#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2iem s LEU 2 N 0.00 3.23 0.24 -3.43 2.01 -1.26 -5.09 118.68 114.39 2iem s LEU 2 Ca 0.00 1.44 0.01 0.00 0.01 0.00 0.00 54.13 55.59 2iem s LEU 2 Cb 0.00 -4.47 -0.04 0.00 0.01 0.00 0.00 46.19 41.69 2iem s LEU 2 CO 0.00 -0.91 0.14 0.12 1.01 0.00 0.00 176.35 176.70 2iem s PHE 3 N -3.16 1.38 0.24 0.29 5.36 -1.26 -5.18 117.98 115.65 2iem s PHE 3 Ca 0.55 -1.35 -0.06 0.00 -0.96 0.00 0.00 56.93 55.11 2iem s PHE 3 Cb -0.11 -0.71 -0.02 0.00 -0.34 0.00 0.00 43.02 41.84 2iem s PHE 3 CO 0.54 -0.57 0.32 0.16 -1.46 0.00 0.00 175.22 174.21 2iem s ASP 4 N -3.25 0.19 0.85 6.13 -4.77 -1.26 -5.16 116.67 109.40 2iem s ASP 4 Ca 0.38 -1.22 -0.11 0.00 -3.30 0.00 0.00 52.55 48.30 2iem s ASP 4 Cb 0.06 0.50 0.10 0.00 -1.09 0.00 0.00 42.92 42.50 2iem s ASP 4 CO 0.15 -1.02 1.09 -1.59 0.70 0.00 0.00 175.17 174.50 2iem s LYS 5 N -3.96 1.65 -0.93 2.11 0.00 -1.26 -4.98 119.74 112.38 2iem s LYS 5 Ca 0.31 0.99 -0.04 0.00 0.00 0.00 0.00 55.97 57.23 2iem s LYS 5 Cb 0.03 -1.84 0.23 0.00 0.00 0.00 0.00 37.83 36.25 2iem s LYS 5 CO 0.12 -2.01 0.84 0.15 0.00 0.00 0.00 175.35 174.45 2iem s LYS 6 N -4.91 3.49 -0.23 1.78 1.02 -1.26 -4.78 119.74 114.85 2iem s LYS 6 Ca 0.63 -3.17 0.16 0.00 0.02 0.00 0.00 55.97 53.61 2iem s LYS 6 Cb -0.18 -4.12 0.47 0.00 -0.52 0.00 0.00 37.83 33.48 2iem s LYS 6 CO 0.57 -1.25 1.16 1.58 -0.92 0.00 0.00 175.35 176.48 2iem n HIS 7 N 2.59 1.51 -2.11 3.18 -0.00 -1.26 -5.05 115.22 114.08 2iem n HIS 7 Ca 0.21 -1.89 0.00 0.00 0.46 0.00 0.00 57.72 56.50 2iem n HIS 7 Cb 0.38 -0.26 0.00 0.00 -0.12 0.00 0.00 29.99 29.99 2iem n HIS 7 CO 0.00 0.00 0.00 -0.11 0.46 0.00 0.00 176.34 176.69 2iem n LEU 8 N -0.57 0.00 -4.71 0.27 -0.00 -1.26 -5.14 117.00 105.59 2iem n LEU 8 Ca 0.22 0.00 -0.34 0.00 -0.00 0.00 0.00 56.01 55.89 2iem n LEU 8 Cb 0.89 0.00 0.11 0.00 -0.00 0.00 0.00 43.42 44.42 2iem n LEU 8 CO 0.17 0.00 0.80 0.54 -0.00 0.00 0.00 177.39 178.89 2iem s VAL 9 N -0.45 2.16 0.71 1.96 0.11 -1.26 -4.96 120.40 118.66 2iem s VAL 9 Ca 0.00 0.08 -0.14 0.00 -2.93 0.00 0.00 61.98 58.99 2iem s VAL 9 Cb 0.00 -2.62 0.03 0.00 -1.53 0.00 0.00 36.38 32.25 2iem s VAL 9 CO 0.00 -0.04 1.12 -0.44 -3.33 0.00 0.00 175.10 172.41 2iem s SER 10 N -2.02 4.70 0.35 3.54 0.01 -1.26 -4.87 113.70 114.15 2iem s SER 10 Ca 0.75 2.02 0.26 0.00 1.31 0.00 0.00 55.95 60.29 2iem s SER 10 Cb -0.30 -2.55 0.89 0.00 0.21 0.00 0.00 66.02 64.27 2iem s SER 10 CO 0.47 -1.91 1.77 1.55 0.41 0.00 0.00 173.24 175.53 2iem h PRO 11 N -0.41 0.00 0.00 12.44 0.13 -1.93 -1.39 132.00 140.84 2iem h PRO 11 Ca -0.46 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.62 2iem h PRO 11 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 2iem h PRO 11 CO 0.52 0.00 -0.25 0.00 -0.23 0.00 0.00 178.00 178.04 2iem h ALA 12 N 2.23 1.00 0.02 -0.56 0.00 -1.98 -3.19 119.26 116.78 2iem h ALA 12 Ca 0.00 -0.22 -0.38 0.00 0.00 0.00 0.00 54.91 54.30 2iem h ALA 12 Cb 0.64 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.33 2iem h ALA 12 CO 0.00 0.31 -2.38 -3.47 0.00 0.00 0.00 179.25 173.71 2iem n ASP 13 N -3.39 1.98 -4.55 0.00 -0.08 -1.04 -4.78 116.55 104.68 2iem n ASP 13 Ca 0.00 -0.07 -0.41 0.00 -1.51 0.00 0.00 54.79 52.80 2iem n ASP 13 Cb 0.45 -0.48 -0.03 0.00 2.34 0.00 0.00 41.12 43.40 2iem n ASP 13 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2iem s ALA 14 N -2.53 2.74 0.25 -1.67 0.00 -0.55 -4.85 121.76 115.14 2iem s ALA 14 Ca -0.32 -1.52 0.05 0.00 0.00 0.00 0.00 51.96 50.17 2iem s ALA 14 Cb 0.08 -4.31 -0.03 0.00 0.00 0.00 0.00 23.12 18.87 2iem s ALA 14 CO 0.64 -3.35 0.36 -0.51 0.00 0.00 0.00 175.76 172.90 2iem s LEU 15 N 5.62 4.28 -0.70 0.00 2.01 -1.26 -4.73 118.68 123.89 2iem s LEU 15 Ca 0.37 0.04 -0.26 0.00 0.01 0.00 0.00 54.13 54.28 2iem s LEU 15 Cb -0.07 -2.83 0.01 0.00 0.01 0.00 0.00 46.19 43.31 2iem s LEU 15 CO 0.11 -0.09 1.57 -2.16 1.01 0.00 0.00 176.35 176.79 2iem s PRO 16 N -3.99 2.93 0.00 1.29 0.04 -1.26 -4.69 135.00 129.33 2iem s PRO 16 Ca 0.35 0.09 0.00 0.00 0.04 0.00 0.00 61.00 61.47 2iem s PRO 16 Cb -0.09 -4.37 0.00 0.00 0.04 0.00 0.00 34.50 30.08 2iem s PRO 16 CO 0.29 -2.47 0.00 0.41 0.04 0.00 0.00 177.00 175.27 2iem n GLY 17 N 5.66 -2.30 3.12 0.56 0.00 -1.26 -4.97 105.19 106.00 2iem n GLY 17 Ca 0.14 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.04 2iem n GLY 17 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2iem s ARG 18 N 0.00 0.71 -0.44 1.61 1.81 -1.14 -5.03 118.95 116.46 2iem s ARG 18 Ca 0.00 -1.08 0.04 0.00 -1.72 0.00 0.00 55.73 52.97 2iem s ARG 18 Cb 0.00 -0.26 0.65 0.00 -0.45 0.00 0.00 34.95 34.89 2iem s ARG 18 CO 0.00 0.02 1.87 0.27 -0.68 0.00 0.00 175.30 176.78 2iem n ASN 19 N 0.62 3.69 -4.30 0.23 6.94 -1.26 -4.06 115.26 117.13 2iem n ASN 19 Ca -0.17 -3.63 -0.27 0.00 -0.02 0.00 0.00 54.58 50.48 2iem n ASN 19 Cb 0.58 -0.82 -0.14 0.00 -2.36 0.00 0.00 39.78 37.04 2iem n ASN 19 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 2iem s THR 20 N -3.33 1.89 0.49 5.53 -4.23 -1.26 -5.07 115.64 109.66 2iem s THR 20 Ca 0.56 -1.34 -0.20 0.00 -1.18 0.00 0.00 61.69 59.53 2iem s THR 20 Cb 0.47 -1.64 -0.08 0.00 1.34 0.00 0.00 72.50 72.59 2iem s THR 20 CO 0.10 0.24 1.04 -2.16 -0.54 0.00 0.00 174.62 173.29 2iem s PRO 21 N -1.32 3.78 0.55 3.99 0.04 -1.26 -4.60 135.00 136.19 2iem s PRO 21 Ca 0.09 1.35 -0.19 0.00 0.04 0.00 0.00 61.00 62.30 2iem s PRO 21 Cb -0.09 -2.09 -0.06 0.00 0.04 0.00 0.00 34.50 32.30 2iem s PRO 21 CO 0.02 -0.44 1.11 -1.64 0.04 0.00 0.00 177.00 176.09 2iem s MET 22 N -3.27 3.36 -0.06 4.56 -1.94 -1.26 -4.97 119.30 115.71 2iem s MET 22 Ca 0.67 1.54 -0.30 0.00 -1.71 0.00 0.00 55.69 55.90 2iem s MET 22 Cb -0.16 -2.01 -0.03 0.00 2.01 0.00 0.00 34.83 34.63 2iem s MET 22 CO 0.21 -0.83 1.22 -1.25 -0.01 0.00 0.00 175.02 174.36 2iem s PRO 23 N -3.38 4.34 -0.00 2.03 0.04 -1.26 -4.93 135.00 131.82 2iem s PRO 23 Ca 0.71 1.70 0.01 0.00 0.04 0.00 0.00 61.00 63.46 2iem s PRO 23 Cb -0.22 -3.58 -0.00 0.00 0.04 0.00 0.00 34.50 30.74 2iem s PRO 23 CO 0.28 -0.48 -0.03 0.08 0.04 0.00 0.00 177.00 176.89 2iem s VAL 24 N 2.33 0.26 0.62 -0.36 1.01 -1.26 -2.81 120.40 120.19 2iem s VAL 24 Ca 0.56 -0.14 -0.18 0.00 0.00 0.00 0.00 61.98 62.23 2iem s VAL 24 Cb -0.25 -0.22 -0.05 0.00 0.00 0.00 0.00 36.38 35.85 2iem s VAL 24 CO 0.22 0.07 0.81 0.00 0.00 0.00 0.00 175.10 176.20 2iem n ALA 25 N 3.00 -0.33 0.04 5.51 0.00 -1.26 -4.92 120.51 122.55 2iem n ALA 25 Ca -0.13 -0.04 -0.20 0.00 0.00 0.00 0.00 53.44 53.08 2iem n ALA 25 Cb 0.59 -2.02 -0.12 0.00 0.00 0.00 0.00 19.45 17.90 2iem n ALA 25 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2iem h THR 26 N 0.26 1.40 -3.32 0.00 2.02 -2.00 -3.44 112.91 107.82 2iem h THR 26 Ca -0.47 -2.31 -0.64 0.00 0.77 0.00 0.00 66.41 63.75 2iem h THR 26 Cb 1.37 2.76 -0.20 0.00 -1.74 0.00 0.00 68.15 70.35 2iem h THR 26 CO 0.49 0.68 -0.64 -0.76 0.37 0.00 0.00 175.52 175.65 2iem s LEU 27 N -8.08 3.39 0.80 2.58 2.01 -1.26 -1.50 118.68 116.62 2iem s LEU 27 Ca -0.12 -0.05 -0.15 0.00 0.01 0.00 0.00 54.13 53.82 2iem s LEU 27 Cb 0.04 -1.81 -0.02 0.00 0.01 0.00 0.00 46.19 44.40 2iem s LEU 27 CO 0.86 0.21 0.40 1.57 1.01 0.00 0.00 176.35 180.41 2iem n HIS 28 N 3.27 -1.29 0.06 0.29 -0.00 0.29 -4.72 115.22 113.12 2iem n HIS 28 Ca -0.17 0.29 -0.03 0.00 0.46 0.00 0.00 57.72 58.27 2iem n HIS 28 Cb 0.53 -1.84 -0.07 0.00 -0.12 0.00 0.00 29.99 28.48 2iem n HIS 28 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2iem h ALA 29 N -0.77 0.61 0.00 1.57 0.00 -1.93 -2.33 119.26 116.42 2iem h ALA 29 Ca -0.45 -0.87 0.00 0.00 0.00 0.00 0.00 54.91 53.59 2iem h ALA 29 Cb 1.33 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.23 2iem h ALA 29 CO 0.39 1.04 -0.15 0.28 0.00 0.00 0.00 179.25 180.81 2iem n VAL 30 N -3.12 0.37 -0.36 0.00 0.31 -1.26 -4.44 118.33 109.84 2iem n VAL 30 Ca -0.05 0.42 0.05 0.00 -0.01 0.00 0.00 64.34 64.75 2iem n VAL 30 Cb 0.88 -1.73 0.20 0.00 -0.91 0.00 0.00 33.84 32.28 2iem n VAL 30 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 2iem h ASN 31 N -0.26 0.94 -0.04 4.52 -1.24 -1.79 -3.45 115.58 114.26 2iem h ASN 31 Ca 0.00 0.03 -0.02 0.00 0.71 0.00 0.00 56.30 57.02 2iem h ASN 31 Cb 0.15 -0.16 -0.01 0.00 0.73 0.00 0.00 38.32 39.03 2iem h ASN 31 CO 0.00 0.55 -0.02 0.61 -1.29 0.00 0.00 177.43 177.29 2iem n GLY 32 N -1.35 0.44 3.33 1.57 0.00 -0.88 -4.96 105.19 103.34 2iem n GLY 32 Ca 0.17 -1.06 -0.17 0.00 0.00 0.00 0.00 46.02 44.96 2iem n GLY 32 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2iem s HIS 33 N -2.03 1.56 0.35 1.61 4.02 -1.25 -4.70 115.29 114.85 2iem s HIS 33 Ca 0.00 -1.18 -0.22 0.00 1.02 0.00 0.00 55.06 54.68 2iem s HIS 33 Cb 0.00 -0.92 -0.15 0.00 -1.02 0.00 0.00 32.58 30.49 2iem s HIS 33 CO 0.00 -0.33 0.18 0.43 1.02 0.00 0.00 174.74 176.04 2iem n SER 34 N -0.50 -2.42 -0.10 1.40 7.64 -1.26 0.11 113.62 118.48 2iem n SER 34 Ca -0.00 0.86 -0.18 0.00 1.01 0.00 0.00 58.87 60.56 2iem n SER 34 Cb 0.66 -0.87 -0.13 0.00 -1.01 0.00 0.00 64.21 62.87 2iem n SER 34 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2iem n MET 35 N 1.22 0.67 -0.49 1.43 2.81 -0.57 -4.25 117.12 117.94 2iem n MET 35 Ca 0.12 0.16 0.03 0.00 -1.81 0.00 0.00 57.70 56.20 2iem n MET 35 Cb 0.35 -1.56 0.22 0.00 -0.71 0.00 0.00 33.22 31.52 2iem n MET 35 CO 0.00 0.00 0.00 -2.37 1.51 0.00 0.00 175.97 175.11 2iem n THR 36 N -3.25 1.52 -3.39 2.03 5.66 -1.26 -4.86 114.28 110.74 2iem n THR 36 Ca -0.42 -0.77 -0.38 0.00 -3.05 0.00 0.00 64.05 59.44 2iem n THR 36 Cb 1.02 -0.39 -0.07 0.00 -1.55 0.00 0.00 70.33 69.33 2iem n THR 36 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 2iem s ASN 37 N -0.41 6.50 -0.30 1.09 -0.87 -1.26 -5.04 114.94 114.65 2iem s ASN 37 Ca 0.30 0.60 -0.03 0.00 -1.57 0.00 0.00 52.86 52.15 2iem s ASN 37 Cb 0.23 -2.24 0.10 0.00 -0.02 0.00 0.00 41.25 39.32 2iem s ASN 37 CO 0.08 -0.03 0.12 -0.69 -2.57 0.00 0.00 177.10 174.02 2iem s VAL 38 N 0.99 0.22 0.16 1.60 1.01 -1.26 -5.02 120.40 118.10 2iem s VAL 38 Ca 0.21 -0.97 -0.30 0.00 0.00 0.00 0.00 61.98 60.91 2iem s VAL 38 Cb -0.14 -1.19 -0.07 0.00 0.00 0.00 0.00 36.38 34.97 2iem s VAL 38 CO 0.08 -0.72 1.12 -2.16 0.00 0.00 0.00 175.10 173.42 2iem s PRO 39 N 1.93 4.56 -0.23 2.72 0.04 -1.26 -4.91 135.00 137.85 2iem s PRO 39 Ca 0.09 1.74 -0.43 0.00 0.04 0.00 0.00 61.00 62.44 2iem s PRO 39 Cb -0.17 -3.28 -0.20 0.00 0.04 0.00 0.00 34.50 30.89 2iem s PRO 39 CO -0.33 0.01 1.35 -0.25 0.04 0.00 0.00 177.00 177.82 2iem n ASP 40 N 2.60 0.70 0.00 6.66 10.43 -1.26 -1.18 116.55 134.50 2iem n ASP 40 Ca 0.04 1.17 0.00 0.00 2.57 0.00 0.00 54.79 58.57 2iem n ASP 40 Cb 0.46 -0.92 0.00 0.00 1.84 0.00 0.00 41.12 42.50 2iem n ASP 40 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2iem n GLY 41 N 2.78 0.78 3.90 0.44 0.00 -1.26 -5.10 105.19 106.73 2iem n GLY 41 Ca 0.25 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.07 2iem n GLY 41 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2iem s MET 42 N -0.54 2.84 0.02 1.61 -1.94 -0.33 -4.44 119.30 116.53 2iem s MET 42 Ca 0.00 -1.22 -0.04 0.00 -1.71 0.00 0.00 55.69 52.72 2iem s MET 42 Cb 0.00 -2.59 -0.01 0.00 2.01 0.00 0.00 34.83 34.24 2iem s MET 42 CO 0.00 0.05 0.06 -2.00 -0.01 0.00 0.00 175.02 173.12 2iem s GLU 43 N -4.07 0.48 0.06 2.03 2.56 -0.88 -4.99 118.70 113.89 2iem s GLU 43 Ca 0.43 -0.66 0.02 0.00 0.00 0.00 0.00 54.97 54.76 2iem s GLU 43 Cb -0.07 0.19 -0.04 0.00 2.00 0.00 0.00 34.13 36.21 2iem s GLU 43 CO 0.28 -0.11 0.09 0.42 -0.56 0.00 0.00 175.26 175.38 2iem s ILE 44 N -2.07 4.62 -0.02 -3.70 1.01 -1.26 -1.67 121.20 118.11 2iem s ILE 44 Ca -0.10 -0.67 0.00 0.00 0.00 0.00 0.00 60.65 59.89 2iem s ILE 44 Cb -0.05 -3.20 0.02 0.00 0.01 0.00 0.00 42.46 39.24 2iem s ILE 44 CO -0.02 0.18 -0.00 0.00 0.00 0.00 0.00 174.94 175.09 2iem s ALA 45 N -1.35 0.26 -0.06 9.38 0.00 0.60 -4.51 121.76 126.08 2iem s ALA 45 Ca 0.28 0.13 0.06 0.00 0.00 0.00 0.00 51.96 52.43 2iem s ALA 45 Cb -0.12 -0.25 -0.01 0.00 0.00 0.00 0.00 23.12 22.73 2iem s ALA 45 CO 0.21 -0.05 -0.24 0.42 0.00 0.00 0.00 175.76 176.09 2iem s ILE 46 N 0.80 2.00 0.16 0.00 1.01 -1.10 0.20 121.20 124.28 2iem s ILE 46 Ca -0.08 -1.04 -0.08 0.00 0.00 0.00 0.00 60.65 59.46 2iem s ILE 46 Cb -0.11 -1.69 -0.01 0.00 0.01 0.00 0.00 42.46 40.65 2iem s ILE 46 CO -0.02 0.56 0.25 -0.36 0.00 0.00 0.00 174.94 175.37 2iem s PHE 47 N -0.14 0.47 -0.02 3.97 0.40 -0.90 -1.09 117.98 120.69 2iem s PHE 47 Ca -0.04 -0.84 0.00 0.00 -0.60 0.00 0.00 56.93 55.45 2iem s PHE 47 Cb -0.14 -0.12 0.02 0.00 0.51 0.00 0.00 43.02 43.29 2iem s PHE 47 CO 0.04 -0.69 0.01 0.00 0.70 0.00 0.00 175.22 175.28 2iem s ALA 48 N -3.98 0.12 0.08 5.36 0.00 -0.48 -1.98 121.76 120.88 2iem s ALA 48 Ca 0.18 0.18 -0.01 0.00 0.00 0.00 0.00 51.96 52.32 2iem s ALA 48 Cb 0.04 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.97 2iem s ALA 48 CO 0.00 -0.06 0.12 -1.33 0.00 0.00 0.00 175.76 174.49 2iem n MET 49 N 3.83 0.17 0.00 0.00 2.81 -1.26 -2.61 117.12 120.07 2iem n MET 49 Ca -0.23 -0.64 0.00 0.00 -1.81 0.00 0.00 57.70 55.02 2iem n MET 49 Cb 0.53 0.63 0.00 0.00 -0.71 0.00 0.00 33.22 33.67 2iem n MET 49 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2iem n GLY 50 N -0.13 -0.57 3.58 3.03 0.00 -1.26 -4.28 105.19 105.55 2iem n GLY 50 Ca -0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 2iem n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2iem h PHE 52 N 11.52 0.00 0.22 0.00 3.57 -1.98 2.18 116.94 132.44 2iem h PHE 52 Ca 0.04 0.00 -0.33 0.00 3.53 0.00 0.00 57.97 61.21 2iem h PHE 52 Cb 0.99 0.00 0.03 0.00 2.79 0.00 0.00 35.95 39.76 2iem h PHE 52 CO 1.07 0.05 -1.55 -1.49 -2.23 0.00 0.00 178.31 174.16 2iem h TRP 53 N 0.00 0.84 0.00 0.41 6.55 -1.96 -2.98 115.95 118.82 2iem h TRP 53 Ca -0.00 -0.62 -0.13 0.00 0.95 0.00 0.00 58.89 59.09 2iem h TRP 53 Cb 0.11 -0.03 -0.02 0.00 -0.86 0.00 0.00 29.16 28.36 2iem h TRP 53 CO 0.00 1.60 -0.64 0.78 -1.05 0.00 0.00 178.44 179.13 2iem h GLY 54 N 0.31 0.00 0.67 1.49 0.00 -1.68 -2.94 103.07 100.92 2iem h GLY 54 Ca -0.29 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.01 2iem h GLY 54 CO 0.22 0.00 -0.32 -2.08 0.00 0.00 0.00 176.54 174.36 2iem h VAL 55 N 0.00 0.00 -1.01 4.60 2.07 0.35 0.21 116.25 122.46 2iem h VAL 55 Ca -0.01 -0.30 0.24 0.00 0.82 0.00 0.00 66.70 67.45 2iem h VAL 55 Cb 1.25 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.91 2iem h VAL 55 CO 0.08 0.00 0.62 1.05 0.02 0.00 0.00 177.57 179.34 2iem h GLU 56 N -1.21 0.54 -0.29 1.57 4.11 -1.60 0.48 114.58 118.17 2iem h GLU 56 Ca -0.09 -0.03 -0.16 0.00 0.07 0.00 0.00 59.36 59.14 2iem h GLU 56 Cb 0.69 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.82 2iem h GLU 56 CO 0.15 0.36 -0.47 0.00 0.07 0.00 0.00 179.01 179.12 2iem h ARG 57 N 0.55 0.78 0.00 1.06 2.47 -1.41 -1.99 114.38 115.85 2iem h ARG 57 Ca 0.61 -0.45 -0.00 0.00 -1.26 0.00 0.00 59.98 58.88 2iem h ARG 57 Cb 1.25 0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 29.60 2iem h ARG 57 CO -0.40 1.08 -0.00 1.37 0.56 0.00 0.00 179.97 182.58 2iem h LEU 58 N 0.62 0.00 0.00 3.04 8.10 0.32 0.99 115.31 128.38 2iem h LEU 58 Ca 0.03 0.00 -0.03 0.00 0.11 0.00 0.00 57.88 57.99 2iem h LEU 58 Cb 1.04 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 41.26 2iem h LEU 58 CO 0.10 0.00 -0.19 -0.26 -4.11 0.00 0.00 178.44 173.98 2iem h PHE 59 N 0.00 0.00 0.05 0.17 0.04 -0.49 -3.13 116.94 113.58 2iem h PHE 59 Ca -0.00 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.77 2iem h PHE 59 Cb 0.30 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.45 2iem h PHE 59 CO 0.00 0.69 -0.02 0.11 -0.60 0.00 0.00 178.31 178.48 2iem h TRP 60 N -1.00 -0.06 -0.08 -0.55 5.08 -1.21 -2.69 115.95 115.45 2iem h TRP 60 Ca -0.04 -0.00 0.02 0.00 1.08 0.00 0.00 58.89 59.95 2iem h TRP 60 Cb 0.70 0.02 -0.00 0.00 -3.00 0.00 0.00 29.16 26.88 2iem h TRP 60 CO 0.14 0.42 0.50 1.96 -1.28 0.00 0.00 178.44 180.18 2iem h GLN 61 N -0.58 0.00 -6.68 0.12 1.08 0.84 -3.40 115.11 106.49 2iem h GLN 61 Ca -0.01 0.00 -0.50 0.00 -1.45 0.00 0.00 58.65 56.69 2iem h GLN 61 Cb 0.51 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.92 2iem h GLN 61 CO 0.01 0.00 0.31 -1.17 -0.95 0.00 0.00 178.83 177.03 2iem s LEU 62 N -5.82 4.63 -0.45 1.46 2.96 -1.01 -4.99 118.68 115.46 2iem s LEU 62 Ca -0.03 1.86 -0.28 0.00 -0.22 0.00 0.00 54.13 55.46 2iem s LEU 62 Cb 0.08 -3.53 0.01 0.00 0.50 0.00 0.00 46.19 43.25 2iem s LEU 62 CO 0.26 0.17 1.44 -2.16 -1.32 0.00 0.00 176.35 174.73 2iem s PRO 63 N -1.13 3.47 0.00 0.98 0.04 -1.26 -2.89 135.00 134.21 2iem s PRO 63 Ca 0.40 0.83 0.00 0.00 0.04 0.00 0.00 61.00 62.27 2iem s PRO 63 Cb -0.25 -4.06 0.00 0.00 0.04 0.00 0.00 34.50 30.22 2iem s PRO 63 CO 0.30 -1.70 0.00 0.41 0.04 0.00 0.00 177.00 176.06 2iem n GLY 64 N 5.16 1.13 3.66 0.56 0.00 -1.26 -4.74 105.19 109.70 2iem n GLY 64 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2iem n GLY 64 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2iem s VAL 65 N -0.08 4.92 -0.13 1.61 1.01 -1.14 -2.68 120.40 123.91 2iem s VAL 65 Ca 0.00 1.48 -0.14 0.00 0.00 0.00 0.00 61.98 63.32 2iem s VAL 65 Cb 0.00 -4.07 -0.12 0.00 0.00 0.00 0.00 36.38 32.19 2iem s VAL 65 CO 0.00 0.04 0.32 0.22 0.00 0.00 0.00 175.10 175.68 2iem h TYR 66 N 7.43 0.00 -3.92 5.22 5.03 -1.51 -3.46 116.97 125.76 2iem h TYR 66 Ca -0.29 0.00 -0.11 0.00 2.58 0.00 0.00 58.73 60.91 2iem h TYR 66 Cb 1.13 0.00 -0.12 0.00 1.55 0.00 0.00 36.73 39.29 2iem h TYR 66 CO 0.72 0.50 -0.33 -1.12 -1.32 0.00 0.00 178.16 176.61 2iem s SER 67 N -5.91 0.05 0.11 -2.11 0.01 -1.08 -4.50 113.70 100.27 2iem s SER 67 Ca -0.10 -0.91 -0.10 0.00 1.31 0.00 0.00 55.95 56.15 2iem s SER 67 Cb -0.01 0.44 0.00 0.00 0.21 0.00 0.00 66.02 66.66 2iem s SER 67 CO 0.33 -0.90 0.23 0.42 0.41 0.00 0.00 173.24 173.73 2iem s THR 68 N -3.98 0.12 -0.09 1.44 -4.23 -1.26 -0.64 115.64 106.99 2iem s THR 68 Ca 0.19 -1.13 -0.12 0.00 -1.18 0.00 0.00 61.69 59.45 2iem s THR 68 Cb 0.03 -1.39 0.03 0.00 1.34 0.00 0.00 72.50 72.51 2iem s THR 68 CO 0.01 -0.55 0.31 0.00 -0.54 0.00 0.00 174.62 173.85 2iem s ALA 69 N -3.87 -0.76 -0.21 3.99 0.00 0.13 -4.98 121.76 116.06 2iem s ALA 69 Ca 0.07 0.72 -0.09 0.00 0.00 0.00 0.00 51.96 52.66 2iem s ALA 69 Cb 0.04 -0.36 -0.04 0.00 0.00 0.00 0.00 23.12 22.76 2iem s ALA 69 CO -0.09 -0.18 0.10 0.00 0.00 0.00 0.00 175.76 175.59 2iem s ALA 70 N -0.23 3.49 0.03 0.00 0.00 -1.26 0.92 121.76 124.71 2iem s ALA 70 Ca -0.04 -0.82 0.00 0.00 0.00 0.00 0.00 51.96 51.11 2iem s ALA 70 Cb -0.03 -2.10 -0.00 0.00 0.00 0.00 0.00 23.12 20.98 2iem s ALA 70 CO 0.01 -0.01 0.03 0.41 0.00 0.00 0.00 175.76 176.20 2iem n GLY 71 N 3.90 3.76 3.32 0.00 0.00 0.43 0.17 105.19 116.77 2iem n GLY 71 Ca -0.16 -1.62 -0.22 0.00 0.00 0.00 0.00 46.02 44.02 2iem n GLY 71 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2iem s TYR 72 N -2.68 1.82 0.15 1.61 2.02 0.20 -2.65 117.35 117.82 2iem s TYR 72 Ca 0.03 -0.45 -0.15 0.00 -0.37 0.00 0.00 57.07 56.12 2iem s TYR 72 Cb 0.00 -0.93 0.03 0.00 -0.40 0.00 0.00 41.96 40.65 2iem s TYR 72 CO 0.02 0.30 0.41 -0.08 -1.57 0.00 0.00 175.55 174.63 2iem s THR 73 N -1.80 0.06 0.00 -0.71 -1.32 -1.07 -2.58 115.64 108.22 2iem s THR 73 Ca 0.13 -0.77 0.00 0.00 -1.21 0.00 0.00 61.69 59.85 2iem s THR 73 Cb -0.07 -1.38 0.00 0.00 -1.51 0.00 0.00 72.50 69.54 2iem s THR 73 CO 0.06 -0.27 0.00 0.61 -2.21 0.00 0.00 174.62 172.81 2iem n GLY 74 N -0.25 2.57 3.90 6.08 0.00 -1.26 0.19 105.19 116.43 2iem n GLY 74 Ca -0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.60 2iem n GLY 74 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2iem s GLY 75 N -1.88 1.61 -0.01 -0.02 0.00 -0.59 -4.44 107.32 101.99 2iem s GLY 75 Ca 0.00 -0.66 0.06 0.00 0.00 0.00 0.00 44.72 44.12 2iem s GLY 75 CO 0.00 -0.19 0.14 2.98 0.00 0.00 0.00 173.10 176.03 2iem n TYR 76 N -3.24 0.00 -2.61 1.90 4.19 0.15 -4.87 117.16 112.68 2iem n TYR 76 Ca 0.08 0.00 -0.42 0.00 3.31 0.00 0.00 57.90 60.87 2iem n TYR 76 Cb 0.61 -0.12 -0.03 0.00 0.49 0.00 0.00 39.34 40.29 2iem n TYR 76 CO 0.00 0.00 0.00 0.99 0.91 0.00 0.00 176.86 178.76 2iem s THR 77 N -2.30 4.50 -0.18 2.97 2.01 -1.26 -4.99 115.64 116.39 2iem s THR 77 Ca -0.02 1.85 -0.29 0.00 0.31 0.00 0.00 61.69 63.54 2iem s THR 77 Cb 0.04 -4.18 -0.01 0.00 0.01 0.00 0.00 72.50 68.35 2iem s THR 77 CO 0.24 0.17 1.28 -2.16 -0.69 0.00 0.00 174.62 173.47 2iem s PRO 78 N 0.79 4.19 -1.00 4.92 0.04 -1.26 -3.87 135.00 138.81 2iem s PRO 78 Ca 0.53 1.63 -0.16 0.00 0.04 0.00 0.00 61.00 63.04 2iem s PRO 78 Cb -0.24 -3.79 0.02 0.00 0.04 0.00 0.00 34.50 30.53 2iem s PRO 78 CO 0.29 -0.77 0.63 0.09 0.04 0.00 0.00 177.00 177.29 2iem n ASN 79 N 6.78 -4.48 -4.03 6.66 3.02 -1.26 -2.89 115.26 119.06 2iem n ASN 79 Ca 0.14 -1.13 -0.30 0.00 -0.03 0.00 0.00 54.58 53.26 2iem n ASN 79 Cb 0.45 -1.59 0.21 0.00 -0.61 0.00 0.00 39.78 38.24 2iem n ASN 79 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2iem s PRO 80 N -6.09 -0.18 0.19 3.52 0.04 -1.25 -4.26 135.00 126.98 2iem s PRO 80 Ca 0.22 -0.20 -0.03 0.00 0.04 0.00 0.00 61.00 61.02 2iem s PRO 80 Cb -0.12 -1.73 -0.05 0.00 0.04 0.00 0.00 34.50 32.64 2iem s PRO 80 CO 0.93 -2.99 0.42 0.95 0.04 0.00 0.00 177.00 176.35 2iem s THR 81 N -3.44 5.15 0.21 1.26 -4.23 -1.26 -4.93 115.64 108.40 2iem s THR 81 Ca 0.72 -0.12 -0.09 0.00 -1.18 0.00 0.00 61.69 61.01 2iem s THR 81 Cb -0.07 -3.69 0.15 0.00 1.34 0.00 0.00 72.50 70.23 2iem s THR 81 CO 0.54 -0.12 1.75 0.22 -0.54 0.00 0.00 174.62 176.48 2iem h TYR 82 N 2.27 0.44 -0.31 3.99 3.20 -1.98 0.80 116.97 125.38 2iem h TYR 82 Ca -0.47 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.34 2iem h TYR 82 Cb 1.18 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.33 2iem h TYR 82 CO 0.58 0.13 -0.19 0.00 -1.64 0.00 0.00 178.16 177.04 2iem h ARG 83 N 0.44 0.57 -0.09 1.82 3.08 -1.99 -0.56 114.38 117.65 2iem h ARG 83 Ca 0.31 -0.20 -0.16 0.00 0.07 0.00 0.00 59.98 60.00 2iem h ARG 83 Cb 0.36 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 2iem h ARG 83 CO -0.29 0.73 -0.64 1.49 -1.07 0.00 0.00 179.97 180.19 2iem h GLU 84 N 0.51 0.34 -0.37 0.04 4.81 -1.46 -2.56 114.58 115.89 2iem h GLU 84 Ca 0.08 -0.25 -0.17 0.00 -0.13 0.00 0.00 59.36 58.90 2iem h GLU 84 Cb 0.61 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.03 2iem h GLU 84 CO 0.04 0.86 -0.42 0.28 -0.73 0.00 0.00 179.01 179.05 2iem h VAL 85 N 0.25 1.27 0.00 0.32 2.07 0.92 -2.69 116.25 118.39 2iem h VAL 85 Ca -0.01 -1.59 -0.03 0.00 0.82 0.00 0.00 66.70 65.88 2iem h VAL 85 Cb 1.17 1.43 -0.00 0.00 -1.52 0.00 0.00 31.29 32.36 2iem h VAL 85 CO 0.11 0.53 -0.15 0.77 0.02 0.00 0.00 177.57 178.85 2iem h SER 86 N 0.75 0.00 -0.49 0.57 4.64 -1.02 -1.69 113.55 116.32 2iem h SER 86 Ca 0.05 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.34 2iem h SER 86 Cb 1.02 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.08 2iem h SER 86 CO 0.10 0.15 0.21 0.28 -0.87 0.00 0.00 176.83 176.69 2iem h SER 87 N 0.00 0.70 0.00 4.97 0.02 -1.11 -3.46 113.55 114.67 2iem h SER 87 Ca -0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 2iem h SER 87 Cb 0.31 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.67 2iem h SER 87 CO 0.02 0.64 0.00 0.61 -1.14 0.00 0.00 176.83 176.96 2iem n GLY 88 N -1.07 0.64 0.56 -3.77 0.00 -0.64 -4.92 105.19 96.00 2iem n GLY 88 Ca 0.04 -0.40 0.14 0.00 0.00 0.00 0.00 46.02 45.80 2iem n GLY 88 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2iem n ASP 89 N 0.73 1.75 -0.03 1.61 9.92 -1.26 -3.77 116.55 125.50 2iem n ASP 89 Ca 0.00 -1.56 -0.00 0.00 -0.53 0.00 0.00 54.79 52.70 2iem n ASP 89 Cb 0.00 0.01 -0.10 0.00 -0.64 0.00 0.00 41.12 40.39 2iem n ASP 89 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 2iem n THR 90 N 0.35 0.43 -1.62 -3.53 -2.24 -1.26 -2.83 114.28 103.58 2iem n THR 90 Ca 0.18 -0.41 -0.05 0.00 -2.27 0.00 0.00 64.05 61.50 2iem n THR 90 Cb 0.40 -0.27 -0.01 0.00 -2.10 0.00 0.00 70.33 68.35 2iem n THR 90 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2iem n GLY 91 N 2.03 0.46 3.81 3.38 0.00 -1.25 0.29 105.19 113.92 2iem n GLY 91 Ca -0.11 -0.76 -0.36 0.00 0.00 0.00 0.00 46.02 44.79 2iem n GLY 91 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2iem s HIS 92 N -2.21 3.59 0.26 1.61 3.76 -1.26 -1.54 115.29 119.50 2iem s HIS 92 Ca 0.00 1.53 0.11 0.00 -0.15 0.00 0.00 55.06 56.54 2iem s HIS 92 Cb 0.00 -2.74 -0.05 0.00 1.11 0.00 0.00 32.58 30.90 2iem s HIS 92 CO 0.00 0.21 -0.11 0.00 -0.85 0.00 0.00 174.74 173.99 2iem s ALA 93 N -1.69 2.93 -0.41 -1.40 0.00 0.51 -4.55 121.76 117.14 2iem s ALA 93 Ca 0.49 -1.74 -0.29 0.00 0.00 0.00 0.00 51.96 50.43 2iem s ALA 93 Cb -0.16 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.46 2iem s ALA 93 CO 0.21 0.30 1.30 -1.21 0.00 0.00 0.00 175.76 176.36 2iem s GLU 94 N -3.47 3.69 0.02 0.00 8.01 0.13 -2.59 118.70 124.48 2iem s GLU 94 Ca 0.30 0.88 -0.04 0.00 0.01 0.00 0.00 54.97 56.11 2iem s GLU 94 Cb -0.06 -3.96 -0.01 0.00 -4.31 0.00 0.00 34.13 25.79 2iem s GLU 94 CO 0.17 -1.42 0.07 0.00 0.01 0.00 0.00 175.26 174.08 2iem s ALA 95 N 4.93 -0.10 0.01 5.21 0.00 -1.09 -4.12 121.76 126.60 2iem s ALA 95 Ca 0.56 -0.40 -0.04 0.00 0.00 0.00 0.00 51.96 52.09 2iem s ALA 95 Cb -0.12 0.15 -0.01 0.00 0.00 0.00 0.00 23.12 23.15 2iem s ALA 95 CO 0.30 -0.22 0.06 0.14 0.00 0.00 0.00 175.76 176.04 2iem s VAL 96 N -1.70 0.09 -0.02 0.00 -7.23 -0.84 -0.43 120.40 110.28 2iem s VAL 96 Ca -0.13 -0.74 -0.01 0.00 -1.81 0.00 0.00 61.98 59.29 2iem s VAL 96 Cb -0.07 -0.33 -0.04 0.00 0.56 0.00 0.00 36.38 36.50 2iem s VAL 96 CO -0.01 -0.41 0.09 0.00 -0.31 0.00 0.00 175.10 174.47 2iem s ARG 97 N -1.31 3.12 -0.03 4.82 1.70 0.26 -2.11 118.95 125.41 2iem s ARG 97 Ca -0.14 -0.44 0.02 0.00 -0.47 0.00 0.00 55.73 54.69 2iem s ARG 97 Cb -0.08 -2.90 0.01 0.00 -0.57 0.00 0.00 34.95 31.41 2iem s ARG 97 CO 0.00 0.66 -0.06 0.42 -1.08 0.00 0.00 175.30 175.24 2iem s ILE 98 N -1.18 0.58 -0.38 4.99 1.09 0.54 0.18 121.20 127.02 2iem s ILE 98 Ca 0.22 -0.22 -0.03 0.00 -1.10 0.00 0.00 60.65 59.53 2iem s ILE 98 Cb -0.12 -0.55 0.09 0.00 -1.06 0.00 0.00 42.46 40.83 2iem s ILE 98 CO 0.13 0.20 0.15 -0.69 -0.10 0.00 0.00 174.94 174.64 2iem s VAL 99 N 0.43 3.22 0.52 2.92 1.01 0.18 0.22 120.40 128.91 2iem s VAL 99 Ca -0.06 -1.88 0.00 0.00 0.00 0.00 0.00 61.98 60.04 2iem s VAL 99 Cb -0.10 -3.13 -0.00 0.00 0.00 0.00 0.00 36.38 33.15 2iem s VAL 99 CO 0.00 -0.55 0.01 -0.72 0.00 0.00 0.00 175.10 173.84 2iem s TYR 100 N 1.17 1.78 -0.16 5.22 1.13 -0.67 -1.21 117.35 124.61 2iem s TYR 100 Ca 0.05 -1.01 -0.06 0.00 -1.41 0.00 0.00 57.07 54.65 2iem s TYR 100 Cb -0.22 -1.57 -0.04 0.00 -1.10 0.00 0.00 41.96 39.04 2iem s TYR 100 CO -0.03 0.18 0.02 -0.51 -2.51 0.00 0.00 175.55 172.70 2iem s ASP 101 N -3.89 5.32 0.00 -0.18 -0.00 -1.09 -2.08 116.67 114.75 2iem s ASP 101 Ca 0.03 0.02 0.23 0.00 -0.00 0.00 0.00 52.55 52.83 2iem s ASP 101 Cb 0.01 -1.85 1.28 0.00 -0.00 0.00 0.00 42.92 42.35 2iem s ASP 101 CO 0.01 0.20 1.77 -0.81 -0.00 0.00 0.00 175.17 176.34 2iem n PRO 102 N 3.34 0.52 -0.03 8.23 -0.04 -1.26 -1.92 135.00 143.85 2iem n PRO 102 Ca -0.17 0.04 -0.03 0.00 -0.04 0.00 0.00 63.50 63.30 2iem n PRO 102 Cb 0.52 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.35 2iem n PRO 102 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2iem n SER 103 N -1.16 0.42 -0.08 3.54 2.88 -1.26 -4.40 113.62 113.57 2iem n SER 103 Ca 0.14 0.19 -0.19 0.00 -1.33 0.00 0.00 58.87 57.68 2iem n SER 103 Cb 0.14 0.72 -0.12 0.00 -0.75 0.00 0.00 64.21 64.19 2iem n SER 103 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 2iem h VAL 104 N 0.00 1.26 -3.64 2.46 2.07 -1.84 -3.48 116.25 113.09 2iem h VAL 104 Ca -0.29 -2.27 -0.35 0.00 0.82 0.00 0.00 66.70 64.61 2iem h VAL 104 Cb 1.78 2.72 -0.18 0.00 -1.52 0.00 0.00 31.29 34.10 2iem h VAL 104 CO 0.04 0.47 -0.74 -0.51 0.02 0.00 0.00 177.57 176.85 2iem s ILE 105 N -2.33 1.10 0.10 4.57 2.07 -0.81 -4.96 121.20 120.94 2iem s ILE 105 Ca -0.24 -1.71 0.02 0.00 -1.41 0.00 0.00 60.65 57.30 2iem s ILE 105 Cb 0.02 -1.47 -0.04 0.00 0.13 0.00 0.00 42.46 41.11 2iem s ILE 105 CO 0.65 -0.53 0.21 -0.94 -1.91 0.00 0.00 174.94 172.42 2iem s SER 106 N -2.53 6.19 0.34 4.50 1.04 -1.26 -4.03 113.70 117.95 2iem s SER 106 Ca 0.08 0.17 0.05 0.00 0.48 0.00 0.00 55.95 56.73 2iem s SER 106 Cb -0.03 -1.85 0.68 0.00 0.10 0.00 0.00 66.02 64.92 2iem s SER 106 CO 0.01 0.12 1.92 0.10 0.98 0.00 0.00 173.24 176.37 2iem h TYR 107 N 2.73 0.88 -0.84 5.02 -0.00 -1.95 -0.64 116.97 122.17 2iem h TYR 107 Ca -0.47 0.02 -0.02 0.00 0.00 0.00 0.00 58.73 58.27 2iem h TYR 107 Cb 1.18 -0.29 -0.04 0.00 0.00 0.00 0.00 36.73 37.58 2iem h TYR 107 CO 0.58 0.44 0.44 1.05 -0.00 0.00 0.00 178.16 180.67 2iem h GLU 108 N 0.84 1.19 -0.31 0.10 4.11 -1.98 -1.58 114.58 116.95 2iem h GLU 108 Ca 0.37 -0.15 0.01 0.00 0.07 0.00 0.00 59.36 59.66 2iem h GLU 108 Cb 0.34 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 2iem h GLU 108 CO -0.14 0.89 0.19 1.96 0.07 0.00 0.00 179.01 181.98 2iem h GLN 109 N 1.19 0.39 -0.99 1.06 4.20 -1.52 0.39 115.11 119.82 2iem h GLN 109 Ca 0.30 -0.02 0.02 0.00 0.06 0.00 0.00 58.65 59.00 2iem h GLN 109 Cb 0.06 -0.09 -0.05 0.00 0.30 0.00 0.00 27.48 27.70 2iem h GLN 109 CO -0.04 0.26 0.66 -0.07 -0.67 0.00 0.00 178.83 178.96 2iem h LEU 110 N 0.40 1.13 -1.04 1.46 3.38 -1.07 -0.09 115.31 119.48 2iem h LEU 110 Ca 0.12 -0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.97 2iem h LEU 110 Cb -0.02 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 2iem h LEU 110 CO -0.04 0.81 -0.46 -0.07 0.09 0.00 0.00 178.44 178.76 2iem h LEU 111 N 1.33 0.00 -0.01 1.67 3.38 -0.53 -0.77 115.31 120.38 2iem h LEU 111 Ca 0.37 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.35 2iem h LEU 111 Cb -0.13 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 2iem h LEU 111 CO -0.09 0.46 -0.07 -0.61 0.09 0.00 0.00 178.44 178.23 2iem h GLN 112 N 0.00 -0.10 -0.08 1.13 4.15 0.17 -1.01 115.11 119.37 2iem h GLN 112 Ca -0.00 0.01 -0.17 0.00 0.77 0.00 0.00 58.65 59.25 2iem h GLN 112 Cb 0.85 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.56 2iem h GLN 112 CO 0.06 -0.07 -0.69 -0.24 -1.93 0.00 0.00 178.83 175.96 2iem h VAL 113 N -0.11 1.38 -0.93 2.39 3.04 -1.35 -3.02 116.25 117.66 2iem h VAL 113 Ca 0.03 -2.10 0.14 0.00 -1.01 0.00 0.00 66.70 63.76 2iem h VAL 113 Cb 0.15 2.07 -0.08 0.00 -2.01 0.00 0.00 31.29 31.43 2iem h VAL 113 CO -0.08 0.63 0.59 0.15 -1.01 0.00 0.00 177.57 177.85 2iem h PHE 114 N 0.25 0.92 0.00 3.17 3.57 -0.63 1.58 116.94 125.81 2iem h PHE 114 Ca -0.02 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.41 2iem h PHE 114 Cb 1.25 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.68 2iem h PHE 114 CO 0.04 0.34 -0.44 -1.49 -2.23 0.00 0.00 178.31 174.53 2iem h TRP 115 N 0.78 0.00 0.15 0.41 6.55 -1.10 0.21 115.95 122.95 2iem h TRP 115 Ca 0.47 0.00 -0.29 0.00 0.95 0.00 0.00 58.89 60.01 2iem h TRP 115 Cb 0.66 0.00 0.01 0.00 -0.86 0.00 0.00 29.16 28.97 2iem h TRP 115 CO -0.00 0.44 -1.35 1.49 -1.05 0.00 0.00 178.44 177.97 2iem h GLU 116 N 0.00 0.32 -0.28 0.49 4.81 0.30 -3.20 114.58 117.02 2iem h GLU 116 Ca -0.00 -0.54 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 2iem h GLU 116 Cb 1.07 0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.66 2iem h GLU 116 CO 0.06 1.24 0.00 0.09 -0.73 0.00 0.00 179.01 179.67 2iem n ASN 117 N -3.55 2.40 -4.55 1.04 4.13 0.48 -4.93 115.26 110.29 2iem n ASN 117 Ca -0.12 -1.85 -0.29 0.00 1.68 0.00 0.00 54.58 54.00 2iem n ASN 117 Cb 1.04 -0.18 0.17 0.00 -1.54 0.00 0.00 39.78 39.27 2iem n ASN 117 CO 0.00 0.00 0.00 -1.38 0.28 0.00 0.00 177.26 176.16 2iem s HIS 118 N -1.64 1.98 0.05 3.10 -3.43 0.74 -4.74 115.29 111.34 2iem s HIS 118 Ca 0.34 0.80 0.07 0.00 -0.80 0.00 0.00 55.06 55.47 2iem s HIS 118 Cb 0.19 -3.41 -0.03 0.00 -1.43 0.00 0.00 32.58 27.90 2iem s HIS 118 CO 0.27 -2.84 -0.15 -0.51 -2.00 0.00 0.00 174.74 169.52 2iem s ASP 119 N -3.86 4.04 0.62 7.38 -0.00 -1.26 -5.02 116.67 118.57 2iem s ASP 119 Ca 0.66 -0.39 -0.14 0.00 -0.00 0.00 0.00 52.55 52.68 2iem s ASP 119 Cb -0.15 -0.72 -0.03 0.00 -0.00 0.00 0.00 42.92 42.03 2iem s ASP 119 CO 0.55 0.24 1.05 -2.16 -0.00 0.00 0.00 175.17 174.85 2iem s PRO 120 N -1.63 3.25 0.01 8.23 0.04 -1.26 -5.02 135.00 138.61 2iem s PRO 120 Ca 0.16 1.09 -0.23 0.00 0.04 0.00 0.00 61.00 62.07 2iem s PRO 120 Cb -0.11 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.35 2iem s PRO 120 CO 0.07 -0.86 0.67 0.00 0.04 0.00 0.00 177.00 176.93 2iem s ALA 121 N -2.67 3.42 -0.22 8.56 0.00 -1.26 -4.96 121.76 124.63 2iem s ALA 121 Ca 0.61 0.14 0.14 0.00 0.00 0.00 0.00 51.96 52.85 2iem s ALA 121 Cb -0.15 -2.86 0.46 0.00 0.00 0.00 0.00 23.12 20.56 2iem s ALA 121 CO 0.43 0.10 1.18 0.00 0.00 0.00 0.00 175.76 177.46 2iem n GLN 122 N 2.86 2.12 -1.75 0.00 10.64 -1.26 -4.87 117.38 125.12 2iem n GLN 122 Ca -0.05 -3.47 -0.03 0.00 -1.83 0.00 0.00 57.00 51.63 2iem n GLN 122 Cb 0.51 -1.61 -0.01 0.00 -0.86 0.00 0.00 30.24 28.27 2iem n GLN 122 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2iem n GLY 123 N -0.61 0.36 3.32 2.61 0.00 -1.26 -4.88 105.19 104.73 2iem n GLY 123 Ca 0.24 -0.82 -0.55 0.00 0.00 0.00 0.00 46.02 44.89 2iem n GLY 123 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2iem n MET 124 N -1.81 0.03 -4.34 1.61 1.56 -1.26 -4.88 117.12 108.03 2iem n MET 124 Ca -0.03 0.01 -0.17 0.00 -0.27 0.00 0.00 57.70 57.23 2iem n MET 124 Cb 0.39 -1.53 -0.10 0.00 2.15 0.00 0.00 33.22 34.13 2iem n MET 124 CO 0.00 0.00 0.00 -0.98 -0.73 0.00 0.00 175.97 174.26 2iem s ARG 125 N 6.77 1.44 0.10 2.12 1.70 -1.26 -5.00 118.95 124.82 2iem s ARG 125 Ca 1.24 -1.78 -0.09 0.00 -0.47 0.00 0.00 55.73 54.62 2iem s ARG 125 Cb -1.42 -0.37 -0.06 0.00 -0.57 0.00 0.00 34.95 32.53 2iem s ARG 125 CO 0.61 -0.27 0.41 1.14 -1.08 0.00 0.00 175.30 176.11 2iem s GLN 126 N -4.00 3.75 0.00 3.89 0.00 -1.26 -4.73 119.66 117.31 2iem s GLN 126 Ca 0.37 0.16 0.00 0.00 -0.00 0.00 0.00 55.36 55.89 2iem s GLN 126 Cb 0.08 -2.96 0.00 0.00 0.00 0.00 0.00 33.01 30.13 2iem s GLN 126 CO 0.14 0.53 0.00 0.41 0.00 0.00 0.00 175.29 176.37 2iem n GLY 127 N 0.75 1.08 3.28 2.60 0.00 -1.26 -4.92 105.19 106.72 2iem n GLY 127 Ca -0.07 -0.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.76 2iem n GLY 127 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2iem n ASN 128 N 0.00 5.13 -3.84 1.61 3.02 -1.26 -4.89 115.26 115.04 2iem n ASN 128 Ca 0.00 -3.01 -0.07 0.00 -0.03 0.00 0.00 54.58 51.47 2iem n ASN 128 Cb 0.00 -1.56 -0.02 0.00 -0.61 0.00 0.00 39.78 37.59 2iem n ASN 128 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2iem s ASP 129 N 2.34 -0.27 -0.43 6.41 1.01 -1.26 -5.07 116.67 119.40 2iem s ASP 129 Ca 0.43 -0.58 0.07 0.00 0.71 0.00 0.00 52.55 53.17 2iem s ASP 129 Cb 0.02 0.71 0.24 0.00 1.01 0.00 0.00 42.92 44.90 2iem s ASP 129 CO 0.01 -1.31 0.63 1.41 0.21 0.00 0.00 175.17 176.12 2iem n HIS 130 N -0.45 -1.56 -2.47 4.23 8.25 -1.26 -4.92 115.22 117.04 2iem n HIS 130 Ca -0.05 -2.84 0.04 0.00 -0.26 0.00 0.00 57.72 54.61 2iem n HIS 130 Cb 0.60 0.42 0.02 0.00 1.12 0.00 0.00 29.99 32.14 2iem n HIS 130 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2iem n GLY 131 N 1.70 1.05 0.14 -1.41 0.00 -1.26 -4.85 105.19 100.56 2iem n GLY 131 Ca 0.18 -0.83 -0.23 0.00 0.00 0.00 0.00 46.02 45.13 2iem n GLY 131 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2iem h THR 132 N 6.91 1.07 -0.75 2.61 1.35 -1.97 -3.34 112.91 118.79 2iem h THR 132 Ca -0.22 -2.55 0.17 0.00 -0.55 0.00 0.00 66.41 63.26 2iem h THR 132 Cb 1.87 2.86 -0.13 0.00 -1.73 0.00 0.00 68.15 71.02 2iem h THR 132 CO 0.10 0.82 0.01 -0.61 -0.25 0.00 0.00 175.52 175.59 2iem h GLN 133 N 0.04 0.10 -5.27 4.72 4.15 -1.89 -3.38 115.11 113.59 2iem h GLN 133 Ca -0.31 -0.01 -0.67 0.00 0.77 0.00 0.00 58.65 58.44 2iem h GLN 133 Cb 2.06 -0.02 -0.31 0.00 0.21 0.00 0.00 27.48 29.41 2iem h GLN 133 CO 0.19 0.07 -0.84 1.52 -1.93 0.00 0.00 178.83 177.84 2iem s TYR 134 N -6.12 2.69 -0.08 3.99 -0.85 -1.25 0.17 117.35 115.89 2iem s TYR 134 Ca -0.13 -1.04 -0.04 0.00 -0.52 0.00 0.00 57.07 55.34 2iem s TYR 134 Cb 0.22 -1.80 0.04 0.00 0.38 0.00 0.00 41.96 40.80 2iem s TYR 134 CO 0.75 -0.44 0.18 0.50 -1.52 0.00 0.00 175.55 175.02 2iem s ARG 135 N 0.57 0.11 -0.34 -3.49 3.52 -1.26 -4.85 118.95 113.21 2iem s ARG 135 Ca -0.11 0.45 -0.28 0.00 -0.13 0.00 0.00 55.73 55.66 2iem s ARG 135 Cb -0.16 -0.17 -0.03 0.00 -1.56 0.00 0.00 34.95 33.02 2iem s ARG 135 CO 0.04 -0.19 2.01 -1.12 -0.81 0.00 0.00 175.30 175.23 2iem s SER 136 N 1.39 5.52 -0.02 -2.12 0.01 -1.26 -4.27 113.70 112.96 2iem s SER 136 Ca -0.07 1.36 -0.04 0.00 1.31 0.00 0.00 55.95 58.51 2iem s SER 136 Cb -0.11 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.60 2iem s SER 136 CO -0.07 -1.99 0.09 0.00 0.41 0.00 0.00 173.24 171.68 2iem s ALA 137 N 8.17 -0.20 -0.13 1.44 0.00 -1.07 -3.81 121.76 126.15 2iem s ALA 137 Ca 0.87 0.00 -0.02 0.00 0.00 0.00 0.00 51.96 52.81 2iem s ALA 137 Cb -0.24 -0.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.82 2iem s ALA 137 CO 0.32 -0.12 -0.06 0.42 0.00 0.00 0.00 175.76 176.33 2iem s ILE 138 N -0.64 3.74 -0.59 0.00 1.01 -0.90 -1.38 121.20 122.43 2iem s ILE 138 Ca -0.07 -0.43 0.04 0.00 0.00 0.00 0.00 60.65 60.19 2iem s ILE 138 Cb -0.04 -2.60 0.17 0.00 0.01 0.00 0.00 42.46 40.00 2iem s ILE 138 CO 0.00 0.53 0.43 -0.31 0.00 0.00 0.00 174.94 175.59 2iem s TYR 139 N 0.00 2.69 0.85 3.97 1.51 -0.25 -2.62 117.35 123.51 2iem s TYR 139 Ca -0.00 -2.97 -0.12 0.00 -1.01 0.00 0.00 57.07 52.97 2iem s TYR 139 Cb -0.13 -2.09 0.10 0.00 -0.11 0.00 0.00 41.96 39.72 2iem s TYR 139 CO 0.03 -0.65 1.12 -1.25 -1.11 0.00 0.00 175.55 173.69 2iem s PRO 140 N -0.86 1.62 -0.09 -1.71 0.04 -1.25 -2.70 135.00 130.05 2iem s PRO 140 Ca 0.27 0.46 -0.09 0.00 0.04 0.00 0.00 61.00 61.68 2iem s PRO 140 Cb -0.03 -1.88 -0.05 0.00 0.04 0.00 0.00 34.50 32.58 2iem s PRO 140 CO -0.16 -1.90 -0.20 1.28 0.04 0.00 0.00 177.00 176.05 2iem n LEU 141 N -3.59 1.43 -4.83 -3.56 4.77 -1.26 -3.00 117.00 106.95 2iem n LEU 141 Ca 0.07 0.23 -0.30 0.00 -0.03 0.00 0.00 56.01 55.98 2iem n LEU 141 Cb 0.58 -0.53 0.07 0.00 -2.33 0.00 0.00 43.42 41.20 2iem n LEU 141 CO 0.57 -0.21 0.72 0.42 -1.33 0.00 0.00 177.39 177.56 2iem s THR 142 N -2.44 3.36 0.14 -5.08 -4.23 -1.26 -4.91 115.64 101.22 2iem s THR 142 Ca -0.18 0.44 -0.03 0.00 -1.18 0.00 0.00 61.69 60.73 2iem s THR 142 Cb 0.04 -3.27 -0.15 0.00 1.34 0.00 0.00 72.50 70.46 2iem s THR 142 CO 0.26 -0.58 1.35 1.55 -0.54 0.00 0.00 174.62 176.66 2iem h PRO 143 N -0.89 0.41 -0.69 3.99 0.13 -1.99 -2.76 132.00 130.21 2iem h PRO 143 Ca -0.46 -0.40 0.03 0.00 -0.87 0.00 0.00 66.00 64.30 2iem h PRO 143 Cb 1.25 0.10 -0.04 0.00 0.13 0.00 0.00 31.00 32.45 2iem h PRO 143 CO 0.60 1.06 0.45 0.93 -0.23 0.00 0.00 178.00 180.82 2iem h GLU 144 N 0.25 0.80 -0.11 0.86 5.08 -1.99 -0.79 114.58 118.68 2iem h GLU 144 Ca -0.06 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 58.12 2iem h GLU 144 Cb 1.48 -0.18 0.01 0.00 0.50 0.00 0.00 28.75 30.55 2iem h GLU 144 CO 0.15 0.53 -0.44 1.96 -1.00 0.00 0.00 179.01 180.21 2iem h GLN 145 N 0.83 0.50 -0.78 2.33 4.20 -1.94 -0.25 115.11 120.00 2iem h GLN 145 Ca 0.27 -0.38 0.10 0.00 0.06 0.00 0.00 58.65 58.70 2iem h GLN 145 Cb 0.06 0.07 -0.07 0.00 0.30 0.00 0.00 27.48 27.84 2iem h GLN 145 CO -0.08 1.01 0.42 -0.44 -0.67 0.00 0.00 178.83 179.08 2iem h ASP 146 N 0.09 0.58 0.01 1.46 5.19 -1.09 1.56 116.42 124.22 2iem h ASP 146 Ca -0.02 0.06 -0.00 0.00 -0.62 0.00 0.00 57.03 56.44 2iem h ASP 146 Cb 1.08 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.54 2iem h ASP 146 CO 0.09 0.32 -0.01 0.00 -3.12 0.00 0.00 179.24 176.53 2iem h ALA 147 N 1.45 -0.01 -0.36 3.45 0.00 -1.14 -0.96 119.26 121.69 2iem h ALA 147 Ca 0.38 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 55.10 2iem h ALA 147 Cb 0.39 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.14 2iem h ALA 147 CO -0.27 -0.26 0.09 0.00 0.00 0.00 0.00 179.25 178.81 2iem h ALA 148 N 0.47 0.40 0.48 0.00 0.00 -0.27 0.95 119.26 121.28 2iem h ALA 148 Ca -0.00 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2iem h ALA 148 Cb 0.50 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2iem h ALA 148 CO 0.00 -0.31 -0.44 0.00 0.00 0.00 0.00 179.25 178.50 2iem h ALA 149 N 1.26 -0.99 -0.95 0.00 0.00 0.22 0.24 119.26 119.03 2iem h ALA 149 Ca 0.17 -0.17 0.09 0.00 0.00 0.00 0.00 54.91 55.01 2iem h ALA 149 Cb 0.18 0.62 -0.07 0.00 0.00 0.00 0.00 17.79 18.52 2iem h ALA 149 CO -0.21 -1.09 0.61 -0.09 0.00 0.00 0.00 179.25 178.47 2iem h ARG 150 N -0.92 0.96 -0.56 0.00 2.43 -0.76 0.19 114.38 115.73 2iem h ARG 150 Ca -0.05 -0.06 0.06 0.00 -0.81 0.00 0.00 59.98 59.12 2iem h ARG 150 Cb 0.80 -0.22 -0.05 0.00 -0.42 0.00 0.00 29.97 30.08 2iem h ARG 150 CO -0.04 0.64 0.27 0.00 -1.51 0.00 0.00 179.97 179.32 2iem h ALA 151 N 1.52 0.72 -0.34 2.80 0.00 0.17 0.64 119.26 124.77 2iem h ALA 151 Ca 0.44 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.27 2iem h ALA 151 Cb 0.36 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2iem h ALA 151 CO -0.20 -0.10 -0.24 0.66 0.00 0.00 0.00 179.25 179.38 2iem h SER 152 N 0.50 0.80 0.17 0.00 4.64 0.60 -0.45 113.55 119.81 2iem h SER 152 Ca 0.26 -0.44 -0.00 0.00 -0.47 0.00 0.00 61.79 61.14 2iem h SER 152 Cb 0.20 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 2iem h SER 152 CO -0.20 1.07 -0.13 0.25 -0.87 0.00 0.00 176.83 176.95 2iem h LEU 153 N 0.55 -0.35 -1.80 5.97 6.46 0.16 1.36 115.31 127.67 2iem h LEU 153 Ca 0.07 0.03 -0.02 0.00 -0.12 0.00 0.00 57.88 57.84 2iem h LEU 153 Cb 0.80 0.11 -0.00 0.00 -0.73 0.00 0.00 40.66 40.84 2iem h LEU 153 CO 0.06 -0.21 -0.11 -0.33 -0.62 0.00 0.00 178.44 177.24 2iem h GLU 154 N -0.31 0.00 0.08 1.25 4.39 0.29 0.13 114.58 120.41 2iem h GLU 154 Ca -0.01 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 2iem h GLU 154 Cb 0.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 2iem h GLU 154 CO -0.01 0.11 -0.04 -0.09 -1.16 0.00 0.00 179.01 177.81 2iem h ARG 155 N 0.00 -0.11 -0.54 2.33 2.43 -0.02 -2.48 114.38 116.00 2iem h ARG 155 Ca -0.00 0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.26 2iem h ARG 155 Cb 0.19 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.70 2iem h ARG 155 CO 0.01 0.41 0.19 0.35 -1.51 0.00 0.00 179.97 179.42 2iem h PHE 156 N -0.91 0.33 -0.33 2.20 3.57 0.20 0.79 116.94 122.79 2iem h PHE 156 Ca -0.01 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.53 2iem h PHE 156 Cb 0.57 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.22 2iem h PHE 156 CO 0.13 0.09 0.20 0.37 -2.23 0.00 0.00 178.31 176.86 2iem h GLN 157 N 0.36 0.40 -0.22 1.11 4.15 -1.08 0.95 115.11 120.78 2iem h GLN 157 Ca 0.27 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.64 2iem h GLN 157 Cb 0.31 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 2iem h GLN 157 CO -0.28 0.26 0.07 0.00 -1.93 0.00 0.00 178.83 176.95 2iem h ALA 158 N 1.14 0.29 -0.64 3.38 0.00 -0.84 0.11 119.26 122.70 2iem h ALA 158 Ca 0.13 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2iem h ALA 158 Cb -0.01 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2iem h ALA 158 CO -0.05 -0.08 0.41 0.00 0.00 0.00 0.00 179.25 179.53 2iem h ALA 159 N 0.89 0.81 -0.67 0.00 0.00 0.95 -0.94 119.26 120.29 2iem h ALA 159 Ca 0.07 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2iem h ALA 159 Cb 0.24 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2iem h ALA 159 CO -0.00 0.25 0.28 1.98 0.00 0.00 0.00 179.25 181.76 2iem h MET 160 N 0.86 0.97 -0.73 0.00 -1.53 0.12 -2.15 114.93 112.48 2iem h MET 160 Ca 0.23 -0.15 -0.06 0.00 -3.44 0.00 0.00 59.70 56.28 2iem h MET 160 Cb -0.08 -0.17 -0.03 0.00 -0.55 0.00 0.00 31.60 30.77 2iem h MET 160 CO -0.05 0.78 0.23 1.25 0.14 0.00 0.00 176.91 179.26 2iem h LEU 161 N 0.96 1.06 -2.60 3.39 7.12 -0.02 -0.61 115.31 124.61 2iem h LEU 161 Ca 0.23 -0.20 -0.00 0.00 0.13 0.00 0.00 57.88 58.04 2iem h LEU 161 Cb 0.16 -0.28 -0.00 0.00 -0.53 0.00 0.00 40.66 40.01 2iem h LEU 161 CO -0.02 0.98 -0.00 0.00 -0.13 0.00 0.00 178.44 179.26 2iem h ALA 162 N 1.16 1.02 0.00 1.25 0.00 -0.55 0.35 119.26 122.49 2iem h ALA 162 Ca 0.24 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2iem h ALA 162 Cb 0.30 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2iem h ALA 162 CO -0.01 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 2iem n ALA 163 N -2.09 2.23 -1.35 0.00 0.00 -0.24 -4.85 120.51 114.20 2iem n ALA 163 Ca -0.02 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.31 2iem n ALA 163 Cb 0.13 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.17 2iem n ALA 163 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2iem n ASP 164 N -1.38 -1.84 -4.45 0.00 2.03 0.12 -5.03 116.55 106.00 2iem n ASP 164 Ca 0.10 0.00 -0.36 0.00 0.52 0.00 0.00 54.79 55.05 2iem n ASP 164 Cb 0.24 -0.46 -0.12 0.00 -0.72 0.00 0.00 41.12 40.06 2iem n ASP 164 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 2iem s ASP 165 N -2.91 5.02 0.00 1.67 1.11 -1.18 -4.95 116.67 115.43 2iem s ASP 165 Ca 0.00 -0.20 0.17 0.00 0.18 0.00 0.00 52.55 52.71 2iem s ASP 165 Cb 0.00 -1.88 0.52 0.00 1.07 0.00 0.00 42.92 42.62 2iem s ASP 165 CO 0.00 0.01 1.41 0.47 1.18 0.00 0.00 175.17 178.24 2iem n ASP 166 N 4.61 2.30 -4.21 0.27 8.00 -1.26 -4.17 116.55 122.09 2iem n ASP 166 Ca -0.17 -1.90 -0.43 0.00 0.71 0.00 0.00 54.79 53.00 2iem n ASP 166 Cb 0.52 -0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.39 2iem n ASP 166 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2iem n ARG 167 N 0.74 3.20 -1.86 -1.24 1.74 -1.26 -4.97 116.66 113.00 2iem n ARG 167 Ca 0.16 -3.23 -0.41 0.00 -0.77 0.00 0.00 57.85 53.60 2iem n ARG 167 Cb 0.39 -3.27 -0.00 0.00 -1.02 0.00 0.00 32.46 28.56 2iem n ARG 167 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 2iem s HIS 168 N 2.85 2.65 0.29 -1.55 5.65 -1.26 -4.51 115.29 119.41 2iem s HIS 168 Ca 0.48 1.23 -0.28 0.00 0.25 0.00 0.00 55.06 56.74 2iem s HIS 168 Cb 0.06 -3.94 -0.09 0.00 -1.18 0.00 0.00 32.58 27.43 2iem s HIS 168 CO 0.01 -2.77 0.96 0.42 -0.65 0.00 0.00 174.74 172.70 2iem s ILE 169 N -1.14 4.07 -0.98 0.89 1.09 -1.26 -4.83 121.20 119.04 2iem s ILE 169 Ca 0.53 1.87 -0.04 0.00 -1.10 0.00 0.00 60.65 61.92 2iem s ILE 169 Cb -0.45 -4.11 0.16 0.00 -1.06 0.00 0.00 42.46 37.00 2iem s ILE 169 CO 0.60 0.29 2.38 1.07 -0.10 0.00 0.00 174.94 179.18 2iem n THR 170 N 0.93 4.69 -3.19 2.92 5.66 -1.26 -4.95 114.28 119.08 2iem n THR 170 Ca 0.00 -4.21 -0.39 0.00 -3.05 0.00 0.00 64.05 56.40 2iem n THR 170 Cb 0.48 -1.78 -0.06 0.00 -1.55 0.00 0.00 70.33 67.43 2iem n THR 170 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2iem s THR 171 N -2.34 5.08 -0.07 1.09 -4.23 -1.26 -4.65 115.64 109.26 2iem s THR 171 Ca 0.53 1.07 0.05 0.00 -1.18 0.00 0.00 61.69 62.16 2iem s THR 171 Cb 0.27 -3.89 -0.00 0.00 1.34 0.00 0.00 72.50 70.21 2iem s THR 171 CO -0.17 0.17 -0.22 -1.83 -0.54 0.00 0.00 174.62 172.03 2iem s GLU 172 N 1.61 2.49 -0.22 3.99 -1.05 -1.25 -5.01 118.70 119.27 2iem s GLU 172 Ca 0.27 -0.81 -0.05 0.00 -0.15 0.00 0.00 54.97 54.23 2iem s GLU 172 Cb -0.16 -2.04 -0.02 0.00 -0.44 0.00 0.00 34.13 31.48 2iem s GLU 172 CO 0.10 0.28 -0.00 0.42 0.95 0.00 0.00 175.26 177.01 2iem s ILE 173 N 0.07 3.79 0.21 1.83 1.01 -1.26 -2.12 121.20 124.73 2iem s ILE 173 Ca -0.09 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.21 2iem s ILE 173 Cb -0.15 -2.73 -0.05 0.00 0.01 0.00 0.00 42.46 39.55 2iem s ILE 173 CO 0.05 0.41 0.08 0.00 0.00 0.00 0.00 174.94 175.48 2iem s ALA 174 N 1.32 1.36 1.01 9.38 0.00 -1.08 -5.03 121.76 128.72 2iem s ALA 174 Ca 0.04 -1.71 -0.14 0.00 0.00 0.00 0.00 51.96 50.16 2iem s ALA 174 Cb -0.15 1.04 0.09 0.00 0.00 0.00 0.00 23.12 24.10 2iem s ALA 174 CO 0.00 -0.48 0.46 -1.71 0.00 0.00 0.00 175.76 174.04 2iem n ASN 175 N -0.31 -1.79 -3.79 0.00 2.85 -1.26 -3.89 115.26 107.07 2iem n ASN 175 Ca -0.01 0.19 -0.42 0.00 -0.11 0.00 0.00 54.58 54.22 2iem n ASN 175 Cb 0.65 -1.19 0.01 0.00 1.24 0.00 0.00 39.78 40.49 2iem n ASN 175 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2iem n ALA 176 N -4.02 5.71 -0.59 5.20 0.00 -1.16 -4.78 120.51 120.86 2iem n ALA 176 Ca 0.06 -4.41 -0.30 0.00 0.00 0.00 0.00 53.44 48.79 2iem n ALA 176 Cb 0.56 -2.72 0.21 0.00 0.00 0.00 0.00 19.45 17.49 2iem n ALA 176 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2iem n THR 177 N 2.21 0.00 -2.33 0.00 5.66 -1.26 -4.87 114.28 113.68 2iem n THR 177 Ca 0.42 -0.20 -0.42 0.00 -3.05 0.00 0.00 64.05 60.80 2iem n THR 177 Cb 0.32 -0.98 -0.03 0.00 -1.55 0.00 0.00 70.33 68.09 2iem n THR 177 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2iem s PRO 178 N -4.49 3.28 0.28 1.09 0.04 -1.26 -4.99 135.00 128.96 2iem s PRO 178 Ca 0.67 0.60 -0.18 0.00 0.04 0.00 0.00 61.00 62.14 2iem s PRO 178 Cb -0.24 -4.14 -0.09 0.00 0.04 0.00 0.00 34.50 30.08 2iem s PRO 178 CO 0.61 -1.95 0.75 -0.06 0.04 0.00 0.00 177.00 176.39 2iem s PHE 179 N 6.28 3.50 -0.27 0.56 0.40 -1.26 -5.04 117.98 122.16 2iem s PHE 179 Ca 0.57 1.33 -0.21 0.00 -0.60 0.00 0.00 56.93 58.01 2iem s PHE 179 Cb -0.12 -2.60 -0.01 0.00 0.51 0.00 0.00 43.02 40.80 2iem s PHE 179 CO 0.26 0.20 0.68 0.71 0.70 0.00 0.00 175.22 177.77 2iem s TYR 180 N -1.78 3.27 0.95 0.36 2.02 -1.07 -4.78 117.35 116.32 2iem s TYR 180 Ca 0.49 0.83 -0.16 0.00 -0.37 0.00 0.00 57.07 57.86 2iem s TYR 180 Cb -0.13 -2.94 0.04 0.00 -0.40 0.00 0.00 41.96 38.53 2iem s TYR 180 CO 0.19 -0.39 -0.24 0.66 -1.57 0.00 0.00 175.55 174.20 2iem n TYR 181 N 5.84 -1.72 -4.57 2.71 4.01 -1.26 0.63 117.16 122.81 2iem n TYR 181 Ca 0.01 0.29 -0.30 0.00 -0.16 0.00 0.00 57.90 57.74 2iem n TYR 181 Cb 0.49 -1.42 -0.08 0.00 -0.31 0.00 0.00 39.34 38.01 2iem n TYR 181 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2iem s ALA 182 N -2.08 3.69 0.08 -0.72 0.00 0.44 -4.40 121.76 118.76 2iem s ALA 182 Ca 0.35 -1.42 -0.36 0.00 0.00 0.00 0.00 51.96 50.52 2iem s ALA 182 Cb -0.02 -0.02 -0.18 0.00 0.00 0.00 0.00 23.12 22.90 2iem s ALA 182 CO 0.43 -0.11 1.02 -1.91 0.00 0.00 0.00 175.76 175.20 2iem n GLU 183 N -1.18 0.35 0.24 0.00 4.07 -1.26 -4.68 120.64 118.19 2iem n GLU 183 Ca -0.10 0.13 0.18 0.00 -0.06 0.00 0.00 57.16 57.31 2iem n GLU 183 Cb 0.67 -1.56 0.86 0.00 -0.06 0.00 0.00 31.44 31.35 2iem n GLU 183 CO 0.00 0.00 0.00 0.38 -0.06 0.00 0.00 177.13 177.45 2iem h ASP 184 N 2.92 0.00 -0.35 4.31 3.04 -1.90 0.24 116.42 124.68 2iem h ASP 184 Ca -0.45 0.00 -0.07 0.00 -3.24 0.00 0.00 57.03 53.27 2iem h ASP 184 Cb 1.40 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.68 2iem h ASP 184 CO 0.66 0.00 -0.04 -0.78 -2.04 0.00 0.00 179.24 177.04 2iem h ASP 185 N 0.00 0.63 -0.24 4.15 3.58 -1.88 -2.91 116.42 119.75 2iem h ASP 185 Ca 0.07 -0.34 -0.13 0.00 0.42 0.00 0.00 57.03 57.06 2iem h ASP 185 Cb 0.59 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.46 2iem h ASP 185 CO -0.00 0.82 -0.29 0.45 -2.88 0.00 0.00 179.24 177.34 2iem h HIS 186 N 0.43 0.86 -0.91 0.28 3.86 -0.88 -3.36 115.15 115.43 2iem h HIS 186 Ca 0.09 -0.22 -0.65 0.00 -1.16 0.00 0.00 60.37 58.43 2iem h HIS 186 Cb 0.52 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.77 2iem h HIS 186 CO 0.04 0.95 1.45 1.04 0.86 0.00 0.00 177.93 182.27 2iem n GLN 187 N -4.08 0.86 -3.54 2.45 1.13 -0.66 0.22 117.38 113.75 2iem n GLN 187 Ca -0.01 0.21 -0.21 0.00 -1.94 0.00 0.00 57.00 55.06 2iem n GLN 187 Cb 0.47 -2.34 0.08 0.00 0.11 0.00 0.00 30.24 28.56 2iem n GLN 187 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2iem n GLN 188 N 8.20 -7.16 0.10 -1.09 3.00 -1.26 -4.90 117.38 114.27 2iem n GLN 188 Ca 0.45 0.82 0.03 0.00 -0.01 0.00 0.00 57.00 58.29 2iem n GLN 188 Cb 0.20 -5.84 -0.01 0.00 0.00 0.00 0.00 30.24 24.60 2iem n GLN 188 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.06 176.14 2iem h TYR 189 N -2.29 0.00 -0.03 1.08 5.03 -0.38 -3.00 116.97 117.39 2iem h TYR 189 Ca -0.58 0.00 -0.08 0.00 2.58 0.00 0.00 58.73 60.64 2iem h TYR 189 Cb 1.36 0.00 0.01 0.00 1.55 0.00 0.00 36.73 39.64 2iem h TYR 189 CO 0.47 0.44 -0.31 1.25 -1.32 0.00 0.00 178.16 178.70 2iem h LEU 190 N 0.00 0.32 -1.55 2.82 7.12 -1.84 -3.11 115.31 119.07 2iem h LEU 190 Ca -0.07 -0.71 -0.05 0.00 0.13 0.00 0.00 57.88 57.18 2iem h LEU 190 Cb 1.40 -0.10 -0.01 0.00 -0.53 0.00 0.00 40.66 41.42 2iem h LEU 190 CO 0.05 0.99 -0.24 1.12 -0.13 0.00 0.00 178.44 180.23 2iem h HIS 191 N -0.31 0.00 0.00 1.25 2.07 -1.90 -1.27 115.15 114.98 2iem h HIS 191 Ca -0.03 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.46 2iem h HIS 191 Cb 1.01 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.99 2iem h HIS 191 CO 0.15 0.24 -0.14 0.87 -3.07 0.00 0.00 177.93 175.98 2iem h LYS 192 N 0.00 0.00 -3.10 5.12 1.79 -1.48 -3.38 116.57 115.52 2iem h LYS 192 Ca -0.00 0.00 -0.48 0.00 -2.18 0.00 0.00 60.65 57.99 2iem h LYS 192 Cb 0.44 0.00 -0.41 0.00 -1.58 0.00 0.00 32.23 30.68 2iem h LYS 192 CO 0.03 0.14 -0.76 -0.80 -1.08 0.00 0.00 179.45 176.98 2iem s ASN 193 N -6.95 2.59 0.00 0.86 0.01 -0.48 -4.98 114.94 105.99 2iem s ASN 193 Ca -0.04 -0.74 0.23 0.00 -0.71 0.00 0.00 52.86 51.61 2iem s ASN 193 Cb 0.16 -0.32 1.25 0.00 0.41 0.00 0.00 41.25 42.75 2iem s ASN 193 CO 0.68 -0.35 1.76 -0.81 -1.51 0.00 0.00 177.10 176.87 2iem n PRO 194 N 5.23 0.48 -0.90 -0.60 -0.04 -1.23 -2.72 135.00 135.22 2iem n PRO 194 Ca -0.07 0.05 -0.04 0.00 -0.04 0.00 0.00 63.50 63.40 2iem n PRO 194 Cb 0.48 -1.50 0.29 0.00 -0.04 0.00 0.00 33.50 32.72 2iem n PRO 194 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2iem n TYR 195 N -1.18 2.15 -2.36 0.54 4.02 -1.26 -4.34 117.16 114.73 2iem n TYR 195 Ca 0.13 -1.02 -0.25 0.00 -0.01 0.00 0.00 57.90 56.76 2iem n TYR 195 Cb 0.15 -0.61 0.01 0.00 -0.02 0.00 0.00 39.34 38.86 2iem n TYR 195 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2iem n GLY 196 N 0.01 5.92 3.64 2.72 0.00 -1.10 -5.04 105.19 111.34 2iem n GLY 196 Ca 0.35 -2.67 -0.43 0.00 0.00 0.00 0.00 46.02 43.27 2iem n GLY 196 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2iem s TYR 197 N -3.55 3.26 -0.87 1.61 1.13 -1.26 -4.93 117.35 112.74 2iem s TYR 197 Ca 0.48 1.20 -0.05 0.00 -1.41 0.00 0.00 57.07 57.28 2iem s TYR 197 Cb 0.40 -3.33 0.02 0.00 -1.10 0.00 0.00 41.96 37.96 2iem s TYR 197 CO -0.11 -0.56 2.75 0.00 -2.51 0.00 0.00 175.55 175.12 2iem n GLY 199 N 1.73 -0.27 3.79 0.00 0.00 -1.26 -4.89 105.19 104.28 2iem n GLY 199 Ca 0.57 0.90 -0.39 0.00 0.00 0.00 0.00 46.02 47.11 2iem n GLY 199 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2iem s ILE 200 N -1.84 4.75 0.00 -0.61 1.01 -1.26 -4.31 121.20 118.93 2iem s ILE 200 Ca 0.24 1.31 0.00 0.00 0.00 0.00 0.00 60.65 62.20 2iem s ILE 200 Cb -0.02 -3.95 0.00 0.00 0.01 0.00 0.00 42.46 38.50 2iem s ILE 200 CO 0.81 0.50 0.00 0.61 0.00 0.00 0.00 174.94 176.86 2iem n GLY 201 N 1.97 2.31 3.27 6.18 0.00 -1.26 -4.90 105.19 112.76 2iem n GLY 201 Ca -0.08 -0.71 0.03 0.00 0.00 0.00 0.00 46.02 45.26 2iem n GLY 201 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2iem s GLY 202 N 0.00 -0.21 0.91 -0.02 0.00 -1.26 -5.09 107.32 101.65 2iem s GLY 202 Ca 0.00 2.99 -0.11 0.00 0.00 0.00 0.00 44.72 47.60 2iem s GLY 202 CO 0.00 3.48 0.92 0.29 0.00 0.00 0.00 173.10 177.78 2iem n ILE 203 N 5.12 0.26 0.00 0.90 -6.64 -1.26 -5.00 119.36 112.73 2iem n ILE 203 Ca -0.08 -0.09 0.00 0.00 -1.77 0.00 0.00 62.75 60.82 2iem n ILE 203 Cb 0.53 -0.90 0.00 0.00 -1.44 0.00 0.00 39.64 37.83 2iem n ILE 203 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 2iem n GLY 204 N 0.70 0.59 3.01 3.28 0.00 -1.26 -4.93 105.19 106.58 2iem n GLY 204 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 2iem n GLY 204 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2iem s VAL 205 N 0.00 1.47 -0.63 1.61 -7.23 -1.26 -5.06 120.40 109.29 2iem s VAL 205 Ca 0.00 -0.58 -0.29 0.00 -1.81 0.00 0.00 61.98 59.30 2iem s VAL 205 Cb 0.00 -1.38 -0.12 0.00 0.56 0.00 0.00 36.38 35.44 2iem s VAL 205 CO 0.00 0.44 2.48 -0.24 -0.31 0.00 0.00 175.10 177.47 2iem n SER 206 N 4.62 1.66 -4.77 4.85 2.88 -1.26 -4.89 113.62 116.70 2iem n SER 206 Ca -0.17 -0.17 -0.33 0.00 -1.33 0.00 0.00 58.87 56.87 2iem n SER 206 Cb 0.50 -1.33 0.05 0.00 -0.75 0.00 0.00 64.21 62.68 2iem n SER 206 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2iem s LEU 207 N 10.56 3.38 0.58 2.46 1.43 -1.26 -5.01 118.68 130.83 2iem s LEU 207 Ca 1.12 1.98 -0.16 0.00 -1.03 0.00 0.00 54.13 56.04 2iem s LEU 207 Cb -0.61 -4.55 -0.04 0.00 0.03 0.00 0.00 46.19 41.02 2iem s LEU 207 CO 0.36 -1.61 1.05 -2.16 0.23 0.00 0.00 176.35 174.22 2iem s PRO 208 N -4.12 3.40 0.52 1.29 0.04 -1.26 -5.06 135.00 129.81 2iem s PRO 208 Ca 0.66 1.17 -0.09 0.00 0.04 0.00 0.00 61.00 62.79 2iem s PRO 208 Cb -0.20 -2.05 0.13 0.00 0.04 0.00 0.00 34.50 32.42 2iem s PRO 208 CO 0.42 -0.74 0.58 -0.35 0.04 0.00 0.00 177.00 176.94 2iem n PRO 209 N -1.96 -1.30 0.18 0.56 -0.04 -1.26 -4.96 135.00 126.22 2iem n PRO 209 Ca 0.08 -0.90 0.07 0.00 -0.04 0.00 0.00 63.50 62.71 2iem n PRO 209 Cb 0.53 -0.71 0.21 0.00 -0.04 0.00 0.00 33.50 33.49 2iem n PRO 209 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2iem h GLU 210 N 0.00 0.00 -0.00 0.54 9.09 -2.07 -3.57 114.58 118.56 2iem h GLU 210 Ca -0.20 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.21 2iem h GLU 210 Cb 0.58 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.68 2iem h GLU 210 CO 0.14 0.31 0.00 0.00 0.05 0.00 0.00 179.01 179.51