#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iei n SER 2 N 0.00 3.21 -3.15 0.00 2.88 -1.26 -4.95 113.62 110.35 1iei n SER 2 Ca 0.00 -1.80 0.05 0.00 -1.33 0.00 0.00 58.87 55.79 1iei n SER 2 Cb 0.00 -0.65 -0.01 0.00 -0.75 0.00 0.00 64.21 62.80 1iei n SER 2 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 1iei s ARG 3 N 0.56 0.28 0.56 -1.46 3.52 -1.26 -0.79 118.95 120.36 1iei s ARG 3 Ca 0.00 0.43 -0.14 0.00 -0.13 0.00 0.00 55.73 55.88 1iei s ARG 3 Cb 0.00 0.23 -0.06 0.00 -1.56 0.00 0.00 34.95 33.56 1iei s ARG 3 CO 0.00 -0.38 1.01 -0.51 -0.81 0.00 0.00 175.30 174.61 1iei s LEU 4 N 2.93 3.46 -0.67 -0.88 1.43 0.35 -4.79 118.68 120.51 1iei s LEU 4 Ca 0.10 1.53 -0.26 0.00 -1.03 0.00 0.00 54.13 54.48 1iei s LEU 4 Cb -0.09 -4.50 0.04 0.00 0.03 0.00 0.00 46.19 41.67 1iei s LEU 4 CO -0.17 -0.76 1.14 -0.22 0.23 0.00 0.00 176.35 176.58 1iei s LEU 5 N -4.55 3.63 0.53 1.79 0.20 -1.26 -0.53 118.68 118.49 1iei s LEU 5 Ca 0.58 -0.47 -0.19 0.00 0.69 0.00 0.00 54.13 54.73 1iei s LEU 5 Cb -0.11 -2.67 -0.06 0.00 -0.43 0.00 0.00 46.19 42.92 1iei s LEU 5 CO 0.41 -1.60 1.10 -0.76 -0.29 0.00 0.00 176.35 175.21 1iei s LEU 6 N 4.96 3.75 0.56 -0.68 1.02 0.16 -4.94 118.68 123.51 1iei s LEU 6 Ca 0.33 2.08 0.31 0.00 0.02 0.00 0.00 54.13 56.87 1iei s LEU 6 Cb -0.11 -4.57 1.69 0.00 0.02 0.00 0.00 46.19 43.22 1iei s LEU 6 CO 0.16 -1.11 1.93 -0.55 0.02 0.00 0.00 176.35 176.81 1iei h ASN 7 N 1.21 0.00 -0.40 2.29 -0.00 -1.88 -1.93 115.58 114.88 1iei h ASN 7 Ca -0.50 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 55.80 1iei h ASN 7 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.57 1iei h ASN 7 CO 0.57 0.00 0.00 -0.46 -0.00 0.00 0.00 177.43 177.54 1iei n ASN 8 N -2.72 4.23 0.00 6.14 6.94 -1.26 -4.85 115.26 123.74 1iei n ASN 8 Ca -0.02 -2.63 0.00 0.00 -0.02 0.00 0.00 54.58 51.91 1iei n ASN 8 Cb 0.21 -0.62 0.00 0.00 -2.36 0.00 0.00 39.78 37.01 1iei n ASN 8 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1iei n GLY 9 N 0.45 1.43 3.93 4.83 0.00 -0.73 -5.01 105.19 110.09 1iei n GLY 9 Ca 0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.95 1iei n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iei s ALA 10 N -2.43 3.24 -0.24 4.61 0.00 -1.25 -4.76 121.76 120.92 1iei s ALA 10 Ca 0.00 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 51.10 1iei s ALA 10 Cb 0.00 -2.57 0.05 0.00 0.00 0.00 0.00 23.12 20.60 1iei s ALA 10 CO 0.00 -1.14 -0.11 0.15 0.00 0.00 0.00 175.76 174.66 1iei s LYS 11 N -5.15 2.16 -0.22 0.00 1.02 -1.26 -0.67 119.74 115.62 1iei s LYS 11 Ca 0.58 -1.18 -0.14 0.00 0.02 0.00 0.00 55.97 55.25 1iei s LYS 11 Cb -0.11 -2.76 -0.04 0.00 -0.52 0.00 0.00 37.83 34.41 1iei s LYS 11 CO 0.44 -0.53 0.33 1.41 -0.92 0.00 0.00 175.35 176.09 1iei s MET 12 N 1.20 4.13 0.44 1.68 -2.45 0.31 -4.93 119.30 119.69 1iei s MET 12 Ca -0.06 0.06 -0.23 0.00 -1.25 0.00 0.00 55.69 54.20 1iei s MET 12 Cb -0.19 -3.55 -0.08 0.00 1.25 0.00 0.00 34.83 32.27 1iei s MET 12 CO -0.06 -0.03 1.17 -2.14 1.05 0.00 0.00 175.02 175.00 1iei s PRO 13 N 1.31 3.83 0.40 4.11 0.02 -1.26 -0.49 135.00 142.92 1iei s PRO 13 Ca 0.15 1.79 0.28 0.00 0.02 0.00 0.00 61.00 63.25 1iei s PRO 13 Cb -0.14 -2.47 1.37 0.00 0.02 0.00 0.00 34.50 33.27 1iei s PRO 13 CO 0.07 -0.50 1.85 0.97 -0.33 0.00 0.00 177.00 179.06 1iei h ILE 14 N 1.98 0.00 -3.23 2.83 2.10 -1.32 -3.43 117.51 116.44 1iei h ILE 14 Ca -0.49 -0.14 -0.49 0.00 1.08 0.00 0.00 64.86 64.82 1iei h ILE 14 Cb 1.24 0.85 -0.40 0.00 -1.09 0.00 0.00 36.82 37.43 1iei h ILE 14 CO 0.61 0.00 -0.76 -0.76 -1.08 0.00 0.00 178.15 176.16 1iei s LEU 15 N -5.02 0.90 0.05 2.19 1.43 -1.26 -0.92 118.68 116.06 1iei s LEU 15 Ca -0.00 -0.60 -0.02 0.00 -1.03 0.00 0.00 54.13 52.48 1iei s LEU 15 Cb 0.09 -0.50 -0.04 0.00 0.03 0.00 0.00 46.19 45.77 1iei s LEU 15 CO 0.34 -0.28 -0.01 -0.83 0.23 0.00 0.00 176.35 175.79 1iei s GLY 16 N 1.93 0.44 -0.52 -3.19 0.00 -0.27 -4.32 107.32 101.40 1iei s GLY 16 Ca 0.01 -1.16 -0.28 0.00 0.00 0.00 0.00 44.72 43.29 1iei s GLY 16 CO -0.07 -1.28 1.55 -2.27 0.00 0.00 0.00 173.10 171.03 1iei s LEU 17 N -2.91 3.42 0.71 0.66 0.20 -0.43 -2.68 118.68 117.65 1iei s LEU 17 Ca 0.07 0.51 -0.16 0.00 0.69 0.00 0.00 54.13 55.24 1iei s LEU 17 Cb 0.08 -3.08 0.00 0.00 -0.43 0.00 0.00 46.19 42.76 1iei s LEU 17 CO -0.10 -1.80 0.97 0.61 -0.29 0.00 0.00 176.35 175.74 1iei n GLY 18 N 5.35 -0.40 0.00 7.98 0.00 0.92 -1.52 105.19 117.52 1iei n GLY 18 Ca 0.16 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1iei n GLY 18 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1iei n THR 19 N -2.43 0.04 -2.06 2.61 -2.24 -1.10 -4.22 114.28 104.89 1iei n THR 19 Ca 0.13 -0.16 -0.42 0.00 -2.27 0.00 0.00 64.05 61.33 1iei n THR 19 Cb 0.49 1.59 -0.03 0.00 -2.10 0.00 0.00 70.33 70.29 1iei n THR 19 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1iei s TRP 20 N -0.04 2.12 0.00 4.78 -0.00 -1.26 -3.11 118.94 121.43 1iei s TRP 20 Ca 0.00 0.31 0.00 0.00 -0.00 0.00 0.00 56.10 56.41 1iei s TRP 20 Cb 0.00 -3.86 0.00 0.00 -0.00 0.00 0.00 33.47 29.61 1iei s TRP 20 CO 0.00 -3.56 0.00 1.63 -0.00 0.00 0.00 176.95 175.02 1iei n LYS 21 N 6.95 0.00 -3.01 5.86 4.01 -1.26 -4.96 118.16 125.75 1iei n LYS 21 Ca 0.17 0.00 -0.43 0.00 -0.51 0.00 0.00 58.31 57.53 1iei n LYS 21 Cb 0.43 0.00 -0.05 0.00 -0.51 0.00 0.00 35.03 34.90 1iei n LYS 21 CO 0.00 0.00 0.00 -1.12 -1.11 0.00 0.00 177.40 175.17 1iei s SER 22 N -2.75 6.29 0.66 4.39 0.01 -1.18 -5.00 113.70 116.11 1iei s SER 22 Ca 0.00 -0.60 -0.17 0.00 1.31 0.00 0.00 55.95 56.49 1iei s SER 22 Cb 0.00 -2.36 -0.00 0.00 0.21 0.00 0.00 66.02 63.87 1iei s SER 22 CO 0.00 -1.02 1.25 -2.84 0.41 0.00 0.00 173.24 171.03 1iei s PRO 23 N 3.22 2.55 0.57 12.44 0.02 -1.26 -4.66 135.00 147.87 1iei s PRO 23 Ca 0.23 1.91 0.33 0.00 0.02 0.00 0.00 61.00 63.49 1iei s PRO 23 Cb -0.16 -1.86 1.45 0.00 0.02 0.00 0.00 34.50 33.95 1iei s PRO 23 CO 0.16 -1.56 1.77 -1.35 -0.33 0.00 0.00 177.00 175.69 1iei h PRO 24 N 0.40 0.00 0.00 5.54 0.11 -1.92 0.14 132.00 136.27 1iei h PRO 24 Ca -0.50 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.56 1iei h PRO 24 Cb 1.31 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.42 1iei h PRO 24 CO 0.53 0.00 -0.23 0.78 -0.21 0.00 0.00 178.00 178.87 1iei h GLY 25 N 0.00 0.00 -0.92 -0.55 0.00 -2.01 -3.33 103.07 96.25 1iei h GLY 25 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.77 1iei h GLY 25 CO -0.00 0.00 -0.28 -1.06 0.00 0.00 0.00 176.54 175.19 1iei n GLN 26 N -3.85 1.59 -0.04 4.80 6.02 0.46 -4.86 117.38 121.49 1iei n GLN 26 Ca -0.02 -1.00 -0.09 0.00 -0.01 0.00 0.00 57.00 55.89 1iei n GLN 26 Cb 0.32 -1.32 -0.14 0.00 1.02 0.00 0.00 30.24 30.12 1iei n GLN 26 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.06 177.60 1iei n VAL 27 N 0.13 1.57 0.05 5.09 3.14 -0.94 -2.77 118.33 124.61 1iei n VAL 27 Ca 0.08 -0.81 -0.12 0.00 -2.96 0.00 0.00 64.34 60.53 1iei n VAL 27 Cb 0.38 -0.93 -0.07 0.00 -1.06 0.00 0.00 33.84 32.16 1iei n VAL 27 CO 0.00 0.00 0.00 0.74 -6.46 0.00 0.00 176.83 171.11 1iei h THR 28 N 0.00 0.99 -0.78 1.55 2.02 -1.80 -1.92 112.91 112.96 1iei h THR 28 Ca -0.34 -0.08 0.15 0.00 0.77 0.00 0.00 66.41 66.92 1iei h THR 28 Cb 2.06 1.04 -0.05 0.00 -1.74 0.00 0.00 68.15 69.45 1iei h THR 28 CO 0.07 0.02 0.52 -0.33 0.37 0.00 0.00 175.52 176.17 1iei h GLU 29 N -0.08 0.43 -0.07 6.66 4.39 -1.91 0.86 114.58 124.85 1iei h GLU 29 Ca -0.01 -0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.64 1iei h GLU 29 Cb 0.07 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 28.62 1iei h GLU 29 CO 0.01 0.28 -0.08 0.00 -1.16 0.00 0.00 179.01 178.06 1iei h ALA 30 N 1.64 0.10 0.21 3.43 0.00 -1.32 -0.83 119.26 122.48 1iei h ALA 30 Ca 0.39 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1iei h ALA 30 Cb 0.86 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1iei h ALA 30 CO -0.13 -0.07 -0.10 0.28 0.00 0.00 0.00 179.25 179.22 1iei h VAL 31 N -0.26 0.85 -0.87 0.00 2.07 -1.30 -1.08 116.25 115.66 1iei h VAL 31 Ca 0.01 -0.30 0.08 0.00 0.82 0.00 0.00 66.70 67.31 1iei h VAL 31 Cb 0.60 1.03 -0.07 0.00 -1.52 0.00 0.00 31.29 31.33 1iei h VAL 31 CO 0.02 0.07 0.52 0.11 0.02 0.00 0.00 177.57 178.31 1iei h LYS 32 N -0.43 0.88 -0.18 1.57 1.57 -0.76 0.03 116.57 119.25 1iei h LYS 32 Ca -0.03 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.65 1iei h LYS 32 Cb 0.33 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1iei h LYS 32 CO 0.05 0.58 -0.11 0.28 -0.57 0.00 0.00 179.45 179.69 1iei h VAL 33 N 0.91 1.18 -0.50 0.50 2.07 -1.21 0.26 116.25 119.46 1iei h VAL 33 Ca 0.40 -0.77 -0.08 0.00 0.82 0.00 0.00 66.70 67.07 1iei h VAL 33 Cb 0.28 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1iei h VAL 33 CO -0.21 0.24 -0.01 0.00 0.02 0.00 0.00 177.57 177.61 1iei h ALA 34 N 1.63 0.67 -0.09 1.67 0.00 0.31 -1.45 119.26 122.00 1iei h ALA 34 Ca 0.06 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.69 1iei h ALA 34 Cb 0.36 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1iei h ALA 34 CO 0.02 0.49 -0.01 0.82 0.00 0.00 0.00 179.25 180.57 1iei h ILE 35 N 0.75 0.92 -0.72 0.00 2.04 -1.10 0.44 117.51 119.84 1iei h ILE 35 Ca 0.14 -0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.05 1iei h ILE 35 Cb 0.53 0.91 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 1iei h ILE 35 CO 0.03 0.00 0.48 0.44 0.00 0.00 0.00 178.15 179.10 1iei h ASP 36 N 0.01 0.70 -0.74 1.72 3.32 -0.78 -1.35 116.42 119.30 1iei h ASP 36 Ca 0.04 -0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.05 1iei h ASP 36 Cb 0.06 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.42 1iei h ASP 36 CO -0.08 0.46 0.30 0.58 -1.72 0.00 0.00 179.24 178.78 1iei h VAL 37 N 0.80 1.25 0.00 -1.35 2.07 -1.00 -3.48 116.25 114.54 1iei h VAL 37 Ca 0.30 -0.79 0.00 0.00 0.82 0.00 0.00 66.70 67.03 1iei h VAL 37 Cb 0.19 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 1iei h VAL 37 CO -0.10 0.32 0.00 0.61 0.02 0.00 0.00 177.57 178.43 1iei n GLY 38 N -0.92 1.13 3.65 2.17 0.00 0.15 -5.09 105.19 106.28 1iei n GLY 38 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1iei n GLY 38 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1iei s TYR 39 N -0.50 2.00 -1.55 1.61 1.51 -0.67 -4.86 117.35 114.89 1iei s TYR 39 Ca 0.00 0.30 0.22 0.00 -1.01 0.00 0.00 57.07 56.58 1iei s TYR 39 Cb 0.00 -3.92 -0.05 0.00 -0.11 0.00 0.00 41.96 37.88 1iei s TYR 39 CO 0.00 -3.61 1.04 0.54 -1.11 0.00 0.00 175.55 172.42 1iei n ARG 40 N 7.29 0.64 -4.43 -0.62 3.00 -1.26 -4.19 116.66 117.09 1iei n ARG 40 Ca 0.18 -0.52 -0.34 0.00 -0.01 0.00 0.00 57.85 57.16 1iei n ARG 40 Cb 0.43 -1.49 -0.12 0.00 0.00 0.00 0.00 32.46 31.28 1iei n ARG 40 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 1iei s HIS 41 N -2.72 3.01 0.01 -1.55 2.46 -1.26 0.09 115.29 115.34 1iei s HIS 41 Ca 0.14 -0.30 0.02 0.00 0.47 0.00 0.00 55.06 55.39 1iei s HIS 41 Cb 0.17 -1.94 -0.01 0.00 -0.13 0.00 0.00 32.58 30.67 1iei s HIS 41 CO 0.70 -0.03 -0.06 0.96 -2.47 0.00 0.00 174.74 173.84 1iei s ILE 42 N 0.31 0.46 -0.34 0.89 -4.36 -0.72 -1.31 121.20 116.12 1iei s ILE 42 Ca -0.04 -0.48 -0.06 0.00 -0.26 0.00 0.00 60.65 59.81 1iei s ILE 42 Cb -0.14 -0.44 0.04 0.00 1.25 0.00 0.00 42.46 43.18 1iei s ILE 42 CO 0.03 -0.02 0.11 -0.62 0.24 0.00 0.00 174.94 174.67 1iei s ASP 43 N -0.55 5.30 0.58 4.36 2.15 -0.57 -2.10 116.67 125.84 1iei s ASP 43 Ca -0.01 -1.19 0.04 0.00 0.43 0.00 0.00 52.55 51.82 1iei s ASP 43 Cb -0.04 -1.86 0.07 0.00 -0.30 0.00 0.00 42.92 40.78 1iei s ASP 43 CO -0.00 -0.34 0.80 0.00 -0.17 0.00 0.00 175.17 175.47 1iei s ALA 45 N -2.77 -1.81 0.28 0.00 0.00 -1.26 -3.96 121.76 112.24 1iei s ALA 45 Ca 0.61 1.02 0.12 0.00 0.00 0.00 0.00 51.96 53.71 1iei s ALA 45 Cb -0.08 0.35 0.46 0.00 0.00 0.00 0.00 23.12 23.85 1iei s ALA 45 CO 0.39 -0.65 1.66 1.25 0.00 0.00 0.00 175.76 178.42 1iei h HIS 46 N 2.09 0.00 -0.23 0.00 2.76 -1.97 -2.98 115.15 114.82 1iei h HIS 46 Ca -0.23 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 57.92 1iei h HIS 46 Cb 1.24 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.19 1iei h HIS 46 CO 0.26 0.55 0.06 -0.24 -1.30 0.00 0.00 177.93 177.26 1iei h VAL 47 N 0.00 1.11 -0.00 5.26 3.04 -1.97 -3.09 116.25 120.60 1iei h VAL 47 Ca -0.01 -0.36 0.00 0.00 -1.01 0.00 0.00 66.70 65.32 1iei h VAL 47 Cb 1.00 0.87 -0.00 0.00 -2.01 0.00 0.00 31.29 31.14 1iei h VAL 47 CO 0.07 0.13 0.11 1.88 -1.01 0.00 0.00 177.57 178.75 1iei h TYR 48 N 0.32 0.00 -0.04 3.17 0.05 -1.91 -3.44 116.97 115.11 1iei h TYR 48 Ca 0.08 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.84 1iei h TYR 48 Cb 0.11 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.84 1iei h TYR 48 CO 0.00 0.00 -0.02 1.04 -1.05 0.00 0.00 178.16 178.14 1iei n GLN 49 N -3.03 -1.45 0.00 4.88 6.02 -1.17 -4.83 117.38 117.81 1iei n GLN 49 Ca -0.03 0.41 0.01 0.00 -0.01 0.00 0.00 57.00 57.38 1iei n GLN 49 Cb 0.17 -4.52 -0.01 0.00 1.02 0.00 0.00 30.24 26.91 1iei n GLN 49 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1iei n ASN 50 N -0.72 0.10 -0.17 1.08 6.94 -1.26 -4.85 115.26 116.37 1iei n ASN 50 Ca -0.01 -0.55 -0.02 0.00 -0.02 0.00 0.00 54.58 53.98 1iei n ASN 50 Cb 0.38 0.98 -0.00 0.00 -2.36 0.00 0.00 39.78 38.77 1iei n ASN 50 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1iei n GLU 51 N -1.01 -0.13 0.00 -3.83 1.02 -1.26 0.17 120.64 115.60 1iei n GLU 51 Ca 0.00 0.67 0.22 0.00 -0.02 0.00 0.00 57.16 58.04 1iei n GLU 51 Cb 0.02 -1.00 0.72 0.00 -0.02 0.00 0.00 31.44 31.17 1iei n GLU 51 CO 0.00 0.00 0.00 -0.97 1.18 0.00 0.00 177.13 177.34 1iei h ASN 52 N 0.00 0.00 0.22 1.62 -0.73 -1.89 0.15 115.58 114.95 1iei h ASN 52 Ca 0.13 0.00 -0.18 0.00 1.87 0.00 0.00 56.30 58.12 1iei h ASN 52 Cb 0.24 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 38.79 1iei h ASN 52 CO -0.43 0.00 -1.96 -0.62 -0.37 0.00 0.00 177.43 174.05 1iei n GLU 53 N -4.11 0.66 -0.15 6.67 1.02 0.13 -3.19 120.64 121.66 1iei n GLU 53 Ca 0.10 -0.01 -0.04 0.00 -0.02 0.00 0.00 57.16 57.20 1iei n GLU 53 Cb 0.67 -1.61 0.03 0.00 -0.02 0.00 0.00 31.44 30.51 1iei n GLU 53 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1iei h VAL 54 N 0.00 0.45 -0.12 2.62 2.07 -0.17 -3.25 116.25 117.85 1iei h VAL 54 Ca -0.25 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.29 1iei h VAL 54 Cb 1.62 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.82 1iei h VAL 54 CO 0.02 0.00 -0.15 1.23 0.02 0.00 0.00 177.57 178.69 1iei h GLY 55 N -0.05 -1.71 0.93 2.17 0.00 -0.87 -2.33 103.07 101.22 1iei h GLY 55 Ca 0.23 0.81 0.10 0.00 0.00 0.00 0.00 47.33 48.47 1iei h GLY 55 CO -0.52 -0.58 0.44 -0.39 0.00 0.00 0.00 176.54 175.49 1iei h VAL 56 N -0.11 0.30 0.55 4.60 -1.51 -1.58 0.20 116.25 118.70 1iei h VAL 56 Ca 0.02 0.00 -0.03 0.00 -1.23 0.00 0.00 66.70 65.46 1iei h VAL 56 Cb 0.16 0.64 0.01 0.00 -2.13 0.00 0.00 31.29 29.96 1iei h VAL 56 CO -0.17 0.00 -0.27 0.00 -1.23 0.00 0.00 177.57 175.91 1iei h ALA 57 N 1.44 -0.74 -0.96 5.19 0.00 -1.51 0.24 119.26 122.92 1iei h ALA 57 Ca 0.16 -0.19 0.10 0.00 0.00 0.00 0.00 54.91 54.98 1iei h ALA 57 Cb 1.04 0.29 -0.12 0.00 0.00 0.00 0.00 17.79 19.00 1iei h ALA 57 CO -0.00 -0.74 -0.53 -0.89 0.00 0.00 0.00 179.25 177.09 1iei n ILE 58 N -5.29 -0.62 -0.06 0.00 5.41 -0.61 0.14 119.36 118.32 1iei n ILE 58 Ca -0.11 2.30 -0.09 0.00 1.00 0.00 0.00 62.75 65.86 1iei n ILE 58 Cb 0.32 -2.88 -0.03 0.00 -0.71 0.00 0.00 39.64 36.35 1iei n ILE 58 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 1iei h GLN 59 N 0.00 -0.30 0.00 0.38 4.15 -0.59 -0.42 115.11 118.33 1iei h GLN 59 Ca 0.19 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.63 1iei h GLN 59 Cb 0.43 0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.18 1iei h GLN 59 CO -0.91 -0.20 0.00 -1.91 -1.93 0.00 0.00 178.83 173.88 1iei n GLU 60 N -5.41 0.12 0.08 1.69 2.13 0.83 -0.96 120.64 119.12 1iei n GLU 60 Ca -0.01 0.32 -0.20 0.00 0.66 0.00 0.00 57.16 57.93 1iei n GLU 60 Cb 0.33 -1.71 -0.11 0.00 0.27 0.00 0.00 31.44 30.22 1iei n GLU 60 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1iei h LYS 61 N 0.00 0.61 0.00 5.31 1.79 0.89 0.46 116.57 125.63 1iei h LYS 61 Ca 0.00 -0.75 0.00 0.00 -2.18 0.00 0.00 60.65 57.72 1iei h LYS 61 Cb 0.36 0.24 0.00 0.00 -1.58 0.00 0.00 32.23 31.24 1iei h LYS 61 CO 0.00 1.33 0.00 1.28 -1.08 0.00 0.00 179.45 180.98 1iei n LEU 62 N -3.79 0.00 -0.13 2.94 4.77 -0.28 -0.52 117.00 119.99 1iei n LEU 62 Ca -0.12 0.70 -0.09 0.00 -0.03 0.00 0.00 56.01 56.47 1iei n LEU 62 Cb 0.94 -0.20 0.04 0.00 -2.33 0.00 0.00 43.42 41.87 1iei n LEU 62 CO 0.57 -0.20 0.69 -0.09 -1.33 0.00 0.00 177.39 177.02 1iei h ARG 63 N 0.00 0.90 -1.00 3.23 1.12 -1.16 -0.38 114.38 117.09 1iei h ARG 63 Ca 0.00 -0.37 0.29 0.00 -1.11 0.00 0.00 59.98 58.79 1iei h ARG 63 Cb 0.00 -0.04 -0.14 0.00 -0.01 0.00 0.00 29.97 29.78 1iei h ARG 63 CO 0.00 1.02 0.58 0.93 -3.11 0.00 0.00 179.97 179.39 1iei h GLU 64 N 0.78 0.42 0.00 0.20 5.08 -1.03 -3.47 114.58 116.56 1iei h GLU 64 Ca 0.11 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1iei h GLU 64 Cb 0.76 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1iei h GLU 64 CO 0.06 0.28 0.00 0.94 -1.00 0.00 0.00 179.01 179.29 1iei n GLN 65 N -4.98 0.00 0.12 2.33 -0.06 -0.15 -5.05 117.38 109.58 1iei n GLN 65 Ca 0.30 0.00 -0.01 0.00 -2.00 0.00 0.00 57.00 55.29 1iei n GLN 65 Cb 0.89 0.00 0.04 0.00 -4.06 0.00 0.00 30.24 27.11 1iei n GLN 65 CO 0.00 0.00 0.00 0.28 -0.20 0.00 0.00 177.06 177.14 1iei h VAL 66 N 0.00 1.21 -3.95 1.69 2.07 -1.01 -3.46 116.25 112.80 1iei h VAL 66 Ca 0.00 -2.50 -0.23 0.00 0.82 0.00 0.00 66.70 64.79 1iei h VAL 66 Cb 0.00 2.46 -0.22 0.00 -1.52 0.00 0.00 31.29 32.00 1iei h VAL 66 CO 0.00 0.65 -0.72 0.54 0.02 0.00 0.00 177.57 178.06 1iei s VAL 67 N -3.05 0.32 -0.06 2.57 0.11 -1.22 -5.04 120.40 114.03 1iei s VAL 67 Ca 0.02 -0.87 -0.14 0.00 -2.93 0.00 0.00 61.98 58.06 1iei s VAL 67 Cb 0.09 -0.40 -0.05 0.00 -1.53 0.00 0.00 36.38 34.49 1iei s VAL 67 CO 0.76 -0.37 0.36 -0.54 -3.33 0.00 0.00 175.10 171.99 1iei s LYS 68 N -1.31 3.97 0.14 1.54 1.02 -1.26 -4.23 119.74 119.60 1iei s LYS 68 Ca -0.11 0.29 -0.07 0.00 0.02 0.00 0.00 55.97 56.10 1iei s LYS 68 Cb -0.09 -3.28 0.20 0.00 -0.52 0.00 0.00 37.83 34.14 1iei s LYS 68 CO -0.00 0.56 0.87 0.54 -0.92 0.00 0.00 175.35 176.40 1iei n ARG 69 N 2.38 -0.09 -0.33 1.68 5.12 -1.26 0.23 116.66 124.39 1iei n ARG 69 Ca -0.14 0.87 0.31 0.00 -1.93 0.00 0.00 57.85 56.97 1iei n ARG 69 Cb 0.52 -1.29 0.56 0.00 -1.16 0.00 0.00 32.46 31.10 1iei n ARG 69 CO 0.00 0.00 0.00 -1.91 -1.93 0.00 0.00 177.63 173.79 1iei n GLU 70 N -4.87 -0.05 0.03 5.56 2.13 -1.26 -2.48 120.64 119.70 1iei n GLU 70 Ca 0.07 1.25 0.11 0.00 0.66 0.00 0.00 57.16 59.25 1iei n GLU 70 Cb 0.25 -2.29 0.01 0.00 0.27 0.00 0.00 31.44 29.68 1iei n GLU 70 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1iei n GLU 71 N -4.96 0.33 -1.49 5.31 1.02 0.14 -4.87 120.64 116.11 1iei n GLU 71 Ca 0.36 -0.01 -0.34 0.00 -0.02 0.00 0.00 57.16 57.15 1iei n GLU 71 Cb 1.25 -1.60 0.09 0.00 -0.02 0.00 0.00 31.44 31.16 1iei n GLU 71 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1iei s LEU 72 N -4.04 3.35 -0.37 -4.62 1.02 -1.03 -4.85 118.68 108.13 1iei s LEU 72 Ca 0.03 2.37 0.00 0.00 0.02 0.00 0.00 54.13 56.55 1iei s LEU 72 Cb 0.14 -4.59 0.12 0.00 0.02 0.00 0.00 46.19 41.88 1iei s LEU 72 CO 0.81 -2.20 0.18 0.12 0.02 0.00 0.00 176.35 175.28 1iei s PHE 73 N -1.93 1.48 -0.11 0.29 2.19 0.11 -4.98 117.98 115.03 1iei s PHE 73 Ca 0.75 -1.92 -0.27 0.00 0.33 0.00 0.00 56.93 55.81 1iei s PHE 73 Cb -0.30 -1.53 -0.02 0.00 -1.31 0.00 0.00 43.02 39.86 1iei s PHE 73 CO 0.44 -0.82 0.89 -1.50 1.83 0.00 0.00 175.22 176.06 1iei s ILE 74 N 1.01 4.87 -0.06 3.12 2.07 -1.26 -1.76 121.20 129.19 1iei s ILE 74 Ca 0.15 1.80 0.02 0.00 -1.41 0.00 0.00 60.65 61.20 1iei s ILE 74 Cb -0.22 -4.20 -0.03 0.00 0.13 0.00 0.00 42.46 38.14 1iei s ILE 74 CO -0.09 0.07 -0.09 -0.69 -1.91 0.00 0.00 174.94 172.23 1iei s VAL 75 N 1.74 3.48 0.34 4.00 1.01 -0.89 -0.67 120.40 129.42 1iei s VAL 75 Ca 0.43 -0.57 0.03 0.00 0.00 0.00 0.00 61.98 61.87 1iei s VAL 75 Cb -0.18 -2.41 -0.01 0.00 0.00 0.00 0.00 36.38 33.78 1iei s VAL 75 CO 0.17 0.59 0.38 -0.55 0.00 0.00 0.00 175.10 175.70 1iei s SER 76 N -0.80 1.37 0.01 3.32 0.15 -1.22 -1.08 113.70 115.44 1iei s SER 76 Ca 0.12 -1.65 -0.03 0.00 0.70 0.00 0.00 55.95 55.09 1iei s SER 76 Cb -0.11 0.62 -0.01 0.00 -1.71 0.00 0.00 66.02 64.81 1iei s SER 76 CO 0.01 -1.19 0.05 -0.54 1.20 0.00 0.00 173.24 172.77 1iei s LYS 77 N -3.19 0.34 -0.39 5.44 1.02 -1.25 -1.18 119.74 120.53 1iei s LYS 77 Ca 0.36 -0.42 -0.27 0.00 0.02 0.00 0.00 55.97 55.65 1iei s LYS 77 Cb 0.01 0.14 -0.07 0.00 -0.52 0.00 0.00 37.83 37.39 1iei s LYS 77 CO 0.25 -0.07 2.34 -0.11 -0.92 0.00 0.00 175.35 176.84 1iei n LEU 78 N 1.76 2.64 -4.68 3.17 0.00 0.18 -3.63 117.00 116.43 1iei n LEU 78 Ca -0.22 -0.17 -0.38 0.00 0.00 0.00 0.00 56.01 55.24 1iei n LEU 78 Cb 0.56 -1.55 0.05 0.00 0.00 0.00 0.00 43.42 42.48 1iei n LEU 78 CO 0.21 -1.17 0.78 1.87 0.00 0.00 0.00 177.39 179.08 1iei n TRP 79 N 13.89 1.63 -0.24 1.96 -0.00 -1.26 -1.24 117.44 132.17 1iei n TRP 79 Ca 0.35 0.44 0.21 0.00 -0.00 0.00 0.00 57.50 58.51 1iei n TRP 79 Cb 0.48 -2.26 0.55 0.00 -0.00 0.00 0.00 31.31 30.08 1iei n TRP 79 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1iei n THR 81 N -4.48 1.77 -2.77 0.00 -2.24 -1.25 0.40 114.28 105.71 1iei n THR 81 Ca 0.20 0.52 -0.03 0.00 -2.27 0.00 0.00 64.05 62.47 1iei n THR 81 Cb 0.76 -1.51 0.05 0.00 -2.10 0.00 0.00 70.33 67.53 1iei n THR 81 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1iei n TYR 82 N -1.64 0.90 0.30 4.78 4.01 -0.78 -4.10 117.16 120.63 1iei n TYR 82 Ca -0.00 -2.31 0.18 0.00 -0.16 0.00 0.00 57.90 55.60 1iei n TYR 82 Cb 0.02 -0.11 0.75 0.00 -0.31 0.00 0.00 39.34 39.69 1iei n TYR 82 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1iei h HIS 83 N 2.62 0.00 -0.93 -0.72 3.86 -1.68 -3.19 115.15 115.10 1iei h HIS 83 Ca -0.15 0.00 -0.69 0.00 -1.16 0.00 0.00 60.37 58.37 1iei h HIS 83 Cb 1.24 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.69 1iei h HIS 83 CO 0.45 0.00 1.36 -1.91 0.86 0.00 0.00 177.93 178.70 1iei n GLU 84 N -2.99 0.90 -0.17 2.45 4.07 -1.26 -4.60 120.64 119.03 1iei n GLU 84 Ca 0.00 0.25 0.14 0.00 -0.06 0.00 0.00 57.16 57.50 1iei n GLU 84 Cb 0.26 -2.27 0.48 0.00 -0.06 0.00 0.00 31.44 29.85 1iei n GLU 84 CO 0.00 0.00 0.00 1.57 -0.06 0.00 0.00 177.13 178.64 1iei h LYS 85 N 11.40 0.45 -0.94 5.31 2.10 -1.85 0.29 116.57 133.33 1iei h LYS 85 Ca -0.26 -0.03 0.14 0.00 -2.00 0.00 0.00 60.65 58.51 1iei h LYS 85 Cb 1.34 -0.10 -0.08 0.00 -0.90 0.00 0.00 32.23 32.49 1iei h LYS 85 CO 1.03 0.30 0.60 0.78 -2.00 0.00 0.00 179.45 180.15 1iei h GLY 86 N 0.46 1.41 1.09 0.07 0.00 -1.94 -2.50 103.07 101.66 1iei h GLY 86 Ca 0.37 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1iei h GLY 86 CO -0.12 0.09 -0.76 1.41 0.00 0.00 0.00 176.54 177.15 1iei h LEU 87 N 0.79 0.00 -0.28 3.11 3.38 -0.79 -3.40 115.31 118.12 1iei h LEU 87 Ca 0.48 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 58.34 1iei h LEU 87 Cb 0.69 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.37 1iei h LEU 87 CO -0.25 0.08 -0.54 0.58 0.09 0.00 0.00 178.44 178.40 1iei h VAL 88 N 0.00 0.00 0.00 1.22 2.07 -0.70 -2.22 116.25 116.62 1iei h VAL 88 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1iei h VAL 88 Cb 0.83 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 1iei h VAL 88 CO 0.00 0.00 0.00 1.17 0.02 0.00 0.00 177.57 178.76 1iei n LYS 89 N -5.31 0.00 0.28 1.57 3.00 -1.26 -0.31 118.16 116.13 1iei n LYS 89 Ca -0.05 0.00 0.14 0.00 -0.00 0.00 0.00 58.31 58.40 1iei n LYS 89 Cb 0.35 0.00 0.80 0.00 0.00 0.00 0.00 35.03 36.18 1iei n LYS 89 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 1iei h GLY 90 N 0.00 0.00 1.02 3.14 0.00 -1.66 -2.30 103.07 103.28 1iei h GLY 90 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.26 1iei h GLY 90 CO 0.00 0.00 0.05 0.00 0.00 0.00 0.00 176.54 176.59 1iei h ALA 91 N 1.92 0.74 0.01 3.60 0.00 -0.51 -0.58 119.26 124.42 1iei h ALA 91 Ca -0.00 -0.27 -0.20 0.00 0.00 0.00 0.00 54.91 54.44 1iei h ALA 91 Cb 0.25 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1iei h ALA 91 CO 0.01 0.51 -0.90 0.00 0.00 0.00 0.00 179.25 178.88 1iei h GLN 93 N 0.12 -0.02 0.00 0.00 4.15 -0.62 -1.61 115.11 117.13 1iei h GLN 93 Ca -0.05 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1iei h GLN 93 Cb 1.53 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.23 1iei h GLN 93 CO 0.14 0.06 0.00 1.17 -1.93 0.00 0.00 178.83 178.27 1iei n LYS 94 N -5.06 0.19 0.05 1.69 4.81 -0.36 -1.35 118.16 118.13 1iei n LYS 94 Ca -0.07 0.24 -0.17 0.00 -0.87 0.00 0.00 58.31 57.44 1iei n LYS 94 Cb 0.07 -1.76 -0.07 0.00 0.02 0.00 0.00 35.03 33.29 1iei n LYS 94 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 1iei h THR 95 N 0.00 1.33 -0.23 3.15 2.02 -1.47 -0.17 112.91 117.54 1iei h THR 95 Ca 0.00 -2.30 -0.12 0.00 0.77 0.00 0.00 66.41 64.76 1iei h THR 95 Cb 0.57 2.35 -0.00 0.00 -1.74 0.00 0.00 68.15 69.33 1iei h THR 95 CO 0.00 0.70 -0.32 -0.07 0.37 0.00 0.00 175.52 176.20 1iei h LEU 96 N 0.34 0.67 -1.72 2.58 3.38 -1.14 0.12 115.31 119.54 1iei h LEU 96 Ca -0.10 -0.51 0.37 0.00 0.09 0.00 0.00 57.88 57.73 1iei h LEU 96 Cb 1.61 -0.19 -0.08 0.00 0.09 0.00 0.00 40.66 42.09 1iei h LEU 96 CO 0.18 1.05 0.88 -1.28 0.09 0.00 0.00 178.44 179.36 1iei h SER 97 N 0.31 0.16 0.04 -0.43 0.87 -1.32 0.57 113.55 113.76 1iei h SER 97 Ca 0.02 0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.63 1iei h SER 97 Cb 0.90 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.89 1iei h SER 97 CO 0.07 -0.01 -0.02 0.44 -0.53 0.00 0.00 176.83 176.78 1iei h ASP 98 N 0.12 -0.05 -0.38 6.23 3.32 0.47 -3.23 116.42 122.91 1iei h ASP 98 Ca 0.67 -0.57 0.11 0.00 0.02 0.00 0.00 57.03 57.25 1iei h ASP 98 Cb 2.32 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 41.86 1iei h ASP 98 CO -0.16 0.70 0.33 -0.07 -1.72 0.00 0.00 179.24 178.32 1iei h LEU 99 N -0.94 0.00 2.59 1.55 -0.00 -0.73 -3.34 115.31 114.44 1iei h LEU 99 Ca -0.01 0.00 -0.38 0.00 -0.00 0.00 0.00 57.88 57.50 1iei h LEU 99 Cb 0.62 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.25 1iei h LEU 99 CO 0.01 0.00 -0.48 0.29 -0.00 0.00 0.00 178.44 178.26 1iei n LYS 100 N -4.04 -1.49 -4.32 1.13 5.02 0.20 -4.56 118.16 110.09 1iei n LYS 100 Ca 0.06 0.92 -0.27 0.00 -2.02 0.00 0.00 58.31 57.01 1iei n LYS 100 Cb 0.51 -5.46 -0.08 0.00 -0.02 0.00 0.00 35.03 29.98 1iei n LYS 100 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1iei s LEU 101 N -5.35 2.93 0.00 -0.35 1.43 -0.94 -5.01 118.68 111.39 1iei s LEU 101 Ca 0.00 -1.24 0.21 0.00 -1.03 0.00 0.00 54.13 52.07 1iei s LEU 101 Cb 0.00 -1.19 -0.10 0.00 0.03 0.00 0.00 46.19 44.93 1iei s LEU 101 CO 0.00 -0.59 0.95 -0.90 0.23 0.00 0.00 176.35 176.05 1iei n ASP 102 N -1.20 1.51 -4.03 2.29 5.68 -1.26 -4.32 116.55 115.22 1iei n ASP 102 Ca -0.04 -1.26 -0.10 0.00 -0.50 0.00 0.00 54.79 52.90 1iei n ASP 102 Cb 0.66 0.71 -0.06 0.00 -1.14 0.00 0.00 41.12 41.28 1iei n ASP 102 CO 0.00 0.00 0.00 -0.72 -1.33 0.00 0.00 177.20 175.15 1iei s TYR 103 N -2.59 0.50 0.13 2.11 1.13 -1.26 -4.69 117.35 112.67 1iei s TYR 103 Ca 0.13 -0.83 0.05 0.00 -1.41 0.00 0.00 57.07 55.00 1iei s TYR 103 Cb 0.16 0.06 -0.04 0.00 -1.10 0.00 0.00 41.96 41.04 1iei s TYR 103 CO 0.66 -0.92 -0.11 -1.17 -2.51 0.00 0.00 175.55 171.50 1iei s LEU 104 N -3.04 2.47 0.06 -3.49 0.20 -0.92 -5.01 118.68 108.95 1iei s LEU 104 Ca 0.25 -0.91 0.18 0.00 0.69 0.00 0.00 54.13 54.34 1iei s LEU 104 Cb 0.01 -0.37 -0.13 0.00 -0.43 0.00 0.00 46.19 45.26 1iei s LEU 104 CO 0.09 -0.27 0.79 0.47 -0.29 0.00 0.00 176.35 177.14 1iei n ASP 105 N 0.18 0.77 -3.35 3.68 10.43 0.16 -2.14 116.55 126.28 1iei n ASP 105 Ca -0.13 0.33 -0.06 0.00 2.57 0.00 0.00 54.79 57.50 1iei n ASP 105 Cb 0.59 0.34 -0.07 0.00 1.84 0.00 0.00 41.12 43.82 1iei n ASP 105 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 1iei s LEU 106 N -5.64 -0.80 -0.12 0.64 2.96 -1.19 -3.46 118.68 111.08 1iei s LEU 106 Ca -0.03 0.47 -0.02 0.00 -0.22 0.00 0.00 54.13 54.33 1iei s LEU 106 Cb 0.09 1.38 -0.03 0.00 0.50 0.00 0.00 46.19 48.13 1iei s LEU 106 CO 0.81 -0.28 -0.05 -0.47 -1.32 0.00 0.00 176.35 175.05 1iei s TYR 107 N 2.62 3.01 -0.05 5.38 5.04 -0.12 -3.40 117.35 129.84 1iei s TYR 107 Ca 0.13 -0.15 -0.01 0.00 -2.44 0.00 0.00 57.07 54.60 1iei s TYR 107 Cb -0.15 -1.85 -0.03 0.00 0.35 0.00 0.00 41.96 40.27 1iei s TYR 107 CO -0.17 0.14 0.01 -0.51 -1.34 0.00 0.00 175.55 173.69 1iei s LEU 108 N -0.17 3.61 -0.28 6.97 2.01 -0.32 -1.12 118.68 129.38 1iei s LEU 108 Ca 0.03 0.11 -0.24 0.00 0.01 0.00 0.00 54.13 54.04 1iei s LEU 108 Cb -0.13 -1.93 -0.00 0.00 0.01 0.00 0.00 46.19 44.14 1iei s LEU 108 CO 0.02 0.34 0.80 -0.63 1.01 0.00 0.00 176.35 177.89 1iei s ILE 109 N -0.98 4.81 0.17 -0.59 1.01 -0.76 -0.65 121.20 124.21 1iei s ILE 109 Ca 0.16 1.32 -0.14 0.00 0.00 0.00 0.00 60.65 61.99 1iei s ILE 109 Cb -0.11 -4.13 0.06 0.00 0.01 0.00 0.00 42.46 38.28 1iei s ILE 109 CO 0.06 -0.18 1.79 -0.74 0.00 0.00 0.00 174.94 175.87 1iei h HIS 110 N 7.96 0.70 -3.26 3.97 2.76 -1.48 0.12 115.15 125.91 1iei h HIS 110 Ca -0.24 -0.01 -0.49 0.00 -2.20 0.00 0.00 60.37 57.43 1iei h HIS 110 Cb 1.10 -0.23 -0.17 0.00 1.55 0.00 0.00 27.41 29.66 1iei h HIS 110 CO 0.77 0.50 -0.77 -1.58 -1.30 0.00 0.00 177.93 175.55 1iei s TRP 111 N -5.93 1.74 -0.82 5.26 0.52 -1.26 -4.16 118.94 114.29 1iei s TRP 111 Ca -0.13 -0.50 0.00 0.00 0.02 0.00 0.00 56.10 55.49 1iei s TRP 111 Cb 0.12 -0.86 0.00 0.00 -1.15 0.00 0.00 33.47 31.58 1iei s TRP 111 CO 0.75 0.31 0.08 -2.30 0.02 0.00 0.00 176.95 175.82 1iei n PRO 112 N 0.20 0.14 -3.56 4.98 -0.02 -1.26 -4.76 135.00 130.72 1iei n PRO 112 Ca -0.12 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.15 1iei n PRO 112 Cb 0.58 -1.14 -0.15 0.00 -0.02 0.00 0.00 33.50 32.77 1iei n PRO 112 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1iei s THR 113 N -0.66 -0.24 -0.40 3.45 2.01 -1.26 -4.63 115.64 113.90 1iei s THR 113 Ca 0.00 -0.02 -0.23 0.00 0.31 0.00 0.00 61.69 61.75 1iei s THR 113 Cb 0.00 -0.56 0.02 0.00 0.01 0.00 0.00 72.50 71.96 1iei s THR 113 CO 0.00 -0.15 0.77 -0.83 -0.69 0.00 0.00 174.62 173.73 1iei s GLY 114 N 2.27 1.64 0.38 4.40 0.00 -1.26 -4.45 107.32 110.29 1iei s GLY 114 Ca 0.05 -0.82 0.06 0.00 0.00 0.00 0.00 44.72 44.00 1iei s GLY 114 CO -0.10 1.75 0.03 -0.11 0.00 0.00 0.00 173.10 174.67 1iei s PHE 115 N 3.16 2.31 -0.04 1.90 -0.00 0.16 -1.45 117.98 124.02 1iei s PHE 115 Ca 0.30 -0.77 -0.30 0.00 -0.00 0.00 0.00 56.93 56.16 1iei s PHE 115 Cb -0.13 -1.58 -0.05 0.00 -0.00 0.00 0.00 43.02 41.25 1iei s PHE 115 CO 0.19 0.29 1.54 -1.59 -0.00 0.00 0.00 175.22 175.65 1iei s LYS 116 N -3.78 4.21 -0.22 1.99 -2.85 -0.94 -3.83 119.74 114.33 1iei s LYS 116 Ca 0.35 2.09 -0.35 0.00 -1.00 0.00 0.00 55.97 57.07 1iei s LYS 116 Cb 0.09 -3.80 -0.12 0.00 -2.06 0.00 0.00 37.83 31.95 1iei s LYS 116 CO 0.17 -0.75 2.00 -0.35 0.10 0.00 0.00 175.35 176.52 1iei n PRO 117 N 6.41 1.63 -1.34 1.78 -0.04 -1.26 -4.74 135.00 137.44 1iei n PRO 117 Ca 0.16 0.54 0.00 0.00 -0.04 0.00 0.00 63.50 64.16 1iei n PRO 117 Cb 0.43 -2.55 0.00 0.00 -0.04 0.00 0.00 33.50 31.34 1iei n PRO 117 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1iei n GLY 118 N 5.21 1.14 0.31 0.55 0.00 -1.26 -5.05 105.19 106.10 1iei n GLY 118 Ca 0.30 -0.85 -0.12 0.00 0.00 0.00 0.00 46.02 45.35 1iei n GLY 118 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1iei h LYS 119 N 0.00 -0.42 -5.50 1.61 3.11 -2.00 -3.40 116.57 109.98 1iei h LYS 119 Ca 0.00 0.03 -0.49 0.00 -2.81 0.00 0.00 60.65 57.38 1iei h LYS 119 Cb 0.00 0.09 -0.02 0.00 -1.00 0.00 0.00 32.23 31.31 1iei h LYS 119 CO 0.00 -0.28 1.65 0.39 -2.81 0.00 0.00 179.45 178.40 1iei n GLU 120 N -5.40 0.84 0.00 1.90 -0.58 -1.26 -4.87 120.64 111.28 1iei n GLU 120 Ca -0.05 0.03 0.00 0.00 -0.42 0.00 0.00 57.16 56.72 1iei n GLU 120 Cb 0.31 -2.94 0.00 0.00 -0.57 0.00 0.00 31.44 28.24 1iei n GLU 120 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 1iei n PHE 121 N 14.20 0.00 -3.06 -0.32 3.72 -1.26 -3.75 117.46 126.98 1iei n PHE 121 Ca 0.44 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.84 1iei n PHE 121 Cb 0.41 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.94 1iei n PHE 121 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1iei s PHE 122 N -1.22 -1.39 -0.13 1.38 0.40 -1.26 -4.92 117.98 110.84 1iei s PHE 122 Ca 0.00 0.14 -0.26 0.00 -0.60 0.00 0.00 56.93 56.21 1iei s PHE 122 Cb 0.00 0.26 -0.02 0.00 0.51 0.00 0.00 43.02 43.77 1iei s PHE 122 CO 0.00 -0.96 0.87 -1.25 0.70 0.00 0.00 175.22 174.58 1iei s PRO 123 N 1.77 4.36 0.05 0.24 0.04 -1.25 -5.01 135.00 135.21 1iei s PRO 123 Ca 0.17 1.11 0.03 0.00 0.04 0.00 0.00 61.00 62.35 1iei s PRO 123 Cb -0.02 -3.54 -0.04 0.00 0.04 0.00 0.00 34.50 30.94 1iei s PRO 123 CO -0.09 -0.26 0.04 -0.51 0.04 0.00 0.00 177.00 176.23 1iei s LEU 124 N 1.88 3.67 0.11 -3.56 1.43 -1.26 -1.59 118.68 119.36 1iei s LEU 124 Ca 0.41 -0.03 0.07 0.00 -1.03 0.00 0.00 54.13 53.55 1iei s LEU 124 Cb -0.17 -2.28 0.41 0.00 0.03 0.00 0.00 46.19 44.17 1iei s LEU 124 CO 0.15 0.21 0.47 -0.67 0.23 0.00 0.00 176.35 176.74 1iei n ASP 125 N 0.80 0.10 0.00 2.29 2.03 0.32 -4.76 116.55 117.33 1iei n ASP 125 Ca -0.11 0.48 0.00 0.00 0.52 0.00 0.00 54.79 55.68 1iei n ASP 125 Cb 0.52 -0.23 0.00 0.00 -0.72 0.00 0.00 41.12 40.69 1iei n ASP 125 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1iei n GLU 126 N -3.61 0.00 0.00 -0.67 -0.58 -1.26 -4.88 120.64 109.63 1iei n GLU 126 Ca 0.11 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.85 1iei n GLU 126 Cb 0.39 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.26 1iei n GLU 126 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1iei n SER 127 N 1.35 0.00 0.07 1.62 7.64 -1.26 -5.13 113.62 117.91 1iei n SER 127 Ca 0.00 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.83 1iei n SER 127 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 1iei n SER 127 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1iei h GLY 128 N 0.00 -0.97 -1.59 0.23 0.00 -1.98 -3.49 103.07 95.27 1iei h GLY 128 Ca 0.00 0.44 -0.49 0.00 0.00 0.00 0.00 47.33 47.28 1iei h GLY 128 CO 0.00 -0.33 0.38 0.21 0.00 0.00 0.00 176.54 176.80 1iei s ASN 129 N -2.92 6.08 0.13 0.19 3.84 -1.26 -4.47 114.94 116.53 1iei s ASN 129 Ca -0.05 1.62 -0.35 0.00 0.21 0.00 0.00 52.86 54.29 1iei s ASN 129 Cb 0.01 -2.51 -0.16 0.00 -0.55 0.00 0.00 41.25 38.05 1iei s ASN 129 CO 0.17 -0.97 1.37 0.52 -2.79 0.00 0.00 177.10 175.40 1iei n VAL 130 N -2.21 0.24 -1.71 -5.21 0.31 0.25 0.12 118.33 110.12 1iei n VAL 130 Ca 0.07 -0.06 -0.39 0.00 -0.01 0.00 0.00 64.34 63.95 1iei n VAL 130 Cb 0.54 -1.04 -0.03 0.00 -0.91 0.00 0.00 33.84 32.40 1iei n VAL 130 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1iei s VAL 131 N 0.41 3.12 0.00 2.52 1.01 -0.62 -4.81 120.40 122.03 1iei s VAL 131 Ca 0.80 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.88 1iei s VAL 131 Cb -0.85 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 32.29 1iei s VAL 131 CO 0.46 -0.20 0.00 -0.81 0.00 0.00 0.00 175.10 174.55 1iei n PRO 132 N 8.89 0.07 -4.15 2.72 -0.04 -1.26 -2.20 135.00 139.02 1iei n PRO 132 Ca 0.30 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.61 1iei n PRO 132 Cb 0.50 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.83 1iei n PRO 132 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1iei s SER 133 N -1.00 0.72 0.14 3.54 1.04 -0.53 -3.36 113.70 114.25 1iei s SER 133 Ca 0.00 -0.22 0.23 0.00 0.48 0.00 0.00 55.95 56.43 1iei s SER 133 Cb 0.00 -0.04 0.89 0.00 0.10 0.00 0.00 66.02 66.97 1iei s SER 133 CO 0.00 -0.00 1.69 -0.67 0.98 0.00 0.00 173.24 175.24 1iei n ASP 134 N 2.54 0.42 -2.42 7.02 -0.08 -1.26 -4.78 116.55 117.99 1iei n ASP 134 Ca -0.16 0.58 0.00 0.00 -1.51 0.00 0.00 54.79 53.70 1iei n ASP 134 Cb 0.57 -0.68 0.00 0.00 2.34 0.00 0.00 41.12 43.35 1iei n ASP 134 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 1iei n THR 135 N -1.94 0.00 -3.76 5.18 -2.24 -1.26 -4.99 114.28 105.27 1iei n THR 135 Ca 0.04 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.69 1iei n THR 135 Cb 0.27 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.38 1iei n THR 135 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1iei s ASN 136 N -0.65 -0.26 0.00 3.42 3.84 -1.26 -5.03 114.94 114.99 1iei s ASN 136 Ca 0.00 0.51 0.00 0.00 0.21 0.00 0.00 52.86 53.58 1iei s ASN 136 Cb 0.00 0.46 0.00 0.00 -0.55 0.00 0.00 41.25 41.16 1iei s ASN 136 CO 0.00 -0.13 0.69 -0.38 -2.79 0.00 0.00 177.10 174.49 1iei n ILE 137 N 3.61 0.00 0.29 -5.21 2.08 -1.26 -2.34 119.36 116.53 1iei n ILE 137 Ca -0.19 1.19 0.16 0.00 0.56 0.00 0.00 62.75 64.46 1iei n ILE 137 Cb 0.56 -1.71 0.58 0.00 -0.75 0.00 0.00 39.64 38.32 1iei n ILE 137 CO 0.00 0.00 0.00 0.17 0.56 0.00 0.00 176.55 177.28 1iei h LEU 138 N 0.00 0.00 -1.67 1.39 8.10 -1.94 -2.15 115.31 119.04 1iei h LEU 138 Ca 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.97 1iei h LEU 138 Cb 0.00 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.21 1iei h LEU 138 CO 0.00 0.00 0.03 0.47 -4.11 0.00 0.00 178.44 174.83 1iei n ASP 139 N -3.01 2.15 0.00 0.17 8.00 -0.99 -2.92 116.55 119.96 1iei n ASP 139 Ca 0.01 -2.18 0.00 0.00 0.71 0.00 0.00 54.79 53.33 1iei n ASP 139 Cb 0.34 -0.54 0.00 0.00 -0.02 0.00 0.00 41.12 40.90 1iei n ASP 139 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1iei n THR 140 N 0.14 0.00 -0.24 -3.53 -2.24 -0.99 -4.46 114.28 102.95 1iei n THR 140 Ca 0.06 0.00 0.30 0.00 -2.27 0.00 0.00 64.05 62.14 1iei n THR 140 Cb 0.49 0.00 0.72 0.00 -2.10 0.00 0.00 70.33 69.43 1iei n THR 140 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 175.07 174.25 1iei h TRP 141 N 0.00 0.05 0.20 4.78 -0.00 -1.38 -3.10 115.95 116.51 1iei h TRP 141 Ca 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 58.89 58.55 1iei h TRP 141 Cb 0.00 -0.02 0.02 0.00 -0.00 0.00 0.00 29.16 29.16 1iei h TRP 141 CO 0.00 0.01 -1.62 0.00 -0.00 0.00 0.00 178.44 176.83 1iei h ALA 142 N 1.50 0.05 0.00 2.65 0.00 -1.75 -2.13 119.26 119.59 1iei h ALA 142 Ca 0.49 -1.03 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1iei h ALA 142 Cb 1.89 0.32 0.00 0.00 0.00 0.00 0.00 17.79 20.00 1iei h ALA 142 CO -0.03 0.92 0.11 0.00 0.00 0.00 0.00 179.25 180.25 1iei h ALA 143 N 0.19 1.11 -0.01 0.00 0.00 -1.76 0.14 119.26 118.92 1iei h ALA 143 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1iei h ALA 143 Cb 2.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.90 1iei h ALA 143 CO 0.21 -0.11 -0.11 0.00 0.00 0.00 0.00 179.25 179.25 1iei n MET 144 N -2.96 1.29 0.05 0.00 -0.00 -1.21 -3.48 117.12 110.81 1iei n MET 144 Ca -0.03 -1.05 -0.04 0.00 -0.00 0.00 0.00 57.70 56.58 1iei n MET 144 Cb 0.17 -1.22 0.17 0.00 -0.00 0.00 0.00 33.22 32.34 1iei n MET 144 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 1iei h GLU 145 N 2.12 0.39 -0.62 3.17 5.08 -0.11 -3.21 114.58 121.39 1iei h GLU 145 Ca 0.00 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.15 1iei h GLU 145 Cb 0.50 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 1iei h GLU 145 CO 0.00 0.73 0.30 0.93 -1.00 0.00 0.00 179.01 179.96 1iei h GLU 146 N 0.32 0.90 -0.40 2.33 3.07 -1.11 -1.77 114.58 117.92 1iei h GLU 146 Ca 0.03 -0.13 0.12 0.00 -0.50 0.00 0.00 59.36 58.87 1iei h GLU 146 Cb 0.84 -0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 28.58 1iei h GLU 146 CO 0.07 0.72 0.36 -0.07 -1.40 0.00 0.00 179.01 178.69 1iei h LEU 147 N 0.86 0.00 0.00 1.33 3.38 -1.61 0.85 115.31 120.12 1iei h LEU 147 Ca 0.21 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 1iei h LEU 147 Cb 0.12 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 1iei h LEU 147 CO -0.03 0.00 -0.06 0.58 0.09 0.00 0.00 178.44 179.02 1iei h VAL 148 N 0.00 0.86 -0.91 1.22 2.07 -1.34 -2.77 116.25 115.39 1iei h VAL 148 Ca 0.19 -1.66 0.19 0.00 0.82 0.00 0.00 66.70 66.23 1iei h VAL 148 Cb 0.91 1.65 -0.17 0.00 -1.52 0.00 0.00 31.29 32.15 1iei h VAL 148 CO -0.00 0.29 -0.21 0.47 0.02 0.00 0.00 177.57 178.14 1iei n ASP 149 N -4.68 -0.31 0.00 0.57 8.00 -0.97 0.42 116.55 119.57 1iei n ASP 149 Ca -0.06 1.56 0.09 0.00 0.71 0.00 0.00 54.79 57.09 1iei n ASP 149 Cb 0.26 -0.48 0.52 0.00 -0.02 0.00 0.00 41.12 41.39 1iei n ASP 149 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1iei n GLU 150 N -5.47 0.83 0.00 -1.24 1.02 0.28 -4.93 120.64 111.13 1iei n GLU 150 Ca 0.15 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.29 1iei n GLU 150 Cb 0.48 -1.33 0.00 0.00 -0.02 0.00 0.00 31.44 30.57 1iei n GLU 150 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1iei n GLY 151 N 0.55 3.10 0.29 0.62 0.00 0.17 -4.89 105.19 105.03 1iei n GLY 151 Ca 0.13 -0.87 0.28 0.00 0.00 0.00 0.00 46.02 45.56 1iei n GLY 151 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1iei n LEU 152 N 0.00 0.27 -3.72 0.99 4.77 -1.20 -4.58 117.00 113.52 1iei n LEU 152 Ca 0.00 1.33 -0.14 0.00 -0.03 0.00 0.00 56.01 57.17 1iei n LEU 152 Cb 0.00 -0.65 -0.15 0.00 -2.33 0.00 0.00 43.42 40.29 1iei n LEU 152 CO 0.00 -1.49 -0.23 -0.69 -1.33 0.00 0.00 177.39 173.66 1iei s VAL 153 N -5.20 -0.11 -1.47 4.08 1.01 -1.05 -2.16 120.40 115.49 1iei s VAL 153 Ca -0.07 0.23 0.19 0.00 0.00 0.00 0.00 61.98 62.33 1iei s VAL 153 Cb 0.28 -0.26 0.35 0.00 0.00 0.00 0.00 36.38 36.75 1iei s VAL 153 CO 0.66 0.10 1.60 0.29 0.00 0.00 0.00 175.10 177.74 1iei n LYS 154 N 4.54 0.30 0.00 2.72 4.76 -0.91 -4.34 118.16 125.23 1iei n LYS 154 Ca -0.20 0.10 0.00 0.00 -2.87 0.00 0.00 58.31 55.34 1iei n LYS 154 Cb 0.51 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.20 1iei n LYS 154 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1iei n ALA 155 N -1.27 0.00 -3.43 7.82 0.00 -1.22 -4.98 120.51 117.43 1iei n ALA 155 Ca 0.10 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.38 1iei n ALA 155 Cb 0.15 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.53 1iei n ALA 155 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1iei s ILE 156 N -2.00 0.02 0.00 0.00 -5.25 -1.26 -0.94 121.20 111.76 1iei s ILE 156 Ca 0.00 -0.14 0.00 0.00 -0.99 0.00 0.00 60.65 59.52 1iei s ILE 156 Cb 0.00 -0.84 0.00 0.00 2.95 0.00 0.00 42.46 44.57 1iei s ILE 156 CO 0.00 -0.08 0.00 0.61 -1.79 0.00 0.00 174.94 173.68 1iei n GLY 157 N 1.40 1.98 3.09 6.27 0.00 -0.28 -0.57 105.19 117.10 1iei n GLY 157 Ca -0.19 -0.57 -0.29 0.00 0.00 0.00 0.00 46.02 44.97 1iei n GLY 157 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1iei s ILE 158 N -2.01 1.61 -0.32 -0.61 -4.36 0.32 -1.82 121.20 114.01 1iei s ILE 158 Ca 0.00 -0.72 -0.16 0.00 -0.26 0.00 0.00 60.65 59.50 1iei s ILE 158 Cb 0.00 -1.45 -0.02 0.00 1.25 0.00 0.00 42.46 42.25 1iei s ILE 158 CO 0.00 0.46 0.44 -0.55 0.24 0.00 0.00 174.94 175.53 1iei s SER 159 N 0.81 6.27 -0.34 4.36 0.15 0.40 -1.13 113.70 124.22 1iei s SER 159 Ca -0.10 0.03 -0.21 0.00 0.70 0.00 0.00 55.95 56.37 1iei s SER 159 Cb -0.16 -2.23 0.03 0.00 -1.71 0.00 0.00 66.02 61.95 1iei s SER 159 CO 0.01 -0.35 0.44 -0.46 1.20 0.00 0.00 173.24 174.08 1iei n ASN 160 N 5.52 -6.68 0.00 5.45 0.23 -0.18 -3.98 115.26 115.63 1iei n ASN 160 Ca -0.07 0.33 0.00 0.00 -0.53 0.00 0.00 54.58 54.31 1iei n ASN 160 Cb 0.49 -3.10 0.00 0.00 -2.08 0.00 0.00 39.78 35.10 1iei n ASN 160 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1iei n PHE 161 N 0.17 0.00 -3.02 -2.53 3.01 -1.26 -4.49 117.46 109.34 1iei n PHE 161 Ca -0.00 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.27 1iei n PHE 161 Cb 0.51 0.00 0.04 0.00 -0.01 0.00 0.00 39.48 40.02 1iei n PHE 161 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1iei s ASN 162 N 0.00 5.30 0.07 4.37 2.20 -1.26 -4.74 114.94 120.87 1iei s ASN 162 Ca 0.00 -0.68 -0.25 0.00 -0.94 0.00 0.00 52.86 50.99 1iei s ASN 162 Cb 0.00 -0.05 -0.11 0.00 -2.00 0.00 0.00 41.25 39.09 1iei s ASN 162 CO 0.00 -1.14 1.39 1.12 -2.94 0.00 0.00 177.10 175.53 1iei h HIS 163 N 0.33 -1.06 0.00 1.54 2.07 -1.67 0.94 115.15 117.31 1iei h HIS 163 Ca -0.34 0.02 0.00 0.00 -2.85 0.00 0.00 60.37 57.21 1iei h HIS 163 Cb 1.29 0.44 0.00 0.00 2.57 0.00 0.00 27.41 31.70 1iei h HIS 163 CO 0.41 -0.44 0.00 1.28 -3.07 0.00 0.00 177.93 176.11 1iei n LEU 164 N -4.58 0.00 0.07 6.12 4.32 -1.26 -0.30 117.00 121.38 1iei n LEU 164 Ca -0.07 0.00 -0.09 0.00 -0.02 0.00 0.00 56.01 55.83 1iei n LEU 164 Cb 0.30 0.00 0.02 0.00 -1.62 0.00 0.00 43.42 42.13 1iei n LEU 164 CO 0.14 0.00 0.31 1.56 -1.22 0.00 0.00 177.39 178.18 1iei h GLN 165 N 0.00 0.28 0.18 3.23 4.20 0.48 -2.20 115.11 121.29 1iei h GLN 165 Ca 0.00 -0.26 0.01 0.00 0.06 0.00 0.00 58.65 58.47 1iei h GLN 165 Cb 0.00 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.81 1iei h GLN 165 CO 0.00 0.94 -0.36 0.28 -0.67 0.00 0.00 178.83 179.01 1iei h VAL 166 N 0.18 0.25 0.00 -0.54 2.07 -0.67 -3.20 116.25 114.34 1iei h VAL 166 Ca -0.04 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 1iei h VAL 166 Cb 1.38 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 31.40 1iei h VAL 166 CO 0.13 0.00 -0.02 1.05 0.02 0.00 0.00 177.57 178.75 1iei h GLU 167 N -0.63 0.00 0.54 1.57 4.11 -0.41 -2.09 114.58 117.67 1iei h GLU 167 Ca 0.01 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.42 1iei h GLU 167 Cb 0.64 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.89 1iei h GLU 167 CO -0.17 0.02 -0.26 0.52 0.07 0.00 0.00 179.01 179.18 1iei h MET 168 N 0.00 -0.70 -0.77 1.06 2.86 -1.46 -3.17 114.93 112.74 1iei h MET 168 Ca -0.00 0.05 0.12 0.00 -2.06 0.00 0.00 59.70 57.81 1iei h MET 168 Cb 0.25 0.16 -0.05 0.00 0.06 0.00 0.00 31.60 32.01 1iei h MET 168 CO 0.00 -0.40 0.51 0.82 1.06 0.00 0.00 176.91 178.90 1iei h ILE 169 N -1.02 0.87 -0.00 -1.22 2.04 -1.37 -1.60 117.51 115.20 1iei h ILE 169 Ca -0.07 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.58 1iei h ILE 169 Cb 0.63 0.24 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 1iei h ILE 169 CO 0.12 0.11 -0.25 0.00 0.00 0.00 0.00 178.15 178.13 1iei n LEU 170 N -4.50 0.57 -0.34 1.44 -0.00 -1.08 -3.00 117.00 110.08 1iei n LEU 170 Ca 0.14 -0.00 0.13 0.00 -0.00 0.00 0.00 56.01 56.27 1iei n LEU 170 Cb 0.42 -0.23 0.33 0.00 -0.00 0.00 0.00 43.42 43.94 1iei n LEU 170 CO 0.32 0.11 0.63 0.59 -0.00 0.00 0.00 177.39 179.04 1iei n ASN 171 N -1.10 1.31 -4.72 1.45 4.13 -0.68 -4.96 115.26 110.69 1iei n ASN 171 Ca 0.10 -1.11 -0.42 0.00 1.68 0.00 0.00 54.58 54.83 1iei n ASN 171 Cb 0.32 0.16 -0.03 0.00 -1.54 0.00 0.00 39.78 38.70 1iei n ASN 171 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1iei s LYS 172 N -2.41 4.15 0.63 3.52 2.20 -0.73 -4.96 119.74 122.14 1iei s LYS 172 Ca 0.26 2.55 -0.16 0.00 -0.36 0.00 0.00 55.97 58.25 1iei s LYS 172 Cb 0.19 -3.10 -0.01 0.00 -1.51 0.00 0.00 37.83 33.40 1iei s LYS 172 CO 0.49 -0.72 1.11 -2.14 -0.36 0.00 0.00 175.35 173.74 1iei s PRO 173 N 1.17 2.93 -0.43 4.03 0.02 -1.26 -2.87 135.00 138.59 1iei s PRO 173 Ca 0.74 1.44 0.00 0.00 0.02 0.00 0.00 61.00 63.19 1iei s PRO 173 Cb -0.48 -1.96 0.00 0.00 0.02 0.00 0.00 34.50 32.07 1iei s PRO 173 CO 0.32 -1.15 0.00 0.41 -0.33 0.00 0.00 177.00 176.24 1iei n GLY 174 N -0.37 0.69 3.55 0.52 0.00 -1.26 -4.86 105.19 103.47 1iei n GLY 174 Ca 0.11 -0.56 -0.31 0.00 0.00 0.00 0.00 46.02 45.25 1iei n GLY 174 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1iei s LEU 175 N -0.93 3.22 0.27 0.99 1.98 -1.14 -4.81 118.68 118.26 1iei s LEU 175 Ca 0.00 0.13 0.03 0.00 -2.89 0.00 0.00 54.13 51.40 1iei s LEU 175 Cb 0.00 -2.54 0.39 0.00 0.66 0.00 0.00 46.19 44.70 1iei s LEU 175 CO 0.00 -2.76 1.68 0.11 -1.89 0.00 0.00 176.35 173.49 1iei h LYS 176 N 14.39 0.40 -5.06 1.98 1.57 -1.92 -3.46 116.57 124.47 1iei h LYS 176 Ca -0.12 -0.18 -0.43 0.00 -1.87 0.00 0.00 60.65 58.05 1iei h LYS 176 Cb 1.11 -0.01 -0.28 0.00 0.08 0.00 0.00 32.23 33.14 1iei h LYS 176 CO 1.18 0.70 -0.79 0.71 -0.57 0.00 0.00 179.45 180.68 1iei s TYR 177 N -4.30 1.06 -0.05 -1.35 2.02 -1.26 -5.15 117.35 108.33 1iei s TYR 177 Ca -0.06 -0.24 -0.13 0.00 -0.37 0.00 0.00 57.07 56.27 1iei s TYR 177 Cb 0.13 -0.67 -0.05 0.00 -0.40 0.00 0.00 41.96 40.97 1iei s TYR 177 CO 0.79 -0.01 0.32 0.21 -1.57 0.00 0.00 175.55 175.30 1iei s LYS 178 N -0.53 3.81 0.23 -0.62 2.20 -1.26 -5.02 119.74 118.56 1iei s LYS 178 Ca 0.03 0.24 -0.31 0.00 -0.36 0.00 0.00 55.97 55.57 1iei s LYS 178 Cb -0.05 -3.23 -0.11 0.00 -1.51 0.00 0.00 37.83 32.93 1iei s LYS 178 CO 0.00 0.67 1.56 -1.25 -0.36 0.00 0.00 175.35 175.97 1iei s PRO 179 N -0.92 4.19 -0.03 4.03 0.04 -1.26 -4.74 135.00 136.31 1iei s PRO 179 Ca 0.21 2.44 -0.23 0.00 0.04 0.00 0.00 61.00 63.46 1iei s PRO 179 Cb -0.15 -3.09 -0.16 0.00 0.04 0.00 0.00 34.50 31.14 1iei s PRO 179 CO 0.10 -0.58 1.04 0.00 0.04 0.00 0.00 177.00 177.60 1iei h ALA 180 N 5.69 -0.29 -3.44 8.56 0.00 -1.23 -3.44 119.26 125.12 1iei h ALA 180 Ca -0.45 -0.21 -0.31 0.00 0.00 0.00 0.00 54.91 53.94 1iei h ALA 180 Cb 1.21 0.11 -0.24 0.00 0.00 0.00 0.00 17.79 18.88 1iei h ALA 180 CO 0.84 -0.41 -0.75 0.54 0.00 0.00 0.00 179.25 179.48 1iei s VAL 181 N -3.96 0.57 -0.57 0.00 0.11 -1.26 -0.27 120.40 115.02 1iei s VAL 181 Ca -0.13 -0.83 -0.03 0.00 -2.93 0.00 0.00 61.98 58.05 1iei s VAL 181 Cb 0.01 -0.58 0.15 0.00 -1.53 0.00 0.00 36.38 34.43 1iei s VAL 181 CO 0.51 -0.20 0.38 0.21 -3.33 0.00 0.00 175.10 172.67 1iei s ASN 182 N -1.13 5.29 -0.64 3.54 3.04 0.29 -0.52 114.94 124.81 1iei s ASN 182 Ca -0.05 -2.61 -0.26 0.00 0.04 0.00 0.00 52.86 49.97 1iei s ASN 182 Cb -0.08 -1.86 -0.02 0.00 -1.54 0.00 0.00 41.25 37.75 1iei s ASN 182 CO 0.00 -0.43 1.86 -1.58 -3.04 0.00 0.00 177.10 173.91 1iei s GLN 183 N 0.29 2.63 0.28 0.43 0.74 -0.29 -3.38 119.66 120.37 1iei s GLN 183 Ca 0.14 0.52 0.08 0.00 0.05 0.00 0.00 55.36 56.15 1iei s GLN 183 Cb -0.21 -4.44 -0.04 0.00 1.10 0.00 0.00 33.01 29.43 1iei s GLN 183 CO -0.04 -2.77 0.15 0.96 -0.55 0.00 0.00 175.29 173.04 1iei s ILE 184 N 9.10 3.88 0.11 -2.34 -4.36 -0.86 -1.01 121.20 125.72 1iei s ILE 184 Ca 0.67 -1.56 -0.29 0.00 -0.26 0.00 0.00 60.65 59.21 1iei s ILE 184 Cb -0.12 -3.18 -0.06 0.00 1.25 0.00 0.00 42.46 40.35 1iei s ILE 184 CO 0.19 -0.31 0.92 -1.83 0.24 0.00 0.00 174.94 174.15 1iei s GLU 185 N -3.82 4.67 0.17 0.37 -1.05 -1.26 0.15 118.70 117.92 1iei s GLU 185 Ca 0.34 1.38 -0.10 0.00 -0.15 0.00 0.00 54.97 56.44 1iei s GLU 185 Cb -0.07 -3.37 -0.00 0.00 -0.44 0.00 0.00 34.13 30.26 1iei s GLU 185 CO 0.24 0.26 0.32 0.00 0.95 0.00 0.00 175.26 177.02 1iei n HIS 187 N -0.23 0.00 0.31 0.00 1.44 -1.18 -4.21 115.22 111.34 1iei n HIS 187 Ca -0.08 0.00 0.19 0.00 -2.01 0.00 0.00 57.72 55.82 1iei n HIS 187 Cb 0.63 0.00 1.06 0.00 0.12 0.00 0.00 29.99 31.80 1iei n HIS 187 CO 0.00 0.00 0.00 -1.35 -2.81 0.00 0.00 176.34 172.18 1iei h PRO 188 N 0.00 0.00 -0.54 -1.40 0.11 -1.88 -2.87 132.00 125.42 1iei h PRO 188 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1iei h PRO 188 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1iei h PRO 188 CO 0.00 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.45 1iei n TYR 189 N -3.48 1.21 -3.85 0.65 4.01 -1.26 -2.15 117.16 112.30 1iei n TYR 189 Ca -0.03 -0.63 -0.27 0.00 -0.16 0.00 0.00 57.90 56.81 1iei n TYR 189 Cb 0.09 -0.21 -0.17 0.00 -0.31 0.00 0.00 39.34 38.74 1iei n TYR 189 CO 0.00 0.00 0.00 -0.48 -0.46 0.00 0.00 176.86 175.92 1iei s LEU 190 N -1.84 1.39 0.24 7.72 2.34 -1.08 0.01 118.68 127.46 1iei s LEU 190 Ca 0.45 -0.60 0.14 0.00 0.06 0.00 0.00 54.13 54.18 1iei s LEU 190 Cb 0.29 -0.79 0.02 0.00 -0.56 0.00 0.00 46.19 45.15 1iei s LEU 190 CO 0.21 -0.21 1.37 0.71 -1.06 0.00 0.00 176.35 177.37 1iei h THR 191 N 6.39 0.90 -6.98 5.48 1.35 -1.78 -3.13 112.91 115.15 1iei h THR 191 Ca -0.22 -2.30 -0.60 0.00 -0.55 0.00 0.00 66.41 62.74 1iei h THR 191 Cb 1.11 2.42 -0.02 0.00 -1.73 0.00 0.00 68.15 69.94 1iei h THR 191 CO 0.37 0.51 -1.01 0.00 -0.25 0.00 0.00 175.52 175.14 1iei n GLN 192 N -3.20 -0.25 -0.32 4.72 6.02 -1.26 -4.85 117.38 118.25 1iei n GLN 192 Ca 0.01 0.07 0.18 0.00 -0.01 0.00 0.00 57.00 57.25 1iei n GLN 192 Cb 0.76 -2.37 0.37 0.00 1.02 0.00 0.00 30.24 30.02 1iei n GLN 192 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1iei h GLU 193 N -2.52 0.23 0.08 -1.09 5.08 -1.98 -0.49 114.58 113.89 1iei h GLU 193 Ca -0.71 -0.01 -0.26 0.00 -1.00 0.00 0.00 59.36 57.38 1iei h GLU 193 Cb 1.39 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 1iei h GLU 193 CO 0.51 0.15 -1.23 0.87 -1.00 0.00 0.00 179.01 178.31 1iei h LYS 194 N 0.24 0.16 -0.15 2.33 6.56 -1.98 -2.81 116.57 120.92 1iei h LYS 194 Ca 0.64 -0.28 0.00 0.00 -1.06 0.00 0.00 60.65 59.94 1iei h LYS 194 Cb 1.37 0.10 0.00 0.00 -0.57 0.00 0.00 32.23 33.13 1iei h LYS 194 CO -0.65 1.09 0.00 -0.11 -2.06 0.00 0.00 179.45 177.72 1iei n LEU 195 N -3.43 1.31 -0.11 2.94 0.00 -1.11 -2.28 117.00 114.32 1iei n LEU 195 Ca -0.07 -0.57 -0.09 0.00 0.00 0.00 0.00 56.01 55.28 1iei n LEU 195 Cb 1.00 -0.10 -0.07 0.00 0.00 0.00 0.00 43.42 44.26 1iei n LEU 195 CO 0.51 0.28 0.50 0.40 0.00 0.00 0.00 177.39 179.08 1iei h ILE 196 N 1.69 0.00 -0.62 1.96 1.08 -0.82 -3.25 117.51 117.55 1iei h ILE 196 Ca 0.00 0.00 -0.35 0.00 -0.39 0.00 0.00 64.86 64.12 1iei h ILE 196 Cb 0.37 0.00 -0.19 0.00 -3.07 0.00 0.00 36.82 33.93 1iei h ILE 196 CO 0.00 0.00 0.45 0.00 -0.69 0.00 0.00 178.15 177.91 1iei n GLN 197 N -4.50 1.86 0.00 2.37 3.00 -0.97 -3.06 117.38 116.09 1iei n GLN 197 Ca -0.02 -1.93 0.00 0.00 -0.01 0.00 0.00 57.00 55.04 1iei n GLN 197 Cb 0.22 -1.76 0.00 0.00 0.00 0.00 0.00 30.24 28.71 1iei n GLN 197 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.06 178.04 1iei n TYR 198 N -0.36 0.00 -1.11 1.08 9.36 -1.10 -4.62 117.16 120.41 1iei n TYR 198 Ca 0.38 -0.20 0.10 0.00 3.32 0.00 0.00 57.90 61.50 1iei n TYR 198 Cb 1.03 -0.02 0.14 0.00 -0.63 0.00 0.00 39.34 39.86 1iei n TYR 198 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1iei n GLN 200 N -1.39 0.00 0.00 0.00 7.27 -1.01 -2.92 117.38 119.33 1iei n GLN 200 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.23 1iei n GLN 200 Cb 0.64 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.29 1iei n GLN 200 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 1iei n SER 201 N 0.00 0.00 -0.26 1.69 3.41 -1.26 -3.87 113.62 113.33 1iei n SER 201 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1iei n SER 201 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1iei n SER 201 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1iei n LYS 202 N 0.00 0.00 -2.75 4.33 5.02 -1.26 -5.00 118.16 118.50 1iei n LYS 202 Ca 0.00 0.11 -0.19 0.00 -2.02 0.00 0.00 58.31 56.21 1iei n LYS 202 Cb 0.00 -0.15 -0.00 0.00 -0.02 0.00 0.00 35.03 34.86 1iei n LYS 202 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1iei n GLY 203 N 1.79 3.99 3.96 0.72 0.00 -1.26 -4.05 105.19 110.33 1iei n GLY 203 Ca 0.00 -2.08 -0.22 0.00 0.00 0.00 0.00 46.02 43.72 1iei n GLY 203 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iei s ILE 204 N -3.97 3.68 -0.07 -0.61 1.01 -1.15 -4.57 121.20 115.52 1iei s ILE 204 Ca 0.40 -0.56 -0.17 0.00 0.00 0.00 0.00 60.65 60.32 1iei s ILE 204 Cb 0.39 -3.36 -0.05 0.00 0.01 0.00 0.00 42.46 39.45 1iei s ILE 204 CO -0.08 -0.25 0.45 -0.69 0.00 0.00 0.00 174.94 174.37 1iei s VAL 205 N -2.58 5.11 -0.28 2.92 1.01 0.63 -2.40 120.40 124.80 1iei s VAL 205 Ca 0.50 0.91 -0.10 0.00 0.00 0.00 0.00 61.98 63.29 1iei s VAL 205 Cb -0.10 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 1iei s VAL 205 CO 0.38 0.42 0.16 -0.69 0.00 0.00 0.00 175.10 175.37 1iei s VAL 206 N -0.02 5.00 -0.44 2.92 1.01 -1.26 -0.55 120.40 127.05 1iei s VAL 206 Ca 0.25 -0.01 -0.17 0.00 0.00 0.00 0.00 61.98 62.04 1iei s VAL 206 Cb -0.16 -3.41 0.03 0.00 0.00 0.00 0.00 36.38 32.85 1iei s VAL 206 CO 0.11 0.22 0.45 -0.89 0.00 0.00 0.00 175.10 175.00 1iei s THR 207 N 1.71 5.08 -0.74 3.92 2.01 -1.22 -1.57 115.64 124.83 1iei s THR 207 Ca 0.07 -0.47 -0.26 0.00 0.31 0.00 0.00 61.69 61.34 1iei s THR 207 Cb -0.16 -4.08 -0.04 0.00 0.01 0.00 0.00 72.50 68.22 1iei s THR 207 CO 0.09 -0.49 1.97 0.00 -0.69 0.00 0.00 174.62 175.49 1iei s ALA 208 N 2.13 1.82 0.73 7.40 0.00 0.18 -2.03 121.76 132.00 1iei s ALA 208 Ca 0.11 -0.97 -0.12 0.00 0.00 0.00 0.00 51.96 50.99 1iei s ALA 208 Cb -0.18 -4.43 0.03 0.00 0.00 0.00 0.00 23.12 18.54 1iei s ALA 208 CO 0.12 -4.45 1.10 1.52 0.00 0.00 0.00 175.76 174.06 1iei s TYR 209 N 10.09 3.19 -1.46 0.00 -0.85 0.12 -2.48 117.35 125.96 1iei s TYR 209 Ca 0.72 1.04 -0.02 0.00 -0.52 0.00 0.00 57.07 58.29 1iei s TYR 209 Cb -0.10 -3.12 0.02 0.00 0.38 0.00 0.00 41.96 39.13 1iei s TYR 209 CO 0.11 -1.35 0.39 0.43 -1.52 0.00 0.00 175.55 173.61 1iei n SER 210 N -3.12 -0.40 0.28 -0.18 7.64 -1.26 -2.17 113.62 114.41 1iei n SER 210 Ca 0.07 -1.05 0.19 0.00 1.01 0.00 0.00 58.87 59.09 1iei n SER 210 Cb 0.57 -2.79 0.93 0.00 -1.01 0.00 0.00 64.21 61.91 1iei n SER 210 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1iei h PRO 211 N -1.79 0.00 -0.65 1.43 0.13 -1.76 -0.55 132.00 128.81 1iei h PRO 211 Ca -0.63 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 1iei h PRO 211 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1iei h PRO 211 CO 0.65 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.70 1iei n LEU 212 N -2.90 4.31 0.00 1.56 4.77 -1.26 -4.70 117.00 118.79 1iei n LEU 212 Ca -0.01 -2.18 0.00 0.00 -0.03 0.00 0.00 56.01 53.78 1iei n LEU 212 Cb 0.14 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.66 1iei n LEU 212 CO 0.20 0.62 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 1iei n GLY 213 N 0.78 0.17 3.29 -0.72 0.00 -0.22 -4.31 105.19 104.18 1iei n GLY 213 Ca 0.21 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.97 1iei n GLY 213 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1iei n SER 214 N -0.32 -6.39 -0.60 1.61 2.88 -1.25 -4.93 113.62 104.62 1iei n SER 214 Ca 0.00 0.03 0.13 0.00 -1.33 0.00 0.00 58.87 57.70 1iei n SER 214 Cb 0.16 -3.07 0.41 0.00 -0.75 0.00 0.00 64.21 60.96 1iei n SER 214 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1iei n PRO 215 N -0.44 1.82 -0.91 -1.46 -0.04 -1.26 -3.29 135.00 129.41 1iei n PRO 215 Ca -0.03 -1.20 0.03 0.00 -0.04 0.00 0.00 63.50 62.26 1iei n PRO 215 Cb 0.60 -1.46 0.37 0.00 -0.04 0.00 0.00 33.50 32.97 1iei n PRO 215 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1iei n ASP 216 N 0.45 5.39 -4.55 3.54 5.75 -1.26 -4.97 116.55 120.90 1iei n ASP 216 Ca 0.18 -2.98 -0.37 0.00 -0.01 0.00 0.00 54.79 51.61 1iei n ASP 216 Cb 0.40 -0.70 -0.03 0.00 -1.03 0.00 0.00 41.12 39.76 1iei n ASP 216 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1iei s ARG 217 N -2.76 2.21 0.00 0.11 1.70 -1.21 -4.89 118.95 114.11 1iei s ARG 217 Ca 0.53 1.36 0.00 0.00 -0.47 0.00 0.00 55.73 57.15 1iei s ARG 217 Cb 0.41 -4.55 0.00 0.00 -0.57 0.00 0.00 34.95 30.24 1iei s ARG 217 CO 0.15 -3.16 0.00 -2.30 -1.08 0.00 0.00 175.30 168.91 1iei n PRO 218 N 9.01 0.00 -1.72 3.89 -0.02 -1.26 -0.69 135.00 144.20 1iei n PRO 218 Ca 0.35 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.48 1iei n PRO 218 Cb 0.54 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.99 1iei n PRO 218 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 1iei n TRP 219 N -1.49 2.12 -2.78 6.00 2.14 -1.26 -4.91 117.44 117.26 1iei n TRP 219 Ca 0.00 -2.49 -0.44 0.00 2.07 0.00 0.00 57.50 56.64 1iei n TRP 219 Cb 0.00 -1.73 0.00 0.00 -0.81 0.00 0.00 31.31 28.77 1iei n TRP 219 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1iei n ALA 220 N 1.65 4.42 -0.06 -1.67 0.00 0.13 -4.69 120.51 120.29 1iei n ALA 220 Ca 0.58 -4.31 -0.13 0.00 0.00 0.00 0.00 53.44 49.58 1iei n ALA 220 Cb 0.38 -2.97 -0.04 0.00 0.00 0.00 0.00 19.45 16.82 1iei n ALA 220 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1iei n LYS 221 N 4.74 0.30 -0.07 0.00 2.85 -1.26 -5.00 118.16 119.71 1iei n LYS 221 Ca 0.37 0.13 0.01 0.00 -1.05 0.00 0.00 58.31 57.76 1iei n LYS 221 Cb 0.40 -1.00 0.02 0.00 -0.65 0.00 0.00 35.03 33.80 1iei n LYS 221 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 1iei n PRO 222 N -3.74 -0.03 -2.66 -1.58 -0.02 -1.26 -4.81 135.00 120.90 1iei n PRO 222 Ca -0.23 0.31 -0.03 0.00 -2.02 0.00 0.00 63.50 61.54 1iei n PRO 222 Cb 0.58 -0.47 -0.03 0.00 -0.02 0.00 0.00 33.50 33.57 1iei n PRO 222 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1iei n GLU 223 N -4.32 -4.14 0.00 -0.52 1.02 -1.26 -5.03 120.64 106.39 1iei n GLU 223 Ca 0.03 3.18 0.00 0.00 -0.02 0.00 0.00 57.16 60.35 1iei n GLU 223 Cb 0.10 -5.25 0.00 0.00 -0.02 0.00 0.00 31.44 26.26 1iei n GLU 223 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1iei n ASP 224 N 1.25 0.00 -4.61 1.62 2.03 -1.26 -5.16 116.55 110.42 1iei n ASP 224 Ca -0.23 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 54.66 1iei n ASP 224 Cb 0.36 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.76 1iei n ASP 224 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 1iei n PRO 225 N 0.65 1.40 -2.86 -0.67 -0.02 -1.26 -4.98 135.00 127.26 1iei n PRO 225 Ca 0.00 0.50 -0.10 0.00 -2.02 0.00 0.00 63.50 61.88 1iei n PRO 225 Cb 0.00 -2.01 0.01 0.00 -0.02 0.00 0.00 33.50 31.48 1iei n PRO 225 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1iei n SER 226 N 0.72 -2.55 -0.31 2.55 7.64 -1.26 -4.93 113.62 115.48 1iei n SER 226 Ca 0.09 -3.01 0.10 0.00 1.01 0.00 0.00 58.87 57.07 1iei n SER 226 Cb 0.37 1.31 0.27 0.00 -1.01 0.00 0.00 64.21 65.16 1iei n SER 226 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1iei h LEU 227 N 4.52 0.53 -1.23 -3.43 3.38 -1.94 0.53 115.31 117.68 1iei h LEU 227 Ca -0.01 0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 1iei h LEU 227 Cb 1.03 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.78 1iei h LEU 227 CO 0.23 0.17 0.44 -0.07 0.09 0.00 0.00 178.44 179.29 1iei h LEU 228 N 0.59 0.85 -3.89 1.67 3.38 -1.92 -3.13 115.31 112.85 1iei h LEU 228 Ca 0.52 -0.04 -0.60 0.00 0.09 0.00 0.00 57.88 57.85 1iei h LEU 228 Cb 0.84 -0.21 -0.31 0.00 0.09 0.00 0.00 40.66 41.06 1iei h LEU 228 CO -0.42 0.64 0.36 -0.62 0.09 0.00 0.00 178.44 178.49 1iei n GLU 229 N -4.40 2.83 -3.73 1.13 -0.58 0.18 -4.83 120.64 111.23 1iei n GLU 229 Ca 0.07 -3.49 -0.35 0.00 -0.42 0.00 0.00 57.16 52.98 1iei n GLU 229 Cb 0.06 -2.24 -0.08 0.00 -0.57 0.00 0.00 31.44 28.60 1iei n GLU 229 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1iei s ASP 230 N -2.29 6.16 0.25 1.62 3.68 -0.62 -4.95 116.67 120.53 1iei s ASP 230 Ca 0.59 0.19 -0.04 0.00 2.13 0.00 0.00 52.55 55.42 1iei s ASP 230 Cb 0.47 -2.09 0.50 0.00 -1.45 0.00 0.00 42.92 40.36 1iei s ASP 230 CO 0.01 0.15 1.66 -0.65 0.13 0.00 0.00 175.17 176.48 1iei h PRO 231 N 6.86 0.19 0.00 4.34 0.11 -1.94 0.22 132.00 141.78 1iei h PRO 231 Ca -0.40 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1iei h PRO 231 Cb 1.16 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1iei h PRO 231 CO 0.73 0.12 0.00 0.00 -0.21 0.00 0.00 178.00 178.65 1iei h ARG 232 N 0.19 0.00 0.01 1.05 3.08 -2.00 -3.10 114.38 113.62 1iei h ARG 232 Ca 0.44 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.38 1iei h ARG 232 Cb 0.79 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.83 1iei h ARG 232 CO -0.59 0.00 -0.58 0.97 -1.07 0.00 0.00 179.97 178.70 1iei h ILE 233 N 0.00 1.41 -0.42 2.04 2.10 -1.35 -3.29 117.51 118.01 1iei h ILE 233 Ca 0.00 -2.29 0.16 0.00 1.08 0.00 0.00 64.86 63.80 1iei h ILE 233 Cb 0.78 2.91 -0.08 0.00 -1.09 0.00 0.00 36.82 39.34 1iei h ILE 233 CO 0.00 0.50 0.16 1.17 -1.08 0.00 0.00 178.15 178.90 1iei n LYS 234 N -4.49 -0.03 -0.05 2.19 4.81 -0.85 -1.46 118.16 118.28 1iei n LYS 234 Ca -0.19 0.59 -0.13 0.00 -0.87 0.00 0.00 58.31 57.70 1iei n LYS 234 Cb 0.59 -1.02 -0.11 0.00 0.02 0.00 0.00 35.03 34.51 1iei n LYS 234 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1iei h ALA 235 N 0.83 -0.01 -0.52 3.14 0.00 -1.68 -0.65 119.26 120.38 1iei h ALA 235 Ca 0.32 -0.40 0.10 0.00 0.00 0.00 0.00 54.91 54.92 1iei h ALA 235 Cb 0.80 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.50 1iei h ALA 235 CO -0.34 -0.08 -0.16 -0.89 0.00 0.00 0.00 179.25 177.78 1iei n ILE 236 N -4.69 -0.24 -0.06 0.00 2.08 -0.53 -1.06 119.36 114.85 1iei n ILE 236 Ca -0.09 1.20 -0.10 0.00 0.56 0.00 0.00 62.75 64.32 1iei n ILE 236 Cb 0.39 -1.64 0.04 0.00 -0.75 0.00 0.00 39.64 37.69 1iei n ILE 236 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1iei h ALA 237 N 0.92 0.72 -0.34 -1.39 0.00 -1.48 -2.76 119.26 114.94 1iei h ALA 237 Ca 0.22 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1iei h ALA 237 Cb 0.35 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1iei h ALA 237 CO -0.53 0.66 0.18 0.00 0.00 0.00 0.00 179.25 179.56 1iei h ALA 238 N 0.94 0.43 -0.07 0.00 0.00 -0.66 0.18 119.26 120.09 1iei h ALA 238 Ca 0.05 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1iei h ALA 238 Cb 0.95 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 1iei h ALA 238 CO 0.09 -0.03 0.07 0.87 0.00 0.00 0.00 179.25 180.25 1iei h LYS 239 N 0.42 0.00 -0.39 0.00 1.79 -0.79 -2.33 116.57 115.27 1iei h LYS 239 Ca 0.12 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.53 1iei h LYS 239 Cb 0.08 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.69 1iei h LYS 239 CO -0.02 0.00 0.03 0.72 -1.08 0.00 0.00 179.45 179.11 1iei n HIS 240 N -3.90 1.34 -2.18 -1.35 8.25 -1.20 -4.94 115.22 111.24 1iei n HIS 240 Ca -0.01 -1.01 -0.08 0.00 -0.26 0.00 0.00 57.72 56.36 1iei n HIS 240 Cb 0.17 -0.42 -0.01 0.00 1.12 0.00 0.00 29.99 30.84 1iei n HIS 240 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1iei n ASN 241 N -0.41 -0.74 -4.79 0.41 2.85 -0.88 -4.90 115.26 106.80 1iei n ASN 241 Ca 0.27 -0.02 -0.23 0.00 -0.11 0.00 0.00 54.58 54.49 1iei n ASN 241 Cb 1.03 -0.70 -0.06 0.00 1.24 0.00 0.00 39.78 41.29 1iei n ASN 241 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 1iei s LYS 242 N -3.49 2.34 0.60 1.20 -0.14 0.62 -5.03 119.74 115.84 1iei s LYS 242 Ca 0.15 -1.73 -0.04 0.00 -1.36 0.00 0.00 55.97 52.99 1iei s LYS 242 Cb -0.09 -2.12 0.03 0.00 -1.68 0.00 0.00 37.83 33.97 1iei s LYS 242 CO 0.19 -0.14 0.88 0.95 -0.76 0.00 0.00 175.35 176.47 1iei s THR 243 N -2.55 3.07 0.08 2.17 -4.23 -1.26 -4.08 115.64 108.84 1iei s THR 243 Ca 0.43 -0.28 -0.22 0.00 -1.18 0.00 0.00 61.69 60.44 1iei s THR 243 Cb 0.01 -3.22 -0.13 0.00 1.34 0.00 0.00 72.50 70.50 1iei s THR 243 CO 0.24 -0.21 1.66 0.71 -0.54 0.00 0.00 174.62 176.48 1iei h THR 244 N -0.18 1.10 -0.75 3.99 1.35 -1.91 0.51 112.91 117.01 1iei h THR 244 Ca -0.44 -0.28 0.14 0.00 -0.55 0.00 0.00 66.41 65.27 1iei h THR 244 Cb 1.28 1.15 -0.14 0.00 -1.73 0.00 0.00 68.15 68.72 1iei h THR 244 CO 0.58 0.08 -0.29 0.00 -0.25 0.00 0.00 175.52 175.64 1iei h ALA 245 N 0.93 0.22 -0.84 6.62 0.00 -1.94 0.38 119.26 124.64 1iei h ALA 245 Ca 0.03 0.24 0.20 0.00 0.00 0.00 0.00 54.91 55.38 1iei h ALA 245 Cb 0.10 0.76 -0.05 0.00 0.00 0.00 0.00 17.79 18.60 1iei h ALA 245 CO -0.00 -0.56 0.57 1.96 0.00 0.00 0.00 179.25 181.22 1iei h GLN 246 N -0.07 0.25 0.00 0.00 4.20 -1.81 -0.50 115.11 117.19 1iei h GLN 246 Ca 0.31 -0.02 -0.19 0.00 0.06 0.00 0.00 58.65 58.82 1iei h GLN 246 Cb 0.57 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.27 1iei h GLN 246 CO -0.80 0.17 -0.91 0.28 -0.67 0.00 0.00 178.83 176.90 1iei h VAL 247 N 0.26 1.51 -0.16 -0.54 2.07 0.20 -1.96 116.25 117.62 1iei h VAL 247 Ca 0.42 -3.14 -0.02 0.00 0.82 0.00 0.00 66.70 64.78 1iei h VAL 247 Cb 1.24 2.74 -0.01 0.00 -1.52 0.00 0.00 31.29 33.75 1iei h VAL 247 CO -0.11 0.86 0.04 -0.07 0.02 0.00 0.00 177.57 178.31 1iei h LEU 248 N 0.00 0.25 0.82 2.57 4.07 -0.17 -2.07 115.31 120.78 1iei h LEU 248 Ca -0.01 -0.23 -0.04 0.00 0.08 0.00 0.00 57.88 57.67 1iei h LEU 248 Cb 1.69 -0.06 0.01 0.00 1.08 0.00 0.00 40.66 43.37 1iei h LEU 248 CO 0.11 0.42 -0.39 0.40 -1.08 0.00 0.00 178.44 177.89 1iei h ILE 249 N 0.06 0.00 -0.89 1.22 2.04 -1.19 -3.24 117.51 115.51 1iei h ILE 249 Ca 0.05 -0.19 0.18 0.00 1.00 0.00 0.00 64.86 65.90 1iei h ILE 249 Cb 0.27 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 36.18 1iei h ILE 249 CO 0.00 0.00 -0.23 -0.09 0.00 0.00 0.00 178.15 177.83 1iei h ARG 250 N -1.29 -0.00 -0.99 2.37 9.65 -1.46 -3.27 114.38 119.38 1iei h ARG 250 Ca -0.11 0.00 0.10 0.00 -1.10 0.00 0.00 59.98 58.87 1iei h ARG 250 Cb 0.85 0.00 -0.13 0.00 -1.39 0.00 0.00 29.97 29.30 1iei h ARG 250 CO 0.19 -0.00 -0.56 0.35 2.80 0.00 0.00 179.97 182.74 1iei h PHE 251 N -0.00 -1.78 -0.52 2.20 3.57 -1.40 -1.86 116.94 117.15 1iei h PHE 251 Ca 0.42 0.13 0.04 0.00 3.53 0.00 0.00 57.97 62.08 1iei h PHE 251 Cb 0.65 0.91 -0.04 0.00 2.79 0.00 0.00 35.95 40.25 1iei h PHE 251 CO -0.70 -0.38 0.29 -1.00 -2.23 0.00 0.00 178.31 174.29 1iei h PRO 252 N -0.01 0.54 -1.07 6.41 0.13 -1.66 -2.96 132.00 133.38 1iei h PRO 252 Ca 0.19 -0.03 0.30 0.00 -0.87 0.00 0.00 66.00 65.59 1iei h PRO 252 Cb 0.44 -0.12 -0.05 0.00 0.13 0.00 0.00 31.00 31.39 1iei h PRO 252 CO -0.94 0.36 0.75 0.00 -0.23 0.00 0.00 178.00 177.94 1iei h MET 253 N 0.56 0.09 -0.01 0.86 -0.00 -1.41 0.37 114.93 115.39 1iei h MET 253 Ca 0.22 -0.01 0.00 0.00 -0.00 0.00 0.00 59.70 59.92 1iei h MET 253 Cb 0.09 -0.02 0.00 0.00 -0.00 0.00 0.00 31.60 31.67 1iei h MET 253 CO -0.13 0.06 -0.27 0.94 -0.00 0.00 0.00 176.91 177.50 1iei n GLN 254 N -4.30 0.82 -0.56 -0.10 7.27 -0.96 -2.62 117.38 116.93 1iei n GLN 254 Ca 0.23 -0.49 0.10 0.00 0.07 0.00 0.00 57.00 56.91 1iei n GLN 254 Cb 1.08 -1.49 0.35 0.00 2.41 0.00 0.00 30.24 32.59 1iei n GLN 254 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1iei n ARG 255 N -0.66 3.54 -1.89 3.69 1.74 0.08 -4.90 116.66 118.26 1iei n ARG 255 Ca 0.12 -2.83 0.00 0.00 -0.77 0.00 0.00 57.85 54.37 1iei n ARG 255 Cb 0.35 -1.82 0.00 0.00 -1.02 0.00 0.00 32.46 29.97 1iei n ARG 255 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1iei n ASN 256 N 1.16 -1.14 -4.71 0.55 2.85 -1.08 -5.07 115.26 107.82 1iei n ASN 256 Ca 0.25 0.00 -0.27 0.00 -0.11 0.00 0.00 54.58 54.45 1iei n ASN 256 Cb 0.83 -0.44 -0.08 0.00 1.24 0.00 0.00 39.78 41.33 1iei n ASN 256 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1iei s LEU 257 N -0.25 2.91 -0.09 1.20 1.02 -1.00 -4.65 118.68 117.81 1iei s LEU 257 Ca 0.00 -1.26 0.03 0.00 0.02 0.00 0.00 54.13 52.92 1iei s LEU 257 Cb 0.00 -1.16 -0.01 0.00 0.02 0.00 0.00 46.19 45.04 1iei s LEU 257 CO 0.00 -0.59 -0.18 -0.69 0.02 0.00 0.00 176.35 174.90 1iei s VAL 258 N -2.68 2.61 -0.24 -1.59 1.01 -0.61 -4.08 120.40 114.82 1iei s VAL 258 Ca 0.34 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.46 1iei s VAL 258 Cb 0.05 -2.03 0.02 0.00 0.00 0.00 0.00 36.38 34.42 1iei s VAL 258 CO 0.18 0.56 -0.06 -0.69 0.00 0.00 0.00 175.10 175.09 1iei s VAL 259 N 0.01 2.91 -1.05 2.92 1.01 -0.09 0.49 120.40 126.60 1iei s VAL 259 Ca -0.06 -0.96 -0.05 0.00 0.00 0.00 0.00 61.98 60.90 1iei s VAL 259 Cb -0.15 -2.45 0.28 0.00 0.00 0.00 0.00 36.38 34.06 1iei s VAL 259 CO 0.05 0.23 1.16 2.30 0.00 0.00 0.00 175.10 178.84 1iei n ILE 260 N 4.68 4.45 -1.64 2.22 -5.35 -1.04 -1.11 119.36 121.58 1iei n ILE 260 Ca -0.17 -5.51 -0.50 0.00 -0.27 0.00 0.00 62.75 56.31 1iei n ILE 260 Cb 0.48 -2.37 -0.05 0.00 -1.74 0.00 0.00 39.64 35.95 1iei n ILE 260 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 1iei n PRO 261 N 2.09 1.64 -3.78 6.28 -0.04 -1.09 -3.73 135.00 136.37 1iei n PRO 261 Ca 0.25 0.59 -0.37 0.00 -0.04 0.00 0.00 63.50 63.93 1iei n PRO 261 Cb 0.37 -2.31 -0.06 0.00 -0.04 0.00 0.00 33.50 31.45 1iei n PRO 261 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1iei s LYS 262 N 1.34 3.69 0.05 0.54 2.36 -1.26 -0.05 119.74 126.41 1iei s LYS 262 Ca 0.85 -0.07 -0.14 0.00 -2.55 0.00 0.00 55.97 54.06 1iei s LYS 262 Cb -0.83 -3.25 0.02 0.00 -1.05 0.00 0.00 37.83 32.72 1iei s LYS 262 CO 0.46 0.64 0.32 0.45 1.55 0.00 0.00 175.35 178.77 1iei s SER 263 N -0.67 -0.14 -0.02 1.43 0.15 -1.26 -4.98 113.70 108.21 1iei s SER 263 Ca 0.15 -0.21 0.18 0.00 0.70 0.00 0.00 55.95 56.77 1iei s SER 263 Cb -0.12 0.38 0.56 0.00 -1.71 0.00 0.00 66.02 65.12 1iei s SER 263 CO 0.04 -0.65 1.46 1.33 1.20 0.00 0.00 173.24 176.62 1iei n VAL 264 N 0.45 0.98 -3.99 4.45 0.24 -1.26 -4.84 118.33 114.36 1iei n VAL 264 Ca -0.18 -0.86 -0.33 0.00 -2.04 0.00 0.00 64.34 60.93 1iei n VAL 264 Cb 0.60 0.34 -0.14 0.00 -1.47 0.00 0.00 33.84 33.16 1iei n VAL 264 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1iei s THR 265 N -1.31 2.50 0.20 3.34 2.01 -1.26 -4.71 115.64 116.41 1iei s THR 265 Ca 0.42 -1.90 -0.16 0.00 0.31 0.00 0.00 61.69 60.35 1iei s THR 265 Cb 0.23 -2.63 0.18 0.00 0.01 0.00 0.00 72.50 70.29 1iei s THR 265 CO 0.27 -0.33 1.62 -0.65 -0.69 0.00 0.00 174.62 174.83 1iei h PRO 266 N 7.79 -0.07 -0.00 4.92 0.11 -1.94 0.41 132.00 143.22 1iei h PRO 266 Ca -0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.98 1iei h PRO 266 Cb 1.04 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 1iei h PRO 266 CO 0.53 -0.05 -0.00 0.39 -0.21 0.00 0.00 178.00 178.66 1iei n GLU 267 N -5.43 -0.00 0.04 1.05 1.02 -1.26 -1.76 120.64 114.30 1iei n GLU 267 Ca 0.06 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.31 1iei n GLU 267 Cb 0.33 -0.00 0.05 0.00 -0.02 0.00 0.00 31.44 31.80 1iei n GLU 267 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1iei n ARG 268 N -2.75 0.32 0.26 3.49 1.85 0.14 -1.25 116.66 118.71 1iei n ARG 268 Ca 0.00 0.02 -0.16 0.00 -1.00 0.00 0.00 57.85 56.71 1iei n ARG 268 Cb 0.00 -1.63 -0.09 0.00 -1.05 0.00 0.00 32.46 29.69 1iei n ARG 268 CO 0.00 0.00 0.00 0.82 -0.01 0.00 0.00 177.63 178.44 1iei h ILE 269 N 0.00 0.00 -0.49 8.89 2.04 -0.90 0.34 117.51 127.38 1iei h ILE 269 Ca 0.00 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.95 1iei h ILE 269 Cb 0.76 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.76 1iei h ILE 269 CO 0.00 0.00 0.05 0.00 0.00 0.00 0.00 178.15 178.20 1iei h ALA 270 N -0.97 0.51 -0.45 1.87 0.00 -1.34 -1.90 119.26 116.99 1iei h ALA 270 Ca -0.05 0.12 0.09 0.00 0.00 0.00 0.00 54.91 55.07 1iei h ALA 270 Cb 0.79 0.19 -0.10 0.00 0.00 0.00 0.00 17.79 18.67 1iei h ALA 270 CO -0.07 -0.35 -0.23 1.05 0.00 0.00 0.00 179.25 179.65 1iei h GLU 271 N 0.18 -0.13 -0.33 0.00 -0.00 -1.26 -3.18 114.58 109.85 1iei h GLU 271 Ca 0.25 0.01 0.07 0.00 -0.00 0.00 0.00 59.36 59.69 1iei h GLU 271 Cb 0.35 0.03 -0.02 0.00 -0.00 0.00 0.00 28.75 29.12 1iei h GLU 271 CO -0.36 -0.09 0.23 -0.91 -0.00 0.00 0.00 179.01 177.87 1iei h ASN 272 N -0.14 0.12 0.86 3.06 2.35 0.09 -1.84 115.58 120.08 1iei h ASN 272 Ca 0.21 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 1iei h ASN 272 Cb 0.47 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.82 1iei h ASN 272 CO -0.53 0.08 0.00 0.33 -1.65 0.00 0.00 177.43 175.65 1iei n PHE 273 N -4.47 0.10 -0.64 1.19 7.35 -0.75 -4.39 117.46 115.85 1iei n PHE 273 Ca 0.04 0.03 -0.06 0.00 -0.76 0.00 0.00 57.45 56.70 1iei n PHE 273 Cb 0.31 -0.55 -0.09 0.00 0.35 0.00 0.00 39.48 39.50 1iei n PHE 273 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1iei n LYS 274 N -1.58 1.28 -0.22 -4.13 5.02 -0.69 -4.56 118.16 113.28 1iei n LYS 274 Ca 0.06 -0.50 0.09 0.00 -2.02 0.00 0.00 58.31 55.93 1iei n LYS 274 Cb 0.29 -1.62 0.16 0.00 -0.02 0.00 0.00 35.03 33.84 1iei n LYS 274 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 1iei n VAL 275 N 2.26 1.96 0.14 -0.18 3.14 -1.26 -4.64 118.33 119.75 1iei n VAL 275 Ca 0.22 -2.51 0.09 0.00 -2.96 0.00 0.00 64.34 59.17 1iei n VAL 275 Cb 0.60 -0.23 -0.13 0.00 -1.06 0.00 0.00 33.84 33.02 1iei n VAL 275 CO 0.00 0.00 0.00 0.49 -6.46 0.00 0.00 176.83 170.86 1iei n PHE 276 N -1.34 0.00 0.05 1.45 3.72 -1.26 -4.43 117.46 115.65 1iei n PHE 276 Ca 0.17 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.65 1iei n PHE 276 Cb 0.66 -0.33 0.52 0.00 -0.94 0.00 0.00 39.48 39.39 1iei n PHE 276 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 1iei h ASP 277 N 0.00 0.28 -3.39 4.37 3.04 -1.97 -3.45 116.42 115.31 1iei h ASP 277 Ca 0.00 -0.00 -0.66 0.00 -3.24 0.00 0.00 57.03 53.13 1iei h ASP 277 Cb 0.73 -0.07 -0.18 0.00 -1.04 0.00 0.00 39.33 38.77 1iei h ASP 277 CO 0.00 0.19 -0.80 0.72 -2.04 0.00 0.00 179.24 177.31 1iei s PHE 278 N -5.32 2.43 -0.22 4.15 -0.71 -1.26 -5.13 117.98 111.92 1iei s PHE 278 Ca -0.07 -0.31 -0.05 0.00 -1.04 0.00 0.00 56.93 55.46 1iei s PHE 278 Cb 0.18 -1.24 -0.02 0.00 -1.21 0.00 0.00 43.02 40.73 1iei s PHE 278 CO 0.72 0.45 0.01 -2.00 -1.34 0.00 0.00 175.22 173.06 1iei s GLU 279 N -2.48 3.55 0.24 1.99 2.56 -1.26 -5.07 118.70 118.22 1iei s GLU 279 Ca 0.20 -0.54 -0.30 0.00 0.00 0.00 0.00 54.97 54.33 1iei s GLU 279 Cb -0.09 -3.15 -0.09 0.00 2.00 0.00 0.00 34.13 32.80 1iei s GLU 279 CO 0.10 -0.13 1.24 -0.51 -0.56 0.00 0.00 175.26 175.40 1iei s LEU 280 N 1.38 4.46 0.76 2.70 1.43 -1.26 -4.99 118.68 123.15 1iei s LEU 280 Ca 0.05 2.39 -0.13 0.00 -1.03 0.00 0.00 54.13 55.40 1iei s LEU 280 Cb -0.15 -3.62 0.05 0.00 0.03 0.00 0.00 46.19 42.51 1iei s LEU 280 CO 0.01 -0.41 1.15 -0.94 0.23 0.00 0.00 176.35 176.39 1iei s SER 281 N -0.13 4.21 0.47 2.29 1.04 -1.26 -4.82 113.70 115.50 1iei s SER 281 Ca 0.52 2.15 0.34 0.00 0.48 0.00 0.00 55.95 59.43 1iei s SER 281 Cb -0.35 -2.56 1.16 0.00 0.10 0.00 0.00 66.02 64.36 1iei s SER 281 CO 0.41 -2.24 1.19 -0.24 0.98 0.00 0.00 173.24 173.34 1iei n SER 282 N -3.08 0.00 0.05 7.02 2.88 -1.26 -1.29 113.62 117.94 1iei n SER 282 Ca 0.12 0.74 -0.20 0.00 -1.33 0.00 0.00 58.87 58.19 1iei n SER 282 Cb 0.51 -0.33 -0.14 0.00 -0.75 0.00 0.00 64.21 63.50 1iei n SER 282 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 1iei h GLN 283 N 0.00 0.30 0.00 -1.46 5.75 -1.98 -1.17 115.11 116.55 1iei h GLN 283 Ca 0.63 -0.52 -0.06 0.00 -0.15 0.00 0.00 58.65 58.55 1iei h GLN 283 Cb 2.83 0.19 -0.01 0.00 1.07 0.00 0.00 27.48 31.56 1iei h GLN 283 CO -0.01 1.19 -0.27 -0.44 -2.65 0.00 0.00 178.83 176.65 1iei h ASP 284 N 0.08 0.00 -0.06 -0.69 3.32 -1.54 0.11 116.42 117.64 1iei h ASP 284 Ca -0.32 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.63 1iei h ASP 284 Cb 2.06 0.00 0.01 0.00 0.22 0.00 0.00 39.33 41.61 1iei h ASP 284 CO 0.15 0.27 -0.37 -0.03 -1.72 0.00 0.00 179.24 177.54 1iei h MET 285 N 0.00 0.36 -0.77 3.56 4.05 -1.23 0.30 114.93 121.20 1iei h MET 285 Ca -0.00 -0.30 0.14 0.00 -0.28 0.00 0.00 59.70 59.26 1iei h MET 285 Cb 0.48 0.07 -0.05 0.00 -0.80 0.00 0.00 31.60 31.29 1iei h MET 285 CO 0.03 0.95 0.51 1.15 0.23 0.00 0.00 176.91 179.78 1iei h THR 286 N -0.14 0.82 0.13 -0.77 2.02 -0.92 -2.98 112.91 111.08 1iei h THR 286 Ca -0.03 -0.16 -0.25 0.00 0.77 0.00 0.00 66.41 66.74 1iei h THR 286 Cb 1.03 0.30 0.01 0.00 -1.74 0.00 0.00 68.15 67.75 1iei h THR 286 CO 0.08 0.09 -1.23 0.74 0.37 0.00 0.00 175.52 175.57 1iei h THR 287 N 0.48 1.20 0.00 3.16 2.02 -0.06 -2.53 112.91 117.18 1iei h THR 287 Ca 0.38 -2.46 0.00 0.00 0.77 0.00 0.00 66.41 65.09 1iei h THR 287 Cb 0.78 2.89 0.00 0.00 -1.74 0.00 0.00 68.15 70.08 1iei h THR 287 CO -0.13 0.71 0.00 0.18 0.37 0.00 0.00 175.52 176.65 1iei n LEU 288 N -3.97 0.16 0.10 2.58 4.77 1.00 0.04 117.00 121.68 1iei n LEU 288 Ca -0.21 0.54 0.08 0.00 -0.03 0.00 0.00 56.01 56.39 1iei n LEU 288 Cb 0.89 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 1iei n LEU 288 CO 0.45 -0.29 0.08 -0.07 -1.33 0.00 0.00 177.39 176.23 1iei h LEU 289 N 0.00 0.00 -0.38 2.23 3.38 -1.47 -3.35 115.31 115.72 1iei h LEU 289 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1iei h LEU 289 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1iei h LEU 289 CO 0.00 0.17 0.00 0.77 0.09 0.00 0.00 178.44 179.47 1iei h SER 290 N 0.00 0.00 0.17 -0.43 4.64 0.06 -3.16 113.55 114.83 1iei h SER 290 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1iei h SER 290 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1iei h SER 290 CO 0.02 0.00 0.00 -1.22 -0.87 0.00 0.00 176.83 174.76 1iei n TYR 291 N -2.87 0.00 -1.55 4.77 4.02 -1.00 -4.79 117.16 115.73 1iei n TYR 291 Ca 0.03 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.67 1iei n TYR 291 Cb 0.44 -0.35 -0.06 0.00 -0.02 0.00 0.00 39.34 39.35 1iei n TYR 291 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1iei n ASN 292 N -1.35 1.90 0.00 7.72 5.15 -0.91 -4.29 115.26 123.47 1iei n ASN 292 Ca 0.03 -0.93 0.02 0.00 -0.60 0.00 0.00 54.58 53.10 1iei n ASN 292 Cb 0.07 -1.57 0.11 0.00 -0.53 0.00 0.00 39.78 37.85 1iei n ASN 292 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1iei n ARG 293 N 8.79 0.97 -1.76 1.20 1.74 -1.13 -4.93 116.66 121.54 1iei n ARG 293 Ca 0.44 0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 57.31 1iei n ARG 293 Cb 0.46 -1.06 -0.07 0.00 -1.02 0.00 0.00 32.46 30.78 1iei n ARG 293 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1iei n ASN 294 N -0.56 -5.45 -4.32 0.55 3.02 -0.82 -4.93 115.26 102.75 1iei n ASN 294 Ca 0.03 0.40 -0.47 0.00 -0.03 0.00 0.00 54.58 54.51 1iei n ASN 294 Cb 0.01 -4.76 -0.03 0.00 -0.61 0.00 0.00 39.78 34.39 1iei n ASN 294 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 1iei s TRP 295 N -2.79 3.57 0.49 3.10 -0.00 0.10 -4.90 118.94 118.52 1iei s TRP 295 Ca 0.00 -1.73 -0.23 0.00 -0.00 0.00 0.00 56.10 54.13 1iei s TRP 295 Cb 0.00 -3.82 -0.07 0.00 -0.00 0.00 0.00 33.47 29.59 1iei s TRP 295 CO 0.00 -1.01 1.35 0.50 -0.00 0.00 0.00 176.95 177.79 1iei s ARG 296 N 0.71 3.49 -0.00 5.86 3.52 -1.26 -4.41 118.95 126.85 1iei s ARG 296 Ca 0.13 2.22 0.04 0.00 -0.13 0.00 0.00 55.73 57.99 1iei s ARG 296 Cb -0.17 -2.46 -0.06 0.00 -1.56 0.00 0.00 34.95 30.70 1iei s ARG 296 CO -0.05 -0.91 0.12 0.28 -0.81 0.00 0.00 175.30 173.93 1iei n VAL 297 N -0.56 0.00 -0.09 7.11 0.31 -1.26 -4.85 118.33 118.99 1iei n VAL 297 Ca 0.08 -0.17 -0.10 0.00 -0.01 0.00 0.00 64.34 64.13 1iei n VAL 297 Cb 0.44 0.55 -0.11 0.00 -0.91 0.00 0.00 33.84 33.81 1iei n VAL 297 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1iei n ALA 299 N -2.78 0.00 0.00 0.00 0.00 -1.26 -4.93 120.51 111.53 1iei n ALA 299 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1iei n ALA 299 Cb 0.95 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.40 1iei n ALA 299 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1iei n LEU 300 N 0.00 0.00 0.00 0.00 0.00 -1.26 -4.97 117.00 110.77 1iei n LEU 300 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 1iei n LEU 300 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.42 1iei n LEU 300 CO 0.00 0.00 -0.22 0.18 0.00 0.00 0.00 177.39 177.35 1iei n LEU 301 N 0.37 0.00 0.00 -1.96 7.99 -1.26 -3.94 117.00 118.20 1iei n LEU 301 Ca 0.00 -0.20 0.02 0.00 -0.01 0.00 0.00 56.01 55.81 1iei n LEU 301 Cb 0.00 0.00 0.10 0.00 -0.11 0.00 0.00 43.42 43.41 1iei n LEU 301 CO 0.00 0.00 0.27 -1.54 -1.51 0.00 0.00 177.39 174.61 1iei n SER 302 N -1.06 0.00 -0.62 -1.43 3.41 -1.26 -1.70 113.62 110.96 1iei n SER 302 Ca 0.00 -0.36 0.06 0.00 -0.26 0.00 0.00 58.87 58.32 1iei n SER 302 Cb 0.00 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.07 1iei n SER 302 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1iei h THR 304 N 2.31 0.00 0.00 0.00 1.35 -1.52 -2.06 112.91 112.99 1iei h THR 304 Ca 0.00 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.68 1iei h THR 304 Cb 0.66 0.91 0.00 0.00 -1.73 0.00 0.00 68.15 67.98 1iei h THR 304 CO 0.00 0.00 -0.63 -1.54 -0.25 0.00 0.00 175.52 173.10 1iei n SER 305 N -2.46 0.66 -4.67 5.36 3.41 -1.26 -4.95 113.62 109.71 1iei n SER 305 Ca 0.00 0.06 -0.46 0.00 -0.26 0.00 0.00 58.87 58.22 1iei n SER 305 Cb 0.17 0.21 -0.04 0.00 -0.26 0.00 0.00 64.21 64.28 1iei n SER 305 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 1iei n HIS 306 N -2.03 2.25 -0.22 7.33 -0.00 -0.78 -4.90 115.22 116.88 1iei n HIS 306 Ca 0.03 0.28 0.03 0.00 -0.00 0.00 0.00 57.72 58.07 1iei n HIS 306 Cb 0.43 -2.53 0.14 0.00 -0.00 0.00 0.00 29.99 28.02 1iei n HIS 306 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.34 177.91 1iei h LYS 307 N 5.84 0.25 -4.10 1.57 2.10 -1.92 -2.90 116.57 117.40 1iei h LYS 307 Ca -0.45 -0.02 -0.77 0.00 -2.00 0.00 0.00 60.65 57.42 1iei h LYS 307 Cb 1.26 -0.06 -0.23 0.00 -0.90 0.00 0.00 32.23 32.30 1iei h LYS 307 CO 0.88 0.17 0.96 -0.25 -2.00 0.00 0.00 179.45 179.21 1iei n ASP 308 N -5.15 5.40 -4.41 7.07 8.00 -1.26 -4.91 116.55 121.28 1iei n ASP 308 Ca 0.11 -3.03 -0.35 0.00 0.71 0.00 0.00 54.79 52.24 1iei n ASP 308 Cb 0.38 -1.47 -0.13 0.00 -0.02 0.00 0.00 41.12 39.88 1iei n ASP 308 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1iei s TYR 309 N 0.07 3.01 0.26 1.24 5.04 -1.10 -4.40 117.35 121.47 1iei s TYR 309 Ca 0.37 -0.58 -0.03 0.00 -2.44 0.00 0.00 57.07 54.39 1iei s TYR 309 Cb -0.05 -2.08 0.33 0.00 0.35 0.00 0.00 41.96 40.51 1iei s TYR 309 CO -0.03 -0.31 1.83 -1.00 -1.34 0.00 0.00 175.55 174.70 1iei h PRO 310 N 7.62 0.98 -2.29 4.97 0.13 -1.91 -3.32 132.00 138.18 1iei h PRO 310 Ca -0.37 -0.17 -0.76 0.00 -0.87 0.00 0.00 66.00 63.83 1iei h PRO 310 Cb 1.18 -0.16 -0.22 0.00 0.13 0.00 0.00 31.00 31.92 1iei h PRO 310 CO 0.60 0.81 1.35 1.19 -0.23 0.00 0.00 178.00 181.72 1iei n PHE 311 N -4.29 2.66 0.00 1.56 3.72 -1.26 -4.19 117.46 115.65 1iei n PHE 311 Ca 0.06 -2.54 0.00 0.00 -0.05 0.00 0.00 57.45 54.91 1iei n PHE 311 Cb 0.19 -1.38 0.00 0.00 -0.94 0.00 0.00 39.48 37.35 1iei n PHE 311 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1iei n HIS 312 N 0.40 0.00 -1.18 1.38 8.25 -1.25 -5.03 115.22 117.80 1iei n HIS 312 Ca 0.52 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.97 1iei n HIS 312 Cb 0.28 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.39 1iei n HIS 312 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1iei n GLU 313 N -1.42 0.03 -0.11 -0.41 4.71 -1.26 -5.09 120.64 117.09 1iei n GLU 313 Ca 0.00 -0.08 -0.21 0.00 -0.01 0.00 0.00 57.16 56.86 1iei n GLU 313 Cb 0.25 -0.05 -0.08 0.00 -1.01 0.00 0.00 31.44 30.56 1iei n GLU 313 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 1iei n GLU 314 N -1.10 0.56 0.00 3.49 2.13 -1.26 -5.15 120.64 119.31 1iei n GLU 314 Ca 0.01 0.33 0.15 0.00 0.66 0.00 0.00 57.16 58.30 1iei n GLU 314 Cb 0.02 -1.54 0.66 0.00 0.27 0.00 0.00 31.44 30.85 1iei n GLU 314 CO 0.00 0.00 0.00 1.97 -0.41 0.00 0.00 177.13 178.69