#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x98 s ALA 1 N 0.00 3.36 -0.89 -5.12 0.00 -1.26 -4.89 121.76 112.96 1x98 s ALA 1 Ca 0.00 1.22 0.28 0.00 0.00 0.00 0.00 51.96 53.46 1x98 s ALA 1 Cb 0.00 -3.47 1.04 0.00 0.00 0.00 0.00 23.12 20.69 1x98 s ALA 1 CO 0.00 -0.71 1.85 -1.13 0.00 0.00 0.00 175.76 175.77 1x98 n SER 2 N 0.45 0.33 -4.19 0.00 3.41 -1.26 -4.86 113.62 107.49 1x98 n SER 2 Ca 0.02 0.50 -0.17 0.00 -0.26 0.00 0.00 58.87 58.96 1x98 n SER 2 Cb 0.43 -0.58 -0.11 0.00 -0.26 0.00 0.00 64.21 63.69 1x98 n SER 2 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1x98 s ARG 3 N -3.04 0.88 -0.01 4.33 0.52 -1.26 -1.03 118.95 119.34 1x98 s ARG 3 Ca 0.13 -1.10 0.07 0.00 -0.52 0.00 0.00 55.73 54.31 1x98 s ARG 3 Cb 0.16 -0.74 -0.02 0.00 0.52 0.00 0.00 34.95 34.87 1x98 s ARG 3 CO 0.56 0.14 -0.23 -1.50 0.02 0.00 0.00 175.30 174.30 1x98 s ILE 4 N -1.92 2.38 -0.07 1.52 2.07 -0.07 -4.86 121.20 120.25 1x98 s ILE 4 Ca 0.03 -1.08 -0.26 0.00 -1.41 0.00 0.00 60.65 57.93 1x98 s ILE 4 Cb -0.06 -1.89 -0.03 0.00 0.13 0.00 0.00 42.46 40.61 1x98 s ILE 4 CO 0.02 0.52 0.84 -0.22 -1.91 0.00 0.00 174.94 174.19 1x98 s LEU 5 N -0.83 4.30 0.46 8.50 2.96 -1.26 -0.59 118.68 132.22 1x98 s LEU 5 Ca 0.11 1.37 -0.04 0.00 -0.22 0.00 0.00 54.13 55.36 1x98 s LEU 5 Cb -0.10 -3.31 -0.03 0.00 0.50 0.00 0.00 46.19 43.25 1x98 s LEU 5 CO 0.01 -0.25 0.74 -0.76 -1.32 0.00 0.00 176.35 174.77 1x98 s LEU 6 N 1.23 3.66 0.00 -0.68 1.43 0.34 -4.97 118.68 119.69 1x98 s LEU 6 Ca 0.43 0.74 0.09 0.00 -1.03 0.00 0.00 54.13 54.36 1x98 s LEU 6 Cb -0.19 -3.65 0.52 0.00 0.03 0.00 0.00 46.19 42.90 1x98 s LEU 6 CO 0.20 -0.59 1.09 -0.46 0.23 0.00 0.00 176.35 176.82 1x98 n ASN 7 N -2.19 0.00 -1.01 2.29 0.23 -1.26 -1.28 115.26 112.04 1x98 n ASN 7 Ca 0.00 -1.12 0.11 0.00 -0.53 0.00 0.00 54.58 53.04 1x98 n ASN 7 Cb 0.56 0.00 0.15 0.00 -2.08 0.00 0.00 39.78 38.41 1x98 n ASN 7 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1x98 n ASN 8 N -0.69 3.15 0.00 0.53 6.94 -1.26 -4.97 115.26 118.95 1x98 n ASN 8 Ca 0.07 -1.97 0.00 0.00 -0.02 0.00 0.00 54.58 52.66 1x98 n ASN 8 Cb 0.03 -0.11 0.00 0.00 -2.36 0.00 0.00 39.78 37.34 1x98 n ASN 8 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1x98 n GLY 9 N 1.36 1.01 3.93 4.83 0.00 -0.40 -5.05 105.19 110.87 1x98 n GLY 9 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 1x98 n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x98 s ALA 10 N -2.84 3.71 -0.13 4.61 0.00 -1.26 -4.87 121.76 120.98 1x98 s ALA 10 Ca 0.00 -0.78 -0.05 0.00 0.00 0.00 0.00 51.96 51.13 1x98 s ALA 10 Cb 0.00 -2.14 -0.04 0.00 0.00 0.00 0.00 23.12 20.95 1x98 s ALA 10 CO 0.00 0.18 0.04 0.15 0.00 0.00 0.00 175.76 176.13 1x98 s LYS 11 N -3.82 3.41 -0.16 0.00 1.02 -1.26 -0.50 119.74 118.42 1x98 s LYS 11 Ca 0.41 -0.34 -0.01 0.00 0.02 0.00 0.00 55.97 56.04 1x98 s LYS 11 Cb -0.10 -3.00 -0.01 0.00 -0.52 0.00 0.00 37.83 34.20 1x98 s LYS 11 CO 0.32 0.56 -0.11 1.41 -0.92 0.00 0.00 175.35 176.61 1x98 s MET 12 N -0.46 3.36 0.24 1.68 -2.45 0.24 -4.89 119.30 117.02 1x98 s MET 12 Ca 0.09 -0.68 -0.31 0.00 -1.25 0.00 0.00 55.69 53.55 1x98 s MET 12 Cb -0.12 -2.74 -0.12 0.00 1.25 0.00 0.00 34.83 33.10 1x98 s MET 12 CO 0.02 0.06 1.67 -2.14 1.05 0.00 0.00 175.02 175.68 1x98 s PRO 13 N 0.75 4.13 0.28 4.11 0.02 -1.26 -0.89 135.00 142.14 1x98 s PRO 13 Ca -0.05 2.58 0.26 0.00 0.02 0.00 0.00 61.00 63.81 1x98 s PRO 13 Cb -0.15 -3.06 0.88 0.00 0.02 0.00 0.00 34.50 32.19 1x98 s PRO 13 CO 0.01 -0.70 1.76 -0.84 -0.33 0.00 0.00 177.00 176.90 1x98 h ILE 14 N 3.67 0.00 -3.32 2.83 3.07 -1.43 -3.41 117.51 118.93 1x98 h ILE 14 Ca -0.44 -0.44 -0.66 0.00 1.55 0.00 0.00 64.86 64.87 1x98 h ILE 14 Cb 1.21 1.35 -0.27 0.00 -0.27 0.00 0.00 36.82 38.83 1x98 h ILE 14 CO 0.90 0.00 -0.76 -0.22 -1.05 0.00 0.00 178.15 177.01 1x98 s LEU 15 N -4.83 2.71 0.25 0.16 2.96 -1.26 -0.50 118.68 118.17 1x98 s LEU 15 Ca 0.07 -0.36 0.04 0.00 -0.22 0.00 0.00 54.13 53.66 1x98 s LEU 15 Cb 0.10 -1.62 -0.05 0.00 0.50 0.00 0.00 46.19 45.11 1x98 s LEU 15 CO 0.52 0.12 -0.01 -0.83 -1.32 0.00 0.00 176.35 174.84 1x98 s GLY 16 N 0.59 1.66 -0.23 7.98 0.00 0.00 -4.31 107.32 113.01 1x98 s GLY 16 Ca -0.07 -1.82 -0.14 0.00 0.00 0.00 0.00 44.72 42.68 1x98 s GLY 16 CO 0.03 -1.71 0.32 -2.27 0.00 0.00 0.00 173.10 169.47 1x98 s LEU 17 N -3.35 4.11 0.53 0.66 2.96 -0.11 -3.34 118.68 120.14 1x98 s LEU 17 Ca 0.30 0.32 -0.13 0.00 -0.22 0.00 0.00 54.13 54.40 1x98 s LEU 17 Cb 0.06 -2.36 -0.06 0.00 0.50 0.00 0.00 46.19 44.32 1x98 s LEU 17 CO 0.10 -0.07 0.95 -0.83 -1.32 0.00 0.00 176.35 175.19 1x98 s GLY 18 N 1.23 1.90 0.00 7.98 0.00 -0.52 -1.02 107.32 116.89 1x98 s GLY 18 Ca 0.14 0.01 0.00 0.00 0.00 0.00 0.00 44.72 44.87 1x98 s GLY 18 CO 0.08 0.26 0.31 -1.30 0.00 0.00 0.00 173.10 172.45 1x98 n THR 19 N -1.92 0.10 -1.92 0.90 -2.24 -1.16 -4.21 114.28 103.83 1x98 n THR 19 Ca 0.05 -0.21 -0.42 0.00 -2.27 0.00 0.00 64.05 61.21 1x98 n THR 19 Cb 0.54 1.42 -0.03 0.00 -2.10 0.00 0.00 70.33 70.16 1x98 n THR 19 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1x98 s TRP 20 N -0.10 3.04 0.00 4.78 -0.00 -1.26 -1.98 118.94 123.41 1x98 s TRP 20 Ca 0.00 0.65 0.00 0.00 -0.00 0.00 0.00 56.10 56.75 1x98 s TRP 20 Cb 0.00 -3.94 0.00 0.00 -0.00 0.00 0.00 33.47 29.53 1x98 s TRP 20 CO 0.00 -3.41 0.00 1.63 -0.00 0.00 0.00 176.95 175.17 1x98 n LYS 21 N 3.75 0.00 -2.23 5.86 5.02 -1.26 -4.99 118.16 124.31 1x98 n LYS 21 Ca 0.13 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.99 1x98 n LYS 21 Cb 0.38 -2.68 -0.02 0.00 -0.02 0.00 0.00 35.03 32.69 1x98 n LYS 21 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1x98 s SER 22 N -2.91 6.48 0.53 4.39 0.01 -0.84 -4.95 113.70 116.41 1x98 s SER 22 Ca 0.00 1.46 -0.22 0.00 1.31 0.00 0.00 55.95 58.50 1x98 s SER 22 Cb 0.00 -2.53 -0.05 0.00 0.21 0.00 0.00 66.02 63.64 1x98 s SER 22 CO 0.00 -1.20 1.33 -2.84 0.41 0.00 0.00 173.24 170.94 1x98 s PRO 23 N 4.50 3.23 0.50 12.44 0.02 -1.26 -4.69 135.00 149.75 1x98 s PRO 23 Ca 0.66 2.17 0.16 0.00 0.02 0.00 0.00 61.00 64.02 1x98 s PRO 23 Cb -0.22 -2.28 1.21 0.00 0.02 0.00 0.00 34.50 33.23 1x98 s PRO 23 CO 0.27 -1.10 2.10 -1.00 -0.33 0.00 0.00 177.00 176.95 1x98 h PRO 24 N 1.55 0.00 0.00 5.54 0.13 -1.93 0.53 132.00 137.83 1x98 h PRO 24 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1x98 h PRO 24 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1x98 h PRO 24 CO 0.58 0.06 0.00 0.41 -0.23 0.00 0.00 178.00 178.82 1x98 n GLY 25 N -1.34 -1.29 0.00 1.56 0.00 -1.26 -3.76 105.19 99.10 1x98 n GLY 25 Ca -0.03 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1x98 n GLY 25 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1x98 n GLN 26 N -1.38 0.36 0.17 1.61 1.13 -0.19 -4.80 117.38 114.27 1x98 n GLN 26 Ca 0.10 -0.00 0.04 0.00 -1.94 0.00 0.00 57.00 55.20 1x98 n GLN 26 Cb 0.26 -1.00 0.22 0.00 0.11 0.00 0.00 30.24 29.83 1x98 n GLN 26 CO 0.00 0.00 0.00 -0.24 -1.44 0.00 0.00 177.06 175.38 1x98 h VAL 27 N 0.00 0.92 -0.16 5.09 3.04 -1.06 -1.07 116.25 123.01 1x98 h VAL 27 Ca -0.00 -1.82 -0.01 0.00 -1.01 0.00 0.00 66.70 63.86 1x98 h VAL 27 Cb 0.10 2.12 -0.01 0.00 -2.01 0.00 0.00 31.29 31.49 1x98 h VAL 27 CO 0.00 0.44 0.06 0.74 -1.01 0.00 0.00 177.57 177.79 1x98 h THR 28 N 0.00 1.17 -0.65 3.17 2.02 -1.76 -0.60 112.91 116.26 1x98 h THR 28 Ca -0.00 -0.52 -0.05 0.00 0.77 0.00 0.00 66.41 66.61 1x98 h THR 28 Cb 1.08 1.22 -0.03 0.00 -1.74 0.00 0.00 68.15 68.68 1x98 h THR 28 CO 0.06 0.16 0.22 -0.08 0.37 0.00 0.00 175.52 176.24 1x98 h GLU 29 N 0.09 0.98 -0.58 6.66 4.57 -1.86 -1.05 114.58 123.39 1x98 h GLU 29 Ca 0.05 -0.19 -0.02 0.00 -1.18 0.00 0.00 59.36 58.03 1x98 h GLU 29 Cb 0.20 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.61 1x98 h GLU 29 CO -0.00 0.83 0.30 0.00 -1.18 0.00 0.00 179.01 178.96 1x98 h ALA 30 N 1.28 0.74 -0.21 2.92 0.00 -0.80 -0.10 119.26 123.09 1x98 h ALA 30 Ca 0.22 -0.11 -0.15 0.00 0.00 0.00 0.00 54.91 54.86 1x98 h ALA 30 Cb 0.25 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1x98 h ALA 30 CO -0.01 0.28 -0.49 0.28 0.00 0.00 0.00 179.25 179.31 1x98 h VAL 31 N 0.78 1.31 -0.35 0.00 2.07 -0.92 -0.56 116.25 118.58 1x98 h VAL 31 Ca 0.20 -1.71 -0.00 0.00 0.82 0.00 0.00 66.70 66.01 1x98 h VAL 31 Cb 0.08 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 1x98 h VAL 31 CO -0.03 0.53 0.20 0.11 0.02 0.00 0.00 177.57 178.40 1x98 h LYS 32 N 0.44 0.48 -0.27 1.57 1.57 -0.81 -1.07 116.57 118.48 1x98 h LYS 32 Ca 0.02 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1x98 h LYS 32 Cb 1.02 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.22 1x98 h LYS 32 CO 0.09 0.39 0.10 0.28 -0.57 0.00 0.00 179.45 179.74 1x98 h VAL 33 N 0.44 1.18 -0.37 0.50 2.07 -0.90 -0.91 116.25 118.27 1x98 h VAL 33 Ca 0.12 -0.58 0.06 0.00 0.82 0.00 0.00 66.70 67.13 1x98 h VAL 33 Cb 0.04 1.06 -0.05 0.00 -1.52 0.00 0.00 31.29 30.82 1x98 h VAL 33 CO -0.02 0.19 0.07 0.00 0.02 0.00 0.00 177.57 177.83 1x98 h ALA 34 N 0.94 0.40 -0.72 1.67 0.00 -0.89 -0.89 119.26 119.77 1x98 h ALA 34 Ca 0.09 0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 1x98 h ALA 34 Cb 0.21 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1x98 h ALA 34 CO -0.01 -0.33 0.25 0.82 0.00 0.00 0.00 179.25 179.98 1x98 h ILE 35 N 0.19 1.25 -0.44 0.00 2.04 -1.05 0.14 117.51 119.65 1x98 h ILE 35 Ca 0.18 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.19 1x98 h ILE 35 Cb 0.21 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.70 1x98 h ILE 35 CO -0.24 0.33 0.23 0.44 0.00 0.00 0.00 178.15 178.91 1x98 h ASP 36 N 1.06 0.53 -0.50 1.72 3.32 -0.20 -2.59 116.42 119.76 1x98 h ASP 36 Ca 0.24 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1x98 h ASP 36 Cb 0.26 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.68 1x98 h ASP 36 CO -0.01 0.44 0.00 1.33 -1.72 0.00 0.00 179.24 179.27 1x98 n VAL 37 N -4.42 0.66 0.00 -1.35 0.24 -0.43 -4.93 118.33 108.10 1x98 n VAL 37 Ca 0.03 -0.77 0.00 0.00 -2.04 0.00 0.00 64.34 61.56 1x98 n VAL 37 Cb 0.10 0.66 0.00 0.00 -1.47 0.00 0.00 33.84 33.13 1x98 n VAL 37 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1x98 n GLY 38 N 1.49 1.43 3.77 7.63 0.00 -0.82 -5.03 105.19 113.66 1x98 n GLY 38 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 1x98 n GLY 38 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1x98 s TYR 39 N -1.31 3.07 0.00 1.61 1.51 -0.02 -4.89 117.35 117.32 1x98 s TYR 39 Ca 0.00 1.44 0.00 0.00 -1.01 0.00 0.00 57.07 57.50 1x98 s TYR 39 Cb 0.00 -3.65 0.00 0.00 -0.11 0.00 0.00 41.96 38.20 1x98 s TYR 39 CO 0.00 -1.77 0.27 0.54 -1.11 0.00 0.00 175.55 173.48 1x98 n ARG 40 N 0.79 1.21 -4.96 -0.62 5.12 -1.26 -4.19 116.66 112.75 1x98 n ARG 40 Ca 0.00 -0.27 -0.32 0.00 -1.93 0.00 0.00 57.85 55.33 1x98 n ARG 40 Cb 0.42 -0.74 -0.17 0.00 -1.16 0.00 0.00 32.46 30.81 1x98 n ARG 40 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1x98 s HIS 41 N -0.25 2.52 -0.10 -1.55 2.46 -1.26 0.33 115.29 117.43 1x98 s HIS 41 Ca 0.00 -1.13 0.02 0.00 0.47 0.00 0.00 55.06 54.43 1x98 s HIS 41 Cb 0.00 -1.70 0.01 0.00 -0.13 0.00 0.00 32.58 30.76 1x98 s HIS 41 CO 0.00 -0.49 -0.17 0.42 -2.47 0.00 0.00 174.74 172.03 1x98 s ILE 42 N 0.56 1.63 -0.27 0.89 -1.09 -0.94 -0.93 121.20 121.04 1x98 s ILE 42 Ca -0.14 -0.74 -0.11 0.00 -2.23 0.00 0.00 60.65 57.43 1x98 s ILE 42 Cb -0.17 -1.46 -0.05 0.00 -1.58 0.00 0.00 42.46 39.21 1x98 s ILE 42 CO 0.04 0.46 0.18 -0.62 -1.23 0.00 0.00 174.94 173.78 1x98 s ASP 43 N 0.77 6.05 0.38 3.58 2.15 -0.19 -1.91 116.67 127.49 1x98 s ASP 43 Ca -0.11 0.02 0.04 0.00 0.43 0.00 0.00 52.55 52.94 1x98 s ASP 43 Cb -0.16 -2.12 -0.05 0.00 -0.30 0.00 0.00 42.92 40.29 1x98 s ASP 43 CO 0.02 -0.02 0.06 0.00 -0.17 0.00 0.00 175.17 175.05 1x98 s ALA 45 N -3.12 -1.85 0.28 0.00 0.00 -1.26 -3.74 121.76 112.07 1x98 s ALA 45 Ca 0.30 1.81 0.01 0.00 0.00 0.00 0.00 51.96 54.08 1x98 s ALA 45 Cb 0.07 -0.98 0.54 0.00 0.00 0.00 0.00 23.12 22.75 1x98 s ALA 45 CO 0.14 -0.31 1.84 1.25 0.00 0.00 0.00 175.76 178.68 1x98 h HIS 46 N 4.14 1.14 0.00 0.00 -0.00 -1.98 -1.64 115.15 116.82 1x98 h HIS 46 Ca -0.27 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.13 1x98 h HIS 46 Cb 1.16 -0.36 0.00 0.00 -0.00 0.00 0.00 27.41 28.21 1x98 h HIS 46 CO 0.36 0.46 0.00 1.55 -0.00 0.00 0.00 177.93 180.29 1x98 n VAL 47 N -4.62 0.85 0.60 5.26 3.14 -1.26 -1.72 118.33 120.58 1x98 n VAL 47 Ca 0.19 0.29 0.12 0.00 -2.96 0.00 0.00 64.34 61.98 1x98 n VAL 47 Cb 0.34 -1.23 0.45 0.00 -1.06 0.00 0.00 33.84 32.35 1x98 n VAL 47 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 1x98 n TYR 48 N -2.24 0.68 -1.35 1.45 4.01 -0.62 -4.92 117.16 114.18 1x98 n TYR 48 Ca 0.02 0.22 -0.12 0.00 -0.16 0.00 0.00 57.90 57.86 1x98 n TYR 48 Cb 0.21 -0.86 -0.05 0.00 -0.31 0.00 0.00 39.34 38.32 1x98 n TYR 48 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1x98 n GLN 49 N -2.08 -1.02 -0.14 -0.72 6.02 -0.70 -4.81 117.38 113.92 1x98 n GLN 49 Ca 0.05 0.90 0.04 0.00 -0.01 0.00 0.00 57.00 57.97 1x98 n GLN 49 Cb 0.34 -4.98 0.05 0.00 1.02 0.00 0.00 30.24 26.67 1x98 n GLN 49 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1x98 n ASN 50 N -0.32 1.36 -0.01 1.08 0.23 -1.26 -4.81 115.26 111.54 1x98 n ASN 50 Ca -0.12 -2.25 -0.00 0.00 -0.53 0.00 0.00 54.58 51.68 1x98 n ASN 50 Cb 0.44 -0.20 0.29 0.00 -2.08 0.00 0.00 39.78 38.23 1x98 n ASN 50 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1x98 h GLU 51 N 0.00 0.54 -0.59 -3.83 5.08 -1.88 -1.73 114.58 112.16 1x98 h GLU 51 Ca 0.00 -0.12 0.04 0.00 -1.00 0.00 0.00 59.36 58.28 1x98 h GLU 51 Cb 0.97 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 30.10 1x98 h GLU 51 CO 0.00 0.56 0.34 -0.97 -1.00 0.00 0.00 179.01 177.95 1x98 h ASN 52 N 0.51 0.54 0.17 1.42 -1.24 -1.88 0.44 115.58 115.54 1x98 h ASN 52 Ca 0.11 0.01 -0.15 0.00 0.71 0.00 0.00 56.30 56.98 1x98 h ASN 52 Cb 0.33 -0.10 -0.01 0.00 0.73 0.00 0.00 38.32 39.28 1x98 h ASN 52 CO 0.01 0.37 -0.56 -0.33 -1.29 0.00 0.00 177.43 175.63 1x98 h GLU 53 N 0.67 0.42 -0.33 6.67 3.07 -1.75 -1.21 114.58 122.11 1x98 h GLU 53 Ca 0.25 -0.27 0.02 0.00 -0.50 0.00 0.00 59.36 58.86 1x98 h GLU 53 Cb 0.08 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.00 1x98 h GLU 53 CO -0.13 0.87 0.19 0.28 -1.40 0.00 0.00 179.01 178.81 1x98 h VAL 54 N 0.32 1.02 -0.26 3.13 2.07 -1.11 -2.83 116.25 118.59 1x98 h VAL 54 Ca 0.00 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 1x98 h VAL 54 Cb 1.08 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1x98 h VAL 54 CO 0.10 0.07 0.04 1.23 0.02 0.00 0.00 177.57 179.02 1x98 h GLY 55 N 0.38 0.40 0.85 2.17 0.00 -0.49 -1.63 103.07 104.75 1x98 h GLY 55 Ca 0.13 -0.20 0.04 0.00 0.00 0.00 0.00 47.33 47.31 1x98 h GLY 55 CO -0.07 0.19 0.59 -2.08 0.00 0.00 0.00 176.54 175.17 1x98 h VAL 56 N 0.37 1.14 -0.25 4.60 2.07 -0.99 -0.24 116.25 122.94 1x98 h VAL 56 Ca 0.09 -0.39 -0.05 0.00 0.82 0.00 0.00 66.70 67.16 1x98 h VAL 56 Cb 0.19 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.85 1x98 h VAL 56 CO 0.00 0.21 -0.05 0.00 0.02 0.00 0.00 177.57 177.75 1x98 h ALA 57 N 1.39 0.35 -0.28 1.67 0.00 -1.23 -1.20 119.26 119.96 1x98 h ALA 57 Ca 0.37 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1x98 h ALA 57 Cb 0.03 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1x98 h ALA 57 CO -0.13 0.14 0.17 0.82 0.00 0.00 0.00 179.25 180.24 1x98 h ILE 58 N 0.23 1.04 -0.78 0.00 2.04 -1.01 -1.85 117.51 117.18 1x98 h ILE 58 Ca 0.07 -0.12 -0.05 0.00 1.00 0.00 0.00 64.86 65.76 1x98 h ILE 58 Cb 0.51 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.22 1x98 h ILE 58 CO 0.02 0.06 0.28 -0.61 0.00 0.00 0.00 178.15 177.91 1x98 h GLN 59 N 0.34 1.18 -0.67 2.37 5.75 -0.99 -0.73 115.11 122.37 1x98 h GLN 59 Ca 0.11 -0.23 -0.06 0.00 -0.15 0.00 0.00 58.65 58.31 1x98 h GLN 59 Cb -0.01 -0.18 -0.03 0.00 1.07 0.00 0.00 27.48 28.33 1x98 h GLN 59 CO -0.04 0.98 0.17 1.49 -2.65 0.00 0.00 178.83 178.78 1x98 h GLU 60 N 1.15 1.06 -0.02 1.69 4.81 -0.91 -0.25 114.58 122.11 1x98 h GLU 60 Ca 0.26 -0.25 -0.16 0.00 -0.13 0.00 0.00 59.36 59.08 1x98 h GLU 60 Cb 0.26 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 1x98 h GLU 60 CO -0.02 0.94 -0.72 0.87 -0.73 0.00 0.00 179.01 179.36 1x98 h LYS 61 N 0.99 0.10 -0.44 1.92 1.79 -0.98 -0.36 116.57 119.60 1x98 h LYS 61 Ca 0.21 -0.09 -0.08 0.00 -2.18 0.00 0.00 60.65 58.52 1x98 h LYS 61 Cb 0.35 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.01 1x98 h LYS 61 CO 0.00 0.77 -0.03 -0.07 -1.08 0.00 0.00 179.45 179.05 1x98 h LEU 62 N 0.06 0.78 -0.51 2.94 3.38 -0.98 -1.78 115.31 119.21 1x98 h LEU 62 Ca -0.01 -0.32 -0.09 0.00 0.09 0.00 0.00 57.88 57.54 1x98 h LEU 62 Cb 1.27 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 1x98 h LEU 62 CO 0.10 0.91 -0.05 -0.09 0.09 0.00 0.00 178.44 179.40 1x98 h ARG 63 N 0.63 0.93 0.00 1.13 2.43 -0.78 -1.72 114.38 116.99 1x98 h ARG 63 Ca 0.12 -0.32 0.00 0.00 -0.81 0.00 0.00 59.98 58.97 1x98 h ARG 63 Cb 0.53 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 1x98 h ARG 63 CO 0.03 0.98 0.00 0.39 -1.51 0.00 0.00 179.97 179.86 1x98 n GLU 64 N -4.26 0.15 -2.66 0.20 1.02 -0.17 -4.88 120.64 110.04 1x98 n GLU 64 Ca 0.01 0.18 -0.21 0.00 -0.02 0.00 0.00 57.16 57.12 1x98 n GLU 64 Cb 0.36 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.28 1x98 n GLU 64 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1x98 n GLN 65 N -1.33 -2.98 0.03 3.49 6.02 -0.65 -4.87 117.38 117.09 1x98 n GLN 65 Ca 0.06 0.94 -0.02 0.00 -0.01 0.00 0.00 57.00 57.96 1x98 n GLN 65 Cb 0.12 -5.68 0.23 0.00 1.02 0.00 0.00 30.24 25.92 1x98 n GLN 65 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1x98 h VAL 66 N -0.55 1.26 -3.62 5.09 2.07 -1.59 -3.46 116.25 115.44 1x98 h VAL 66 Ca -0.50 -1.21 -0.09 0.00 0.82 0.00 0.00 66.70 65.72 1x98 h VAL 66 Cb 1.36 1.35 -0.16 0.00 -1.52 0.00 0.00 31.29 32.32 1x98 h VAL 66 CO 0.57 0.38 -0.35 0.68 0.02 0.00 0.00 177.57 178.87 1x98 s VAL 67 N -4.51 0.12 0.10 2.57 -7.23 -1.22 -5.07 120.40 105.15 1x98 s VAL 67 Ca -0.06 -0.97 0.01 0.00 -1.81 0.00 0.00 61.98 59.15 1x98 s VAL 67 Cb 0.14 -1.12 -0.04 0.00 0.56 0.00 0.00 36.38 35.92 1x98 s VAL 67 CO 0.78 -0.54 0.22 -0.54 -0.31 0.00 0.00 175.10 174.71 1x98 s LYS 68 N -3.20 3.36 0.32 4.82 1.02 -1.26 -4.37 119.74 120.42 1x98 s LYS 68 Ca -0.00 -0.54 0.03 0.00 0.02 0.00 0.00 55.97 55.48 1x98 s LYS 68 Cb 0.02 -2.97 0.62 0.00 -0.52 0.00 0.00 37.83 34.98 1x98 s LYS 68 CO -0.07 0.57 1.89 -0.09 -0.92 0.00 0.00 175.35 176.73 1x98 h ARG 69 N 2.75 0.89 0.00 1.68 9.65 -1.95 -0.86 114.38 126.54 1x98 h ARG 69 Ca -0.46 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.36 1x98 h ARG 69 Cb 1.17 -0.20 0.00 0.00 -1.39 0.00 0.00 29.97 29.55 1x98 h ARG 69 CO 0.72 0.59 0.00 1.05 2.80 0.00 0.00 179.97 185.13 1x98 h GLU 70 N 0.92 0.00 0.00 0.20 4.11 -2.03 -1.86 114.58 115.92 1x98 h GLU 70 Ca 0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.84 1x98 h GLU 70 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1x98 h GLU 70 CO -0.17 0.00 -0.38 0.39 0.07 0.00 0.00 179.01 178.92 1x98 n GLU 71 N -3.03 0.11 -3.64 1.06 1.02 -0.33 -4.88 120.64 110.96 1x98 n GLU 71 Ca -0.01 0.05 -0.32 0.00 -0.02 0.00 0.00 57.16 56.86 1x98 n GLU 71 Cb 0.22 -1.59 -0.05 0.00 -0.02 0.00 0.00 31.44 30.00 1x98 n GLU 71 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1x98 s LEU 72 N -3.52 4.29 -0.33 -4.62 1.43 -0.70 -4.82 118.68 110.41 1x98 s LEU 72 Ca 0.10 0.66 0.01 0.00 -1.03 0.00 0.00 54.13 53.87 1x98 s LEU 72 Cb 0.16 -3.22 0.10 0.00 0.03 0.00 0.00 46.19 43.26 1x98 s LEU 72 CO 0.66 0.08 0.09 0.12 0.23 0.00 0.00 176.35 177.53 1x98 s PHE 73 N -1.59 2.49 -0.18 0.29 5.36 0.15 -4.94 117.98 119.57 1x98 s PHE 73 Ca 0.39 -2.25 -0.05 0.00 -0.96 0.00 0.00 56.93 54.06 1x98 s PHE 73 Cb -0.13 -2.18 -0.03 0.00 -0.34 0.00 0.00 43.02 40.35 1x98 s PHE 73 CO 0.22 -0.90 -0.01 0.42 -1.46 0.00 0.00 175.22 173.50 1x98 s ILE 74 N 1.28 4.04 -0.09 3.12 -1.09 -1.26 -2.22 121.20 124.98 1x98 s ILE 74 Ca 0.11 -0.30 0.02 0.00 -2.23 0.00 0.00 60.65 58.25 1x98 s ILE 74 Cb -0.18 -2.80 -0.02 0.00 -1.58 0.00 0.00 42.46 37.88 1x98 s ILE 74 CO -0.18 0.46 -0.16 -0.69 -1.23 0.00 0.00 174.94 173.15 1x98 s VAL 75 N 0.66 2.87 0.31 2.92 1.01 -0.80 -1.24 120.40 126.12 1x98 s VAL 75 Ca -0.01 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.28 1x98 s VAL 75 Cb -0.14 -2.16 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 1x98 s VAL 75 CO 0.02 0.55 0.23 -0.24 0.00 0.00 0.00 175.10 175.67 1x98 n SER 76 N 3.04 -0.30 -3.84 3.32 2.88 -0.85 -0.55 113.62 117.33 1x98 n SER 76 Ca -0.18 -2.96 -0.12 0.00 -1.33 0.00 0.00 58.87 54.28 1x98 n SER 76 Cb 0.52 1.39 -0.13 0.00 -0.75 0.00 0.00 64.21 65.24 1x98 n SER 76 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1x98 s LYS 77 N -3.25 0.08 -0.22 -1.46 1.02 -1.25 -1.15 119.74 113.52 1x98 s LYS 77 Ca 0.33 0.13 -0.29 0.00 0.02 0.00 0.00 55.97 56.15 1x98 s LYS 77 Cb 0.02 0.02 -0.00 0.00 -0.52 0.00 0.00 37.83 37.34 1x98 s LYS 77 CO 0.23 -0.03 1.18 -1.17 -0.92 0.00 0.00 175.35 174.64 1x98 s LEU 78 N 0.16 4.09 0.69 3.17 2.96 0.49 -3.82 118.68 126.41 1x98 s LEU 78 Ca -0.01 1.46 -0.11 0.00 -0.22 0.00 0.00 54.13 55.25 1x98 s LEU 78 Cb -0.02 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.14 1x98 s LEU 78 CO -0.00 -0.79 1.06 0.86 -1.32 0.00 0.00 176.35 176.15 1x98 s TRP 79 N 3.54 3.19 0.55 5.38 -0.11 -1.26 -1.96 118.94 128.28 1x98 s TRP 79 Ca 0.51 1.39 0.23 0.00 1.22 0.00 0.00 56.10 59.44 1x98 s TRP 79 Cb -0.18 -2.87 1.54 0.00 -1.50 0.00 0.00 33.47 30.47 1x98 s TRP 79 CO 0.13 -1.17 2.20 0.00 -4.62 0.00 0.00 176.95 173.50 1x98 n THR 81 N -4.20 0.07 -1.33 0.00 -2.24 -1.26 -0.32 114.28 105.01 1x98 n THR 81 Ca -0.03 -0.12 0.08 0.00 -2.27 0.00 0.00 64.05 61.71 1x98 n THR 81 Cb 0.09 -0.06 0.15 0.00 -2.10 0.00 0.00 70.33 68.41 1x98 n THR 81 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1x98 n TYR 82 N -0.40 0.00 0.31 4.78 4.01 -0.68 -4.06 117.16 121.12 1x98 n TYR 82 Ca 0.14 -1.11 0.16 0.00 -0.16 0.00 0.00 57.90 56.93 1x98 n TYR 82 Cb 0.15 -0.18 0.59 0.00 -0.31 0.00 0.00 39.34 39.59 1x98 n TYR 82 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1x98 h HIS 83 N 0.36 0.00 -3.58 -0.72 3.86 -1.70 -3.34 115.15 110.02 1x98 h HIS 83 Ca -0.01 0.00 -0.54 0.00 -1.16 0.00 0.00 60.37 58.66 1x98 h HIS 83 Cb 1.04 0.00 0.10 0.00 1.06 0.00 0.00 27.41 29.61 1x98 h HIS 83 CO 0.26 0.00 0.76 0.39 0.86 0.00 0.00 177.93 180.20 1x98 n GLU 84 N -2.89 2.58 -0.27 2.45 -0.58 -1.26 -4.42 120.64 116.25 1x98 n GLU 84 Ca 0.01 0.91 0.11 0.00 -0.42 0.00 0.00 57.16 57.77 1x98 n GLU 84 Cb 0.31 -2.63 0.36 0.00 -0.57 0.00 0.00 31.44 28.91 1x98 n GLU 84 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 1x98 h LYS 85 N 3.50 0.71 0.00 3.49 2.10 -1.88 0.25 116.57 124.74 1x98 h LYS 85 Ca -0.49 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.12 1x98 h LYS 85 Cb 1.24 -0.16 0.00 0.00 -0.90 0.00 0.00 32.23 32.41 1x98 h LYS 85 CO 0.69 0.47 0.00 0.78 -2.00 0.00 0.00 179.45 179.39 1x98 h GLY 86 N 0.73 0.00 0.00 0.07 0.00 -1.94 -3.21 103.07 98.71 1x98 h GLY 86 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.77 1x98 h GLY 86 CO -0.20 0.00 -1.03 1.04 0.00 0.00 0.00 176.54 176.34 1x98 n LEU 87 N -2.31 0.20 -0.08 3.11 4.77 0.06 -4.72 117.00 118.02 1x98 n LEU 87 Ca 0.01 -0.21 -0.10 0.00 -0.03 0.00 0.00 56.01 55.67 1x98 n LEU 87 Cb 0.17 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.23 1x98 n LEU 87 CO 0.17 0.05 0.87 0.58 -1.33 0.00 0.00 177.39 177.73 1x98 h VAL 88 N 0.00 1.18 -0.87 4.08 2.07 -1.52 -1.93 116.25 119.26 1x98 h VAL 88 Ca 0.00 -0.55 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 1x98 h VAL 88 Cb 0.36 1.05 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 1x98 h VAL 88 CO 0.00 0.19 0.47 0.50 0.02 0.00 0.00 177.57 178.75 1x98 h LYS 89 N 0.27 1.21 -0.33 1.57 3.64 -1.85 -1.18 116.57 119.91 1x98 h LYS 89 Ca 0.09 -0.14 -0.10 0.00 -1.27 0.00 0.00 60.65 59.22 1x98 h LYS 89 Cb 0.20 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1x98 h LYS 89 CO -0.01 0.89 -0.21 0.78 -2.27 0.00 0.00 179.45 178.63 1x98 h GLY 90 N 1.21 0.68 0.90 5.01 0.00 -1.80 0.86 103.07 109.93 1x98 h GLY 90 Ca 0.31 -0.55 -0.03 0.00 0.00 0.00 0.00 47.33 47.06 1x98 h GLY 90 CO -0.05 0.50 0.08 0.00 0.00 0.00 0.00 176.54 177.07 1x98 h ALA 91 N 1.22 0.41 -0.42 3.60 0.00 -0.85 -0.61 119.26 122.60 1x98 h ALA 91 Ca 0.08 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1x98 h ALA 91 Cb 0.66 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1x98 h ALA 91 CO 0.05 0.07 0.26 0.00 0.00 0.00 0.00 179.25 179.63 1x98 h GLN 93 N 0.56 0.38 -0.36 0.00 5.75 -0.63 -0.04 115.11 120.77 1x98 h GLN 93 Ca 0.15 -0.12 -0.02 0.00 -0.15 0.00 0.00 58.65 58.51 1x98 h GLN 93 Cb -0.01 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.49 1x98 h GLN 93 CO -0.03 0.57 0.13 -0.22 -2.65 0.00 0.00 178.83 176.63 1x98 h LYS 94 N 0.34 0.55 -0.41 1.69 1.63 -0.95 -0.08 116.57 119.34 1x98 h LYS 94 Ca 0.06 -0.11 0.03 0.00 -0.85 0.00 0.00 60.65 59.78 1x98 h LYS 94 Cb 0.56 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 32.07 1x98 h LYS 94 CO 0.04 0.56 0.21 1.15 -3.45 0.00 0.00 179.45 177.96 1x98 h THR 95 N 0.44 0.99 -0.60 1.00 2.02 -1.01 -0.06 112.91 115.69 1x98 h THR 95 Ca 0.12 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1x98 h THR 95 Cb 0.22 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 67.12 1x98 h THR 95 CO -0.01 0.08 0.37 -0.07 0.37 0.00 0.00 175.52 176.27 1x98 h LEU 96 N 0.43 0.70 -0.47 2.58 3.38 -0.75 0.29 115.31 121.48 1x98 h LEU 96 Ca 0.17 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1x98 h LEU 96 Cb 0.06 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1x98 h LEU 96 CO -0.11 0.54 0.23 0.28 0.09 0.00 0.00 178.44 179.47 1x98 h SER 97 N 0.81 0.61 -0.70 -0.43 0.02 -0.78 0.13 113.55 113.20 1x98 h SER 97 Ca 0.22 -0.12 -0.05 0.00 -0.84 0.00 0.00 61.79 61.00 1x98 h SER 97 Cb -0.05 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.30 1x98 h SER 97 CO -0.04 0.56 0.24 0.44 -1.14 0.00 0.00 176.83 176.89 1x98 h ASP 98 N 0.62 1.00 1.11 3.07 3.45 -0.65 -2.55 116.42 122.47 1x98 h ASP 98 Ca 0.16 -0.19 0.00 0.00 0.43 0.00 0.00 57.03 57.43 1x98 h ASP 98 Cb 0.10 -0.26 0.00 0.00 -0.56 0.00 0.00 39.33 38.61 1x98 h ASP 98 CO -0.02 0.93 0.00 0.18 -1.57 0.00 0.00 179.24 178.76 1x98 n LEU 99 N -4.33 0.37 -3.72 1.55 4.77 0.06 -3.96 117.00 111.75 1x98 n LEU 99 Ca 0.05 0.54 -0.25 0.00 -0.03 0.00 0.00 56.01 56.33 1x98 n LEU 99 Cb 0.20 -0.44 0.05 0.00 -2.33 0.00 0.00 43.42 40.91 1x98 n LEU 99 CO 0.41 -0.15 0.09 0.29 -1.33 0.00 0.00 177.39 176.70 1x98 n LYS 100 N -1.86 -6.04 -4.13 3.23 5.02 0.28 -4.41 118.16 110.26 1x98 n LYS 100 Ca 0.06 0.69 -0.25 0.00 -2.02 0.00 0.00 58.31 56.78 1x98 n LYS 100 Cb 0.35 -5.54 -0.06 0.00 -0.02 0.00 0.00 35.03 29.77 1x98 n LYS 100 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1x98 s LEU 101 N -7.00 3.68 -0.00 -0.35 1.43 -0.25 -4.97 118.68 111.21 1x98 s LEU 101 Ca 0.38 -0.24 0.20 0.00 -1.03 0.00 0.00 54.13 53.44 1x98 s LEU 101 Cb -0.18 -2.27 -0.24 0.00 0.03 0.00 0.00 46.19 43.53 1x98 s LEU 101 CO 0.79 0.04 0.81 0.47 0.23 0.00 0.00 176.35 178.69 1x98 n ASP 102 N -0.57 0.86 -3.69 2.29 8.00 -1.26 -4.50 116.55 117.69 1x98 n ASP 102 Ca -0.08 -0.85 -0.10 0.00 0.71 0.00 0.00 54.79 54.46 1x98 n ASP 102 Cb 0.56 1.13 -0.05 0.00 -0.02 0.00 0.00 41.12 42.73 1x98 n ASP 102 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1x98 s TYR 103 N -3.00 -0.12 -0.02 1.24 -0.85 -1.26 -4.74 117.35 108.60 1x98 s TYR 103 Ca 0.06 -0.21 -0.01 0.00 -0.52 0.00 0.00 57.07 56.38 1x98 s TYR 103 Cb 0.15 0.18 -0.04 0.00 0.38 0.00 0.00 41.96 42.63 1x98 s TYR 103 CO 0.84 -0.66 0.09 -0.51 -1.52 0.00 0.00 175.55 173.79 1x98 s LEU 104 N -2.79 3.95 0.25 -3.49 1.43 -0.47 -4.99 118.68 112.58 1x98 s LEU 104 Ca 0.03 0.19 0.07 0.00 -1.03 0.00 0.00 54.13 53.39 1x98 s LEU 104 Cb 0.02 -2.25 0.30 0.00 0.03 0.00 0.00 46.19 44.30 1x98 s LEU 104 CO -0.11 0.29 1.59 0.44 0.23 0.00 0.00 176.35 178.78 1x98 h ASP 105 N 4.24 0.15 -3.25 2.29 3.32 -1.52 0.61 116.42 122.26 1x98 h ASP 105 Ca -0.50 -0.09 -0.12 0.00 0.02 0.00 0.00 57.03 56.34 1x98 h ASP 105 Cb 1.19 -0.04 -0.27 0.00 0.22 0.00 0.00 39.33 40.43 1x98 h ASP 105 CO 0.62 0.72 -0.31 -0.22 -1.72 0.00 0.00 179.24 178.33 1x98 s LEU 106 N -7.80 -0.04 -0.09 1.55 2.96 -1.07 -2.16 118.68 112.03 1x98 s LEU 106 Ca -0.03 0.86 0.03 0.00 -0.22 0.00 0.00 54.13 54.78 1x98 s LEU 106 Cb 0.12 1.30 0.01 0.00 0.50 0.00 0.00 46.19 48.12 1x98 s LEU 106 CO 0.78 -0.19 -0.19 -0.47 -1.32 0.00 0.00 176.35 174.96 1x98 s TYR 107 N 1.36 2.15 0.00 5.38 5.04 -0.36 -2.00 117.35 128.93 1x98 s TYR 107 Ca -0.09 -0.87 0.04 0.00 -2.44 0.00 0.00 57.07 53.71 1x98 s TYR 107 Cb -0.08 -1.48 -0.03 0.00 0.35 0.00 0.00 41.96 40.72 1x98 s TYR 107 CO -0.12 -0.38 -0.11 -0.51 -1.34 0.00 0.00 175.55 173.09 1x98 s LEU 108 N 0.49 2.95 -0.16 6.97 1.43 -0.30 -1.27 118.68 128.79 1x98 s LEU 108 Ca -0.17 -0.23 -0.29 0.00 -1.03 0.00 0.00 54.13 52.41 1x98 s LEU 108 Cb -0.17 -1.69 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 1x98 s LEU 108 CO 0.07 0.29 1.42 -0.63 0.23 0.00 0.00 176.35 177.73 1x98 s ILE 109 N -0.93 3.99 0.17 -0.59 1.01 -0.28 -0.38 121.20 124.20 1x98 s ILE 109 Ca 0.15 1.18 -0.09 0.00 0.00 0.00 0.00 60.65 61.89 1x98 s ILE 109 Cb -0.11 -3.83 0.03 0.00 0.01 0.00 0.00 42.46 38.56 1x98 s ILE 109 CO 0.06 -0.18 1.58 -0.74 0.00 0.00 0.00 174.94 175.66 1x98 h HIS 110 N 9.05 1.14 -4.08 3.97 2.76 -1.67 -1.31 115.15 125.01 1x98 h HIS 110 Ca -0.31 -0.25 -0.13 0.00 -2.20 0.00 0.00 60.37 57.48 1x98 h HIS 110 Cb 1.13 -0.27 -0.17 0.00 1.55 0.00 0.00 27.41 29.65 1x98 h HIS 110 CO 0.85 1.08 -0.63 -1.58 -1.30 0.00 0.00 177.93 176.34 1x98 s TRP 111 N -4.76 0.38 -1.01 5.26 0.52 -1.25 -4.33 118.94 113.74 1x98 s TRP 111 Ca -0.11 -0.82 0.19 0.00 0.02 0.00 0.00 56.10 55.37 1x98 s TRP 111 Cb 0.13 -0.28 0.83 0.00 -1.15 0.00 0.00 33.47 32.99 1x98 s TRP 111 CO 0.87 -0.35 1.62 -0.35 0.02 0.00 0.00 176.95 178.75 1x98 n PRO 112 N 0.51 0.01 -3.16 4.98 -0.04 -1.26 -4.70 135.00 131.33 1x98 n PRO 112 Ca -0.17 0.17 -0.40 0.00 -0.04 0.00 0.00 63.50 63.05 1x98 n PRO 112 Cb 0.59 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.49 1x98 n PRO 112 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1x98 s THR 113 N -2.99 5.01 0.13 0.52 -4.23 -1.26 -4.77 115.64 108.05 1x98 s THR 113 Ca 0.10 0.98 -0.18 0.00 -1.18 0.00 0.00 61.69 61.41 1x98 s THR 113 Cb 0.13 -3.90 -0.07 0.00 1.34 0.00 0.00 72.50 70.00 1x98 s THR 113 CO 0.35 0.02 0.59 -0.83 -0.54 0.00 0.00 174.62 174.22 1x98 s GLY 114 N 1.53 2.60 0.25 3.99 0.00 -1.26 -4.61 107.32 109.81 1x98 s GLY 114 Ca 0.24 0.01 0.11 0.00 0.00 0.00 0.00 44.72 45.08 1x98 s GLY 114 CO 0.09 0.37 -0.21 -1.36 0.00 0.00 0.00 173.10 172.00 1x98 s PHE 115 N -1.31 2.24 0.02 1.90 0.08 0.57 -1.34 117.98 120.14 1x98 s PHE 115 Ca 0.35 -0.36 -0.36 0.00 0.12 0.00 0.00 56.93 56.68 1x98 s PHE 115 Cb -0.18 -1.02 -0.15 0.00 -0.57 0.00 0.00 43.02 41.11 1x98 s PHE 115 CO 0.20 0.62 1.56 1.17 -0.10 0.00 0.00 175.22 178.67 1x98 n LYS 116 N -0.32 1.60 -1.24 0.44 4.81 -0.01 -4.19 118.16 119.26 1x98 n LYS 116 Ca -0.08 0.58 -0.32 0.00 -0.87 0.00 0.00 58.31 57.63 1x98 n LYS 116 Cb 0.59 -2.30 0.10 0.00 0.02 0.00 0.00 35.03 33.44 1x98 n LYS 116 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1x98 s PRO 117 N 1.69 2.04 0.00 1.64 0.02 -1.26 -4.79 135.00 134.34 1x98 s PRO 117 Ca 0.86 1.38 0.00 0.00 0.02 0.00 0.00 61.00 63.27 1x98 s PRO 117 Cb -0.85 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 31.81 1x98 s PRO 117 CO 0.48 -1.84 0.00 0.41 -0.33 0.00 0.00 177.00 175.72 1x98 n GLY 118 N -0.52 -0.70 0.18 0.52 0.00 -1.26 -4.97 105.19 98.44 1x98 n GLY 118 Ca 0.11 -1.61 -0.03 0.00 0.00 0.00 0.00 46.02 44.48 1x98 n GLY 118 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x98 h LYS 119 N 3.33 0.20 -6.48 1.61 1.57 -1.99 -3.44 116.57 111.37 1x98 h LYS 119 Ca 0.00 -0.12 -0.53 0.00 -1.87 0.00 0.00 60.65 58.13 1x98 h LYS 119 Cb 0.00 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.30 1x98 h LYS 119 CO 0.00 0.68 0.30 -1.21 -0.57 0.00 0.00 179.45 178.65 1x98 s GLU 120 N -3.89 4.63 0.38 3.15 0.41 -1.26 -4.94 118.70 117.18 1x98 s GLU 120 Ca -0.04 1.33 0.20 0.00 -0.41 0.00 0.00 54.97 56.05 1x98 s GLU 120 Cb 0.13 -3.37 0.65 0.00 -1.78 0.00 0.00 34.13 29.75 1x98 s GLU 120 CO 0.78 0.23 1.71 0.74 -0.49 0.00 0.00 175.26 178.24 1x98 h PHE 121 N 5.61 0.00 -2.87 1.61 0.04 -1.96 -3.34 116.94 116.04 1x98 h PHE 121 Ca -0.43 0.00 -0.61 0.00 2.80 0.00 0.00 57.97 59.73 1x98 h PHE 121 Cb 1.21 0.00 -0.41 0.00 2.20 0.00 0.00 35.95 38.95 1x98 h PHE 121 CO 0.65 0.33 -0.72 -0.06 -0.60 0.00 0.00 178.31 177.92 1x98 s PHE 122 N -3.49 2.61 0.20 -0.55 0.40 -1.26 -4.72 117.98 111.17 1x98 s PHE 122 Ca 0.01 -2.92 -0.30 0.00 -0.60 0.00 0.00 56.93 53.12 1x98 s PHE 122 Cb 0.10 -2.07 -0.09 0.00 0.51 0.00 0.00 43.02 41.47 1x98 s PHE 122 CO 0.68 -0.67 1.36 -1.25 0.70 0.00 0.00 175.22 176.04 1x98 s PRO 123 N -0.73 4.35 0.11 0.24 0.04 -1.25 -4.96 135.00 132.79 1x98 s PRO 123 Ca 0.26 2.13 0.09 0.00 0.04 0.00 0.00 61.00 63.52 1x98 s PRO 123 Cb -0.05 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.27 1x98 s PRO 123 CO -0.15 -0.32 -0.21 -0.51 0.04 0.00 0.00 177.00 175.85 1x98 s LEU 124 N -0.05 2.54 -0.20 -3.56 1.43 -1.26 -1.23 118.68 116.36 1x98 s LEU 124 Ca 0.58 -0.60 -0.16 0.00 -1.03 0.00 0.00 54.13 52.92 1x98 s LEU 124 Cb -0.38 -1.43 -0.04 0.00 0.03 0.00 0.00 46.19 44.37 1x98 s LEU 124 CO 0.39 0.19 0.41 1.51 0.23 0.00 0.00 176.35 179.08 1x98 s ASP 125 N -1.98 6.45 0.19 2.29 3.84 -0.63 -4.88 116.67 121.96 1x98 s ASP 125 Ca 0.16 0.53 0.00 0.00 -0.00 0.00 0.00 52.55 53.24 1x98 s ASP 125 Cb -0.10 -2.24 0.00 0.00 -1.38 0.00 0.00 42.92 39.20 1x98 s ASP 125 CO 0.08 -0.09 0.54 -1.84 -0.00 0.00 0.00 175.17 173.86 1x98 n GLU 126 N 4.50 0.01 -0.08 2.11 0.28 -1.26 -1.96 120.64 124.24 1x98 n GLU 126 Ca -0.08 0.27 -0.18 0.00 -0.16 0.00 0.00 57.16 57.01 1x98 n GLU 126 Cb 0.51 -1.75 -0.13 0.00 1.43 0.00 0.00 31.44 31.50 1x98 n GLU 126 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1x98 n SER 127 N -1.26 1.88 0.00 -1.84 7.64 -1.26 -5.06 113.62 113.72 1x98 n SER 127 Ca 0.00 -0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1x98 n SER 127 Cb 0.54 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 1x98 n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x98 n GLY 128 N 2.13 0.49 3.78 0.23 0.00 -0.83 -5.08 105.19 105.91 1x98 n GLY 128 Ca -0.40 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.29 1x98 n GLY 128 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1x98 s ASN 129 N 0.00 5.44 0.14 1.61 0.01 -1.26 -4.74 114.94 116.13 1x98 s ASN 129 Ca 0.00 2.02 -0.30 0.00 -0.71 0.00 0.00 52.86 53.87 1x98 s ASN 129 Cb 0.00 -2.56 -0.06 0.00 0.41 0.00 0.00 41.25 39.04 1x98 s ASN 129 CO 0.00 -1.41 0.98 0.54 -1.51 0.00 0.00 177.10 175.71 1x98 s VAL 130 N -2.19 4.35 -0.36 1.60 0.11 -1.26 -1.60 120.40 121.06 1x98 s VAL 130 Ca 0.68 2.00 -0.29 0.00 -2.93 0.00 0.00 61.98 61.45 1x98 s VAL 130 Cb -0.20 -4.28 0.02 0.00 -1.53 0.00 0.00 36.38 30.39 1x98 s VAL 130 CO 0.36 0.33 1.08 -0.69 -3.33 0.00 0.00 175.10 172.85 1x98 s VAL 131 N -0.17 4.45 0.74 2.04 1.01 -0.36 -4.90 120.40 123.20 1x98 s VAL 131 Ca 0.47 1.58 -0.11 0.00 0.00 0.00 0.00 61.98 63.91 1x98 s VAL 131 Cb -0.25 -4.45 0.03 0.00 0.00 0.00 0.00 36.38 31.71 1x98 s VAL 131 CO 0.31 -0.61 1.08 -2.84 0.00 0.00 0.00 175.10 173.04 1x98 s PRO 132 N 3.82 2.60 0.20 2.72 0.02 -1.26 -0.83 135.00 142.27 1x98 s PRO 132 Ca 0.45 0.69 0.05 0.00 0.02 0.00 0.00 61.00 62.21 1x98 s PRO 132 Cb -0.11 -1.97 -0.03 0.00 0.02 0.00 0.00 34.50 32.40 1x98 s PRO 132 CO 0.19 -1.27 0.23 0.45 -0.33 0.00 0.00 177.00 176.27 1x98 s SER 133 N -4.00 5.88 0.00 2.53 0.15 -0.45 -3.77 113.70 114.04 1x98 s SER 133 Ca 0.59 -0.05 0.23 0.00 0.70 0.00 0.00 55.95 57.41 1x98 s SER 133 Cb -0.13 -1.63 1.04 0.00 -1.71 0.00 0.00 66.02 63.59 1x98 s SER 133 CO 0.54 0.01 1.71 -0.67 1.20 0.00 0.00 173.24 176.02 1x98 n ASP 134 N -0.85 0.97 -4.74 5.45 4.64 -1.26 -4.77 116.55 115.99 1x98 n ASP 134 Ca -0.08 -1.51 -0.40 0.00 -1.38 0.00 0.00 54.79 51.42 1x98 n ASP 134 Cb 0.56 -0.04 -0.05 0.00 -1.04 0.00 0.00 41.12 40.55 1x98 n ASP 134 CO 0.00 0.00 0.00 -0.89 -0.82 0.00 0.00 177.20 175.49 1x98 s THR 135 N -1.91 4.52 0.44 5.18 2.01 -1.26 -5.05 115.64 119.57 1x98 s THR 135 Ca 0.34 1.89 0.08 0.00 0.31 0.00 0.00 61.69 64.31 1x98 s THR 135 Cb 0.17 -4.24 0.02 0.00 0.01 0.00 0.00 72.50 68.46 1x98 s THR 135 CO 0.27 0.37 0.59 0.54 -0.69 0.00 0.00 174.62 175.71 1x98 s ASN 136 N -0.25 5.60 0.35 3.53 4.22 -1.26 -4.78 114.94 122.35 1x98 s ASN 136 Ca 0.42 -0.46 0.11 0.00 -2.14 0.00 0.00 52.86 50.80 1x98 s ASN 136 Cb -0.23 -0.57 0.64 0.00 1.28 0.00 0.00 41.25 42.37 1x98 s ASN 136 CO 0.27 -0.82 1.79 -0.29 -2.04 0.00 0.00 177.10 176.02 1x98 h ILE 137 N 0.59 1.28 -0.86 0.54 6.09 -1.97 -2.52 117.51 120.66 1x98 h ILE 137 Ca -0.39 -1.35 0.01 0.00 -1.37 0.00 0.00 64.86 61.76 1x98 h ILE 137 Cb 1.28 1.68 -0.04 0.00 0.47 0.00 0.00 36.82 40.21 1x98 h ILE 137 CO 0.45 0.39 0.57 -0.07 -3.07 0.00 0.00 178.15 176.42 1x98 h LEU 138 N 0.07 0.98 -0.32 2.19 3.38 -1.95 0.28 115.31 119.93 1x98 h LEU 138 Ca 0.01 -0.02 -0.20 0.00 0.09 0.00 0.00 57.88 57.75 1x98 h LEU 138 Cb 0.70 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1x98 h LEU 138 CO 0.05 0.70 -0.73 0.44 0.09 0.00 0.00 178.44 179.00 1x98 h ASP 139 N 1.15 0.68 -0.82 -0.43 3.45 -1.89 -1.25 116.42 117.32 1x98 h ASP 139 Ca 0.32 -0.44 -0.00 0.00 0.43 0.00 0.00 57.03 57.34 1x98 h ASP 139 Cb -0.11 -0.20 -0.04 0.00 -0.56 0.00 0.00 39.33 38.42 1x98 h ASP 139 CO -0.07 1.20 0.50 0.74 -1.57 0.00 0.00 179.24 180.04 1x98 h THR 140 N 0.40 1.23 -0.74 0.35 2.02 -0.91 -2.04 112.91 113.22 1x98 h THR 140 Ca -0.04 -0.48 0.01 0.00 0.77 0.00 0.00 66.41 66.68 1x98 h THR 140 Cb 1.33 0.07 -0.04 0.00 -1.74 0.00 0.00 68.15 67.77 1x98 h THR 140 CO 0.14 0.23 0.48 -0.25 0.37 0.00 0.00 175.52 176.49 1x98 h TRP 141 N 1.12 0.91 -0.85 3.16 2.91 -0.26 -1.16 115.95 121.78 1x98 h TRP 141 Ca 0.29 0.02 0.03 0.00 1.13 0.00 0.00 58.89 60.37 1x98 h TRP 141 Cb -0.06 -0.31 -0.05 0.00 -0.51 0.00 0.00 29.16 28.24 1x98 h TRP 141 CO -0.01 0.56 0.56 0.00 -1.03 0.00 0.00 178.44 178.53 1x98 h ALA 142 N 1.28 1.45 -0.65 2.65 0.00 -0.84 0.37 119.26 123.52 1x98 h ALA 142 Ca 0.28 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 1x98 h ALA 142 Cb -0.08 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.37 1x98 h ALA 142 CO -0.07 0.47 0.20 0.00 0.00 0.00 0.00 179.25 179.85 1x98 h ALA 143 N 1.49 1.14 -0.67 0.00 0.00 -0.66 -2.06 119.26 118.50 1x98 h ALA 143 Ca 0.33 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1x98 h ALA 143 Cb -0.01 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 1x98 h ALA 143 CO -0.09 0.60 0.27 0.52 0.00 0.00 0.00 179.25 180.54 1x98 h MET 144 N 0.95 1.00 -0.65 0.00 2.07 -0.12 -2.63 114.93 115.55 1x98 h MET 144 Ca 0.21 -0.18 0.05 0.00 -2.07 0.00 0.00 59.70 57.71 1x98 h MET 144 Cb 0.27 -0.16 -0.04 0.00 -1.87 0.00 0.00 31.60 29.80 1x98 h MET 144 CO -0.01 0.83 0.43 0.93 1.07 0.00 0.00 176.91 180.16 1x98 h GLU 145 N 0.94 0.70 -0.40 1.72 5.08 -0.58 -1.54 114.58 120.50 1x98 h GLU 145 Ca 0.22 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.50 1x98 h GLU 145 Cb 0.20 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 1x98 h GLU 145 CO -0.02 0.46 0.08 0.93 -1.00 0.00 0.00 179.01 179.47 1x98 h GLU 146 N 0.72 0.59 -0.58 2.33 5.08 -1.01 -2.44 114.58 119.27 1x98 h GLU 146 Ca 0.27 -0.11 -0.04 0.00 -1.00 0.00 0.00 59.36 58.48 1x98 h GLU 146 Cb 0.15 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 1x98 h GLU 146 CO -0.08 0.56 0.20 -0.07 -1.00 0.00 0.00 179.01 178.62 1x98 h LEU 147 N 0.58 0.79 -0.23 1.33 3.38 -1.16 -0.69 115.31 119.32 1x98 h LEU 147 Ca 0.13 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1x98 h LEU 147 Cb 0.24 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1x98 h LEU 147 CO -0.00 0.73 0.15 0.58 0.09 0.00 0.00 178.44 179.99 1x98 h VAL 148 N 0.84 1.05 0.00 1.22 2.07 -1.40 -1.94 116.25 118.09 1x98 h VAL 148 Ca 0.19 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.61 1x98 h VAL 148 Cb 0.21 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 1x98 h VAL 148 CO -0.01 0.06 0.00 0.47 0.02 0.00 0.00 177.57 178.10 1x98 n ASP 149 N -4.93 0.00 -0.66 0.57 8.00 -0.77 -1.57 116.55 117.19 1x98 n ASP 149 Ca -0.03 0.50 0.11 0.00 0.71 0.00 0.00 54.79 56.08 1x98 n ASP 149 Cb 0.03 -0.50 0.04 0.00 -0.02 0.00 0.00 41.12 40.66 1x98 n ASP 149 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1x98 n GLU 150 N -1.50 1.65 -0.97 -1.24 1.02 -0.34 -4.98 120.64 114.27 1x98 n GLU 150 Ca 0.04 -1.33 0.00 0.00 -0.02 0.00 0.00 57.16 55.85 1x98 n GLU 150 Cb 0.21 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 1x98 n GLU 150 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1x98 n GLY 151 N 1.35 0.64 0.15 0.62 0.00 -0.61 -4.92 105.19 102.41 1x98 n GLY 151 Ca 0.11 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.15 1x98 n GLY 151 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1x98 h LEU 152 N 0.00 0.00 -7.86 0.99 -0.00 -1.60 -3.44 115.31 103.39 1x98 h LEU 152 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 57.88 57.65 1x98 h LEU 152 Cb 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 40.66 40.41 1x98 h LEU 152 CO 0.00 0.52 -0.72 0.68 -0.00 0.00 0.00 178.44 178.92 1x98 s VAL 153 N -3.14 0.13 -0.13 1.22 -7.23 -1.20 -1.37 120.40 108.67 1x98 s VAL 153 Ca 0.02 -0.39 0.16 0.00 -1.81 0.00 0.00 61.98 59.96 1x98 s VAL 153 Cb 0.09 -0.18 -0.06 0.00 0.56 0.00 0.00 36.38 36.79 1x98 s VAL 153 CO 0.73 -0.17 1.07 0.11 -0.31 0.00 0.00 175.10 176.54 1x98 h LYS 154 N 5.55 0.00 -3.37 4.82 1.79 -1.00 -3.37 116.57 120.99 1x98 h LYS 154 Ca -0.28 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.05 1x98 h LYS 154 Cb 1.21 0.00 -0.21 0.00 -1.58 0.00 0.00 32.23 31.64 1x98 h LYS 154 CO 0.47 0.39 -0.44 0.00 -1.08 0.00 0.00 179.45 178.79 1x98 s ALA 155 N -2.94 -0.45 0.16 3.86 0.00 -0.92 -5.00 121.76 116.47 1x98 s ALA 155 Ca -0.00 0.07 0.10 0.00 0.00 0.00 0.00 51.96 52.12 1x98 s ALA 155 Cb 0.08 0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.20 1x98 s ALA 155 CO 0.79 -0.20 -0.22 0.96 0.00 0.00 0.00 175.76 177.08 1x98 s ILE 156 N -1.16 2.07 0.00 0.00 -4.36 -1.26 -1.22 121.20 115.26 1x98 s ILE 156 Ca -0.12 -1.86 0.00 0.00 -0.26 0.00 0.00 60.65 58.40 1x98 s ILE 156 Cb -0.06 -1.92 0.00 0.00 1.25 0.00 0.00 42.46 41.73 1x98 s ILE 156 CO 0.02 -0.13 0.00 0.61 0.24 0.00 0.00 174.94 175.68 1x98 n GLY 157 N 0.54 2.66 3.13 6.27 0.00 -0.39 -0.90 105.19 116.50 1x98 n GLY 157 Ca -0.15 -0.85 -0.09 0.00 0.00 0.00 0.00 46.02 44.93 1x98 n GLY 157 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1x98 s ILE 158 N -3.00 0.14 -0.13 -0.61 -4.36 -0.28 -1.13 121.20 111.85 1x98 s ILE 158 Ca 0.00 -1.85 -0.11 0.00 -0.26 0.00 0.00 60.65 58.43 1x98 s ILE 158 Cb 0.00 -1.84 0.03 0.00 1.25 0.00 0.00 42.46 41.90 1x98 s ILE 158 CO 0.00 -0.65 0.33 -0.55 0.24 0.00 0.00 174.94 174.31 1x98 s SER 159 N -3.00 -0.35 -1.71 4.36 0.15 -0.49 -1.21 113.70 111.45 1x98 s SER 159 Ca 0.18 0.67 0.00 0.00 0.70 0.00 0.00 55.95 57.50 1x98 s SER 159 Cb 0.08 0.67 0.00 0.00 -1.71 0.00 0.00 66.02 65.06 1x98 s SER 159 CO -0.03 -0.12 0.00 0.59 1.20 0.00 0.00 173.24 174.88 1x98 n ASN 160 N 3.00 -5.31 -4.75 5.45 3.02 -0.29 -3.89 115.26 112.48 1x98 n ASN 160 Ca -0.14 0.14 -0.39 0.00 -0.03 0.00 0.00 54.58 54.16 1x98 n ASN 160 Cb 0.57 -4.39 -0.06 0.00 -0.61 0.00 0.00 39.78 35.29 1x98 n ASN 160 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1x98 s PHE 161 N -2.84 3.65 0.86 3.10 0.40 -1.26 -4.51 117.98 117.37 1x98 s PHE 161 Ca 0.00 1.17 -0.11 0.00 -0.60 0.00 0.00 56.93 57.39 1x98 s PHE 161 Cb 0.00 -2.62 0.15 0.00 0.51 0.00 0.00 43.02 41.06 1x98 s PHE 161 CO 0.00 0.30 1.20 0.54 0.70 0.00 0.00 175.22 177.96 1x98 s ASN 162 N 0.00 3.78 0.33 1.36 2.20 -1.26 -4.77 114.94 116.58 1x98 s ASN 162 Ca 0.31 0.24 0.06 0.00 -0.94 0.00 0.00 52.86 52.53 1x98 s ASN 162 Cb -0.18 -0.50 0.59 0.00 -2.00 0.00 0.00 41.25 39.17 1x98 s ASN 162 CO 0.16 -2.29 1.83 -0.74 -2.94 0.00 0.00 177.10 173.12 1x98 h HIS 163 N -1.20 0.43 0.00 1.54 -0.00 -1.89 -0.65 115.15 113.38 1x98 h HIS 163 Ca -0.43 -0.06 -0.13 0.00 -0.00 0.00 0.00 60.37 59.75 1x98 h HIS 163 Cb 1.26 -0.12 -0.02 0.00 -0.00 0.00 0.00 27.41 28.54 1x98 h HIS 163 CO -0.56 0.53 -0.61 -0.07 -0.00 0.00 0.00 177.93 177.22 1x98 h LEU 164 N 0.37 0.00 -0.20 0.26 3.38 -1.94 0.14 115.31 117.33 1x98 h LEU 164 Ca 0.07 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.82 1x98 h LEU 164 Cb 0.48 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.23 1x98 h LEU 164 CO 0.03 0.61 -0.82 1.56 0.09 0.00 0.00 178.44 179.91 1x98 h GLN 165 N 0.00 0.65 -0.47 1.13 4.20 -1.69 0.12 115.11 119.05 1x98 h GLN 165 Ca -0.01 -0.57 0.02 0.00 0.06 0.00 0.00 58.65 58.15 1x98 h GLN 165 Cb 1.13 0.13 -0.03 0.00 0.30 0.00 0.00 27.48 29.01 1x98 h GLN 165 CO 0.08 1.18 0.29 0.28 -0.67 0.00 0.00 178.83 179.99 1x98 h VAL 166 N 0.43 1.07 -0.98 -0.54 2.07 -1.00 -2.41 116.25 114.89 1x98 h VAL 166 Ca -0.06 -0.20 0.03 0.00 0.82 0.00 0.00 66.70 67.29 1x98 h VAL 166 Cb 1.44 0.44 -0.06 0.00 -1.52 0.00 0.00 31.29 31.59 1x98 h VAL 166 CO 0.16 0.11 0.65 -0.08 0.02 0.00 0.00 177.57 178.42 1x98 h GLU 167 N 0.59 1.23 -0.52 1.57 4.81 -0.79 -0.86 114.58 120.60 1x98 h GLU 167 Ca 0.18 -0.07 0.05 0.00 -0.13 0.00 0.00 59.36 59.39 1x98 h GLU 167 Cb -0.02 -0.28 -0.05 0.00 0.63 0.00 0.00 28.75 29.04 1x98 h GLU 167 CO -0.07 0.82 0.26 0.52 -0.73 0.00 0.00 179.01 179.81 1x98 h MET 168 N 1.27 0.49 -0.17 1.92 2.86 -0.56 -0.15 114.93 120.60 1x98 h MET 168 Ca 0.38 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.97 1x98 h MET 168 Cb -0.04 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.50 1x98 h MET 168 CO -0.11 0.33 0.03 0.82 1.06 0.00 0.00 176.91 179.03 1x98 h ILE 169 N 0.51 1.22 -0.03 -1.22 2.04 -0.91 -1.64 117.51 117.49 1x98 h ILE 169 Ca 0.23 -0.73 0.01 0.00 1.00 0.00 0.00 64.86 65.37 1x98 h ILE 169 Cb 0.14 1.38 -0.00 0.00 -0.74 0.00 0.00 36.82 37.60 1x98 h ILE 169 CO -0.16 0.22 0.02 -0.07 0.00 0.00 0.00 178.15 178.16 1x98 h LEU 170 N 0.07 0.00 -2.30 1.44 3.38 -0.83 -1.25 115.31 115.82 1x98 h LEU 170 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1x98 h LEU 170 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1x98 h LEU 170 CO 0.00 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.12 1x98 n ASN 171 N -4.27 3.39 -4.67 -0.43 5.03 -0.10 -4.99 115.26 109.22 1x98 n ASN 171 Ca -0.02 -1.98 -0.47 0.00 0.87 0.00 0.00 54.58 52.98 1x98 n ASN 171 Cb 0.11 -0.35 -0.04 0.00 -1.02 0.00 0.00 39.78 38.48 1x98 n ASN 171 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.26 176.60 1x98 n LYS 172 N 1.38 2.16 -1.68 3.52 4.81 -0.48 -4.90 118.16 122.98 1x98 n LYS 172 Ca 0.21 0.79 -0.45 0.00 -0.87 0.00 0.00 58.31 57.98 1x98 n LYS 172 Cb 0.56 -2.58 -0.04 0.00 0.02 0.00 0.00 35.03 32.99 1x98 n LYS 172 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1x98 n PRO 173 N 4.63 2.29 -1.04 1.64 -0.02 -1.26 -1.95 135.00 139.29 1x98 n PRO 173 Ca 0.19 0.82 -0.01 0.00 -2.02 0.00 0.00 63.50 62.48 1x98 n PRO 173 Cb 0.29 -2.61 -0.01 0.00 -0.02 0.00 0.00 33.50 31.16 1x98 n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1x98 n GLY 174 N 3.46 0.51 3.65 -1.23 0.00 -1.26 -4.96 105.19 105.36 1x98 n GLY 174 Ca 0.16 -0.39 -0.51 0.00 0.00 0.00 0.00 46.02 45.28 1x98 n GLY 174 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1x98 n LEU 175 N -0.16 2.41 -0.12 0.99 7.94 -0.82 -4.91 117.00 122.33 1x98 n LEU 175 Ca -0.01 1.08 -0.20 0.00 -1.11 0.00 0.00 56.01 55.77 1x98 n LEU 175 Cb 0.09 -1.27 -0.11 0.00 0.53 0.00 0.00 43.42 42.67 1x98 n LEU 175 CO 0.02 -0.60 -1.32 1.17 -1.11 0.00 0.00 177.39 175.56 1x98 n LYS 176 N 3.83 0.59 -4.63 1.96 4.81 -1.26 -4.95 118.16 118.50 1x98 n LYS 176 Ca 0.20 0.17 -0.26 0.00 -0.87 0.00 0.00 58.31 57.55 1x98 n LYS 176 Cb 0.22 -1.46 -0.17 0.00 0.02 0.00 0.00 35.03 33.64 1x98 n LYS 176 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1x98 s TYR 177 N -2.48 1.66 0.66 5.64 2.02 -1.26 -5.13 117.35 118.46 1x98 s TYR 177 Ca -0.33 -0.65 -0.15 0.00 -0.37 0.00 0.00 57.07 55.56 1x98 s TYR 177 Cb 0.10 -1.20 0.00 0.00 -0.40 0.00 0.00 41.96 40.46 1x98 s TYR 177 CO 0.53 -0.33 1.12 0.15 -1.57 0.00 0.00 175.55 175.45 1x98 s LYS 178 N 0.70 2.77 0.32 -0.62 1.02 -1.26 -4.97 119.74 117.69 1x98 s LYS 178 Ca -0.14 1.43 -0.29 0.00 0.02 0.00 0.00 55.97 56.99 1x98 s LYS 178 Cb -0.16 -1.94 -0.11 0.00 -0.52 0.00 0.00 37.83 35.09 1x98 s LYS 178 CO 0.03 -1.28 1.56 -2.30 -0.92 0.00 0.00 175.35 172.44 1x98 n PRO 179 N -2.39 2.68 0.04 -1.68 -0.02 -1.26 -4.85 135.00 127.51 1x98 n PRO 179 Ca 0.11 0.95 -0.06 0.00 -2.02 0.00 0.00 63.50 62.48 1x98 n PRO 179 Cb 0.52 -2.71 -0.11 0.00 -0.02 0.00 0.00 33.50 31.18 1x98 n PRO 179 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1x98 h ALA 180 N 4.20 0.54 -3.16 3.55 0.00 -1.40 -3.43 119.26 119.56 1x98 h ALA 180 Ca -0.48 -1.02 -0.17 0.00 0.00 0.00 0.00 54.91 53.23 1x98 h ALA 180 Cb 1.23 0.08 -0.24 0.00 0.00 0.00 0.00 17.79 18.86 1x98 h ALA 180 CO 0.74 1.25 -0.53 0.08 0.00 0.00 0.00 179.25 180.80 1x98 s VAL 181 N -2.72 0.03 -0.22 0.00 1.01 -1.26 -1.68 120.40 115.56 1x98 s VAL 181 Ca -0.01 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 61.73 1x98 s VAL 181 Cb 0.09 -0.29 0.03 0.00 0.00 0.00 0.00 36.38 36.21 1x98 s VAL 181 CO 0.81 -0.14 -0.13 0.21 0.00 0.00 0.00 175.10 175.85 1x98 s ASN 182 N -0.44 3.84 -0.28 3.32 3.04 -0.34 -1.13 114.94 122.96 1x98 s ASN 182 Ca -0.05 -0.87 -0.13 0.00 0.04 0.00 0.00 52.86 51.85 1x98 s ASN 182 Cb -0.03 -1.56 -0.04 0.00 -1.54 0.00 0.00 41.25 38.07 1x98 s ASN 182 CO 0.01 -0.08 0.28 -1.58 -3.04 0.00 0.00 177.10 172.69 1x98 s GLN 183 N 1.27 3.96 0.06 0.43 0.74 -0.35 -2.22 119.66 123.54 1x98 s GLN 183 Ca 0.00 -0.16 0.00 0.00 0.05 0.00 0.00 55.36 55.25 1x98 s GLN 183 Cb -0.16 -3.67 -0.04 0.00 1.10 0.00 0.00 33.01 30.25 1x98 s GLN 183 CO -0.08 -0.24 -0.04 0.96 -0.55 0.00 0.00 175.29 175.33 1x98 s ILE 184 N 1.92 0.35 0.29 -2.34 -4.36 -0.04 -1.14 121.20 115.87 1x98 s ILE 184 Ca 0.11 -1.69 -0.29 0.00 -0.26 0.00 0.00 60.65 58.52 1x98 s ILE 184 Cb -0.16 -1.35 -0.10 0.00 1.25 0.00 0.00 42.46 42.10 1x98 s ILE 184 CO 0.11 -0.87 1.31 -0.70 0.24 0.00 0.00 174.94 175.02 1x98 s GLU 185 N -3.45 4.38 -0.28 0.37 2.12 -1.26 -0.81 118.70 119.76 1x98 s GLU 185 Ca 0.04 2.16 -0.17 0.00 0.36 0.00 0.00 54.97 57.37 1x98 s GLU 185 Cb 0.04 -3.11 0.10 0.00 0.26 0.00 0.00 34.13 31.42 1x98 s GLU 185 CO -0.07 -0.19 0.78 0.00 -0.54 0.00 0.00 175.26 175.24 1x98 s HIS 187 N 1.47 -0.00 0.66 0.00 -3.43 -0.88 -4.24 115.29 108.86 1x98 s HIS 187 Ca -0.09 -0.27 0.41 0.00 -0.80 0.00 0.00 55.06 54.31 1x98 s HIS 187 Cb -0.05 0.63 2.25 0.00 -1.43 0.00 0.00 32.58 33.99 1x98 s HIS 187 CO -0.17 -0.65 2.30 -1.35 -2.00 0.00 0.00 174.74 172.86 1x98 h PRO 188 N 2.00 0.00 -0.01 -0.38 0.11 -1.87 -0.46 132.00 131.38 1x98 h PRO 188 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1x98 h PRO 188 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1x98 h PRO 188 CO 0.31 0.00 -0.17 0.66 -0.21 0.00 0.00 178.00 178.59 1x98 n TYR 189 N -3.17 0.00 -3.05 0.65 4.01 -1.26 -1.38 117.16 112.95 1x98 n TYR 189 Ca -0.03 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.56 1x98 n TYR 189 Cb 0.12 -0.05 -0.04 0.00 -0.31 0.00 0.00 39.34 39.06 1x98 n TYR 189 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 1x98 n LEU 190 N -0.08 -2.00 0.16 7.72 7.94 -0.20 -1.06 117.00 129.49 1x98 n LEU 190 Ca 0.14 -3.64 0.12 0.00 -1.11 0.00 0.00 56.01 51.52 1x98 n LEU 190 Cb 0.39 0.67 0.20 0.00 0.53 0.00 0.00 43.42 45.21 1x98 n LEU 190 CO 0.22 1.91 0.68 0.71 -1.11 0.00 0.00 177.39 179.80 1x98 h THR 191 N 4.65 0.00 -6.90 1.96 1.35 -1.76 -2.35 112.91 109.87 1x98 h THR 191 Ca 0.15 -0.83 -0.58 0.00 -0.55 0.00 0.00 66.41 64.60 1x98 h THR 191 Cb 1.01 1.73 -0.26 0.00 -1.73 0.00 0.00 68.15 68.89 1x98 h THR 191 CO 0.20 0.00 -0.86 0.00 -0.25 0.00 0.00 175.52 174.60 1x98 n GLN 192 N -2.76 -2.30 -0.31 4.72 6.02 -1.26 -4.84 117.38 116.66 1x98 n GLN 192 Ca 0.04 0.29 0.10 0.00 -0.01 0.00 0.00 57.00 57.42 1x98 n GLN 192 Cb 0.50 -4.91 0.27 0.00 1.02 0.00 0.00 30.24 27.12 1x98 n GLN 192 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1x98 h GLU 193 N -1.32 0.56 -0.26 -1.09 3.07 -2.00 -1.54 114.58 112.01 1x98 h GLU 193 Ca -0.60 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 58.20 1x98 h GLU 193 Cb 1.39 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 29.16 1x98 h GLU 193 CO 0.81 0.37 0.04 0.87 -1.40 0.00 0.00 179.01 179.70 1x98 h LYS 194 N 0.58 0.43 -0.31 2.33 1.57 -1.99 -2.05 116.57 117.14 1x98 h LYS 194 Ca 0.51 -0.12 -0.14 0.00 -1.87 0.00 0.00 60.65 59.04 1x98 h LYS 194 Cb 0.82 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.07 1x98 h LYS 194 CO -0.42 0.56 -0.36 1.25 -0.57 0.00 0.00 179.45 179.91 1x98 h LEU 195 N 0.24 0.74 -0.44 2.94 5.85 -1.77 -1.60 115.31 121.26 1x98 h LEU 195 Ca 0.08 -0.32 -0.02 0.00 0.84 0.00 0.00 57.88 58.46 1x98 h LEU 195 Cb 0.34 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 1x98 h LEU 195 CO 0.01 1.03 0.19 0.40 -0.34 0.00 0.00 178.44 179.73 1x98 h ILE 196 N 0.58 1.19 -0.55 4.05 2.04 -1.30 -0.53 117.51 122.99 1x98 h ILE 196 Ca 0.06 -0.57 -0.02 0.00 1.00 0.00 0.00 64.86 65.32 1x98 h ILE 196 Cb 0.89 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 1x98 h ILE 196 CO 0.08 0.22 0.26 -0.61 0.00 0.00 0.00 178.15 178.10 1x98 h GLN 197 N 0.57 0.80 0.06 2.37 -0.00 -1.22 0.13 115.11 117.82 1x98 h GLN 197 Ca 0.15 -0.12 0.02 0.00 -0.00 0.00 0.00 58.65 58.70 1x98 h GLN 197 Cb 0.16 -0.14 -0.03 0.00 0.00 0.00 0.00 27.48 27.46 1x98 h GLN 197 CO -0.02 0.66 -0.20 -0.92 0.00 0.00 0.00 178.83 178.35 1x98 h TYR 198 N 0.75 -0.53 -0.21 3.99 3.20 -1.04 0.14 116.97 123.27 1x98 h TYR 198 Ca 0.19 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.07 1x98 h TYR 198 Cb 0.13 0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 1x98 h TYR 198 CO -0.00 -0.29 0.12 0.00 -1.64 0.00 0.00 178.16 176.35 1x98 h GLN 200 N 0.24 0.72 0.00 0.00 4.20 -0.90 -0.56 115.11 118.81 1x98 h GLN 200 Ca 0.07 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1x98 h GLN 200 Cb 0.05 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.69 1x98 h GLN 200 CO -0.01 0.58 0.00 0.66 -0.67 0.00 0.00 178.83 179.39 1x98 h SER 201 N 0.72 0.00 -0.38 1.46 4.64 -0.01 -1.76 113.55 118.23 1x98 h SER 201 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1x98 h SER 201 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1x98 h SER 201 CO -0.02 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.23 1x98 n LYS 202 N -2.93 2.36 -1.03 4.77 4.76 -0.34 -4.94 118.16 120.81 1x98 n LYS 202 Ca -0.00 -2.06 -0.01 0.00 -2.87 0.00 0.00 58.31 53.37 1x98 n LYS 202 Cb 0.23 -1.49 -0.00 0.00 -1.84 0.00 0.00 35.03 31.93 1x98 n LYS 202 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1x98 n GLY 203 N 1.44 0.49 3.66 0.72 0.00 -0.66 -5.02 105.19 105.82 1x98 n GLY 203 Ca 0.19 -0.28 -0.40 0.00 0.00 0.00 0.00 46.02 45.53 1x98 n GLY 203 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x98 s ILE 204 N -1.93 5.02 0.19 -0.61 1.01 -0.47 -4.46 121.20 119.96 1x98 s ILE 204 Ca 0.00 1.22 -0.30 0.00 0.00 0.00 0.00 60.65 61.58 1x98 s ILE 204 Cb 0.00 -3.96 -0.08 0.00 0.01 0.00 0.00 42.46 38.43 1x98 s ILE 204 CO 0.00 0.12 1.07 -0.69 0.00 0.00 0.00 174.94 175.44 1x98 s VAL 205 N 1.84 3.89 -0.20 2.92 1.01 -0.67 -3.49 120.40 125.69 1x98 s VAL 205 Ca 0.30 1.68 -0.10 0.00 0.00 0.00 0.00 61.98 63.86 1x98 s VAL 205 Cb -0.16 -4.07 -0.05 0.00 0.00 0.00 0.00 36.38 32.10 1x98 s VAL 205 CO 0.11 0.31 0.13 -0.69 0.00 0.00 0.00 175.10 174.96 1x98 s VAL 206 N -0.45 5.34 -0.19 2.92 1.01 -1.26 -1.20 120.40 126.57 1x98 s VAL 206 Ca 0.48 0.17 -0.09 0.00 0.00 0.00 0.00 61.98 62.54 1x98 s VAL 206 Cb -0.29 -3.44 -0.05 0.00 0.00 0.00 0.00 36.38 32.60 1x98 s VAL 206 CO 0.35 0.43 0.10 -0.89 0.00 0.00 0.00 175.10 175.09 1x98 s THR 207 N 0.44 5.10 -0.34 3.92 2.01 -0.94 -1.53 115.64 124.29 1x98 s THR 207 Ca 0.07 0.08 -0.22 0.00 0.31 0.00 0.00 61.69 61.93 1x98 s THR 207 Cb -0.11 -3.31 0.00 0.00 0.01 0.00 0.00 72.50 69.08 1x98 s THR 207 CO -0.01 0.45 0.71 0.00 -0.69 0.00 0.00 174.62 175.08 1x98 s ALA 208 N 0.37 3.48 0.41 7.40 0.00 0.79 -0.86 121.76 133.35 1x98 s ALA 208 Ca 0.06 -0.67 0.06 0.00 0.00 0.00 0.00 51.96 51.41 1x98 s ALA 208 Cb -0.12 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.76 1x98 s ALA 208 CO -0.01 -1.31 0.57 1.52 0.00 0.00 0.00 175.76 176.53 1x98 s TYR 209 N 2.86 2.97 -1.48 0.00 -0.85 0.01 -2.84 117.35 118.01 1x98 s TYR 209 Ca 0.28 -0.22 -0.02 0.00 -0.52 0.00 0.00 57.07 56.59 1x98 s TYR 209 Cb -0.14 -2.28 0.02 0.00 0.38 0.00 0.00 41.96 39.94 1x98 s TYR 209 CO 0.14 -0.32 0.35 0.43 -1.52 0.00 0.00 175.55 174.63 1x98 n SER 210 N -1.86 -0.31 0.28 -0.18 7.64 -1.26 -1.86 113.62 116.07 1x98 n SER 210 Ca 0.04 -1.08 0.17 0.00 1.01 0.00 0.00 58.87 59.01 1x98 n SER 210 Cb 0.59 -2.62 0.72 0.00 -1.01 0.00 0.00 64.21 61.89 1x98 n SER 210 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1x98 h PRO 211 N -1.77 0.00 -0.39 1.43 0.13 -1.80 -1.06 132.00 128.54 1x98 h PRO 211 Ca -0.63 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 1x98 h PRO 211 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1x98 h PRO 211 CO 0.67 0.02 0.00 1.28 -0.23 0.00 0.00 178.00 179.74 1x98 n LEU 212 N -3.13 3.13 -0.24 1.56 4.77 -1.26 -4.81 117.00 117.02 1x98 n LEU 212 Ca 0.00 -1.38 -0.03 0.00 -0.03 0.00 0.00 56.01 54.57 1x98 n LEU 212 Cb 0.29 -0.25 -0.01 0.00 -2.33 0.00 0.00 43.42 41.11 1x98 n LEU 212 CO 0.27 0.69 -0.03 0.61 -1.33 0.00 0.00 177.39 177.60 1x98 n GLY 213 N 1.44 0.63 3.88 -0.72 0.00 -0.40 -4.42 105.19 105.60 1x98 n GLY 213 Ca 0.19 -0.75 -0.34 0.00 0.00 0.00 0.00 46.02 45.12 1x98 n GLY 213 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1x98 n SER 214 N 1.13 -3.49 0.24 1.61 2.88 -1.26 -4.83 113.62 109.90 1x98 n SER 214 Ca -0.03 -1.10 0.18 0.00 -1.33 0.00 0.00 58.87 56.59 1x98 n SER 214 Cb 0.12 -2.79 0.88 0.00 -0.75 0.00 0.00 64.21 61.67 1x98 n SER 214 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1x98 h PRO 215 N -2.06 0.00 -0.38 -1.46 0.13 -1.98 -0.75 132.00 125.49 1x98 h PRO 215 Ca -0.67 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 1x98 h PRO 215 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1x98 h PRO 215 CO 0.54 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.91 1x98 n ASP 216 N -3.50 2.24 -4.71 1.44 5.75 -1.26 -4.93 116.55 111.58 1x98 n ASP 216 Ca 0.01 -1.95 -0.43 0.00 -0.01 0.00 0.00 54.79 52.41 1x98 n ASP 216 Cb 0.33 -0.25 -0.01 0.00 -1.03 0.00 0.00 41.12 40.15 1x98 n ASP 216 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1x98 n ARG 217 N 0.71 2.30 0.29 0.11 1.85 -0.29 -4.86 116.66 116.77 1x98 n ARG 217 Ca 0.15 0.81 0.18 0.00 -1.00 0.00 0.00 57.85 57.99 1x98 n ARG 217 Cb 0.37 -2.47 0.78 0.00 -1.05 0.00 0.00 32.46 30.09 1x98 n ARG 217 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 1x98 h PRO 218 N 3.36 0.00 -0.65 2.89 0.13 -1.93 -2.88 132.00 132.93 1x98 h PRO 218 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1x98 h PRO 218 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1x98 h PRO 218 CO 0.68 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.78 1x98 n TRP 219 N -3.08 1.20 -1.70 1.56 2.14 -1.26 -5.00 117.44 111.30 1x98 n TRP 219 Ca -0.00 -0.50 -0.42 0.00 2.07 0.00 0.00 57.50 58.65 1x98 n TRP 219 Cb 0.26 -0.16 0.00 0.00 -0.81 0.00 0.00 31.31 30.60 1x98 n TRP 219 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1x98 n ALA 220 N 1.11 1.32 -2.48 -1.67 0.00 -1.09 -5.02 120.51 112.67 1x98 n ALA 220 Ca 0.23 0.31 -0.26 0.00 0.00 0.00 0.00 53.44 53.72 1x98 n ALA 220 Cb 0.73 -2.26 -0.14 0.00 0.00 0.00 0.00 19.45 17.78 1x98 n ALA 220 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1x98 s LYS 221 N -2.05 1.41 0.35 0.00 -0.14 -1.26 -5.04 119.74 113.00 1x98 s LYS 221 Ca 0.58 -0.94 0.15 0.00 -1.36 0.00 0.00 55.97 54.40 1x98 s LYS 221 Cb -0.53 -1.52 1.13 0.00 -1.68 0.00 0.00 37.83 35.23 1x98 s LYS 221 CO 0.60 0.39 1.62 -1.00 -0.76 0.00 0.00 175.35 176.20 1x98 h PRO 222 N 4.89 0.17 -0.14 -1.68 0.13 -2.02 -0.40 132.00 132.95 1x98 h PRO 222 Ca -0.43 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1x98 h PRO 222 Cb 1.16 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1x98 h PRO 222 CO 0.44 0.11 0.00 -0.85 -0.23 0.00 0.00 178.00 177.47 1x98 n GLU 223 N -5.17 1.41 -2.24 0.86 0.00 -1.26 -4.89 120.64 109.35 1x98 n GLU 223 Ca 0.33 -0.63 -0.35 0.00 0.00 0.00 0.00 57.16 56.51 1x98 n GLU 223 Cb 1.06 -1.24 0.00 0.00 0.00 0.00 0.00 31.44 31.26 1x98 n GLU 223 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1x98 s ASP 224 N -1.27 5.75 0.48 -1.84 -0.00 -0.16 -5.01 116.67 114.63 1x98 s ASP 224 Ca 0.21 2.10 -0.23 0.00 -0.00 0.00 0.00 52.55 54.63 1x98 s ASP 224 Cb 0.11 -2.57 -0.07 0.00 -0.00 0.00 0.00 42.92 40.39 1x98 s ASP 224 CO 0.16 -1.20 1.27 -2.16 -0.00 0.00 0.00 175.17 173.24 1x98 s PRO 225 N -3.40 3.56 -0.30 8.23 0.04 -1.26 -5.01 135.00 136.86 1x98 s PRO 225 Ca 0.71 2.04 0.03 0.00 0.04 0.00 0.00 61.00 63.82 1x98 s PRO 225 Cb -0.22 -2.42 0.08 0.00 0.04 0.00 0.00 34.50 31.98 1x98 s PRO 225 CO 0.28 -0.79 -0.01 0.45 0.04 0.00 0.00 177.00 176.97 1x98 s SER 226 N -1.06 4.50 0.18 6.66 0.15 -1.26 -5.03 113.70 117.85 1x98 s SER 226 Ca 0.65 -1.76 -0.13 0.00 0.70 0.00 0.00 55.95 55.42 1x98 s SER 226 Cb -0.35 -1.49 0.11 0.00 -1.71 0.00 0.00 66.02 62.58 1x98 s SER 226 CO 0.43 -0.30 1.83 -0.07 1.20 0.00 0.00 173.24 176.33 1x98 h LEU 227 N 7.74 0.59 -1.68 3.45 3.38 -1.93 -1.82 115.31 125.04 1x98 h LEU 227 Ca -0.11 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1x98 h LEU 227 Cb 1.03 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.65 1x98 h LEU 227 CO 0.48 0.42 -0.06 -0.07 0.09 0.00 0.00 178.44 179.31 1x98 h LEU 228 N 0.71 0.00 -2.19 1.67 3.38 -1.96 -2.46 115.31 114.45 1x98 h LEU 228 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1x98 h LEU 228 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1x98 h LEU 228 CO -0.08 0.06 0.00 -0.62 0.09 0.00 0.00 178.44 177.88 1x98 n GLU 229 N -3.22 2.24 -2.16 1.13 -0.58 -0.79 -4.87 120.64 112.39 1x98 n GLU 229 Ca -0.00 -2.06 -0.43 0.00 -0.42 0.00 0.00 57.16 54.26 1x98 n GLU 229 Cb 0.28 -1.44 -0.02 0.00 -0.57 0.00 0.00 31.44 29.69 1x98 n GLU 229 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1x98 s ASP 230 N -1.45 6.69 0.51 1.62 3.68 -0.75 -4.86 116.67 122.11 1x98 s ASP 230 Ca 0.32 1.93 0.24 0.00 2.13 0.00 0.00 52.55 57.16 1x98 s ASP 230 Cb 0.19 -2.53 1.34 0.00 -1.45 0.00 0.00 42.92 40.47 1x98 s ASP 230 CO 0.28 -0.94 1.98 -0.65 0.13 0.00 0.00 175.17 175.96 1x98 h PRO 231 N 9.36 0.07 -0.15 4.34 0.11 -1.91 -0.46 132.00 143.36 1x98 h PRO 231 Ca -0.34 -0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.62 1x98 h PRO 231 Cb 1.15 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1x98 h PRO 231 CO 0.97 0.05 -0.53 0.00 -0.21 0.00 0.00 178.00 178.28 1x98 h ARG 232 N 0.07 0.41 0.22 1.05 3.08 -1.96 -0.90 114.38 116.36 1x98 h ARG 232 Ca 0.27 -0.25 -0.33 0.00 0.07 0.00 0.00 59.98 59.74 1x98 h ARG 232 Cb 0.98 0.03 0.03 0.00 0.08 0.00 0.00 29.97 31.08 1x98 h ARG 232 CO -0.02 0.84 -1.46 0.82 -1.07 0.00 0.00 179.97 179.08 1x98 h ILE 233 N 0.32 1.29 -0.65 2.04 2.04 -1.66 -2.92 117.51 117.98 1x98 h ILE 233 Ca 0.01 -2.76 0.09 0.00 1.00 0.00 0.00 64.86 63.20 1x98 h ILE 233 Cb 1.03 3.00 -0.04 0.00 -0.74 0.00 0.00 36.82 40.07 1x98 h ILE 233 CO 0.09 0.83 0.43 0.11 0.00 0.00 0.00 178.15 179.61 1x98 h LYS 234 N 0.13 0.50 -0.34 2.37 1.57 -1.07 -1.36 116.57 118.37 1x98 h LYS 234 Ca -0.24 -0.03 -0.16 0.00 -1.87 0.00 0.00 60.65 58.34 1x98 h LYS 234 Cb 2.13 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 34.32 1x98 h LYS 234 CO 0.25 0.33 -0.44 0.00 -0.57 0.00 0.00 179.45 179.03 1x98 h ALA 235 N 1.67 0.58 -0.73 3.86 0.00 -0.98 -0.44 119.26 123.22 1x98 h ALA 235 Ca 0.30 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1x98 h ALA 235 Cb 0.48 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1x98 h ALA 235 CO -0.09 0.68 0.29 0.82 0.00 0.00 0.00 179.25 180.94 1x98 h ILE 236 N 0.70 1.25 -0.48 0.00 2.04 -1.27 -1.30 117.51 118.46 1x98 h ILE 236 Ca 0.04 -0.80 -0.01 0.00 1.00 0.00 0.00 64.86 65.10 1x98 h ILE 236 Cb 1.03 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 1x98 h ILE 236 CO 0.10 0.32 0.27 0.00 0.00 0.00 0.00 178.15 178.84 1x98 h ALA 237 N 1.14 0.61 -0.57 1.87 0.00 -0.98 -2.47 119.26 118.86 1x98 h ALA 237 Ca 0.24 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.07 1x98 h ALA 237 Cb 0.22 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1x98 h ALA 237 CO -0.02 0.13 0.37 0.00 0.00 0.00 0.00 179.25 179.74 1x98 h ALA 238 N 1.11 0.72 -0.59 0.00 0.00 -0.80 -0.29 119.26 119.41 1x98 h ALA 238 Ca 0.17 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.07 1x98 h ALA 238 Cb 0.04 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1x98 h ALA 238 CO -0.03 0.15 0.39 -0.22 0.00 0.00 0.00 179.25 179.54 1x98 h LYS 239 N 0.76 0.70 -0.10 0.00 3.64 -0.88 -2.09 116.57 118.59 1x98 h LYS 239 Ca 0.21 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1x98 h LYS 239 Cb -0.08 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.58 1x98 h LYS 239 CO -0.05 0.46 0.00 0.72 -2.27 0.00 0.00 179.45 178.31 1x98 n HIS 240 N -4.46 0.12 -3.70 1.91 8.25 -0.60 -4.94 115.22 111.79 1x98 n HIS 240 Ca 0.07 -0.06 -0.26 0.00 -0.26 0.00 0.00 57.72 57.21 1x98 n HIS 240 Cb 0.11 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.28 1x98 n HIS 240 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1x98 n ASN 241 N 0.53 -5.91 -4.46 0.41 5.15 -0.24 -5.01 115.26 105.73 1x98 n ASN 241 Ca 0.17 -0.61 -0.22 0.00 -0.60 0.00 0.00 54.58 53.32 1x98 n ASN 241 Cb 0.41 -4.68 -0.11 0.00 -0.53 0.00 0.00 39.78 34.87 1x98 n ASN 241 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1x98 s LYS 242 N -6.41 1.66 0.69 1.20 -0.14 -0.51 -5.04 119.74 111.19 1x98 s LYS 242 Ca 0.61 -1.91 -0.11 0.00 -1.36 0.00 0.00 55.97 53.20 1x98 s LYS 242 Cb -0.28 -0.96 0.01 0.00 -1.68 0.00 0.00 37.83 34.91 1x98 s LYS 242 CO 0.76 -0.15 1.08 0.95 -0.76 0.00 0.00 175.35 177.23 1x98 s THR 243 N -3.22 3.81 0.27 2.17 -4.23 -1.26 -4.23 115.64 108.95 1x98 s THR 243 Ca 0.36 0.59 -0.03 0.00 -1.18 0.00 0.00 61.69 61.42 1x98 s THR 243 Cb 0.08 -3.54 0.27 0.00 1.34 0.00 0.00 72.50 70.65 1x98 s THR 243 CO 0.15 -0.77 1.92 0.00 -0.54 0.00 0.00 174.62 175.38 1x98 h THR 244 N -0.62 1.18 -0.88 3.99 1.03 -1.92 -1.89 112.91 113.80 1x98 h THR 244 Ca -0.45 -0.42 -0.02 0.00 -0.01 0.00 0.00 66.41 65.51 1x98 h THR 244 Cb 1.23 -0.16 -0.04 0.00 -1.07 0.00 0.00 68.15 68.12 1x98 h THR 244 CO 0.62 0.22 0.46 0.00 -0.01 0.00 0.00 175.52 176.82 1x98 h ALA 245 N 1.43 1.13 -0.62 0.00 0.00 -1.93 -0.81 119.26 118.46 1x98 h ALA 245 Ca 0.38 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 1x98 h ALA 245 Cb -0.01 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 1x98 h ALA 245 CO -0.11 0.66 0.25 1.96 0.00 0.00 0.00 179.25 182.00 1x98 h GLN 246 N 1.24 0.91 -0.41 0.00 4.20 -1.73 -0.59 115.11 118.72 1x98 h GLN 246 Ca 0.31 -0.14 -0.06 0.00 0.06 0.00 0.00 58.65 58.81 1x98 h GLN 246 Cb 0.06 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 1x98 h GLN 246 CO -0.05 0.74 0.03 0.28 -0.67 0.00 0.00 178.83 179.17 1x98 h VAL 247 N 0.89 1.25 0.00 -0.54 2.07 -0.88 -0.60 116.25 118.45 1x98 h VAL 247 Ca 0.21 -0.96 -0.04 0.00 0.82 0.00 0.00 66.70 66.73 1x98 h VAL 247 Cb 0.18 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 1x98 h VAL 247 CO -0.02 0.33 -0.17 -0.07 0.02 0.00 0.00 177.57 177.66 1x98 h LEU 248 N 0.55 0.00 0.21 2.57 3.38 -0.58 -1.18 115.31 120.26 1x98 h LEU 248 Ca 0.12 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.80 1x98 h LEU 248 Cb 0.44 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.22 1x98 h LEU 248 CO 0.02 0.17 -1.29 0.40 0.09 0.00 0.00 178.44 177.83 1x98 h ILE 249 N 0.00 1.32 -0.36 1.22 2.04 -0.94 -3.35 117.51 117.44 1x98 h ILE 249 Ca -0.00 -2.62 -0.07 0.00 1.00 0.00 0.00 64.86 63.17 1x98 h ILE 249 Cb 0.35 3.06 -0.02 0.00 -0.74 0.00 0.00 36.82 39.48 1x98 h ILE 249 CO 0.02 0.78 -0.08 -0.09 0.00 0.00 0.00 178.15 178.79 1x98 h ARG 250 N -0.05 0.59 0.04 2.37 9.65 -0.87 -3.21 114.38 122.91 1x98 h ARG 250 Ca -0.23 -0.16 0.03 0.00 -1.10 0.00 0.00 59.98 58.51 1x98 h ARG 250 Cb 1.98 -0.07 -0.05 0.00 -1.39 0.00 0.00 29.97 30.44 1x98 h ARG 250 CO 0.22 0.67 -0.37 0.35 2.80 0.00 0.00 179.97 183.64 1x98 h PHE 251 N 0.55 -1.03 -0.34 2.20 3.57 -1.35 -2.11 116.94 118.43 1x98 h PHE 251 Ca 0.11 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.60 1x98 h PHE 251 Cb 0.47 0.45 -0.02 0.00 2.79 0.00 0.00 35.95 39.64 1x98 h PHE 251 CO 0.02 -0.46 0.04 -1.00 -2.23 0.00 0.00 178.31 174.67 1x98 h PRO 252 N -0.55 0.51 -0.93 6.41 0.13 -1.74 -2.44 132.00 133.39 1x98 h PRO 252 Ca 0.04 -0.10 0.13 0.00 -0.87 0.00 0.00 66.00 65.21 1x98 h PRO 252 Cb 0.62 -0.08 -0.09 0.00 0.13 0.00 0.00 31.00 31.58 1x98 h PRO 252 CO -0.27 0.51 0.55 0.52 -0.23 0.00 0.00 178.00 179.09 1x98 h MET 253 N 0.50 0.82 -0.00 0.86 2.86 -1.41 -1.03 114.93 117.53 1x98 h MET 253 Ca 0.11 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1x98 h MET 253 Cb 0.27 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 31.74 1x98 h MET 253 CO 0.00 0.54 -0.04 1.04 1.06 0.00 0.00 176.91 179.51 1x98 n GLN 254 N -4.72 0.70 -0.32 1.72 6.02 -0.88 -2.14 117.38 117.77 1x98 n GLN 254 Ca 0.18 -0.13 0.08 0.00 -0.01 0.00 0.00 57.00 57.11 1x98 n GLN 254 Cb 0.38 -1.50 0.23 0.00 1.02 0.00 0.00 30.24 30.37 1x98 n GLN 254 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1x98 n ARG 255 N -1.04 2.43 -3.55 -1.09 1.74 -0.50 -4.92 116.66 109.73 1x98 n ARG 255 Ca 0.17 -1.89 -0.23 0.00 -0.77 0.00 0.00 57.85 55.13 1x98 n ARG 255 Cb 0.23 -1.50 0.08 0.00 -1.02 0.00 0.00 32.46 30.25 1x98 n ARG 255 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1x98 n ASN 256 N 0.90 -6.02 -4.72 0.55 3.02 -0.91 -5.03 115.26 103.05 1x98 n ASN 256 Ca 0.17 -0.52 -0.23 0.00 -0.03 0.00 0.00 54.58 53.97 1x98 n ASN 256 Cb 0.51 -4.87 -0.06 0.00 -0.61 0.00 0.00 39.78 34.75 1x98 n ASN 256 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1x98 s LEU 257 N -7.03 3.48 0.30 3.41 1.43 -0.56 -4.67 118.68 115.04 1x98 s LEU 257 Ca 0.54 -0.45 -0.14 0.00 -1.03 0.00 0.00 54.13 53.05 1x98 s LEU 257 Cb -0.24 -2.01 -0.09 0.00 0.03 0.00 0.00 46.19 43.88 1x98 s LEU 257 CO 0.70 -0.01 0.70 -0.69 0.23 0.00 0.00 176.35 177.28 1x98 s VAL 258 N -2.19 4.73 -0.04 -1.59 1.01 -0.58 -4.15 120.40 117.59 1x98 s VAL 258 Ca 0.32 0.85 -0.04 0.00 0.00 0.00 0.00 61.98 63.11 1x98 s VAL 258 Cb -0.07 -3.61 0.01 0.00 0.00 0.00 0.00 36.38 32.70 1x98 s VAL 258 CO 0.22 -0.16 0.11 0.54 0.00 0.00 0.00 175.10 175.81 1x98 s VAL 259 N -1.94 0.01 -0.48 2.92 0.11 0.35 -0.15 120.40 121.22 1x98 s VAL 259 Ca 0.53 -0.04 0.08 0.00 -2.93 0.00 0.00 61.98 59.62 1x98 s VAL 259 Cb -0.10 -0.17 0.33 0.00 -1.53 0.00 0.00 36.38 34.90 1x98 s VAL 259 CO 0.18 -0.02 0.79 2.30 -3.33 0.00 0.00 175.10 175.02 1x98 n ILE 260 N 2.94 1.23 -1.85 7.04 -5.35 -1.13 -0.82 119.36 121.41 1x98 n ILE 260 Ca -0.13 -4.96 -0.41 0.00 -0.27 0.00 0.00 62.75 56.98 1x98 n ILE 260 Cb 0.59 -1.03 0.00 0.00 -1.74 0.00 0.00 39.64 37.46 1x98 n ILE 260 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 1x98 s PRO 261 N -2.70 4.03 -0.12 6.28 0.04 -1.21 -3.25 135.00 138.08 1x98 s PRO 261 Ca 0.43 2.47 -0.10 0.00 0.04 0.00 0.00 61.00 63.84 1x98 s PRO 261 Cb 0.29 -2.89 -0.05 0.00 0.04 0.00 0.00 34.50 31.89 1x98 s PRO 261 CO -0.10 -0.56 0.22 0.21 0.04 0.00 0.00 177.00 176.82 1x98 s LYS 262 N -2.15 3.81 -0.08 4.56 2.36 -1.26 -1.43 119.74 125.54 1x98 s LYS 262 Ca 0.54 0.01 -0.23 0.00 -2.55 0.00 0.00 55.97 53.74 1x98 s LYS 262 Cb -0.45 -3.28 0.05 0.00 -1.05 0.00 0.00 37.83 33.11 1x98 s LYS 262 CO 0.60 0.58 0.54 0.45 1.55 0.00 0.00 175.35 179.07 1x98 s SER 263 N -0.54 -0.50 0.00 1.43 0.15 -1.26 -4.94 113.70 108.04 1x98 s SER 263 Ca 0.16 0.63 0.13 0.00 0.70 0.00 0.00 55.95 57.56 1x98 s SER 263 Cb -0.13 0.62 0.31 0.00 -1.71 0.00 0.00 66.02 65.11 1x98 s SER 263 CO 0.05 -0.46 1.23 1.33 1.20 0.00 0.00 173.24 176.59 1x98 n VAL 264 N 1.47 0.82 -3.41 4.45 0.24 -1.26 -4.88 118.33 115.75 1x98 n VAL 264 Ca -0.18 -0.91 -0.41 0.00 -2.04 0.00 0.00 64.34 60.80 1x98 n VAL 264 Cb 0.56 0.64 -0.09 0.00 -1.47 0.00 0.00 33.84 33.48 1x98 n VAL 264 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1x98 s THR 265 N -1.02 5.18 0.27 3.34 2.01 -1.26 -4.78 115.64 119.38 1x98 s THR 265 Ca 0.25 -0.01 0.01 0.00 0.31 0.00 0.00 61.69 62.25 1x98 s THR 265 Cb 0.14 -3.83 0.26 0.00 0.01 0.00 0.00 72.50 69.08 1x98 s THR 265 CO 0.18 -0.11 1.77 -0.65 -0.69 0.00 0.00 174.62 175.13 1x98 h PRO 266 N 8.48 0.67 -0.53 4.92 0.11 -1.97 0.48 132.00 144.17 1x98 h PRO 266 Ca -0.30 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.71 1x98 h PRO 266 Cb 1.14 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.08 1x98 h PRO 266 CO 0.69 0.44 0.08 0.93 -0.21 0.00 0.00 178.00 179.93 1x98 h GLU 267 N 0.69 0.84 0.00 1.05 3.07 -2.00 -2.09 114.58 116.14 1x98 h GLU 267 Ca 0.49 -0.20 -0.21 0.00 -0.50 0.00 0.00 59.36 58.95 1x98 h GLU 267 Cb 0.69 -0.11 -0.00 0.00 -0.84 0.00 0.00 28.75 28.49 1x98 h GLU 267 CO -0.36 0.79 -0.90 0.00 -1.40 0.00 0.00 179.01 177.14 1x98 h ARG 268 N 0.80 0.29 -0.41 2.33 3.08 -1.54 -0.21 114.38 118.72 1x98 h ARG 268 Ca 0.17 -0.32 0.06 0.00 0.07 0.00 0.00 59.98 59.96 1x98 h ARG 268 Cb 0.37 0.09 -0.05 0.00 0.08 0.00 0.00 29.97 30.45 1x98 h ARG 268 CO 0.01 1.02 0.09 0.82 -1.07 0.00 0.00 179.97 180.84 1x98 h ILE 269 N 0.16 0.80 -0.39 2.04 2.04 -0.73 0.99 117.51 122.42 1x98 h ILE 269 Ca -0.06 -0.08 -0.06 0.00 1.00 0.00 0.00 64.86 65.67 1x98 h ILE 269 Cb 1.53 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 1x98 h ILE 269 CO 0.15 0.04 0.03 0.00 0.00 0.00 0.00 178.15 178.37 1x98 h ALA 270 N 1.31 0.52 -0.28 1.87 0.00 -1.31 -3.09 119.26 118.29 1x98 h ALA 270 Ca 0.20 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1x98 h ALA 270 Cb 0.24 -0.15 -0.08 0.00 0.00 0.00 0.00 17.79 17.80 1x98 h ALA 270 CO -0.25 0.27 -0.34 1.49 0.00 0.00 0.00 179.25 180.41 1x98 h GLU 271 N 0.50 -0.32 0.00 0.00 4.22 -0.60 -2.17 114.58 116.22 1x98 h GLU 271 Ca 0.11 0.02 -0.00 0.00 0.08 0.00 0.00 59.36 59.57 1x98 h GLU 271 Cb 0.43 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 1x98 h GLU 271 CO 0.01 -0.21 -0.02 -0.91 -2.18 0.00 0.00 179.01 175.70 1x98 h ASN 272 N -0.33 0.00 1.21 1.04 -0.26 -0.75 -0.90 115.58 115.59 1x98 h ASN 272 Ca 0.13 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.87 1x98 h ASN 272 Cb 0.55 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.81 1x98 h ASN 272 CO -0.46 0.02 -0.54 0.15 -1.06 0.00 0.00 177.43 175.54 1x98 h PHE 273 N 0.00 0.00 -0.70 1.19 3.57 -1.31 -3.40 116.94 116.28 1x98 h PHE 273 Ca -0.00 0.00 -0.72 0.00 3.53 0.00 0.00 57.97 60.78 1x98 h PHE 273 Cb 0.16 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 38.83 1x98 h PHE 273 CO 0.00 0.00 2.87 1.17 -2.23 0.00 0.00 178.31 180.12 1x98 n LYS 274 N -2.51 3.92 0.00 1.11 4.81 -0.34 -4.30 118.16 120.85 1x98 n LYS 274 Ca 0.03 -2.99 0.00 0.00 -0.87 0.00 0.00 58.31 54.48 1x98 n LYS 274 Cb 0.49 -2.82 0.00 0.00 0.02 0.00 0.00 35.03 32.72 1x98 n LYS 274 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 1x98 n VAL 275 N 3.01 0.57 -0.57 3.15 0.24 -1.26 -4.81 118.33 118.66 1x98 n VAL 275 Ca 0.62 -0.58 0.10 0.00 -2.04 0.00 0.00 64.34 62.44 1x98 n VAL 275 Cb 0.28 0.73 0.35 0.00 -1.47 0.00 0.00 33.84 33.73 1x98 n VAL 275 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1x98 n PHE 276 N -0.28 1.36 -0.88 6.34 3.72 -1.26 -4.49 117.46 121.97 1x98 n PHE 276 Ca 0.00 -0.59 0.00 0.00 -0.05 0.00 0.00 57.45 56.81 1x98 n PHE 276 Cb 0.35 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 1x98 n PHE 276 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1x98 n ASP 277 N 1.20 0.48 -4.36 4.37 3.85 -1.26 -3.83 116.55 117.00 1x98 n ASP 277 Ca 0.25 -1.35 -0.19 0.00 -0.71 0.00 0.00 54.79 52.79 1x98 n ASP 277 Cb 0.83 -0.03 -0.10 0.00 -1.35 0.00 0.00 41.12 40.47 1x98 n ASP 277 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.20 176.91 1x98 s PHE 278 N -0.28 1.77 -0.05 2.11 -0.71 -1.26 -5.11 117.98 114.45 1x98 s PHE 278 Ca 0.01 -0.58 0.02 0.00 -1.04 0.00 0.00 56.93 55.34 1x98 s PHE 278 Cb 0.01 -0.85 0.02 0.00 -1.21 0.00 0.00 43.02 40.99 1x98 s PHE 278 CO 0.00 0.37 -0.07 -1.83 -1.34 0.00 0.00 175.22 172.35 1x98 s GLU 279 N -3.65 1.07 0.29 1.99 -1.05 -1.26 -5.00 118.70 111.10 1x98 s GLU 279 Ca 0.24 -0.21 -0.29 0.00 -0.15 0.00 0.00 54.97 54.56 1x98 s GLU 279 Cb -0.00 -0.99 -0.09 0.00 -0.44 0.00 0.00 34.13 32.61 1x98 s GLU 279 CO 0.08 -0.02 1.10 -0.51 0.95 0.00 0.00 175.26 176.86 1x98 s LEU 280 N 0.74 4.51 0.82 1.83 1.43 -1.26 -5.05 118.68 121.69 1x98 s LEU 280 Ca -0.12 2.26 -0.11 0.00 -1.03 0.00 0.00 54.13 55.13 1x98 s LEU 280 Cb -0.14 -3.68 0.08 0.00 0.03 0.00 0.00 46.19 42.48 1x98 s LEU 280 CO 0.01 -0.19 1.10 -0.94 0.23 0.00 0.00 176.35 176.56 1x98 s SER 281 N -0.93 4.26 0.37 2.29 1.04 -1.26 -4.84 113.70 114.62 1x98 s SER 281 Ca 0.46 1.33 0.05 0.00 0.48 0.00 0.00 55.95 58.27 1x98 s SER 281 Cb -0.31 -2.05 0.73 0.00 0.10 0.00 0.00 66.02 64.48 1x98 s SER 281 CO 0.40 -2.12 1.99 0.28 0.98 0.00 0.00 173.24 174.77 1x98 h SER 282 N -1.19 0.66 -0.52 7.02 0.02 -1.99 -0.45 113.55 117.10 1x98 h SER 282 Ca -0.48 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.46 1x98 h SER 282 Cb 1.27 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.64 1x98 h SER 282 CO 0.58 0.45 0.28 -0.61 -1.14 0.00 0.00 176.83 176.40 1x98 h GLN 283 N 0.76 0.72 -0.67 3.45 4.15 -1.99 -0.20 115.11 121.33 1x98 h GLN 283 Ca 0.27 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.60 1x98 h GLN 283 Cb 0.11 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 27.62 1x98 h GLN 283 CO -0.08 0.56 0.42 -0.44 -1.93 0.00 0.00 178.83 177.36 1x98 h ASP 284 N 0.69 0.79 -0.33 -0.69 3.32 -1.67 -0.23 116.42 118.30 1x98 h ASP 284 Ca 0.18 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 1x98 h ASP 284 Cb 0.05 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 1x98 h ASP 284 CO -0.03 0.59 0.12 0.24 -1.72 0.00 0.00 179.24 178.44 1x98 h MET 285 N 0.91 0.50 -0.83 3.56 2.86 -0.60 0.28 114.93 121.61 1x98 h MET 285 Ca 0.24 -0.10 -0.02 0.00 -2.06 0.00 0.00 59.70 57.76 1x98 h MET 285 Cb -0.06 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 31.48 1x98 h MET 285 CO -0.05 0.52 0.43 1.15 1.06 0.00 0.00 176.91 180.02 1x98 h THR 286 N 0.38 1.25 -0.27 2.22 2.02 -0.84 0.25 112.91 117.92 1x98 h THR 286 Ca 0.11 -0.66 -0.02 0.00 0.77 0.00 0.00 66.41 66.61 1x98 h THR 286 Cb 0.22 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.78 1x98 h THR 286 CO -0.01 0.29 0.09 0.74 0.37 0.00 0.00 175.52 177.00 1x98 h THR 287 N 1.17 1.20 -0.75 3.16 2.02 -0.76 -1.33 112.91 117.62 1x98 h THR 287 Ca 0.29 -0.63 -0.04 0.00 0.77 0.00 0.00 66.41 66.80 1x98 h THR 287 Cb 0.07 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 67.55 1x98 h THR 287 CO -0.04 0.21 0.29 -0.07 0.37 0.00 0.00 175.52 176.28 1x98 h LEU 288 N 0.27 1.03 -2.03 2.58 3.38 -0.64 -1.16 115.31 118.74 1x98 h LEU 288 Ca 0.09 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 57.92 1x98 h LEU 288 Cb 0.24 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 1x98 h LEU 288 CO -0.00 0.92 0.06 -0.07 0.09 0.00 0.00 178.44 179.43 1x98 h LEU 289 N 1.09 0.00 -0.05 1.67 3.38 -0.72 -2.11 115.31 118.57 1x98 h LEU 289 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1x98 h LEU 289 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1x98 h LEU 289 CO -0.02 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 176.97 1x98 n SER 290 N -4.47 0.05 -0.15 -0.43 3.41 -0.44 -2.55 113.62 109.04 1x98 n SER 290 Ca -0.01 0.51 0.11 0.00 -0.26 0.00 0.00 58.87 59.23 1x98 n SER 290 Cb 0.17 -0.52 0.60 0.00 -0.26 0.00 0.00 64.21 64.20 1x98 n SER 290 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1x98 n TYR 291 N -1.56 0.04 -1.73 7.33 4.01 -0.79 -4.92 117.16 119.53 1x98 n TYR 291 Ca 0.03 -0.02 -0.42 0.00 -0.16 0.00 0.00 57.90 57.34 1x98 n TYR 291 Cb 0.18 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.21 1x98 n TYR 291 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1x98 n ASN 292 N -0.53 3.21 -0.31 7.72 4.05 -0.48 -4.33 115.26 124.59 1x98 n ASN 292 Ca 0.17 1.21 0.00 0.00 0.45 0.00 0.00 54.58 56.41 1x98 n ASN 292 Cb 0.15 -1.55 0.00 0.00 1.23 0.00 0.00 39.78 39.61 1x98 n ASN 292 CO 0.00 0.00 0.00 -2.11 -3.05 0.00 0.00 177.26 172.10 1x98 n ARG 293 N 0.45 0.00 -3.63 1.20 1.85 -0.22 -4.97 116.66 111.34 1x98 n ARG 293 Ca 0.03 -0.79 -0.27 0.00 -1.00 0.00 0.00 57.85 55.82 1x98 n ARG 293 Cb 0.38 -0.49 0.02 0.00 -1.05 0.00 0.00 32.46 31.32 1x98 n ARG 293 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1x98 n ASN 294 N 0.00 -4.70 -4.62 2.89 5.03 -0.50 -4.95 115.26 108.41 1x98 n ASN 294 Ca 0.00 -0.59 -0.40 0.00 0.87 0.00 0.00 54.58 54.45 1x98 n ASN 294 Cb 0.62 -3.79 -0.07 0.00 -1.02 0.00 0.00 39.78 35.52 1x98 n ASN 294 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 1x98 s TRP 295 N -3.17 3.26 -0.18 3.10 -0.00 -0.70 -4.99 118.94 116.25 1x98 s TRP 295 Ca 0.54 0.67 -0.07 0.00 -0.00 0.00 0.00 56.10 57.24 1x98 s TRP 295 Cb -0.27 -2.79 -0.04 0.00 -0.00 0.00 0.00 33.47 30.37 1x98 s TRP 295 CO 0.66 -0.32 0.05 1.03 -0.00 0.00 0.00 176.95 178.37 1x98 s ARG 296 N 2.40 3.94 0.05 5.86 0.52 -1.26 -4.35 118.95 126.10 1x98 s ARG 296 Ca 0.23 -0.37 -0.26 0.00 -0.52 0.00 0.00 55.73 54.81 1x98 s ARG 296 Cb -0.15 -3.18 -0.17 0.00 0.52 0.00 0.00 34.95 31.97 1x98 s ARG 296 CO 0.09 0.27 1.51 0.28 0.02 0.00 0.00 175.30 177.47 1x98 h VAL 297 N 4.91 0.81 -3.51 3.52 2.07 -1.97 -3.42 116.25 118.65 1x98 h VAL 297 Ca -0.36 -0.32 -0.69 0.00 0.82 0.00 0.00 66.70 66.15 1x98 h VAL 297 Cb 1.17 1.00 -0.35 0.00 -1.52 0.00 0.00 31.29 31.58 1x98 h VAL 297 CO 0.69 0.07 -0.57 0.00 0.02 0.00 0.00 177.57 177.78 1x98 n ALA 299 N 4.55 2.48 -3.97 0.00 0.00 -1.26 -5.00 120.51 117.31 1x98 n ALA 299 Ca -0.01 -0.61 -0.30 0.00 0.00 0.00 0.00 53.44 52.51 1x98 n ALA 299 Cb 0.41 -0.47 -0.01 0.00 0.00 0.00 0.00 19.45 19.38 1x98 n ALA 299 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1x98 n LEU 300 N 0.78 -1.93 0.27 0.00 7.94 -1.26 -4.82 117.00 117.99 1x98 n LEU 300 Ca 0.08 -1.09 0.14 0.00 -1.11 0.00 0.00 56.01 54.03 1x98 n LEU 300 Cb 0.35 -2.09 0.78 0.00 0.53 0.00 0.00 43.42 42.99 1x98 n LEU 300 CO 0.09 0.49 1.01 -0.07 -1.11 0.00 0.00 177.39 177.81 1x98 h LEU 301 N -1.94 0.00 -0.17 -1.96 3.38 -1.99 -1.29 115.31 111.34 1x98 h LEU 301 Ca -0.65 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.32 1x98 h LEU 301 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 1x98 h LEU 301 CO 0.59 0.09 0.00 -1.54 0.09 0.00 0.00 178.44 177.67 1x98 n SER 302 N -3.63 0.15 -0.09 -0.43 3.41 -1.26 -3.67 113.62 108.10 1x98 n SER 302 Ca -0.02 0.54 0.09 0.00 -0.26 0.00 0.00 58.87 59.22 1x98 n SER 302 Cb 0.20 -0.57 0.13 0.00 -0.26 0.00 0.00 64.21 63.71 1x98 n SER 302 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x98 n THR 304 N -1.36 1.15 0.80 0.00 -2.24 -1.24 -1.46 114.28 109.94 1x98 n THR 304 Ca 0.15 0.50 0.10 0.00 -2.27 0.00 0.00 64.05 62.52 1x98 n THR 304 Cb 0.64 -1.45 0.07 0.00 -2.10 0.00 0.00 70.33 67.49 1x98 n THR 304 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1x98 n SER 305 N -2.03 2.49 -4.77 3.42 7.64 -1.26 -4.89 113.62 114.21 1x98 n SER 305 Ca 0.00 -1.74 -0.41 0.00 1.01 0.00 0.00 58.87 57.73 1x98 n SER 305 Cb 0.10 0.07 -0.01 0.00 -1.01 0.00 0.00 64.21 63.36 1x98 n SER 305 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 1x98 s HIS 306 N -1.67 2.64 0.56 1.43 5.04 -0.53 -4.85 115.29 117.91 1x98 s HIS 306 Ca 0.21 1.04 0.25 0.00 -1.54 0.00 0.00 55.06 55.03 1x98 s HIS 306 Cb 0.16 -4.04 1.57 0.00 0.04 0.00 0.00 32.58 30.31 1x98 s HIS 306 CO 0.27 -3.18 2.13 1.57 -2.34 0.00 0.00 174.74 173.19 1x98 h LYS 307 N 3.60 0.00 -0.38 2.88 2.10 -1.92 -1.27 116.57 121.57 1x98 h LYS 307 Ca -0.50 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.15 1x98 h LYS 307 Cb 1.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1x98 h LYS 307 CO 0.69 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.89 1x98 n ASP 308 N -4.07 4.20 -4.67 7.07 8.00 -1.26 -4.99 116.55 120.84 1x98 n ASP 308 Ca 0.01 -2.77 -0.52 0.00 0.71 0.00 0.00 54.79 52.21 1x98 n ASP 308 Cb 0.26 -0.53 -0.06 0.00 -0.02 0.00 0.00 41.12 40.77 1x98 n ASP 308 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1x98 n TYR 309 N 0.08 1.99 0.43 1.24 9.36 -0.48 -4.43 117.16 125.35 1x98 n TYR 309 Ca 0.22 0.41 0.12 0.00 3.32 0.00 0.00 57.90 61.97 1x98 n TYR 309 Cb 0.88 -2.48 0.25 0.00 -0.63 0.00 0.00 39.34 37.35 1x98 n TYR 309 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1x98 h PRO 310 N 6.71 0.00 -0.40 2.98 0.13 -1.91 -3.39 132.00 136.13 1x98 h PRO 310 Ca -0.47 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.57 1x98 h PRO 310 Cb 1.30 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.38 1x98 h PRO 310 CO 0.90 0.00 0.05 1.19 -0.23 0.00 0.00 178.00 179.90 1x98 n PHE 311 N -2.55 1.35 -0.06 1.56 3.72 -1.26 -4.11 117.46 116.11 1x98 n PHE 311 Ca 0.04 -1.11 -0.13 0.00 -0.05 0.00 0.00 57.45 56.20 1x98 n PHE 311 Cb 0.48 -0.45 -0.12 0.00 -0.94 0.00 0.00 39.48 38.46 1x98 n PHE 311 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1x98 h HIS 312 N 1.86 -0.01 -2.82 1.38 3.86 -1.97 -3.46 115.15 113.98 1x98 h HIS 312 Ca 0.11 -0.00 -0.59 0.00 -1.16 0.00 0.00 60.37 58.73 1x98 h HIS 312 Cb 1.71 0.00 0.10 0.00 1.06 0.00 0.00 27.41 30.29 1x98 h HIS 312 CO 0.81 0.84 0.37 0.39 0.86 0.00 0.00 177.93 181.20 1x98 n GLU 313 N -4.67 1.77 -0.14 2.45 -0.58 -1.26 -4.90 120.64 113.32 1x98 n GLU 313 Ca -0.09 0.62 0.21 0.00 -0.42 0.00 0.00 57.16 57.48 1x98 n GLU 313 Cb 0.41 -2.13 0.62 0.00 -0.57 0.00 0.00 31.44 29.76 1x98 n GLU 313 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 1x98 h GLU 314 N 2.65 0.18 0.00 3.49 4.22 -1.92 -3.50 114.58 119.70 1x98 h GLU 314 Ca -0.43 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.00 1x98 h GLU 314 Cb 1.31 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1x98 h GLU 314 CO 0.64 0.12 0.00 1.97 -2.18 0.00 0.00 179.01 179.56