.00 0.38 0.10 0.00 2.35 -1.44 -2.42 115.58 114.55 1g18 h ASN 83 Ca -0.00 -0.86 0.00 0.00 -0.55 0.00 0.00 56.30 54.89 1g18 h ASN 83 Cb 0.39 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1g18 h ASN 83 CO 0.02 1.62 0.00 0.00 -1.65 0.00 0.00 177.43 177.42 1g18 n ALA 84 N -2.96 1.87 -0.13 -0.83 0.00 -1.07 -2.21 120.51 115.19 1g18 n ALA 84 Ca -0.25 -0.07 -0.26 0.00 0.00 0.00 0.00 53.44 52.86 1g18 n ALA 84 Cb 0.90 -1.21 -0.10 0.00 0.00 0.00 0.00 19.45 19.05 1g18 n ALA 84 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1g18 n GLN 85 N -1.13 0.56 0.08 0.00 7.27 -1.03 -2.98 117.38 120.16 1g18 n GLN 85 Ca 0.08 0.22 0.04 0.00 0.07 0.00 0.00 57.00 57.42 1g18 n GLN 85 Cb 0.07 -1.44 0.23 0.00 2.41 0.00 0.00 30.24 31.52 1g18 n GLN 85 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1g18 n ALA 86 N -3.97 0.83 -2.15 1.69 0.00 -0.91 -0.69 120.51 115.30 1g18 n ALA 86 Ca -0.50 0.08 -0.29 0.00 0.00 0.00 0.00 53.44 52.73 1g18 n ALA 86 Cb 0.88 -0.94 0.02 0.00 0.00 0.00 0.00 19.45 19.42 1g18 n ALA 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1g18 n ALA 87 N -1.54 5.44 -0.67 0.00 0.00 -1.20 -4.94 120.51 117.61 1g18 n ALA 87 Ca -0.01 -4.07 0.00 0.00 0.00 0.00 0.00 53.44 49.36 1g18 n ALA 87 Cb 0.13 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 18.71 1g18 n ALA 87 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1g18 n GLY 88 N -0.59 0.00 3.92 0.00 0.00 0.13 -4.94 105.19 103.70 1g18 n GLY 88 Ca 0.45 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.18 1g18 n GLY 88 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1g18 s GLY 89 N -1.37 1.68 0.07 -0.02 0.00 -1.16 -5.03 107.32 101.49 1g18 s GLY 89 Ca 0.00 -0.92 0.08 0.00 0.00 0.00 0.00 44.72 43.87 1g18 s GLY 89 CO 0.00 -0.30 -0.21 0.54 0.00 0.00 0.00 173.10 173.13 1g18 s VAL 90 N -3.72 1.70 0.15 1.40 0.11 -1.26 -4.50 120.40 114.28 1g18 s VAL 90 Ca 0.68 -1.33 0.07 0.00 -2.93 0.00 0.00 61.98 58.47 1g18 s VAL 90 Cb -0.08 -1.50 -0.04 0.00 -1.53 0.00 0.00 36.38 33.23 1g18 s VAL 90 CO 0.51 0.11 -0.16 0.00 -3.33 0.00 0.00 175.10 172.23 1g18 s ALA 91 N -0.93 1.78 -0.02 1.54 0.00 -1.26 -0.92 121.76 121.95 1g18 s ALA 91 Ca 0.07 -1.41 0.05 0.00 0.00 0.00 0.00 51.96 50.67 1g18 s ALA 91 Cb -0.09 -0.13 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 1g18 s ALA 91 CO 0.03 0.17 -0.16 0.00 0.00 0.00 0.00 175.76 175.80 1g18 s ALA 92 N -2.11 1.36 -0.29 0.00 0.00 -1.11 -1.02 121.76 118.59 1g18 s ALA 92 Ca 0.13 -0.67 0.02 0.00 0.00 0.00 0.00 51.96 51.43 1g18 s ALA 92 Cb -0.05 -0.39 0.07 0.00 0.00 0.00 0.00 23.12 22.75 1g18 s ALA 92 CO 0.05 0.30 -0.05 0.12 0.00 0.00 0.00 175.76 176.19 1g18 s PHE 93 N -0.23 3.36 -0.77 0.00 2.19 0.62 -1.54 117.98 121.61 1g18 s PHE 93 Ca 0.03 -2.32 -0.21 0.00 0.33 0.00 0.00 56.93 54.75 1g18 s PHE 93 Cb -0.08 -2.18 0.09 0.00 -1.31 0.00 0.00 43.02 39.54 1g18 s PHE 93 CO 0.00 -0.88 1.05 0.42 1.83 0.00 0.00 175.22 177.65 1g18 s ILE 94 N 1.11 4.41 -0.07 3.12 1.09 0.10 -1.45 121.20 129.51 1g18 s ILE 94 Ca -0.04 -0.76 -0.27 0.00 -1.10 0.00 0.00 60.65 58.47 1g18 s ILE 94 Cb -0.20 -4.74 -0.02 0.00 -1.06 0.00 0.00 42.46 36.43 1g18 s ILE 94 CO -0.04 -1.51 0.89 -0.62 -0.10 0.00 0.00 174.94 173.55 1g18 s ASP 95 N 3.75 7.17 0.00 3.58 2.15 0.34 -1.06 116.67 132.60 1g18 s ASP 95 Ca 0.27 1.42 0.00 0.00 0.43 0.00 0.00 52.55 54.68 1g18 s ASP 95 Cb -0.12 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 40.00 1g18 s ASP 95 CO 0.03 -0.29 0.40 0.00 -0.17 0.00 0.00 175.17 175.13 1g18 n ALA 96 N 4.36 1.29 -0.00 3.66 0.00 -1.24 -4.00 120.51 124.57 1g18 n ALA 96 Ca 0.05 -0.40 0.01 0.00 0.00 0.00 0.00 53.44 53.10 1g18 n ALA 96 Cb 0.50 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.94 1g18 n ALA 96 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1g18 n GLU 97 N -0.07 0.62 -2.93 0.00 -0.58 -1.26 -4.84 120.64 111.58 1g18 n GLU 97 Ca 0.00 -0.01 -0.08 0.00 -0.42 0.00 0.00 57.16 56.65 1g18 n GLU 97 Cb 0.21 -1.04 0.04 0.00 -0.57 0.00 0.00 31.44 30.07 1g18 n GLU 97 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1g18 n HIS 98 N -1.64 -2.27 -2.38 -0.32 8.25 -1.26 -4.99 115.22 110.61 1g18 n HIS 98 Ca -0.01 0.82 -0.03 0.00 -0.26 0.00 0.00 57.72 58.24 1g18 n HIS 98 Cb 0.12 -3.83 0.03 0.00 1.12 0.00 0.00 29.99 27.43 1g18 n HIS 98 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1g18 n ALA 99 N -2.46 3.20 -2.23 -1.41 0.00 -1.26 -5.11 120.51 111.24 1g18 n ALA 99 Ca -0.04 -1.13 -0.38 0.00 0.00 0.00 0.00 53.44 51.89 1g18 n ALA 99 Cb 0.56 -0.61 -0.06 0.00 0.00 0.00 0.00 19.45 19.34 1g18 n ALA 99 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1g18 s LEU 100 N -1.97 4.47 -0.41 0.00 2.96 -1.26 -5.04 118.68 117.43 1g18 s LEU 100 Ca 0.09 1.30 0.00 0.00 -0.22 0.00 0.00 54.13 55.30 1g18 s LEU 100 Cb 0.24 -3.14 0.11 0.00 0.50 0.00 0.00 46.19 43.91 1g18 s LEU 100 CO -0.07 0.19 0.17 -0.62 -1.32 0.00 0.00 176.35 174.70 1g18 s ASP 101 N -1.33 4.99 0.39 3.68 2.15 -1.26 -4.99 116.67 120.30 1g18 s ASP 101 Ca 0.34 -2.24 0.19 0.00 0.43 0.00 0.00 52.55 51.28 1g18 s ASP 101 Cb -0.19 -1.74 1.14 0.00 -0.30 0.00 0.00 42.92 41.84 1g18 s ASP 101 CO 0.20 -0.44 1.73 -0.65 -0.17 0.00 0.00 175.17 175.84 1g18 h PRO 102 N 7.66 0.34 0.00 4.34 0.11 -1.98 -1.04 132.00 141.43 1g18 h PRO 102 Ca -0.08 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 66.02 1g18 h PRO 102 Cb 1.02 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.03 1g18 h PRO 102 CO 0.63 0.22 -0.07 -0.44 -0.21 0.00 0.00 178.00 178.14 1g18 h ASP 103 N 0.35 -0.19 -0.75 -2.05 3.32 -1.98 0.19 116.42 115.30 1g18 h ASP 103 Ca 0.65 0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.69 1g18 h ASP 103 Cb 1.69 0.08 -0.03 0.00 0.22 0.00 0.00 39.33 41.29 1g18 h ASP 103 CO -0.36 -0.10 0.30 0.22 -1.72 0.00 0.00 179.24 177.58 1g18 h TYR 104 N -0.12 1.14 0.02 4.55 3.20 -1.57 -0.00 116.97 124.19 1g18 h TYR 104 Ca 0.03 -0.08 -0.00 0.00 3.14 0.00 0.00 58.73 61.81 1g18 h TYR 104 Cb 0.15 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 38.08 1g18 h TYR 104 CO -0.14 0.87 -0.01 0.00 -1.64 0.00 0.00 178.16 177.24 1g18 h ALA 105 N 1.15 -0.03 -1.00 1.82 0.00 -1.07 -0.92 119.26 119.21 1g18 h ALA 105 Ca 0.25 -0.03 0.10 0.00 0.00 0.00 0.00 54.91 55.22 1g18 h ALA 105 Cb 0.21 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.93 1g18 h ALA 105 CO -0.02 -0.49 0.64 1.57 0.00 0.00 0.00 179.25 180.94 1g18 h LYS 106 N -0.08 1.04 -0.27 0.00 5.09 -0.14 0.15 116.57 122.35 1g18 h LYS 106 Ca -0.00 -0.06 -0.08 0.00 0.09 0.00 0.00 60.65 60.59 1g18 h LYS 106 Cb 0.07 -0.23 -0.02 0.00 0.10 0.00 0.00 32.23 32.15 1g18 h LYS 106 CO 0.01 0.69 -0.17 1.57 -2.09 0.00 0.00 179.45 179.45 1g18 h LYS 107 N 1.07 0.49 0.00 0.07 2.10 -0.59 -1.61 116.57 118.10 1g18 h LYS 107 Ca 0.47 -0.15 -0.13 0.00 -2.00 0.00 0.00 60.65 58.84 1g18 h LYS 107 Cb 0.34 -0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 31.61 1g18 h LYS 107 CO -0.22 0.64 -0.60 -0.07 -2.00 0.00 0.00 179.45 177.20 1g18 h LEU 108 N 0.44 0.00 0.00 7.07 3.38 0.55 -3.47 115.31 123.28 1g18 h LEU 108 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1g18 h LEU 108 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1g18 h LEU 108 CO 0.04 0.60 0.00 0.61 0.09 0.00 0.00 178.44 179.78 1g18 n GLY 109 N 0.43 0.64 3.70 0.83 0.00 0.27 -4.97 105.19 106.09 1g18 n GLY 109 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1g18 n GLY 109 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g18 s VAL 110 N -1.40 3.93 -1.39 1.61 1.01 -0.53 -4.78 120.40 118.85 1g18 s VAL 110 Ca 0.00 1.36 -0.14 0.00 0.00 0.00 0.00 61.98 63.19 1g18 s VAL 110 Cb 0.00 -3.87 0.01 0.00 0.00 0.00 0.00 36.38 32.52 1g18 s VAL 110 CO 0.00 0.06 2.26 -0.67 0.00 0.00 0.00 175.10 176.75 1g18 n ASP 111 N 4.45 4.15 -0.43 3.32 2.03 -1.26 -4.07 116.55 124.73 1g18 n ASP 111 Ca 0.10 -2.79 0.36 0.00 0.52 0.00 0.00 54.79 52.98 1g18 n ASP 111 Cb 0.45 -1.59 0.59 0.00 -0.72 0.00 0.00 41.12 39.86 1g18 n ASP 111 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1g18 n THR 112 N 5.06 -0.17 -0.16 5.18 -2.24 -1.26 -0.40 114.28 120.29 1g18 n THR 112 Ca 0.54 1.45 -0.06 0.00 -2.27 0.00 0.00 64.05 63.71 1g18 n THR 112 Cb 0.37 -2.38 0.03 0.00 -2.10 0.00 0.00 70.33 66.25 1g18 n THR 112 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1g18 h ASP 113 N 0.00 0.45 0.87 3.42 5.19 -2.00 -2.36 116.42 121.99 1g18 h ASP 113 Ca 0.74 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 57.16 1g18 h ASP 113 Cb 2.53 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 41.95 1g18 h ASP 113 CO -0.31 0.32 -0.08 -1.20 -3.12 0.00 0.00 179.24 174.85 1g18 n SER 114 N -4.83 0.09 -4.59 6.45 7.64 0.46 -4.85 113.62 114.00 1g18 n SER 114 Ca 0.03 0.29 -0.42 0.00 1.01 0.00 0.00 58.87 59.79 1g18 n SER 114 Cb 0.08 -0.35 -0.03 0.00 -1.01 0.00 0.00 64.21 62.89 1g18 n SER 114 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1g18 s LEU 115 N -2.95 3.45 -0.44 -3.43 0.20 -0.89 -4.75 118.68 109.87 1g18 s LEU 115 Ca 0.15 1.44 -0.28 0.00 0.69 0.00 0.00 54.13 56.14 1g18 s LEU 115 Cb 0.19 -3.31 -0.02 0.00 -0.43 0.00 0.00 46.19 42.61 1g18 s LEU 115 CO 0.55 -2.01 1.87 -0.76 -0.29 0.00 0.00 176.35 175.71 1g18 s LEU 116 N 8.30 3.42 0.07 -0.68 1.02 -0.19 -4.87 118.68 125.74 1g18 s LEU 116 Ca 0.90 0.95 0.04 0.00 0.02 0.00 0.00 54.13 56.04 1g18 s LEU 116 Cb -0.25 -3.08 -0.04 0.00 0.02 0.00 0.00 46.19 42.84 1g18 s LEU 116 CO 0.32 -2.05 -0.03 -0.69 0.02 0.00 0.00 176.35 173.93 1g18 s VAL 117 N 8.12 3.87 0.04 -1.59 1.01 -1.26 0.23 120.40 130.82 1g18 s VAL 117 Ca 0.77 -0.95 -0.09 0.00 0.00 0.00 0.00 61.98 61.71 1g18 s VAL 117 Cb -0.19 -2.80 0.00 0.00 0.00 0.00 0.00 36.38 33.40 1g18 s VAL 117 CO 0.28 0.19 0.19 -0.94 0.00 0.00 0.00 175.10 174.82 1g18 s SER 118 N -2.05 0.04 -0.40 3.32 1.04 -0.53 -4.90 113.70 110.22 1g18 s SER 118 Ca 0.23 -0.36 0.07 0.00 0.48 0.00 0.00 55.95 56.36 1g18 s SER 118 Cb -0.11 0.28 0.23 0.00 0.10 0.00 0.00 66.02 66.52 1g18 s SER 118 CO 0.15 -0.54 0.50 0.00 0.98 0.00 0.00 173.24 174.33 1g18 n GLN 119 N 0.74 0.60 -0.91 4.02 6.02 -1.26 -0.51 117.38 126.09 1g18 n GLN 119 Ca -0.19 -3.13 -0.34 0.00 -0.01 0.00 0.00 57.00 53.33 1g18 n GLN 119 Cb 0.59 -1.32 0.09 0.00 1.02 0.00 0.00 30.24 30.62 1g18 n GLN 119 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1g18 n PRO 120 N 1.74 -0.14 -0.15 -1.09 -0.02 -1.26 -4.96 135.00 129.11 1g18 n PRO 120 Ca 0.22 -0.01 0.05 0.00 -2.02 0.00 0.00 63.50 61.74 1g18 n PRO 120 Cb 0.52 -1.59 0.13 0.00 -0.02 0.00 0.00 33.50 32.54 1g18 n PRO 120 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1g18 n ASP 121 N 0.22 2.81 -3.68 2.55 5.68 -1.26 -4.96 116.55 117.91 1g18 n ASP 121 Ca 0.05 -2.01 -0.15 0.00 -0.50 0.00 0.00 54.79 52.18 1g18 n ASP 121 Cb 0.54 -0.20 -0.08 0.00 -1.14 0.00 0.00 41.12 40.23 1g18 n ASP 121 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1g18 s THR 122 N -1.01 0.03 0.17 2.12 -4.23 -1.26 -4.99 115.64 106.46 1g18 s THR 122 Ca 0.20 -0.23 -0.15 0.00 -1.18 0.00 0.00 61.69 60.33 1g18 s THR 122 Cb 0.11 -0.73 0.04 0.00 1.34 0.00 0.00 72.50 73.26 1g18 s THR 122 CO 0.14 -0.13 1.81 1.23 -0.54 0.00 0.00 174.62 177.13 1g18 h GLY 123 N 3.98 0.64 0.39 3.99 0.00 -0.42 -2.15 103.07 109.51 1g18 h GLY 123 Ca -0.28 -0.22 0.04 0.00 0.00 0.00 0.00 47.33 46.87 1g18 h GLY 123 CO 0.35 0.20 -0.22 0.83 0.00 0.00 0.00 176.54 177.70 1g18 h GLU 124 N 0.57 -0.30 -0.84 4.80 5.08 -1.79 0.13 114.58 122.23 1g18 h GLU 124 Ca 0.18 0.02 0.13 0.00 -1.00 0.00 0.00 59.36 58.68 1g18 h GLU 124 Cb -0.02 0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.24 1g18 h GLU 124 CO -0.07 -0.20 0.55 0.37 -1.00 0.00 0.00 179.01 178.66 1g18 h GLN 125 N -0.31 0.66 -0.16 2.33 4.15 -1.93 -1.87 115.11 117.97 1g18 h GLN 125 Ca 0.08 -0.04 0.02 0.00 0.77 0.00 0.00 58.65 59.49 1g18 h GLN 125 Cb 0.43 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.95 1g18 h GLN 125 CO -0.26 0.44 0.02 0.00 -1.93 0.00 0.00 178.83 177.10 1g18 h ALA 126 N 1.60 0.16 -0.08 3.38 0.00 -0.08 -2.05 119.26 122.19 1g18 h ALA 126 Ca 0.41 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.26 1g18 h ALA 126 Cb 0.63 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1g18 h ALA 126 CO -0.17 -0.42 -0.39 -0.07 0.00 0.00 0.00 179.25 178.19 1g18 h LEU 127 N 0.08 0.17 -0.24 0.00 3.38 -0.77 -3.00 115.31 114.94 1g18 h LEU 127 Ca 0.07 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1g18 h LEU 127 Cb 0.08 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1g18 h LEU 127 CO -0.11 0.56 -0.05 -0.33 0.09 0.00 0.00 178.44 178.60 1g18 h GLU 128 N 0.14 0.47 -0.75 1.13 4.39 -1.12 0.31 114.58 119.16 1g18 h GLU 128 Ca 0.01 -0.18 0.11 0.00 0.34 0.00 0.00 59.36 59.64 1g18 h GLU 128 Cb 0.76 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 29.34 1g18 h GLU 128 CO 0.06 0.69 0.49 0.82 -1.16 0.00 0.00 179.01 179.91 1g18 h ILE 129 N 0.21 0.91 -0.16 3.13 2.04 -1.34 0.49 117.51 122.80 1g18 h ILE 129 Ca 0.06 -0.21 -0.14 0.00 1.00 0.00 0.00 64.86 65.57 1g18 h ILE 129 Cb 0.51 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1g18 h ILE 129 CO 0.02 0.11 -0.52 0.00 0.00 0.00 0.00 178.15 177.77 1g18 h ALA 130 N 1.63 0.82 0.45 1.87 0.00 -1.27 -1.38 119.26 121.38 1g18 h ALA 130 Ca 0.35 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1g18 h ALA 130 Cb 0.53 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1g18 h ALA 130 CO -0.13 0.68 -0.22 0.22 0.00 0.00 0.00 179.25 179.80 1g18 h ASP 131 N 0.34 -0.52 0.22 0.00 3.58 0.21 -0.97 116.42 119.28 1g18 h ASP 131 Ca 0.01 -0.09 -0.08 0.00 0.42 0.00 0.00 57.03 57.30 1g18 h ASP 131 Cb 1.02 0.13 -0.01 0.00 1.72 0.00 0.00 39.33 42.20 1g18 h ASP 131 CO 0.09 -0.12 -0.30 0.00 -2.88 0.00 0.00 179.24 176.03 1g18 h MET 132 N -1.00 0.14 -0.64 0.28 -0.00 -1.19 0.50 114.93 113.01 1g18 h MET 132 Ca -0.06 -0.05 -0.06 0.00 -0.00 0.00 0.00 59.70 59.53 1g18 h MET 132 Cb 0.57 -0.01 -0.03 0.00 -0.00 0.00 0.00 31.60 32.13 1g18 h MET 132 CO 0.10 0.43 0.16 1.25 -0.00 0.00 0.00 176.91 178.86 1g18 h LEU 133 N 0.12 0.94 0.40 -0.10 5.85 -1.27 -2.90 115.31 118.37 1g18 h LEU 133 Ca 0.02 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.53 1g18 h LEU 133 Cb 0.60 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.38 1g18 h LEU 133 CO 0.04 0.91 -0.19 0.40 -0.34 0.00 0.00 178.44 179.26 1g18 h ILE 134 N 0.96 0.37 -0.15 4.05 2.04 -0.20 -3.25 117.51 121.34 1g18 h ILE 134 Ca 0.21 -0.62 0.04 0.00 1.00 0.00 0.00 64.86 65.49 1g18 h ILE 134 Cb 0.33 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1g18 h ILE 134 CO -0.00 0.08 0.71 0.03 0.00 0.00 0.00 178.15 178.97 1g18 h ARG 135 N -1.00 0.00 0.00 2.37 3.08 0.11 -0.22 114.38 118.73 1g18 h ARG 135 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1g18 h ARG 135 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1g18 h ARG 135 CO 0.09 0.00 0.00 0.66 -1.07 0.00 0.00 179.97 179.65 1g18 h SER 136 N 0.00 0.00 -1.01 7.04 4.64 -1.54 -3.46 113.55 119.21 1g18 h SER 136 Ca 0.07 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.12 1g18 h SER 136 Cb 1.50 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.51 1g18 h SER 136 CO -0.00 0.00 -0.28 0.61 -0.87 0.00 0.00 176.83 176.29 1g18 n GLY 137 N 0.08 0.98 0.12 -0.77 0.00 -0.09 -4.87 105.19 100.63 1g18 n GLY 137 Ca 0.01 -0.36 -0.25 0.00 0.00 0.00 0.00 46.02 45.42 1g18 n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g18 n ALA 138 N 0.44 0.97 -1.77 4.61 0.00 -1.26 -4.97 120.51 118.53 1g18 n ALA 138 Ca -0.14 -0.75 -0.40 0.00 0.00 0.00 0.00 53.44 52.15 1g18 n ALA 138 Cb 0.50 -0.29 -0.02 0.00 0.00 0.00 0.00 19.45 19.63 1g18 n ALA 138 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1g18 s LEU 139 N -7.66 4.37 -0.24 0.00 2.01 -1.26 -4.46 118.68 111.45 1g18 s LEU 139 Ca -0.33 2.49 -0.10 0.00 0.01 0.00 0.00 54.13 56.21 1g18 s LEU 139 Cb 0.09 -3.77 -0.17 0.00 0.01 0.00 0.00 46.19 42.36 1g18 s LEU 139 CO 0.56 -0.51 -0.10 0.47 1.01 0.00 0.00 176.35 177.79 1g18 n ASP 140 N 0.63 1.97 -4.00 2.29 9.92 -0.09 -4.48 116.55 122.79 1g18 n ASP 140 Ca 0.01 0.20 -0.22 0.00 -0.53 0.00 0.00 54.79 54.26 1g18 n ASP 140 Cb 0.44 -0.74 -0.16 0.00 -0.64 0.00 0.00 41.12 40.02 1g18 n ASP 140 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 1g18 s ILE 141 N -2.49 0.90 -0.02 0.53 2.07 -1.22 -1.55 121.20 119.42 1g18 s ILE 141 Ca -0.33 -0.39 0.03 0.00 -1.41 0.00 0.00 60.65 58.55 1g18 s ILE 141 Cb 0.10 -0.82 -0.00 0.00 0.13 0.00 0.00 42.46 41.87 1g18 s ILE 141 CO 0.58 0.29 -0.12 0.54 -1.91 0.00 0.00 174.94 174.32 1g18 s VAL 142 N 0.42 1.03 -0.07 4.00 0.11 -0.98 -2.75 120.40 122.17 1g18 s VAL 142 Ca -0.08 -0.52 0.02 0.00 -2.93 0.00 0.00 61.98 58.47 1g18 s VAL 142 Cb -0.12 -0.89 0.02 0.00 -1.53 0.00 0.00 36.38 33.86 1g18 s VAL 142 CO 0.01 0.30 -0.10 0.54 -3.33 0.00 0.00 175.10 172.53 1g18 s VAL 143 N -0.03 0.97 -0.41 2.04 0.11 -0.59 -0.16 120.40 122.33 1g18 s VAL 143 Ca -0.00 -0.37 -0.14 0.00 -2.93 0.00 0.00 61.98 58.54 1g18 s VAL 143 Cb -0.08 -0.92 0.03 0.00 -1.53 0.00 0.00 36.38 33.89 1g18 s VAL 143 CO 0.00 0.32 0.29 -0.63 -3.33 0.00 0.00 175.10 171.76 1g18 s ILE 144 N 0.85 5.05 -0.39 7.04 1.09 -0.10 0.01 121.20 134.75 1g18 s ILE 144 Ca -0.11 -0.81 -0.29 0.00 -1.10 0.00 0.00 60.65 58.34 1g18 s ILE 144 Cb -0.15 -3.86 0.01 0.00 -1.06 0.00 0.00 42.46 37.40 1g18 s ILE 144 CO 0.01 -0.35 1.28 -0.62 -0.10 0.00 0.00 174.94 175.17 1g18 s ASP 145 N 1.82 6.56 0.07 3.58 -1.08 -0.22 -2.40 116.67 125.00 1g18 s ASP 145 Ca 0.04 0.87 0.00 0.00 -0.52 0.00 0.00 52.55 52.94 1g18 s ASP 145 Cb -0.20 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 38.72 1g18 s ASP 145 CO 0.08 -1.24 0.00 -0.24 0.52 0.00 0.00 175.17 174.30 1g18 n SER 146 N 8.06 -5.60 -0.05 -0.34 2.88 -1.10 -3.72 113.62 113.76 1g18 n SER 146 Ca 0.14 0.77 -0.14 0.00 -1.33 0.00 0.00 58.87 58.32 1g18 n SER 146 Cb 0.48 -3.07 -0.02 0.00 -0.75 0.00 0.00 64.21 60.85 1g18 n SER 146 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1g18 h VAL 147 N 2.16 1.29 0.00 2.46 2.07 -0.95 -3.20 116.25 120.08 1g18 h VAL 147 Ca 0.00 -1.80 0.00 0.00 0.82 0.00 0.00 66.70 65.72 1g18 h VAL 147 Cb 0.00 1.73 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 1g18 h VAL 147 CO 0.00 0.58 0.00 0.00 0.02 0.00 0.00 177.57 178.17 1g18 h ALA 148 N 0.75 1.00 -0.02 1.67 0.00 -1.93 -2.80 119.26 117.93 1g18 h ALA 148 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1g18 h ALA 148 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1g18 h ALA 148 CO 0.12 0.00 -0.14 0.00 0.00 0.00 0.00 179.25 179.24 1g18 n ALA 149 N -1.99 2.83 -0.79 0.00 0.00 -1.21 -4.49 120.51 114.85 1g18 n ALA 149 Ca -0.00 -0.50 -0.07 0.00 0.00 0.00 0.00 53.44 52.87 1g18 n ALA 149 Cb 0.20 -1.05 -0.10 0.00 0.00 0.00 0.00 19.45 18.50 1g18 n ALA 149 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1g18 n LEU 150 N 0.09 5.30 -4.66 0.00 4.32 -1.06 -4.81 117.00 116.17 1g18 n LEU 150 Ca 0.15 -2.86 -0.46 0.00 -0.02 0.00 0.00 56.01 52.82 1g18 n LEU 150 Cb 0.41 -1.30 -0.04 0.00 -1.62 0.00 0.00 43.42 40.87 1g18 n LEU 150 CO 0.21 1.41 1.15 1.33 -1.22 0.00 0.00 177.39 180.26 1g18 n VAL 151 N 2.06 0.13 -1.68 4.08 0.24 -1.26 -3.77 118.33 118.13 1g18 n VAL 151 Ca 0.25 -0.03 -0.38 0.00 -2.04 0.00 0.00 64.34 62.14 1g18 n VAL 151 Cb 0.74 -1.48 0.06 0.00 -1.47 0.00 0.00 33.84 31.69 1g18 n VAL 151 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 1g18 n PRO 152 N 3.16 1.09 -0.31 7.34 -0.02 -1.26 0.12 135.00 145.11 1g18 n PRO 152 Ca 0.16 0.42 0.07 0.00 -2.02 0.00 0.00 63.50 62.14 1g18 n PRO 152 Cb 0.28 -2.38 0.23 0.00 -0.02 0.00 0.00 33.50 31.61 1g18 n PRO 152 CO 0.00 0.00 0.00 0.07 1.98 0.00 0.00 175.50 177.55 1g18 h ARG 153 N 0.62 0.70 0.62 -0.52 -0.00 -1.92 0.14 114.38 114.02 1g18 h ARG 153 Ca -0.50 -0.04 -0.03 0.00 -0.00 0.00 0.00 59.98 59.41 1g18 h ARG 153 Cb 1.35 -0.16 -0.00 0.00 -0.00 0.00 0.00 29.97 31.16 1g18 h ARG 153 CO 0.53 0.46 -0.37 0.00 -0.00 0.00 0.00 179.97 180.59 1g18 h ALA 154 N 1.55 -1.20 0.00 0.08 0.00 -1.93 1.14 119.26 118.91 1g18 h ALA 154 Ca 0.48 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1g18 h ALA 154 Cb 0.63 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1g18 h ALA 154 CO -0.34 -1.16 0.09 1.49 0.00 0.00 0.00 179.25 179.34 1g18 h GLU 155 N -0.92 0.00 0.06 0.00 4.81 -1.68 0.13 114.58 116.97 1g18 h GLU 155 Ca -0.08 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 58.85 1g18 h GLU 155 Cb 0.74 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.09 1g18 h GLU 155 CO 0.09 0.00 -1.59 1.25 -0.73 0.00 0.00 179.01 178.03 1g18 h LEU 156 N 0.00 0.21 -0.31 1.64 5.85 0.46 -3.29 115.31 119.87 1g18 h LEU 156 Ca 0.00 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.37 1g18 h LEU 156 Cb 0.18 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.14 1g18 h LEU 156 CO 0.00 1.30 0.00 -0.33 -0.34 0.00 0.00 178.44 179.07 1g18 h GLU 157 N 0.04 0.00 0.00 1.25 5.08 0.38 -3.48 114.58 117.85 1g18 h GLU 157 Ca -0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1g18 h GLU 157 Cb 1.99 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.24 1g18 h GLU 157 CO 0.12 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.54 1g18 n GLY 158 N 0.87 1.58 3.50 -3.84 0.00 -0.26 -5.03 105.19 102.02 1g18 n GLY 158 Ca 0.04 -0.46 -0.40 0.00 0.00 0.00 0.00 46.02 45.19 1g18 n GLY 158 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1g18 n GLU 159 N 0.00 0.01 -4.04 1.61 1.02 -1.17 -4.90 120.64 113.18 1g18 n GLU 159 Ca 0.00 -1.09 -0.36 0.00 -0.02 0.00 0.00 57.16 55.70 1g18 n GLU 159 Cb 0.00 -2.68 -0.07 0.00 -0.02 0.00 0.00 31.44 28.67 1g18 n GLU 159 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1g18 s MET 160 N 7.17 3.27 0.00 3.49 1.00 -1.26 -4.58 119.30 128.39 1g18 s MET 160 Ca 0.70 -0.26 0.00 0.00 0.00 0.00 0.00 55.69 56.13 1g18 s MET 160 Cb 0.12 -3.03 0.00 0.00 0.00 0.00 0.00 34.83 31.92 1g18 s MET 160 CO 0.32 0.74 0.00 -2.39 0.00 0.00 0.00 175.02 173.69 1g18 n HIS 164 N 1.85 0.00 -3.29 -0.03 1.44 -1.26 -5.16 115.22 108.77 1g18 n HIS 164 Ca -0.18 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.53 1g18 n HIS 164 Cb 0.54 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.65 1g18 n HIS 164 CO 0.00 0.00 0.00 1.55 -2.81 0.00 0.00 176.34 175.08 1g18 n VAL 165 N 0.00 0.00 -2.14 0.61 3.14 -1.26 -5.00 118.33 113.67 1g18 n VAL 165 Ca 0.00 0.00 -0.04 0.00 -2.96 0.00 0.00 64.34 61.34 1g18 n VAL 165 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 1g18 n VAL 165 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1g18 n GLY 166 N 0.00 0.28 0.07 7.55 0.00 -1.26 -4.93 105.19 106.90 1g18 n GLY 166 Ca 0.00 -0.71 -0.11 0.00 0.00 0.00 0.00 46.02 45.20 1g18 n GLY 166 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1g18 h LEU 167 N -0.06 -0.01 0.00 0.99 3.38 -2.01 -3.39 115.31 114.22 1g18 h LEU 167 Ca -0.09 -0.73 0.00 0.00 0.09 0.00 0.00 57.88 57.16 1g18 h LEU 167 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1g18 h LEU 167 CO 0.10 0.83 0.00 1.67 0.09 0.00 0.00 178.44 181.13 1g18 n GLN 168 N -4.68 0.00 -1.73 1.13 -0.06 -1.26 -2.33 117.38 108.46 1g18 n GLN 168 Ca -0.08 0.57 -0.24 0.00 -2.00 0.00 0.00 57.00 55.25 1g18 n GLN 168 Cb 0.35 -1.24 -0.05 0.00 -4.06 0.00 0.00 30.24 25.24 1g18 n GLN 168 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1g18 s ALA 169 N -3.13 1.29 0.00 1.69 0.00 -1.26 -0.80 121.76 119.55 1g18 s ALA 169 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 51.96 51.20 1g18 s ALA 169 Cb 0.00 -4.49 0.00 0.00 0.00 0.00 0.00 23.12 18.63 1g18 s ALA 169 CO 0.00 -5.11 0.00 2.89 0.00 0.00 0.00 175.76 173.54 1g18 n ARG 170 N 8.92 0.00 -0.24 0.00 1.85 -1.21 -4.83 116.66 121.15 1g18 n ARG 170 Ca 0.40 0.00 0.04 0.00 -1.00 0.00 0.00 57.85 57.29 1g18 n ARG 170 Cb 0.48 0.00 0.14 0.00 -1.05 0.00 0.00 32.46 32.03 1g18 n ARG 170 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 1g18 h LEU 171 N 0.00 -0.21 0.83 2.89 5.85 -0.56 0.30 115.31 124.41 1g18 h LEU 171 Ca 0.00 0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.85 1g18 h LEU 171 Cb 0.00 0.27 0.01 0.00 0.37 0.00 0.00 40.66 41.31 1g18 h LEU 171 CO 0.00 -0.12 -0.40 0.24 -0.34 0.00 0.00 178.44 177.83 1g18 h MET 172 N 0.15 -1.07 -0.47 1.25 2.86 -1.53 -0.67 114.93 115.45 1g18 h MET 172 Ca 0.38 0.07 0.09 0.00 -2.06 0.00 0.00 59.70 58.19 1g18 h MET 172 Cb 0.65 0.24 -0.09 0.00 0.06 0.00 0.00 31.60 32.47 1g18 h MET 172 CO -0.57 -0.71 -0.11 0.77 1.06 0.00 0.00 176.91 177.35 1g18 h SER 173 N -1.17 -0.43 0.12 1.22 0.02 -1.52 1.26 113.55 113.06 1g18 h SER 173 Ca -0.11 0.14 0.01 0.00 -0.84 0.00 0.00 61.79 60.99 1g18 h SER 173 Cb 0.86 0.29 -0.04 0.00 0.14 0.00 0.00 62.40 63.64 1g18 h SER 173 CO 0.19 -0.15 -0.50 1.56 -1.14 0.00 0.00 176.83 176.78 1g18 h GLN 174 N 0.00 -0.70 -0.08 3.45 1.08 -0.37 0.27 115.11 118.76 1g18 h GLN 174 Ca 0.22 0.05 0.02 0.00 -1.45 0.00 0.00 58.65 57.50 1g18 h GLN 174 Cb 0.34 0.16 -0.02 0.00 -0.05 0.00 0.00 27.48 27.91 1g18 h GLN 174 CO -0.48 -0.46 -0.06 0.00 -0.95 0.00 0.00 178.83 176.87 1g18 h ALA 175 N -0.60 0.00 -0.74 3.87 0.00 -0.04 -2.10 119.26 119.65 1g18 h ALA 175 Ca -0.01 0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.05 1g18 h ALA 175 Cb 0.73 0.14 -0.08 0.00 0.00 0.00 0.00 17.79 18.57 1g18 h ALA 175 CO -0.27 -0.53 0.34 -0.07 0.00 0.00 0.00 179.25 178.72 1g18 h LEU 176 N -0.08 0.40 0.31 0.00 -0.00 0.21 2.55 115.31 118.69 1g18 h LEU 176 Ca 0.05 0.08 -0.01 0.00 -0.00 0.00 0.00 57.88 58.01 1g18 h LEU 176 Cb 0.16 0.02 -0.00 0.00 -0.00 0.00 0.00 40.66 40.84 1g18 h LEU 176 CO -0.13 0.20 -0.18 -0.09 -0.00 0.00 0.00 178.44 178.24 1g18 h ARG 177 N 0.54 -0.44 0.32 1.13 2.43 0.02 1.32 114.38 119.70 1g18 h ARG 177 Ca 0.38 0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.57 1g18 h ARG 177 Cb 0.49 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1g18 h ARG 177 CO -0.33 -0.30 -0.15 -0.22 -1.51 0.00 0.00 179.97 177.47 1g18 h LYS 178 N -0.46 -0.41 -0.01 0.20 3.64 -0.85 -3.25 116.57 115.43 1g18 h LYS 178 Ca -0.03 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1g18 h LYS 178 Cb 0.37 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1g18 h LYS 178 CO 0.04 -0.09 0.01 1.98 -2.27 0.00 0.00 179.45 179.12 1g18 h MET 179 N -0.78 0.00 -0.19 1.90 4.05 0.45 -1.50 114.93 118.86 1g18 h MET 179 Ca -0.04 0.00 -0.10 0.00 -0.28 0.00 0.00 59.70 59.27 1g18 h MET 179 Cb 0.51 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.30 1g18 h MET 179 CO 0.07 0.00 -0.34 0.00 0.23 0.00 0.00 176.91 176.88 1g18 h THR 180 N 0.00 1.29 0.75 -0.77 1.03 0.17 -3.25 112.91 112.12 1g18 h THR 180 Ca 0.01 -1.40 -0.04 0.00 -0.01 0.00 0.00 66.41 64.97 1g18 h THR 180 Cb 0.03 1.51 0.01 0.00 -1.07 0.00 0.00 68.15 68.62 1g18 h THR 180 CO -0.00 0.43 -0.36 1.23 -0.01 0.00 0.00 175.52 176.81 1g18 h GLY 181 N 1.09 -1.05 -0.06 2.99 0.00 -1.34 -3.20 103.07 101.50 1g18 h GLY 181 Ca 0.04 0.39 0.11 0.00 0.00 0.00 0.00 47.33 47.87 1g18 h GLY 181 CO 0.06 -0.38 -0.12 0.00 0.00 0.00 0.00 176.54 176.10 1g18 h ALA 182 N -0.99 0.37 -0.30 3.60 0.00 -1.64 -2.59 119.26 117.71 1g18 h ALA 182 Ca -0.10 0.21 0.04 0.00 0.00 0.00 0.00 54.91 55.05 1g18 h ALA 182 Cb 0.79 0.40 -0.06 0.00 0.00 0.00 0.00 17.79 18.92 1g18 h ALA 182 CO 0.17 -0.43 -0.39 -0.07 0.00 0.00 0.00 179.25 178.53 1g18 h LEU 183 N 0.01 -1.31 -2.30 0.00 3.38 -1.61 0.22 115.31 113.70 1g18 h LEU 183 Ca 0.26 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.40 1g18 h LEU 183 Cb 0.40 0.54 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1g18 h LEU 183 CO -0.55 -0.28 0.00 0.78 0.09 0.00 0.00 178.44 178.49 1g18 h ASN 184 N -0.27 0.00 -0.05 -0.43 -0.26 -1.47 0.45 115.58 113.56 1g18 h ASN 184 Ca 0.05 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.79 1g18 h ASN 184 Cb 0.41 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.67 1g18 h ASN 184 CO -0.42 0.00 0.00 0.59 -1.06 0.00 0.00 177.43 176.54 1g18 n ASN 185 N -2.73 2.70 0.00 5.81 3.02 0.54 -4.52 115.26 120.08 1g18 n ASN 185 Ca -0.02 -1.90 0.00 0.00 -0.03 0.00 0.00 54.58 52.63 1g18 n ASN 185 Cb 0.06 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 1g18 n ASN 185 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1g18 n SER 186 N 1.11 3.39 0.00 6.41 3.41 0.06 -5.05 113.62 122.95 1g18 n SER 186 Ca 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.76 1g18 n SER 186 Cb 0.55 0.36 0.00 0.00 -0.26 0.00 0.00 64.21 64.86 1g18 n SER 186 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1g18 n GLY 187 N 2.16 0.93 3.83 5.00 0.00 -0.14 -4.94 105.19 112.02 1g18 n GLY 187 Ca 0.00 -0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 1g18 n GLY 187 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1g18 s THR 188 N -2.00 5.08 -0.22 2.61 2.01 -1.24 -3.90 115.64 117.97 1g18 s THR 188 Ca 0.00 -0.14 -0.04 0.00 0.31 0.00 0.00 61.69 61.82 1g18 s THR 188 Cb 0.00 -3.27 -0.01 0.00 0.01 0.00 0.00 72.50 69.23 1g18 s THR 188 CO 0.00 0.46 -0.04 0.28 -0.69 0.00 0.00 174.62 174.64 1g18 s THR 189 N -1.13 3.43 -0.02 -0.82 -1.32 -0.59 -3.02 115.64 112.16 1g18 s THR 189 Ca 0.20 -0.47 -0.19 0.00 -1.21 0.00 0.00 61.69 60.01 1g18 s THR 189 Cb -0.12 -2.56 -0.05 0.00 -1.51 0.00 0.00 72.50 68.26 1g18 s THR 189 CO 0.10 0.42 0.55 0.00 -2.21 0.00 0.00 174.62 173.49 1g18 s ALA 190 N 1.45 3.51 -0.15 11.08 0.00 -0.69 -2.32 121.76 134.65 1g18 s ALA 190 Ca 0.05 -0.03 0.01 0.00 0.00 0.00 0.00 51.96 51.99 1g18 s ALA 190 Cb -0.14 -2.68 0.00 0.00 0.00 0.00 0.00 23.12 20.30 1g18 s ALA 190 CO -0.03 0.18 -0.19 0.42 0.00 0.00 0.00 175.76 176.15 1g18 s ILE 191 N -0.18 2.37 -0.15 0.00 1.01 0.78 0.65 121.20 125.68 1g18 s ILE 191 Ca 0.29 -0.88 -0.04 0.00 0.00 0.00 0.00 60.65 60.03 1g18 s ILE 191 Cb -0.18 -1.97 -0.03 0.00 0.01 0.00 0.00 42.46 40.29 1g18 s ILE 191 CO 0.16 0.53 -0.03 -0.36 0.00 0.00 0.00 174.94 175.24 1g18 s PHE 192 N 0.78 3.04 -0.26 3.97 0.40 0.37 -0.93 117.98 125.36 1g18 s PHE 192 Ca -0.07 -0.26 -0.17 0.00 -0.60 0.00 0.00 56.93 55.83 1g18 s PHE 192 Cb -0.16 -1.96 -0.03 0.00 0.51 0.00 0.00 43.02 41.38 1g18 s PHE 192 CO -0.00 -0.01 0.47 0.42 0.70 0.00 0.00 175.22 176.80 1g18 s ILE 193 N 0.32 5.10 0.12 0.64 1.09 -1.01 -1.56 121.20 125.91 1g18 s ILE 193 Ca -0.03 0.79 0.04 0.00 -1.10 0.00 0.00 60.65 60.34 1g18 s ILE 193 Cb -0.14 -3.79 -0.04 0.00 -1.06 0.00 0.00 42.46 37.43 1g18 s ILE 193 CO 0.03 0.11 0.12 0.21 -0.10 0.00 0.00 174.94 175.31 1g18 s ASN 194 N 1.55 5.59 -0.89 3.58 2.47 -0.87 -0.32 114.94 126.05 1g18 s ASN 194 Ca 0.19 -0.04 0.00 0.00 0.42 0.00 0.00 52.86 53.44 1g18 s ASN 194 Cb -0.16 -1.50 0.28 0.00 -1.45 0.00 0.00 41.25 38.42 1g18 s ASN 194 CO 0.09 0.12 1.15 1.67 -3.72 0.00 0.00 177.10 176.42 1g18 n GLN 195 N 0.07 3.61 0.00 0.43 7.27 -1.26 -3.62 117.38 123.88 1g18 n GLN 195 Ca -0.08 -4.61 0.00 0.00 0.07 0.00 0.00 57.00 52.38 1g18 n GLN 195 Cb 0.53 -2.40 0.00 0.00 2.41 0.00 0.00 30.24 30.78 1g18 n GLN 195 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1g18 n LEU 196 N 1.14 0.00 0.00 1.69 4.77 -0.38 -4.88 117.00 119.34 1g18 n LEU 196 Ca 0.28 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 1g18 n LEU 196 Cb 0.37 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 1g18 n LEU 196 CO 0.58 0.00 0.00 0.41 -1.33 0.00 0.00 177.39 177.05 1g18 n THR 211 N 0.00 0.00 0.20 -5.08 -1.04 -1.26 -4.77 114.28 102.33 1g18 n THR 211 Ca 0.00 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 62.07 1g18 n THR 211 Cb 0.00 0.24 0.42 0.00 -1.82 0.00 0.00 70.33 69.17 1g18 n THR 211 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1g18 h GLY 212 N 0.00 0.00 0.00 3.41 0.00 -1.98 -3.45 103.07 101.05 1g18 h GLY 212 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1g18 h GLY 212 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1g18 n GLY 213 N -0.16 1.97 0.02 4.60 0.00 -1.26 -3.30 105.19 107.07 1g18 n GLY 213 Ca -0.01 0.30 -0.01 0.00 0.00 0.00 0.00 46.02 46.30 1g18 n GLY 213 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1g18 n LYS 214 N 13.07 -0.03 -0.03 1.61 -0.00 -1.26 -1.34 118.16 130.18 1g18 n LYS 214 Ca 0.00 0.17 -0.04 0.00 -0.00 0.00 0.00 58.31 58.44 1g18 n LYS 214 Cb 0.00 -0.25 -0.03 0.00 -0.00 0.00 0.00 35.03 34.75 1g18 n LYS 214 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1g18 h ALA 215 N -0.05 -0.47 -0.47 0.58 0.00 -1.97 -1.37 119.26 115.51 1g18 h ALA 215 Ca 0.01 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.99 1g18 h ALA 215 Cb 0.02 0.80 -0.06 0.00 0.00 0.00 0.00 17.79 18.55 1g18 h ALA 215 CO -0.05 -0.54 0.11 1.25 0.00 0.00 0.00 179.25 180.01 1g18 h LEU 216 N -0.13 0.04 -0.94 0.00 5.85 -1.54 -1.40 115.31 117.18 1g18 h LEU 216 Ca 0.02 0.08 0.28 0.00 0.84 0.00 0.00 57.88 59.10 1g18 h LEU 216 Cb 0.18 0.10 -0.17 0.00 0.37 0.00 0.00 40.66 41.15 1g18 h LEU 216 CO -0.17 0.05 0.19 0.50 -0.34 0.00 0.00 178.44 178.68 1g18 h LYS 217 N 0.25 0.09 0.10 1.25 3.64 -0.43 0.16 116.57 121.61 1g18 h LYS 217 Ca 0.23 -0.01 -0.30 0.00 -1.27 0.00 0.00 60.65 59.31 1g18 h LYS 217 Cb 0.29 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1g18 h LYS 217 CO -0.29 0.06 -1.60 0.74 -2.27 0.00 0.00 179.45 176.09 1g18 h PHE 218 N 0.09 0.37 -0.61 1.91 -1.00 -0.21 -3.36 116.94 114.12 1g18 h PHE 218 Ca 0.62 -0.27 -0.07 0.00 2.81 0.00 0.00 57.97 61.07 1g18 h PHE 218 Cb 1.34 -0.01 -0.02 0.00 3.61 0.00 0.00 35.95 40.86 1g18 h PHE 218 CO -0.32 1.63 0.13 1.88 -1.61 0.00 0.00 178.31 180.01 1g18 h TYR 219 N -0.31 1.05 -2.10 -0.55 0.05 -0.97 -3.43 116.97 110.71 1g18 h TYR 219 Ca -0.36 -0.13 -0.63 0.00 0.05 0.00 0.00 58.73 57.66 1g18 h TYR 219 Cb 1.77 -0.29 0.07 0.00 1.01 0.00 0.00 36.73 39.28 1g18 h TYR 219 CO 0.10 0.89 0.53 0.00 -1.05 0.00 0.00 178.16 178.64 1g18 n ALA 220 N -2.43 0.09 0.24 3.88 0.00 0.51 -4.82 120.51 117.98 1g18 n ALA 220 Ca 0.03 0.47 0.11 0.00 0.00 0.00 0.00 53.44 54.05 1g18 n ALA 220 Cb 0.26 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.54 1g18 n ALA 220 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1g18 n SER 221 N 2.55 0.68 -3.68 0.00 7.64 -0.73 -4.82 113.62 115.26 1g18 n SER 221 Ca 0.16 0.16 -0.16 0.00 1.01 0.00 0.00 58.87 60.03 1g18 n SER 221 Cb 0.25 0.68 -0.15 0.00 -1.01 0.00 0.00 64.21 63.98 1g18 n SER 221 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1g18 s VAL 222 N -3.33 -0.22 -0.14 0.44 1.01 -1.24 -2.07 120.40 114.86 1g18 s VAL 222 Ca 0.00 0.32 -0.02 0.00 0.00 0.00 0.00 61.98 62.29 1g18 s VAL 222 Cb 0.12 -0.28 -0.02 0.00 0.00 0.00 0.00 36.38 36.19 1g18 s VAL 222 CO 0.80 0.13 -0.08 -0.13 0.00 0.00 0.00 175.10 175.83 1g18 s ARG 223 N 2.08 3.46 -0.14 2.72 0.52 -0.97 -1.38 118.95 125.23 1g18 s ARG 223 Ca 0.01 -0.59 0.00 0.00 -0.52 0.00 0.00 55.73 54.63 1g18 s ARG 223 Cb -0.12 -2.77 -0.01 0.00 0.52 0.00 0.00 34.95 32.57 1g18 s ARG 223 CO -0.06 0.28 -0.14 -1.64 0.02 0.00 0.00 175.30 173.76 1g18 s MET 224 N 0.22 3.31 -0.40 3.54 -1.94 0.22 -1.43 119.30 122.82 1g18 s MET 224 Ca -0.05 -0.72 -0.12 0.00 -1.71 0.00 0.00 55.69 53.09 1g18 s MET 224 Cb -0.14 -2.62 0.04 0.00 2.01 0.00 0.00 34.83 34.12 1g18 s MET 224 CO 0.04 0.15 0.26 0.34 -0.01 0.00 0.00 175.02 175.80 1g18 s ASP 225 N 0.51 5.87 -0.12 3.03 -1.08 -0.12 -0.12 116.67 124.64 1g18 s ASP 225 Ca -0.10 -1.10 -0.02 0.00 -0.52 0.00 0.00 52.55 50.82 1g18 s ASP 225 Cb -0.16 -2.07 -0.03 0.00 -1.46 0.00 0.00 42.92 39.20 1g18 s ASP 225 CO 0.04 -0.46 -0.05 -0.69 0.52 0.00 0.00 175.17 174.53 1g18 s VAL 226 N 1.58 3.84 -0.13 1.11 1.01 -0.81 0.99 120.40 127.99 1g18 s VAL 226 Ca 0.03 -0.40 -0.18 0.00 0.00 0.00 0.00 61.98 61.42 1g18 s VAL 226 Cb -0.20 -2.63 0.05 0.00 0.00 0.00 0.00 36.38 33.59 1g18 s VAL 226 CO 0.07 0.54 0.47 -0.13 0.00 0.00 0.00 175.10 176.06 1g18 s ARG 227 N -0.19 0.66 -0.06 2.72 0.52 -1.14 -4.05 118.95 117.40 1g18 s ARG 227 Ca 0.03 0.42 -0.28 0.00 -0.52 0.00 0.00 55.73 55.38 1g18 s ARG 227 Cb -0.13 0.31 -0.02 0.00 0.52 0.00 0.00 34.95 35.63 1g18 s ARG 227 CO 0.02 -0.13 0.92 1.03 0.02 0.00 0.00 175.30 177.16 1g18 s ARG 228 N -0.30 4.47 -0.04 3.54 3.00 -1.26 -1.91 118.95 126.45 1g18 s ARG 228 Ca -0.05 1.27 -0.01 0.00 0.00 0.00 0.00 55.73 56.93 1g18 s ARG 228 Cb -0.03 -3.49 -0.00 0.00 0.00 0.00 0.00 34.95 31.42 1g18 s ARG 228 CO 0.03 -0.13 -0.03 0.28 0.00 0.00 0.00 175.30 175.45 1g18 h VAL 229 N 4.92 0.00 -4.00 3.52 2.07 -1.58 -3.48 116.25 117.70 1g18 h VAL 229 Ca -0.37 -0.28 -0.40 0.00 0.82 0.00 0.00 66.70 66.46 1g18 h VAL 229 Cb 1.19 0.00 -0.24 0.00 -1.52 0.00 0.00 31.29 30.72 1g18 h VAL 229 CO 0.79 0.00 -0.78 -0.70 0.02 0.00 0.00 177.57 176.90 1g18 s GLU 230 N -1.27 0.81 -0.98 1.57 2.56 -1.23 -4.99 118.70 115.17 1g18 s GLU 230 Ca -0.02 -0.74 -0.24 0.00 0.00 0.00 0.00 54.97 53.97 1g18 s GLU 230 Cb 0.00 -0.78 0.03 0.00 2.00 0.00 0.00 34.13 35.38 1g18 s GLU 230 CO 0.04 0.19 1.55 0.99 -0.56 0.00 0.00 175.26 177.46 1g18 s THR 231 N -0.93 3.80 -0.75 -1.70 2.01 -1.26 -1.66 115.64 115.14 1g18 s THR 231 Ca -0.01 -0.61 -0.27 0.00 0.31 0.00 0.00 61.69 61.11 1g18 s THR 231 Cb -0.08 -4.81 -0.18 0.00 0.01 0.00 0.00 72.50 67.44 1g18 s THR 231 CO 0.01 -1.71 2.13 -0.11 -0.69 0.00 0.00 174.62 174.25 1g18 n LEU 232 N 10.05 0.29 -4.74 4.42 -0.00 -0.70 -4.90 117.00 121.42 1g18 n LEU 232 Ca 0.33 0.20 -0.41 0.00 -0.00 0.00 0.00 56.01 56.14 1g18 n LEU 232 Cb 0.50 -0.75 -0.05 0.00 -0.00 0.00 0.00 43.42 43.13 1g18 n LEU 232 CO 0.65 -0.59 0.73 -0.54 -0.00 0.00 0.00 177.39 177.63 1g18 s LYS 233 N 6.97 4.69 -0.48 1.96 1.02 -1.26 -2.93 119.74 129.70 1g18 s LYS 233 Ca 1.09 1.60 0.06 0.00 0.02 0.00 0.00 55.97 58.74 1g18 s LYS 233 Cb -1.05 -3.29 0.19 0.00 -0.52 0.00 0.00 37.83 33.15 1g18 s LYS 233 CO 0.42 0.23 0.62 -0.25 -0.92 0.00 0.00 175.35 175.45 1g18 n ASP 234 N 2.13 -2.45 0.00 2.83 10.43 -1.26 -4.92 116.55 123.32 1g18 n ASP 234 Ca 0.01 -2.78 0.00 0.00 2.57 0.00 0.00 54.79 54.59 1g18 n ASP 234 Cb 0.47 1.02 0.00 0.00 1.84 0.00 0.00 41.12 44.45 1g18 n ASP 234 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1g18 n GLY 235 N 2.76 0.02 0.00 0.44 0.00 -1.26 -4.33 105.19 102.82 1g18 n GLY 235 Ca 0.21 0.44 0.00 0.00 0.00 0.00 0.00 46.02 46.66 1g18 n GLY 235 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1g18 n THR 236 N 0.00 0.00 0.00 2.61 5.66 -1.26 -5.03 114.28 116.26 1g18 n THR 236 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1g18 n THR 236 Cb 0.00 -0.22 0.00 0.00 -1.55 0.00 0.00 70.33 68.56 1g18 n THR 236 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1g18 n ASN 237 N 0.00 0.00 -3.66 1.09 4.13 -1.26 -5.09 115.26 110.47 1g18 n ASN 237 Ca 0.00 0.00 -0.06 0.00 1.68 0.00 0.00 54.58 56.20 1g18 n ASN 237 Cb 0.00 -0.17 -0.08 0.00 -1.54 0.00 0.00 39.78 37.99 1g18 n ASN 237 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1g18 s ALA 238 N -3.45 -1.48 -0.08 5.41 0.00 -1.26 -4.32 121.76 116.57 1g18 s ALA 238 Ca 0.00 1.84 0.14 0.00 0.00 0.00 0.00 51.96 53.94 1g18 s ALA 238 Cb 0.00 -1.44 -0.20 0.00 0.00 0.00 0.00 23.12 21.47 1g18 s ALA 238 CO 0.00 -0.75 0.66 1.33 0.00 0.00 0.00 175.76 177.01 1g18 n VAL 239 N 5.24 1.44 -2.32 0.00 0.24 -1.15 -4.82 118.33 116.96 1g18 n VAL 239 Ca -0.12 -0.76 0.00 0.00 -2.04 0.00 0.00 64.34 61.42 1g18 n VAL 239 Cb 0.50 -0.89 0.00 0.00 -1.47 0.00 0.00 33.84 31.99 1g18 n VAL 239 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1g18 n GLY 240 N 1.52 1.95 2.98 7.63 0.00 -1.26 0.33 105.19 118.33 1g18 n GLY 240 Ca -0.16 -0.63 -0.17 0.00 0.00 0.00 0.00 46.02 45.07 1g18 n GLY 240 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1g18 s ASN 241 N 2.00 0.74 -0.77 1.61 0.02 -0.43 -1.72 114.94 116.39 1g18 s ASN 241 Ca 0.00 -0.12 -0.18 0.00 -1.02 0.00 0.00 52.86 51.54 1g18 s ASN 241 Cb 0.00 -0.08 0.13 0.00 0.02 0.00 0.00 41.25 41.32 1g18 s ASN 241 CO 0.00 0.07 0.90 -0.60 0.02 0.00 0.00 177.10 177.50 1g18 s ARG 242 N -0.17 3.37 0.62 -0.60 3.52 -0.66 0.80 118.95 125.83 1g18 s ARG 242 Ca 0.02 -1.65 -0.12 0.00 -0.13 0.00 0.00 55.73 53.86 1g18 s ARG 242 Cb -0.03 -4.54 -0.03 0.00 -1.56 0.00 0.00 34.95 28.80 1g18 s ARG 242 CO -0.00 -1.61 1.03 0.99 -0.81 0.00 0.00 175.30 174.90 1g18 s THR 243 N 2.37 4.45 -0.21 4.11 2.01 0.14 -1.47 115.64 127.05 1g18 s THR 243 Ca 0.22 0.87 -0.04 0.00 0.31 0.00 0.00 61.69 63.05 1g18 s THR 243 Cb -0.13 -3.69 0.07 0.00 0.01 0.00 0.00 72.50 68.75 1g18 s THR 243 CO -0.02 -0.97 0.08 -0.60 -0.69 0.00 0.00 174.62 172.42 1g18 s ARG 244 N -4.92 0.30 -0.03 4.92 3.52 -0.80 -0.64 118.95 121.30 1g18 s ARG 244 Ca 0.57 -0.32 -0.12 0.00 -0.13 0.00 0.00 55.73 55.73 1g18 s ARG 244 Cb -0.12 -1.82 -0.05 0.00 -1.56 0.00 0.00 34.95 31.40 1g18 s ARG 244 CO 0.50 -0.74 0.33 0.08 -0.81 0.00 0.00 175.30 174.67 1g18 s VAL 245 N 2.02 5.16 -0.32 7.11 1.01 0.21 -2.90 120.40 132.68 1g18 s VAL 245 Ca 0.03 0.64 0.01 0.00 0.00 0.00 0.00 61.98 62.66 1g18 s VAL 245 Cb -0.16 -3.62 0.10 0.00 0.00 0.00 0.00 36.38 32.69 1g18 s VAL 245 CO -0.14 0.57 0.08 -0.75 0.00 0.00 0.00 175.10 174.87 1g18 s LYS 246 N -1.11 1.01 -0.68 2.72 2.20 0.28 -1.63 119.74 122.53 1g18 s LYS 246 Ca 0.22 -1.39 -0.26 0.00 -0.36 0.00 0.00 55.97 54.18 1g18 s LYS 246 Cb -0.15 -2.44 -0.03 0.00 -1.51 0.00 0.00 37.83 33.70 1g18 s LYS 246 CO 0.11 -0.97 1.92 0.14 -0.36 0.00 0.00 175.35 176.18 1g18 s VAL 247 N 1.32 3.35 -0.31 4.02 -7.23 -1.15 -0.94 120.40 119.47 1g18 s VAL 247 Ca 0.10 0.06 0.27 0.00 -1.81 0.00 0.00 61.98 60.61 1g18 s VAL 247 Cb -0.18 -3.89 0.33 0.00 0.56 0.00 0.00 36.38 33.20 1g18 s VAL 247 CO -0.18 -0.86 1.79 -0.37 -0.31 0.00 0.00 175.10 175.16 1g18 h VAL 248 N 7.03 0.00 -3.33 1.32 -1.51 -1.55 -2.70 116.25 115.50 1g18 h VAL 248 Ca -0.17 -0.60 -0.23 0.00 -1.23 0.00 0.00 66.70 64.46 1g18 h VAL 248 Cb 1.13 1.56 -0.30 0.00 -2.13 0.00 0.00 31.29 31.55 1g18 h VAL 248 CO 1.21 0.00 -0.59 -0.75 -1.23 0.00 0.00 177.57 176.21 1g18 s LYS 249 N -3.37 0.11 -0.44 5.19 2.20 -1.22 -4.60 119.74 117.60 1g18 s LYS 249 Ca 0.05 0.29 0.06 0.00 -0.36 0.00 0.00 55.97 56.01 1g18 s LYS 249 Cb 0.08 -0.09 0.18 0.00 -1.51 0.00 0.00 37.83 36.49 1g18 s LYS 249 CO 0.56 -0.11 0.55 1.21 -0.36 0.00 0.00 175.35 177.20 1g18 s ASN 250 N 0.77 -0.25 0.00 1.43 3.84 -1.25 -2.30 114.94 117.18 1g18 s ASN 250 Ca -0.06 -1.82 0.04 0.00 0.21 0.00 0.00 52.86 51.23 1g18 s ASN 250 Cb -0.08 1.11 0.22 0.00 -0.55 0.00 0.00 41.25 41.95 1g18 s ASN 250 CO -0.04 -0.15 0.61 0.29 -2.79 0.00 0.00 177.10 175.03 1g18 n LYS 251 N 3.48 0.37 -0.00 0.43 4.76 -0.88 -1.95 118.16 124.36 1g18 n LYS 251 Ca 0.18 0.00 0.01 0.00 -2.87 0.00 0.00 58.31 55.63 1g18 n LYS 251 Cb 0.52 -1.16 -0.03 0.00 -1.84 0.00 0.00 35.03 32.52 1g18 n LYS 251 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1g18 s LEU 253 N -3.37 -0.60 -0.28 0.00 -0.00 -0.82 -4.86 118.68 108.74 1g18 s LEU 253 Ca -0.01 0.75 -0.26 0.00 -0.00 0.00 0.00 54.13 54.61 1g18 s LEU 253 Cb 0.02 2.35 -0.11 0.00 -0.00 0.00 0.00 46.19 48.45 1g18 s LEU 253 CO 0.13 -0.48 1.05 0.00 -0.00 0.00 0.00 176.35 177.05 1g18 n ALA 254 N 1.16 -0.33 -1.10 1.48 0.00 -1.26 -4.49 120.51 115.96 1g18 n ALA 254 Ca -0.16 0.20 -0.04 0.00 0.00 0.00 0.00 53.44 53.44 1g18 n ALA 254 Cb 0.57 -1.13 0.04 0.00 0.00 0.00 0.00 19.45 18.93 1g18 n ALA 254 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1g18 n PRO 255 N 3.22 -0.69 -0.94 0.00 -0.04 -1.26 -4.48 135.00 130.82 1g18 n PRO 255 Ca 0.24 -0.33 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 1g18 n PRO 255 Cb -0.03 -0.25 0.00 0.00 -0.04 0.00 0.00 33.50 33.18 1g18 n PRO 255 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1g18 n PHE 256 N -2.55 0.00 -2.42 0.54 3.72 -1.02 -5.00 117.46 110.73 1g18 n PHE 256 Ca 0.03 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.15 1g18 n PHE 256 Cb 0.10 -0.98 0.01 0.00 -0.94 0.00 0.00 39.48 37.66 1g18 n PHE 256 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1g18 s LYS 257 N -0.92 3.41 0.22 -1.08 3.01 -1.26 -4.93 119.74 118.19 1g18 s LYS 257 Ca 0.00 0.27 -0.15 0.00 -1.01 0.00 0.00 55.97 55.09 1g18 s LYS 257 Cb 0.00 -2.29 0.01 0.00 -1.01 0.00 0.00 37.83 34.54 1g18 s LYS 257 CO 0.00 -0.40 0.49 1.14 0.51 0.00 0.00 175.35 177.09 1g18 s GLN 258 N -4.89 1.45 -0.00 1.68 -2.07 -1.26 -2.91 119.66 111.65 1g18 s GLN 258 Ca 0.50 -1.07 -0.10 0.00 -1.82 0.00 0.00 55.36 52.87 1g18 s GLN 258 Cb -0.10 0.49 0.01 0.00 -1.09 0.00 0.00 33.01 32.31 1g18 s GLN 258 CO 0.47 -0.61 0.20 0.00 -1.32 0.00 0.00 175.29 174.03 1g18 s ALA 259 N -3.95 -0.50 0.12 2.60 0.00 -0.64 -4.84 121.76 114.55 1g18 s ALA 259 Ca 0.16 0.03 0.09 0.00 0.00 0.00 0.00 51.96 52.23 1g18 s ALA 259 Cb -0.01 0.11 -0.04 0.00 0.00 0.00 0.00 23.12 23.18 1g18 s ALA 259 CO 0.03 -0.23 -0.21 -1.21 0.00 0.00 0.00 175.76 174.13 1g18 s GLU 260 N -1.42 1.21 -0.08 0.00 2.02 -1.26 0.64 118.70 119.82 1g18 s GLU 260 Ca -0.14 -1.25 -0.31 0.00 0.02 0.00 0.00 54.97 53.29 1g18 s GLU 260 Cb -0.06 -1.47 0.12 0.00 0.10 0.00 0.00 34.13 32.81 1g18 s GLU 260 CO 0.02 0.33 0.99 -0.59 0.02 0.00 0.00 175.26 176.04 1g18 s PHE 261 N -1.34 -0.28 0.32 1.61 -0.12 0.19 -4.88 117.98 113.47 1g18 s PHE 261 Ca 0.10 0.22 -0.15 0.00 -0.05 0.00 0.00 56.93 57.05 1g18 s PHE 261 Cb -0.09 0.52 -0.09 0.00 -0.63 0.00 0.00 43.02 42.73 1g18 s PHE 261 CO 0.05 -0.42 0.74 -0.51 -0.05 0.00 0.00 175.22 175.03 1g18 s ASP 262 N -2.23 6.79 -0.36 1.98 1.01 -1.26 0.27 116.67 122.86 1g18 s ASP 262 Ca 0.06 1.29 0.00 0.00 0.71 0.00 0.00 52.55 54.60 1g18 s ASP 262 Cb -0.01 -2.37 0.12 0.00 1.01 0.00 0.00 42.92 41.66 1g18 s ASP 262 CO -0.07 -0.19 0.17 -0.63 0.21 0.00 0.00 175.17 174.66 1g18 s ILE 263 N -1.96 0.89 0.32 0.77 1.01 0.24 -2.94 121.20 119.53 1g18 s ILE 263 Ca 0.54 -1.83 -0.29 0.00 0.00 0.00 0.00 60.65 59.07 1g18 s ILE 263 Cb -0.10 -1.65 -0.11 0.00 0.01 0.00 0.00 42.46 40.60 1g18 s ILE 263 CO 0.18 -0.81 1.45 -0.76 0.00 0.00 0.00 174.94 175.00 1g18 s LEU 264 N 1.10 4.37 -0.29 2.97 2.01 0.18 -1.31 118.68 127.71 1g18 s LEU 264 Ca 0.14 2.85 -0.28 0.00 0.01 0.00 0.00 54.13 56.85 1g18 s LEU 264 Cb -0.21 -3.65 -0.05 0.00 0.01 0.00 0.00 46.19 42.30 1g18 s LEU 264 CO -0.12 -0.76 2.20 -0.31 1.01 0.00 0.00 176.35 178.37 1g18 s TYR 265 N -0.65 1.23 0.00 0.29 2.02 0.99 -0.42 117.35 120.80 1g18 s TYR 265 Ca 0.55 0.74 0.00 0.00 -0.37 0.00 0.00 57.07 57.99 1g18 s TYR 265 Cb -0.44 -3.89 0.00 0.00 -0.40 0.00 0.00 41.96 37.23 1g18 s TYR 265 CO 0.53 -3.65 0.00 0.41 -1.57 0.00 0.00 175.55 171.27 1g18 n GLY 266 N 5.77 2.97 0.06 0.71 0.00 -1.26 -4.78 105.19 108.65 1g18 n GLY 266 Ca 0.30 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.29 1g18 n GLY 266 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1g18 n LYS 267 N -2.00 1.23 0.00 1.61 4.76 -0.60 -4.83 118.16 118.33 1g18 n LYS 267 Ca 0.00 -0.05 0.00 0.00 -2.87 0.00 0.00 58.31 55.39 1g18 n LYS 267 Cb 0.00 -1.39 0.00 0.00 -1.84 0.00 0.00 35.03 31.80 1g18 n LYS 267 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1g18 n GLY 268 N 1.92 -1.56 3.69 0.72 0.00 0.43 -4.63 105.19 105.76 1g18 n GLY 268 Ca -0.19 -1.62 -0.42 0.00 0.00 0.00 0.00 46.02 43.79 1g18 n GLY 268 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1g18 s ILE 269 N 0.00 2.91 -0.83 -0.61 1.01 -1.26 -0.65 121.20 121.77 1g18 s ILE 269 Ca 0.00 0.33 -0.25 0.00 0.00 0.00 0.00 60.65 60.73 1g18 s ILE 269 Cb 0.00 -3.21 0.05 0.00 0.01 0.00 0.00 42.46 39.31 1g18 s ILE 269 CO 0.00 -0.00 1.29 -0.55 0.00 0.00 0.00 174.94 175.68 1g18 s SER 270 N 2.72 6.29 0.54 3.58 0.15 -1.15 -4.79 113.70 121.04 1g18 s SER 270 Ca 0.77 -0.91 0.25 0.00 0.70 0.00 0.00 55.95 56.76 1g18 s SER 270 Cb -0.42 -2.54 1.41 0.00 -1.71 0.00 0.00 66.02 62.76 1g18 s SER 270 CO 0.34 -1.65 2.02 0.08 1.20 0.00 0.00 173.24 175.23 1g18 h ARG 271 N 9.85 0.00 0.03 5.44 -0.00 -1.92 0.63 114.38 128.41 1g18 h ARG 271 Ca -0.11 0.00 -0.00 0.00 -0.00 0.00 0.00 59.98 59.87 1g18 h ARG 271 Cb 1.04 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.01 1g18 h ARG 271 CO 1.31 0.00 -0.01 0.93 -0.00 0.00 0.00 179.97 182.19 1g18 h GLU 272 N 0.00 -0.04 0.00 0.08 3.07 -1.91 -2.28 114.58 113.51 1g18 h GLU 272 Ca 0.21 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.07 1g18 h GLU 272 Cb 0.86 0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.78 1g18 h GLU 272 CO -0.00 0.32 -0.01 0.78 -1.40 0.00 0.00 179.01 178.70 1g18 h GLY 273 N -0.40 0.00 0.82 -3.84 0.00 -1.26 -1.14 103.07 97.26 1g18 h GLY 273 Ca -0.00 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.15 1g18 h GLY 273 CO 0.01 0.00 -0.71 0.23 0.00 0.00 0.00 176.54 176.07 1g18 h SER 274 N 0.00 0.57 -0.76 0.19 0.87 -1.12 -3.27 113.55 110.03 1g18 h SER 274 Ca -0.00 -0.79 0.10 0.00 -1.23 0.00 0.00 61.79 59.87 1g18 h SER 274 Cb 0.01 -0.18 -0.08 0.00 -0.44 0.00 0.00 62.40 61.72 1g18 h SER 274 CO 0.00 1.30 0.39 -0.07 -0.53 0.00 0.00 176.83 177.91 1g18 h LEU 275 N -0.09 0.50 0.36 2.23 4.07 -0.61 -1.34 115.31 120.43 1g18 h LEU 275 Ca -0.10 0.07 -0.02 0.00 0.08 0.00 0.00 57.88 57.91 1g18 h LEU 275 Cb 1.43 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 43.15 1g18 h LEU 275 CO 0.14 0.27 -0.17 0.40 -1.08 0.00 0.00 178.44 178.00 1g18 h ILE 276 N 0.63 0.57 -0.65 1.22 2.04 -1.67 0.44 117.51 120.09 1g18 h ILE 276 Ca 0.38 -0.59 0.14 0.00 1.00 0.00 0.00 64.86 65.79 1g18 h ILE 276 Cb 0.43 0.84 -0.11 0.00 -0.74 0.00 0.00 36.82 37.23 1g18 h ILE 276 CO -0.29 0.10 -0.01 0.44 0.00 0.00 0.00 178.15 178.39 1g18 h ASP 277 N -0.85 -0.31 -0.28 1.72 3.32 -1.58 0.61 116.42 119.05 1g18 h ASP 277 Ca -0.05 0.17 -0.17 0.00 0.02 0.00 0.00 57.03 57.00 1g18 h ASP 277 Cb 0.53 0.30 -0.00 0.00 0.22 0.00 0.00 39.33 40.37 1g18 h ASP 277 CO 0.08 -0.14 -0.45 0.24 -1.72 0.00 0.00 179.24 177.25 1g18 h MET 278 N 0.11 0.85 -0.59 3.56 2.86 -1.25 -1.86 114.93 118.61 1g18 h MET 278 Ca 0.34 -0.48 0.12 0.00 -2.06 0.00 0.00 59.70 57.62 1g18 h MET 278 Cb 0.57 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.23 1g18 h MET 278 CO -0.57 1.12 0.40 0.78 1.06 0.00 0.00 176.91 179.70 1g18 h GLY 279 N 0.81 0.45 0.96 8.32 0.00 0.40 -1.33 103.07 112.68 1g18 h GLY 279 Ca 0.04 -0.12 -0.31 0.00 0.00 0.00 0.00 47.33 46.94 1g18 h GLY 279 CO 0.10 0.07 -1.73 -0.39 0.00 0.00 0.00 176.54 174.59 1g18 h VAL 280 N 0.30 0.86 0.00 4.60 -1.51 0.12 0.50 116.25 121.13 1g18 h VAL 280 Ca 0.28 -2.65 0.00 0.00 -1.23 0.00 0.00 66.70 63.10 1g18 h VAL 280 Cb 0.69 2.50 0.00 0.00 -2.13 0.00 0.00 31.29 32.35 1g18 h VAL 280 CO -0.06 0.66 0.00 0.47 -1.23 0.00 0.00 177.57 177.40 1g18 n ASP 281 N -3.22 0.00 -0.27 4.19 8.00 -0.64 -3.08 116.55 121.53 1g18 n ASP 281 Ca -0.20 -1.49 0.01 0.00 0.71 0.00 0.00 54.79 53.82 1g18 n ASP 281 Cb 1.04 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 42.16 1g18 n ASP 281 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1g18 n GLN 282 N -0.65 0.26 -0.19 -1.24 1.13 -0.60 -5.04 117.38 111.06 1g18 n GLN 282 Ca 0.06 -0.98 0.00 0.00 -1.94 0.00 0.00 57.00 54.14 1g18 n GLN 282 Cb 0.03 -0.61 0.00 0.00 0.11 0.00 0.00 30.24 29.77 1g18 n GLN 282 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1g18 n GLY 283 N -0.14 1.52 0.23 1.08 0.00 -1.18 -4.84 105.19 101.86 1g18 n GLY 283 Ca 0.01 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.15 1g18 n GLY 283 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1g18 h LEU 284 N 0.00 0.00 -8.15 0.99 3.38 -1.69 -3.43 115.31 106.41 1g18 h LEU 284 Ca 0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 1g18 h LEU 284 Cb 0.00 0.00 -0.33 0.00 0.09 0.00 0.00 40.66 40.42 1g18 h LEU 284 CO 0.00 0.09 -0.84 -0.63 0.09 0.00 0.00 178.44 177.15 1g18 s ILE 285 N -3.34 1.47 -0.04 1.22 1.01 0.17 -4.19 121.20 117.50 1g18 s ILE 285 Ca 0.04 -0.69 0.00 0.00 0.00 0.00 0.00 60.65 60.00 1g18 s ILE 285 Cb 0.07 -1.29 -0.03 0.00 0.01 0.00 0.00 42.46 41.22 1g18 s ILE 285 CO 0.64 0.43 -0.01 -0.13 0.00 0.00 0.00 174.94 175.87 1g18 s ARG 286 N 0.37 2.85 -0.55 2.79 3.00 0.20 -4.14 118.95 123.48 1g18 s ARG 286 Ca -0.12 -0.53 -0.00 0.00 0.00 0.00 0.00 55.73 55.08 1g18 s ARG 286 Cb -0.15 -2.70 0.14 0.00 0.00 0.00 0.00 34.95 32.24 1g18 s ARG 286 CO 0.05 0.66 0.33 0.15 0.00 0.00 0.00 175.30 176.48 1g18 s LYS 287 N -1.23 2.25 0.00 3.54 1.02 -1.26 0.28 119.74 124.33 1g18 s LYS 287 Ca 0.16 -2.45 -0.04 0.00 0.02 0.00 0.00 55.97 53.67 1g18 s LYS 287 Cb -0.11 -3.55 -0.17 0.00 -0.52 0.00 0.00 37.83 33.48 1g18 s LYS 287 CO 0.06 -1.13 2.81 0.43 -0.92 0.00 0.00 175.35 176.61 1g18 n SER 288 N 3.52 4.56 -2.31 2.83 7.64 -0.85 -4.74 113.62 124.26 1g18 n SER 288 Ca 0.06 -2.31 -0.03 0.00 1.01 0.00 0.00 58.87 57.59 1g18 n SER 288 Cb 0.37 -1.16 -0.02 0.00 -1.01 0.00 0.00 64.21 62.38 1g18 n SER 288 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1g18 n GLY 289 N 2.30 -4.43 3.78 0.23 0.00 -1.26 -4.32 105.19 101.49 1g18 n GLY 289 Ca 0.27 0.92 0.00 0.00 0.00 0.00 0.00 46.02 47.21 1g18 n GLY 289 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g18 n ALA 290 N 1.00 0.00 -1.85 4.61 0.00 -1.26 -4.96 120.51 118.04 1g18 n ALA 290 Ca -0.21 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 52.90 1g18 n ALA 290 Cb 0.33 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.71 1g18 n ALA 290 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1g18 s TRP 291 N -0.01 3.32 -0.22 0.00 0.52 -1.26 -2.30 118.94 119.00 1g18 s TRP 291 Ca 0.00 1.57 0.02 0.00 0.02 0.00 0.00 56.10 57.71 1g18 s TRP 291 Cb 0.00 -2.82 0.04 0.00 -1.15 0.00 0.00 33.47 29.55 1g18 s TRP 291 CO 0.00 -0.08 -0.12 -0.06 0.02 0.00 0.00 176.95 176.70 1g18 s PHE 292 N -2.15 2.79 0.14 -1.98 0.08 -0.29 -2.01 117.98 114.56 1g18 s PHE 292 Ca 0.61 -1.87 0.04 0.00 0.12 0.00 0.00 56.93 55.83 1g18 s PHE 292 Cb -0.09 -1.80 -0.04 0.00 -0.57 0.00 0.00 43.02 40.52 1g18 s PHE 292 CO 0.14 -0.81 0.16 -0.08 -0.10 0.00 0.00 175.22 174.53 1g18 s THR 293 N 1.27 4.71 -0.15 0.64 -1.32 0.81 -0.76 115.64 120.84 1g18 s THR 293 Ca -0.03 -0.90 -0.05 0.00 -1.21 0.00 0.00 61.69 59.50 1g18 s THR 293 Cb -0.17 -3.38 0.07 0.00 -1.51 0.00 0.00 72.50 67.52 1g18 s THR 293 CO -0.08 -0.04 0.31 -0.47 -2.21 0.00 0.00 174.62 172.12 1g18 s TYR 294 N -1.66 -0.53 -1.45 9.09 5.04 -0.71 0.62 117.35 127.75 1g18 s TYR 294 Ca 0.32 1.09 -0.01 0.00 -2.44 0.00 0.00 57.07 56.03 1g18 s TYR 294 Cb -0.11 0.04 0.01 0.00 0.35 0.00 0.00 41.96 42.25 1g18 s TYR 294 CO 0.24 -0.41 0.02 0.39 -1.34 0.00 0.00 175.55 174.45 1g18 n GLU 295 N 5.36 -0.94 0.00 4.97 -0.58 -1.26 -1.91 120.64 126.28 1g18 n GLU 295 Ca -0.07 0.09 0.00 0.00 -0.42 0.00 0.00 57.16 56.76 1g18 n GLU 295 Cb 0.50 -3.37 0.00 0.00 -0.57 0.00 0.00 31.44 28.00 1g18 n GLU 295 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1g18 n GLY 296 N -2.44 2.15 3.65 0.62 0.00 -1.26 -5.00 105.19 102.92 1g18 n GLY 296 Ca -0.29 -0.35 -0.46 0.00 0.00 0.00 0.00 46.02 44.91 1g18 n GLY 296 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1g18 n GLU 297 N 0.00 1.92 -2.84 1.61 2.13 -0.80 -4.95 120.64 117.70 1g18 n GLU 297 Ca 0.00 0.69 -0.41 0.00 0.66 0.00 0.00 57.16 58.10 1g18 n GLU 297 Cb 0.00 -2.38 -0.04 0.00 0.27 0.00 0.00 31.44 29.29 1g18 n GLU 297 CO 0.00 0.00 0.00 1.14 -0.41 0.00 0.00 177.13 177.86 1g18 s GLN 298 N 0.26 4.57 -0.17 5.31 -2.07 -1.26 -1.73 119.66 124.56 1g18 s GLN 298 Ca 0.75 1.25 -0.19 0.00 -1.82 0.00 0.00 55.36 55.35 1g18 s GLN 298 Cb -0.71 -3.40 -0.16 0.00 -1.09 0.00 0.00 33.01 27.64 1g18 s GLN 298 CO 0.44 0.15 0.23 -0.07 -1.32 0.00 0.00 175.29 174.73 1g18 h LEU 299 N 6.06 0.00 0.00 2.60 4.07 -1.30 -3.48 115.31 123.26 1g18 h LEU 299 Ca -0.42 -0.47 0.00 0.00 0.08 0.00 0.00 57.88 57.06 1g18 h LEU 299 Cb 1.21 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.95 1g18 h LEU 299 CO 0.73 1.19 0.00 0.61 -1.08 0.00 0.00 178.44 179.89 1g18 n GLY 300 N 1.53 -0.38 3.10 0.83 0.00 -1.22 -4.74 105.19 104.30 1g18 n GLY 300 Ca -0.21 -1.05 -0.35 0.00 0.00 0.00 0.00 46.02 44.41 1g18 n GLY 300 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1g18 s GLN 301 N -2.00 1.97 0.00 1.61 0.74 -1.26 -1.13 119.66 119.59 1g18 s GLN 301 Ca 0.00 -1.93 0.00 0.00 0.05 0.00 0.00 55.36 53.48 1g18 s GLN 301 Cb 0.00 -3.53 0.00 0.00 1.10 0.00 0.00 33.01 30.58 1g18 s GLN 301 CO 0.00 -1.06 0.00 0.41 -0.55 0.00 0.00 175.29 174.09 1g18 n GLY 302 N 4.38 2.71 0.28 2.59 0.00 -0.97 -4.56 105.19 109.61 1g18 n GLY 302 Ca 0.00 -1.17 0.20 0.00 0.00 0.00 0.00 46.02 45.05 1g18 n GLY 302 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1g18 n LYS 303 N 1.17 -0.06 0.12 1.61 4.81 -1.26 0.12 118.16 124.67 1g18 n LYS 303 Ca 0.00 1.21 -0.02 0.00 -0.87 0.00 0.00 58.31 58.62 1g18 n LYS 303 Cb 0.00 -2.04 0.15 0.00 0.02 0.00 0.00 35.03 33.16 1g18 n LYS 303 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 1g18 h GLU 304 N 0.00 0.04 0.00 1.64 4.57 -1.98 0.13 114.58 118.98 1g18 h GLU 304 Ca 0.62 -0.03 -0.10 0.00 -1.18 0.00 0.00 59.36 58.66 1g18 h GLU 304 Cb 1.49 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 30.07 1g18 h GLU 304 CO -0.71 0.66 -0.50 -0.97 -1.18 0.00 0.00 179.01 176.31 1g18 h ASN 305 N 0.03 0.00 0.43 1.04 -0.73 0.68 0.83 115.58 117.85 1g18 h ASN 305 Ca -0.01 0.00 -0.31 0.00 1.87 0.00 0.00 56.30 57.85 1g18 h ASN 305 Cb 1.13 0.00 0.01 0.00 0.27 0.00 0.00 38.32 39.73 1g18 h ASN 305 CO 0.09 0.50 -1.45 0.00 -0.37 0.00 0.00 177.43 176.19 1g18 h ALA 306 N 1.50 0.08 -0.03 1.57 0.00 -0.91 -1.46 119.26 120.02 1g18 h ALA 306 Ca -0.00 -0.97 0.01 0.00 0.00 0.00 0.00 54.91 53.94 1g18 h ALA 306 Cb 1.01 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1g18 h ALA 306 CO 0.06 0.95 -0.05 0.07 0.00 0.00 0.00 179.25 180.29 1g18 h ARG 307 N 0.10 -0.07 -0.16 0.00 -0.00 -0.44 0.24 114.38 114.04 1g18 h ARG 307 Ca -0.22 0.00 0.05 0.00 -0.00 0.00 0.00 59.98 59.81 1g18 h ARG 307 Cb 2.06 0.02 -0.05 0.00 -0.00 0.00 0.00 29.97 31.99 1g18 h ARG 307 CO 0.21 -0.04 -0.15 -2.95 -0.00 0.00 0.00 179.97 177.04 1g18 h ASN 308 N -0.07 -0.47 -0.53 0.08 -1.07 -0.87 -0.99 115.58 111.65 1g18 h ASN 308 Ca 0.03 0.09 0.08 0.00 0.07 0.00 0.00 56.30 56.57 1g18 h ASN 308 Cb 0.11 0.23 -0.07 0.00 -2.07 0.00 0.00 38.32 36.52 1g18 h ASN 308 CO -0.07 -0.19 0.17 0.15 0.07 0.00 0.00 177.43 177.56 1g18 h PHE 309 N -0.16 0.29 -0.04 4.14 3.57 -0.34 -2.49 116.94 121.91 1g18 h PHE 309 Ca 0.11 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.63 1g18 h PHE 309 Cb 0.32 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.01 1g18 h PHE 309 CO -0.28 0.07 0.02 -0.07 -2.23 0.00 0.00 178.31 175.81 1g18 h LEU 310 N 0.33 0.05 -0.88 0.59 3.38 0.42 -2.11 115.31 117.09 1g18 h LEU 310 Ca 0.26 -0.14 0.08 0.00 0.09 0.00 0.00 57.88 58.17 1g18 h LEU 310 Cb 0.32 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 40.99 1g18 h LEU 310 CO -0.29 0.18 0.53 1.62 0.09 0.00 0.00 178.44 180.58 1g18 h VAL 311 N -0.08 0.98 0.00 1.22 3.04 -0.88 0.15 116.25 120.69 1g18 h VAL 311 Ca 0.01 -0.32 0.00 0.00 -1.01 0.00 0.00 66.70 65.39 1g18 h VAL 311 Cb 0.15 -0.03 0.00 0.00 -2.01 0.00 0.00 31.29 29.40 1g18 h VAL 311 CO -0.00 0.17 0.00 -1.84 -1.01 0.00 0.00 177.57 174.89 1g18 n GLU 312 N -4.65 0.14 -2.68 4.17 0.28 -0.97 -3.50 120.64 113.43 1g18 n GLU 312 Ca 0.14 0.19 -0.27 0.00 -0.16 0.00 0.00 57.16 57.06 1g18 n GLU 312 Cb 0.24 -1.69 -0.02 0.00 1.43 0.00 0.00 31.44 31.40 1g18 n GLU 312 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1g18 n ASN 313 N -1.94 4.55 -0.31 -1.84 3.02 0.49 -4.91 115.26 114.33 1g18 n ASN 313 Ca 0.05 -3.69 0.16 0.00 -0.03 0.00 0.00 54.58 51.07 1g18 n ASN 313 Cb 0.34 -0.50 0.35 0.00 -0.61 0.00 0.00 39.78 39.35 1g18 n ASN 313 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1g18 h ALA 314 N 2.76 1.51 -0.80 5.41 0.00 -1.50 -1.18 119.26 125.45 1g18 h ALA 314 Ca 0.22 0.20 0.19 0.00 0.00 0.00 0.00 54.91 55.53 1g18 h ALA 314 Cb 0.75 0.24 -0.13 0.00 0.00 0.00 0.00 17.79 18.64 1g18 h ALA 314 CO 0.83 -0.47 0.10 0.38 0.00 0.00 0.00 179.25 180.08 1g18 h ASP 315 N 0.28 -0.20 1.28 0.00 2.03 -1.91 0.66 116.42 118.56 1g18 h ASP 315 Ca 0.61 0.19 -0.13 0.00 -0.73 0.00 0.00 57.03 56.97 1g18 h ASP 315 Cb 1.27 0.31 -0.02 0.00 -0.83 0.00 0.00 39.33 40.06 1g18 h ASP 315 CO -0.62 -0.16 -0.74 1.62 -1.03 0.00 0.00 179.24 178.31 1g18 h VAL 316 N 0.15 0.92 -0.16 4.15 3.04 -1.61 -3.33 116.25 119.42 1g18 h VAL 316 Ca 0.46 -2.36 0.03 0.00 -1.01 0.00 0.00 66.70 63.82 1g18 h VAL 316 Cb 0.86 2.42 -0.03 0.00 -2.01 0.00 0.00 31.29 32.53 1g18 h VAL 316 CO -0.65 0.53 -0.01 0.00 -1.01 0.00 0.00 177.57 176.42 1g18 h ALA 317 N 1.41 0.13 0.00 3.17 0.00 0.13 -0.30 119.26 123.80 1g18 h ALA 317 Ca -0.04 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1g18 h ALA 317 Cb 1.48 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.36 1g18 h ALA 317 CO 0.07 -0.45 0.00 -0.40 0.00 0.00 0.00 179.25 178.47 1g18 n ASP 318 N -5.14 0.00 0.02 0.00 5.68 -0.81 -2.54 116.55 113.76 1g18 n ASP 318 Ca -0.03 -0.49 -0.12 0.00 -0.50 0.00 0.00 54.79 53.64 1g18 n ASP 318 Cb 0.10 -0.16 -0.09 0.00 -1.14 0.00 0.00 41.12 39.83 1g18 n ASP 318 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 1g18 h GLU 319 N 0.00 -0.11 0.53 0.11 4.81 -1.16 0.56 114.58 119.32 1g18 h GLU 319 Ca 0.00 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 1g18 h GLU 319 Cb 0.15 0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.56 1g18 h GLU 319 CO 0.00 0.38 -0.25 0.82 -0.73 0.00 0.00 179.01 179.23 1g18 h ILE 320 N -0.66 0.48 -1.02 2.32 5.03 -1.35 0.12 117.51 122.43 1g18 h ILE 320 Ca -0.01 -0.03 0.25 0.00 -0.12 0.00 0.00 64.86 64.95 1g18 h ILE 320 Cb 0.54 0.50 -0.09 0.00 -3.03 0.00 0.00 36.82 34.73 1g18 h ILE 320 CO 0.02 0.01 0.66 -0.08 -0.68 0.00 0.00 178.15 178.07 1g18 h GLU 321 N -0.73 0.39 0.16 2.37 4.81 -1.50 -0.73 114.58 119.36 1g18 h GLU 321 Ca -0.07 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.13 1g18 h GLU 321 Cb 0.55 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1g18 h GLU 321 CO 0.12 0.26 -0.08 0.87 -0.73 0.00 0.00 179.01 179.45 1g18 h LYS 322 N 0.40 -0.21 0.00 1.92 1.57 0.17 -2.97 116.57 117.45 1g18 h LYS 322 Ca 0.57 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.36 1g18 h LYS 322 Cb 1.45 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.80 1g18 h LYS 322 CO -0.27 0.16 0.00 0.87 -0.57 0.00 0.00 179.45 179.65 1g18 h LYS 323 N -0.65 0.00 0.00 3.15 1.57 0.64 -1.27 116.57 120.02 1g18 h LYS 323 Ca -0.02 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.61 1g18 h LYS 323 Cb 0.48 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.76 1g18 h LYS 323 CO 0.04 0.00 -1.39 1.51 -0.57 0.00 0.00 179.45 179.04 1g18 n ILE 324 N -2.79 1.10 0.03 1.86 3.06 -0.78 -3.40 119.36 118.44 1g18 n ILE 324 Ca -0.01 -0.67 -0.13 0.00 -2.50 0.00 0.00 62.75 59.44 1g18 n ILE 324 Cb 0.13 -0.67 -0.09 0.00 0.54 0.00 0.00 39.64 39.54 1g18 n ILE 324 CO 0.00 0.00 0.00 0.11 -2.50 0.00 0.00 176.55 174.16 1g18 h LYS 325 N 0.00 -0.10 -0.83 9.51 1.57 -1.08 -2.93 116.57 122.72 1g18 h LYS 325 Ca -0.15 0.01 0.16 0.00 -1.87 0.00 0.00 60.65 58.81 1g18 h LYS 325 Cb 1.51 0.02 -0.10 0.00 0.08 0.00 0.00 32.23 33.74 1g18 h LYS 325 CO 0.04 0.31 0.37 0.93 -0.57 0.00 0.00 179.45 180.53 1g18 h GLU 326 N -0.53 0.48 -0.30 3.15 5.08 -1.51 -0.11 114.58 120.83 1g18 h GLU 326 Ca -0.01 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1g18 h GLU 326 Cb 0.45 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1g18 h GLU 326 CO 0.02 0.32 0.00 1.63 -1.00 0.00 0.00 179.01 179.97 1g18 n LYS 327 N -4.97 0.98 0.02 2.33 5.02 -1.12 -4.64 118.16 115.78 1g18 n LYS 327 Ca 0.17 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 1g18 n LYS 327 Cb 0.49 -1.15 0.00 0.00 -0.02 0.00 0.00 35.03 34.35 1g18 n LYS 327 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1g18 n LEU 328 N -0.34 -0.33 -0.61 -0.35 4.77 -0.16 -5.05 117.00 114.93 1g18 n LEU 328 Ca 0.00 0.08 0.08 0.00 -0.03 0.00 0.00 56.01 56.14 1g18 n LEU 328 Cb 0.07 0.64 0.06 0.00 -2.33 0.00 0.00 43.42 41.86 1g18 n LEU 328 CO 0.00 -0.45 0.49 0.61 -1.33 0.00 0.00 177.39 176.71