#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 3.86 -0.19 -3.43 2.01 -1.26 -4.88 118.68 114.80 2iem s LEU 2 Ca 0.00 1.27 -0.06 0.00 0.01 0.00 0.00 54.13 55.35 2iem s LEU 2 Cb 0.00 -3.54 -0.24 0.00 0.01 0.00 0.00 46.19 42.42 2iem s LEU 2 CO 0.00 -1.14 3.46 2.22 1.01 0.00 0.00 176.35 181.90 2iem n PHE 3 N 7.88 0.28 -3.23 0.29 -1.74 -1.26 -4.47 117.46 115.21 2iem n PHE 3 Ca 0.16 -1.64 -0.11 0.00 -0.56 0.00 0.00 57.45 55.30 2iem n PHE 3 Cb 0.46 -1.66 -0.05 0.00 1.52 0.00 0.00 39.48 39.75 2iem n PHE 3 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 2iem s ASP 4 N 2.06 0.03 0.40 5.98 1.11 -1.26 -5.07 116.67 119.92 2iem s ASP 4 Ca 0.65 -1.53 0.08 0.00 0.18 0.00 0.00 52.55 51.92 2iem s ASP 4 Cb 0.29 1.06 -0.03 0.00 1.07 0.00 0.00 42.92 45.31 2iem s ASP 4 CO -0.01 -0.19 0.28 -0.54 1.18 0.00 0.00 175.17 175.89 2iem s LYS 5 N 1.32 2.42 -0.71 8.23 1.02 -1.26 -4.76 119.74 125.99 2iem s LYS 5 Ca 0.20 -1.63 -0.26 0.00 0.02 0.00 0.00 55.97 54.30 2iem s LYS 5 Cb -0.08 -2.22 -0.06 0.00 -0.52 0.00 0.00 37.83 34.95 2iem s LYS 5 CO -0.06 -0.12 2.09 -1.59 -0.92 0.00 0.00 175.35 174.75 2iem s LYS 6 N -4.01 2.32 -0.01 1.68 -2.85 -1.26 -4.87 119.74 110.74 2iem s LYS 6 Ca 0.44 0.44 -0.14 0.00 -1.00 0.00 0.00 55.97 55.72 2iem s LYS 6 Cb -0.01 -4.71 0.02 0.00 -2.06 0.00 0.00 37.83 31.07 2iem s LYS 6 CO 0.25 -3.35 0.28 -1.01 0.10 0.00 0.00 175.35 171.63 2iem s HIS 7 N 11.00 -0.14 0.13 1.78 3.76 -1.26 -5.18 115.29 125.38 2iem s HIS 7 Ca 0.78 0.18 0.01 0.00 -0.15 0.00 0.00 55.06 55.88 2iem s HIS 7 Cb -0.12 0.07 0.01 0.00 1.11 0.00 0.00 32.58 33.65 2iem s HIS 7 CO 0.12 -0.38 0.05 1.28 -0.85 0.00 0.00 174.74 174.96 2iem n LEU 8 N 1.27 0.00 -4.76 0.89 7.99 -1.26 -4.90 117.00 116.23 2iem n LEU 8 Ca -0.22 -0.72 -0.39 0.00 -0.01 0.00 0.00 56.01 54.68 2iem n LEU 8 Cb 0.56 0.04 0.02 0.00 -0.11 0.00 0.00 43.42 43.93 2iem n LEU 8 CO 0.22 -0.22 0.97 0.54 -1.51 0.00 0.00 177.39 177.39 2iem s VAL 9 N -1.03 2.36 0.88 4.08 0.11 -1.26 -4.99 120.40 120.55 2iem s VAL 9 Ca 0.04 0.29 -0.12 0.00 -2.93 0.00 0.00 61.98 59.26 2iem s VAL 9 Cb -0.00 -3.16 0.12 0.00 -1.53 0.00 0.00 36.38 31.81 2iem s VAL 9 CO 0.02 0.02 1.09 -0.44 -3.33 0.00 0.00 175.10 172.46 2iem s SER 10 N -0.89 3.61 0.12 3.54 0.01 -1.26 -4.83 113.70 114.00 2iem s SER 10 Ca 0.65 1.45 -0.08 0.00 1.31 0.00 0.00 55.95 59.28 2iem s SER 10 Cb -0.39 -2.13 -0.11 0.00 0.21 0.00 0.00 66.02 63.60 2iem s SER 10 CO 0.47 -2.54 1.30 1.55 0.41 0.00 0.00 173.24 174.43 2iem h PRO 11 N -1.48 0.57 0.00 12.44 0.13 -1.94 0.17 132.00 141.88 2iem h PRO 11 Ca -0.49 -0.55 -0.05 0.00 -0.87 0.00 0.00 66.00 64.04 2iem h PRO 11 Cb 1.28 0.14 -0.01 0.00 0.13 0.00 0.00 31.00 32.55 2iem h PRO 11 CO 0.55 1.17 -0.25 0.00 -0.23 0.00 0.00 178.00 179.24 2iem h ALA 12 N 0.65 0.90 0.15 -0.56 0.00 -2.02 -3.12 119.26 115.26 2iem h ALA 12 Ca -0.08 -0.23 -0.33 0.00 0.00 0.00 0.00 54.91 54.28 2iem h ALA 12 Cb 1.52 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.27 2iem h ALA 12 CO 0.17 0.32 -1.63 -0.44 0.00 0.00 0.00 179.25 177.67 2iem h ASP 13 N 0.00 0.49 -2.72 0.00 5.19 -1.91 -3.47 116.42 113.99 2iem h ASP 13 Ca -0.00 -0.70 -0.50 0.00 -0.62 0.00 0.00 57.03 55.21 2iem h ASP 13 Cb 0.99 -0.16 0.23 0.00 0.18 0.00 0.00 39.33 40.57 2iem h ASP 13 CO 0.03 1.59 -0.99 0.00 -3.12 0.00 0.00 179.24 176.75 2iem n ALA 14 N -2.75 -3.63 -2.93 3.45 0.00 0.58 -4.95 120.51 110.28 2iem n ALA 14 Ca -0.20 -0.95 -0.29 0.00 0.00 0.00 0.00 53.44 52.01 2iem n ALA 14 Cb 1.06 -1.58 -0.04 0.00 0.00 0.00 0.00 19.45 18.89 2iem n ALA 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2iem s LEU 15 N -0.12 4.35 -0.60 0.00 1.43 -1.17 -4.98 118.68 117.59 2iem s LEU 15 Ca 0.54 0.22 -0.27 0.00 -1.03 0.00 0.00 54.13 53.59 2iem s LEU 15 Cb -0.15 -2.93 0.01 0.00 0.03 0.00 0.00 46.19 43.14 2iem s LEU 15 CO 0.68 0.11 1.52 -2.16 0.23 0.00 0.00 176.35 176.73 2iem s PRO 16 N -2.86 3.12 0.45 1.29 0.04 -1.26 -4.66 135.00 131.12 2iem s PRO 16 Ca 0.35 0.41 -0.06 0.00 0.04 0.00 0.00 61.00 61.73 2iem s PRO 16 Cb -0.12 -4.20 0.09 0.00 0.04 0.00 0.00 34.50 30.31 2iem s PRO 16 CO 0.28 -2.17 0.21 0.41 0.04 0.00 0.00 177.00 175.78 2iem n GLY 17 N 5.40 -2.26 3.59 0.56 0.00 -1.26 -5.02 105.19 106.19 2iem n GLY 17 Ca 0.13 -0.74 -0.27 0.00 0.00 0.00 0.00 46.02 45.14 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 -2.62 1.90 -0.52 1.61 0.52 -1.19 -4.92 118.95 113.73 2iem s ARG 18 Ca 0.17 -2.05 0.02 0.00 -0.52 0.00 0.00 55.73 53.34 2iem s ARG 18 Cb -0.03 -1.58 0.51 0.00 0.52 0.00 0.00 34.95 34.38 2iem s ARG 18 CO 0.14 -0.02 1.83 0.09 0.02 0.00 0.00 175.30 177.36 2iem n ASN 19 N -0.90 5.71 -3.90 0.23 3.02 -1.26 -4.19 115.26 113.97 2iem n ASN 19 Ca -0.05 -3.74 -0.30 0.00 -0.03 0.00 0.00 54.58 50.46 2iem n ASN 19 Cb 0.66 -0.82 -0.15 0.00 -0.61 0.00 0.00 39.78 38.86 2iem n ASN 19 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2iem s THR 20 N -4.22 1.71 0.26 3.41 -4.23 -1.26 -5.11 115.64 106.20 2iem s THR 20 Ca 0.59 -2.01 -0.30 0.00 -1.18 0.00 0.00 61.69 58.79 2iem s THR 20 Cb 0.48 -2.27 -0.09 0.00 1.34 0.00 0.00 72.50 71.95 2iem s THR 20 CO 0.03 -0.64 1.09 -2.16 -0.54 0.00 0.00 174.62 172.39 2iem s PRO 21 N 1.14 4.65 0.46 3.99 0.04 -1.26 -4.93 135.00 139.08 2iem s PRO 21 Ca 0.11 1.76 -0.23 0.00 0.04 0.00 0.00 61.00 62.69 2iem s PRO 21 Cb -0.19 -3.21 -0.08 0.00 0.04 0.00 0.00 34.50 31.07 2iem s PRO 21 CO -0.14 0.22 1.13 -1.64 0.04 0.00 0.00 177.00 176.60 2iem s MET 22 N -1.23 3.79 0.23 4.56 -1.94 -1.26 -4.99 119.30 118.45 2iem s MET 22 Ca 0.45 1.68 -0.30 0.00 -1.71 0.00 0.00 55.69 55.81 2iem s MET 22 Cb -0.31 -2.36 -0.09 0.00 2.01 0.00 0.00 34.83 34.08 2iem s MET 22 CO 0.39 -0.50 1.10 -1.25 -0.01 0.00 0.00 175.02 174.75 2iem s PRO 23 N -2.76 4.62 -0.02 2.03 0.04 -1.26 -5.01 135.00 132.64 2iem s PRO 23 Ca 0.64 1.76 0.04 0.00 0.04 0.00 0.00 61.00 63.48 2iem s PRO 23 Cb -0.26 -3.23 -0.01 0.00 0.04 0.00 0.00 34.50 31.04 2iem s PRO 23 CO 0.31 0.15 -0.14 0.08 0.04 0.00 0.00 177.00 177.44 2iem s VAL 24 N -0.70 1.14 0.68 -0.36 1.01 -1.26 -3.95 120.40 116.95 2iem s VAL 24 Ca 0.47 -0.61 -0.17 0.00 0.00 0.00 0.00 61.98 61.67 2iem s VAL 24 Cb -0.31 -0.96 -0.06 0.00 0.00 0.00 0.00 36.38 35.05 2iem s VAL 24 CO 0.38 0.33 0.48 0.00 0.00 0.00 0.00 175.10 176.29 2iem n ALA 25 N 2.81 -1.52 0.04 5.51 0.00 -1.26 -4.92 120.51 121.18 2iem n ALA 25 Ca -0.15 -0.18 -0.19 0.00 0.00 0.00 0.00 53.44 52.92 2iem n ALA 25 Cb 0.55 -1.82 -0.14 0.00 0.00 0.00 0.00 19.45 18.04 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 -0.19 1.50 -3.69 0.00 2.02 -2.00 -3.46 112.91 107.10 2iem h THR 26 Ca -0.45 -2.43 -0.68 0.00 0.77 0.00 0.00 66.41 63.61 2iem h THR 26 Cb 1.37 3.07 -0.19 0.00 -1.74 0.00 0.00 68.15 70.66 2iem h THR 26 CO 0.43 0.69 -0.71 -0.76 0.37 0.00 0.00 175.52 175.55 2iem s LEU 27 N -7.99 3.11 0.82 2.58 2.01 -1.26 -3.40 118.68 114.55 2iem s LEU 27 Ca -0.13 -0.11 -0.15 0.00 0.01 0.00 0.00 54.13 53.75 2iem s LEU 27 Cb 0.01 -1.73 -0.02 0.00 0.01 0.00 0.00 46.19 44.46 2iem s LEU 27 CO 0.83 0.32 0.37 1.57 1.01 0.00 0.00 176.35 180.45 2iem n HIS 28 N 1.90 -1.43 0.08 0.29 -0.00 0.48 -4.69 115.22 111.85 2iem n HIS 28 Ca -0.17 0.28 0.01 0.00 0.46 0.00 0.00 57.72 58.30 2iem n HIS 28 Cb 0.53 -1.82 -0.04 0.00 -0.12 0.00 0.00 29.99 28.53 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 -0.85 0.64 0.00 1.57 0.00 -1.91 -2.41 119.26 116.30 2iem h ALA 29 Ca -0.44 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 53.78 2iem h ALA 29 Cb 1.32 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2iem h ALA 29 CO 0.38 0.82 -0.22 0.28 0.00 0.00 0.00 179.25 180.50 2iem n VAL 30 N -3.07 0.43 -0.28 0.00 0.31 -1.26 -4.48 118.33 109.98 2iem n VAL 30 Ca -0.04 0.41 0.07 0.00 -0.01 0.00 0.00 64.34 64.76 2iem n VAL 30 Cb 0.80 -1.76 0.29 0.00 -0.91 0.00 0.00 33.84 32.27 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 -0.29 0.80 -0.00 4.52 -0.00 -1.81 -3.45 115.58 115.35 2iem h ASN 31 Ca 0.00 0.02 -0.00 0.00 -0.00 0.00 0.00 56.30 56.32 2iem h ASN 31 Cb 0.22 -0.15 -0.00 0.00 -0.00 0.00 0.00 38.32 38.40 2iem h ASN 31 CO 0.00 0.48 -0.00 0.61 -0.00 0.00 0.00 177.43 178.52 2iem n GLY 32 N -1.41 0.42 3.28 1.57 0.00 -0.90 -4.95 105.19 103.20 2iem n GLY 32 Ca 0.15 -0.77 -0.15 0.00 0.00 0.00 0.00 46.02 45.24 2iem n GLY 32 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2iem s HIS 33 N -2.00 1.38 0.10 1.61 5.04 -1.25 -4.62 115.29 115.55 2iem s HIS 33 Ca 0.00 -0.88 -0.36 0.00 -1.54 0.00 0.00 55.06 52.28 2iem s HIS 33 Cb 0.00 -0.77 -0.17 0.00 0.04 0.00 0.00 32.58 31.68 2iem s HIS 33 CO 0.00 -0.03 1.22 0.45 -2.34 0.00 0.00 174.74 174.03 2iem n SER 34 N -0.30 1.19 -0.09 9.88 2.88 -1.26 0.18 113.62 126.11 2iem n SER 34 Ca -0.07 1.13 -0.08 0.00 -1.33 0.00 0.00 58.87 58.52 2iem n SER 34 Cb 0.63 -1.15 -0.16 0.00 -0.75 0.00 0.00 64.21 62.78 2iem n SER 34 CO 0.00 0.00 0.00 1.15 -1.23 0.00 0.00 175.04 174.96 2iem n MET 35 N 2.07 0.68 0.07 -1.46 0.00 -1.22 -4.34 117.12 112.93 2iem n MET 35 Ca 0.18 -0.00 -0.12 0.00 0.00 0.00 0.00 57.70 57.76 2iem n MET 35 Cb 0.19 -1.54 -0.03 0.00 0.00 0.00 0.00 33.22 31.84 2iem n MET 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2iem h THR 36 N 0.00 1.43 -2.89 3.17 1.03 -1.90 -3.44 112.91 110.31 2iem h THR 36 Ca -0.48 -2.49 -0.52 0.00 -0.01 0.00 0.00 66.41 62.91 2iem h THR 36 Cb 2.13 2.42 0.05 0.00 -1.07 0.00 0.00 68.15 71.67 2iem h THR 36 CO 0.03 0.74 0.87 0.20 -0.01 0.00 0.00 175.52 177.35 2iem s ASN 37 N -7.02 6.59 -0.33 0.00 0.01 -1.26 -4.98 114.94 107.94 2iem s ASN 37 Ca -0.05 2.63 0.01 0.00 -0.71 0.00 0.00 52.86 54.74 2iem s ASN 37 Cb 0.09 -2.60 0.08 0.00 0.41 0.00 0.00 41.25 39.24 2iem s ASN 37 CO 0.85 -0.82 0.04 -0.69 -1.51 0.00 0.00 177.10 174.98 2iem s VAL 38 N 1.00 2.69 0.13 1.60 1.01 -1.26 -4.99 120.40 120.58 2iem s VAL 38 Ca 0.69 -1.89 -0.30 0.00 0.00 0.00 0.00 61.98 60.48 2iem s VAL 38 Cb -0.44 -2.76 -0.07 0.00 0.00 0.00 0.00 36.38 33.12 2iem s VAL 38 CO 0.33 -0.38 1.14 -2.16 0.00 0.00 0.00 175.10 174.02 2iem s PRO 39 N 1.09 4.52 -0.37 2.72 0.04 -1.26 -4.89 135.00 136.86 2iem s PRO 39 Ca 0.02 1.74 -0.45 0.00 0.04 0.00 0.00 61.00 62.35 2iem s PRO 39 Cb -0.20 -3.31 -0.20 0.00 0.04 0.00 0.00 34.50 30.83 2iem s PRO 39 CO -0.05 -0.06 1.46 -0.25 0.04 0.00 0.00 177.00 178.14 2iem n ASP 40 N 3.00 0.89 0.00 6.66 8.00 -1.26 0.50 116.55 134.34 2iem n ASP 40 Ca 0.05 1.18 0.00 0.00 0.71 0.00 0.00 54.79 56.73 2iem n ASP 40 Cb 0.46 -0.89 0.00 0.00 -0.02 0.00 0.00 41.12 40.67 2iem n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2iem n GLY 41 N 3.34 0.46 3.86 0.44 0.00 -1.26 -5.08 105.19 106.95 2iem n GLY 41 Ca 0.28 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.93 2iem n GLY 41 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2iem s MET 42 N -0.77 3.63 0.15 1.61 -2.45 0.18 -4.51 119.30 117.14 2iem s MET 42 Ca 0.00 0.08 0.08 0.00 -1.25 0.00 0.00 55.69 54.59 2iem s MET 42 Cb 0.00 -3.19 -0.04 0.00 1.25 0.00 0.00 34.83 32.85 2iem s MET 42 CO 0.00 0.73 -0.17 -1.21 1.05 0.00 0.00 175.02 175.42 2iem s GLU 43 N -1.14 1.18 0.08 4.11 2.02 -0.73 -4.84 118.70 119.38 2iem s GLU 43 Ca 0.20 -1.34 0.07 0.00 0.02 0.00 0.00 54.97 53.92 2iem s GLU 43 Cb -0.14 -1.17 -0.04 0.00 0.10 0.00 0.00 34.13 32.88 2iem s GLU 43 CO 0.09 0.24 -0.15 0.42 0.02 0.00 0.00 175.26 175.87 2iem s ILE 44 N -2.06 3.02 -0.04 -1.63 1.01 -1.26 -1.59 121.20 118.66 2iem s ILE 44 Ca 0.13 -1.28 0.01 0.00 0.00 0.00 0.00 60.65 59.51 2iem s ILE 44 Cb -0.05 -2.35 0.02 0.00 0.01 0.00 0.00 42.46 40.09 2iem s ILE 44 CO 0.05 0.21 -0.03 0.00 0.00 0.00 0.00 174.94 175.17 2iem s ALA 45 N -1.08 0.52 -0.22 9.38 0.00 0.58 -4.62 121.76 126.32 2iem s ALA 45 Ca 0.18 0.04 -0.08 0.00 0.00 0.00 0.00 51.96 52.09 2iem s ALA 45 Cb -0.11 -0.37 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 2iem s ALA 45 CO 0.09 -0.03 0.10 0.42 0.00 0.00 0.00 175.76 176.34 2iem s ILE 46 N 0.94 4.86 0.12 0.00 1.01 -1.07 -0.14 121.20 126.91 2iem s ILE 46 Ca -0.11 0.00 -0.02 0.00 0.00 0.00 0.00 60.65 60.52 2iem s ILE 46 Cb -0.14 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.06 2iem s ILE 46 CO -0.01 0.39 0.08 -0.36 0.00 0.00 0.00 174.94 175.04 2iem s PHE 47 N 0.90 0.70 -0.08 3.97 0.08 -0.96 -1.01 117.98 121.58 2iem s PHE 47 Ca 0.05 -1.11 -0.03 0.00 0.12 0.00 0.00 56.93 55.96 2iem s PHE 47 Cb -0.13 -0.39 0.04 0.00 -0.57 0.00 0.00 43.02 41.97 2iem s PHE 47 CO 0.03 -0.52 0.16 0.00 -0.10 0.00 0.00 175.22 174.79 2iem s ALA 48 N -4.01 -0.28 0.10 5.36 0.00 -0.69 -0.83 121.76 121.41 2iem s ALA 48 Ca 0.19 0.69 0.02 0.00 0.00 0.00 0.00 51.96 52.86 2iem s ALA 48 Cb 0.07 -0.59 -0.01 0.00 0.00 0.00 0.00 23.12 22.59 2iem s ALA 48 CO -0.01 -0.29 0.06 -1.33 0.00 0.00 0.00 175.76 174.19 2iem n MET 49 N 4.56 0.40 0.00 0.00 2.81 -1.23 -2.44 117.12 121.22 2iem n MET 49 Ca -0.20 -0.89 0.00 0.00 -1.81 0.00 0.00 57.70 54.81 2iem n MET 49 Cb 0.51 0.63 0.00 0.00 -0.71 0.00 0.00 33.22 33.65 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 0.51 -1.75 3.54 3.03 0.00 -1.26 -4.10 105.19 105.16 2iem n GLY 50 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 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 10.35 0.66 -0.76 0.00 -5.15 -1.90 1.11 116.94 121.24 2iem h PHE 52 Ca 0.15 0.04 0.09 0.00 -0.20 0.00 0.00 57.97 58.06 2iem h PHE 52 Cb 0.93 -0.14 -0.07 0.00 0.22 0.00 0.00 35.95 36.89 2iem h PHE 52 CO 1.12 -0.14 0.40 -1.49 -2.00 0.00 0.00 178.31 176.21 2iem h TRP 53 N 0.32 0.73 -0.15 6.09 6.55 -1.89 0.55 115.95 128.16 2iem h TRP 53 Ca 0.62 0.03 -0.16 0.00 0.95 0.00 0.00 58.89 60.33 2iem h TRP 53 Cb 1.28 -0.21 0.01 0.00 -0.86 0.00 0.00 29.16 29.38 2iem h TRP 53 CO -0.13 0.28 -0.54 0.78 -1.05 0.00 0.00 178.44 177.77 2iem h GLY 54 N 0.68 0.69 0.70 1.49 0.00 0.81 -2.58 103.07 104.85 2iem h GLY 54 Ca 0.37 -0.92 0.04 0.00 0.00 0.00 0.00 47.33 46.81 2iem h GLY 54 CO -0.26 0.82 0.10 -2.08 0.00 0.00 0.00 176.54 175.12 2iem h VAL 55 N 0.28 0.89 -0.85 4.60 2.07 0.91 0.79 116.25 124.94 2iem h VAL 55 Ca -0.03 -0.08 0.04 0.00 0.82 0.00 0.00 66.70 67.46 2iem h VAL 55 Cb 1.17 0.64 -0.05 0.00 -1.52 0.00 0.00 31.29 31.53 2iem h VAL 55 CO 0.11 0.04 0.54 -0.08 0.02 0.00 0.00 177.57 178.21 2iem h GLU 56 N 0.23 0.99 0.28 1.57 4.81 0.05 0.31 114.58 122.83 2iem h GLU 56 Ca 0.15 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 2iem h GLU 56 Cb 0.13 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.29 2iem h GLU 56 CO -0.16 0.66 -0.14 -0.09 -0.73 0.00 0.00 179.01 178.55 2iem h ARG 57 N 1.02 -0.37 -0.10 1.92 2.43 -0.87 -0.95 114.38 117.47 2iem h ARG 57 Ca 0.35 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.57 2iem h ARG 57 Cb 0.07 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.70 2iem h ARG 57 CO -0.14 -0.03 0.18 1.25 -1.51 0.00 0.00 179.97 179.72 2iem h LEU 58 N -0.79 0.00 0.10 3.80 6.46 0.80 0.71 115.31 126.38 2iem h LEU 58 Ca -0.04 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.72 2iem h LEU 58 Cb 0.51 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.44 2iem h LEU 58 CO 0.06 0.00 -0.05 -0.26 -0.62 0.00 0.00 178.44 177.58 2iem h PHE 59 N 0.00 -0.12 0.01 1.25 0.04 -0.09 -2.97 116.94 115.05 2iem h PHE 59 Ca 0.05 -0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.83 2iem h PHE 59 Cb 0.41 0.04 -0.02 0.00 2.20 0.00 0.00 35.95 38.58 2iem h PHE 59 CO 0.00 -0.08 -0.09 0.11 -0.60 0.00 0.00 178.31 177.66 2iem h TRP 60 N -0.51 -0.22 -0.26 -0.55 5.08 -0.84 0.11 115.95 118.76 2iem h TRP 60 Ca -0.01 0.01 0.07 0.00 1.08 0.00 0.00 58.89 60.04 2iem h TRP 60 Cb 0.10 0.10 -0.01 0.00 -3.00 0.00 0.00 29.16 26.35 2iem h TRP 60 CO 0.02 -0.14 0.62 1.96 -1.28 0.00 0.00 178.44 179.63 2iem h GLN 61 N -0.16 0.00 -6.92 0.12 4.20 0.27 -3.41 115.11 109.21 2iem h GLN 61 Ca 0.03 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 58.25 2iem h GLN 61 Cb 0.19 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.00 2iem h GLN 61 CO -0.08 0.00 0.46 -1.17 -0.67 0.00 0.00 178.83 177.37 2iem s LEU 62 N -6.17 4.24 -0.26 1.46 0.20 0.38 -4.97 118.68 113.57 2iem s LEU 62 Ca -0.03 2.20 -0.29 0.00 0.69 0.00 0.00 54.13 56.70 2iem s LEU 62 Cb 0.10 -4.01 -0.00 0.00 -0.43 0.00 0.00 46.19 41.84 2iem s LEU 62 CO 0.32 -0.49 1.33 -2.16 -0.29 0.00 0.00 176.35 175.05 2iem s PRO 63 N -2.21 3.97 0.00 0.98 0.04 -1.26 -2.82 135.00 133.69 2iem s PRO 63 Ca 0.55 1.37 0.00 0.00 0.04 0.00 0.00 61.00 62.96 2iem s PRO 63 Cb -0.27 -3.87 0.00 0.00 0.04 0.00 0.00 34.50 30.39 2iem s PRO 63 CO 0.34 -1.05 0.00 0.41 0.04 0.00 0.00 177.00 176.74 2iem n GLY 64 N 4.21 1.76 3.63 0.56 0.00 -1.26 -4.56 105.19 109.53 2iem n GLY 64 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.37 4.56 -0.08 1.61 1.01 -1.13 -2.44 120.40 122.56 2iem s VAL 65 Ca 0.00 1.55 -0.27 0.00 0.00 0.00 0.00 61.98 63.25 2iem s VAL 65 Cb 0.00 -4.37 -0.23 0.00 0.00 0.00 0.00 36.38 31.78 2iem s VAL 65 CO 0.00 -0.47 1.01 0.22 0.00 0.00 0.00 175.10 175.86 2iem h TYR 66 N 8.19 0.02 -3.10 5.22 5.03 0.18 -3.46 116.97 129.05 2iem h TYR 66 Ca -0.22 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.09 2iem h TYR 66 Cb 1.07 -0.00 -0.10 0.00 1.55 0.00 0.00 36.73 39.25 2iem h TYR 66 CO 0.83 0.77 0.16 -1.12 -1.32 0.00 0.00 178.16 177.47 2iem s SER 67 N -5.99 -0.39 0.05 -2.11 0.01 -0.92 -4.57 113.70 99.78 2iem s SER 67 Ca -0.17 -0.31 -0.05 0.00 1.31 0.00 0.00 55.95 56.72 2iem s SER 67 Cb -0.01 0.63 -0.01 0.00 0.21 0.00 0.00 66.02 66.84 2iem s SER 67 CO 0.69 -1.10 0.10 0.42 0.41 0.00 0.00 173.24 173.76 2iem s THR 68 N -3.83 0.15 0.11 1.44 -4.23 -1.26 -0.33 115.64 107.69 2iem s THR 68 Ca 0.06 -1.27 0.02 0.00 -1.18 0.00 0.00 61.69 59.32 2iem s THR 68 Cb -0.02 -1.16 -0.04 0.00 1.34 0.00 0.00 72.50 72.62 2iem s THR 68 CO -0.05 -0.70 -0.07 0.00 -0.54 0.00 0.00 174.62 173.26 2iem s ALA 69 N -3.25 1.06 -0.20 3.99 0.00 -0.70 -4.89 121.76 117.78 2iem s ALA 69 Ca 0.00 -1.38 0.01 0.00 0.00 0.00 0.00 51.96 50.60 2iem s ALA 69 Cb 0.03 0.14 0.04 0.00 0.00 0.00 0.00 23.12 23.32 2iem s ALA 69 CO -0.08 -0.21 -0.14 0.00 0.00 0.00 0.00 175.76 175.33 2iem s ALA 70 N -3.57 2.19 0.00 0.00 0.00 -1.26 0.18 121.76 119.30 2iem s ALA 70 Ca 0.13 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 50.82 2iem s ALA 70 Cb 0.05 -1.27 0.00 0.00 0.00 0.00 0.00 23.12 21.90 2iem s ALA 70 CO -0.04 -0.66 0.00 0.41 0.00 0.00 0.00 175.76 175.47 2iem n GLY 71 N 4.63 4.54 3.34 0.00 0.00 -0.99 0.16 105.19 116.88 2iem n GLY 71 Ca -0.17 -1.42 -0.20 0.00 0.00 0.00 0.00 46.02 44.23 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 -1.78 1.79 0.17 1.61 2.02 -1.01 -2.63 117.35 117.52 2iem s TYR 72 Ca 0.00 -0.50 -0.23 0.00 -0.37 0.00 0.00 57.07 55.97 2iem s TYR 72 Cb 0.00 -0.86 0.07 0.00 -0.40 0.00 0.00 41.96 40.77 2iem s TYR 72 CO 0.00 0.37 0.61 -0.08 -1.57 0.00 0.00 175.55 174.88 2iem s THR 73 N -2.47 0.00 0.00 -0.71 -1.32 -0.92 -2.52 115.64 107.70 2iem s THR 73 Ca 0.19 -0.08 0.00 0.00 -1.21 0.00 0.00 61.69 60.60 2iem s THR 73 Cb -0.04 -1.08 0.00 0.00 -1.51 0.00 0.00 72.50 69.88 2iem s THR 73 CO 0.07 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.09 2iem n GLY 74 N -0.38 1.37 3.94 6.08 0.00 -1.26 0.22 105.19 115.16 2iem n GLY 74 Ca -0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.02 1.69 -0.04 -0.02 0.00 -0.92 -4.53 107.32 101.46 2iem s GLY 75 Ca 0.00 -0.97 0.11 0.00 0.00 0.00 0.00 44.72 43.86 2iem s GLY 75 CO 0.00 -0.65 0.20 2.98 0.00 0.00 0.00 173.10 175.62 2iem n TYR 76 N -2.61 0.00 -2.43 1.90 9.36 -0.72 -4.88 117.16 117.78 2iem n TYR 76 Ca 0.06 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.86 2iem n TYR 76 Cb 0.59 -0.36 -0.02 0.00 -0.63 0.00 0.00 39.34 38.92 2iem n TYR 76 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 2iem s THR 77 N -2.67 4.23 0.59 2.97 2.01 -1.24 -4.96 115.64 116.56 2iem s THR 77 Ca -0.05 1.54 -0.16 0.00 0.31 0.00 0.00 61.69 63.33 2iem s THR 77 Cb 0.06 -3.99 -0.04 0.00 0.01 0.00 0.00 72.50 68.54 2iem s THR 77 CO 0.49 -0.05 1.05 -2.16 -0.69 0.00 0.00 174.62 173.26 2iem s PRO 78 N 2.71 3.39 -0.97 4.92 0.04 -1.26 -4.06 135.00 139.76 2iem s PRO 78 Ca 0.56 1.17 -0.12 0.00 0.04 0.00 0.00 61.00 62.65 2iem s PRO 78 Cb -0.24 -2.04 -0.00 0.00 0.04 0.00 0.00 34.50 32.26 2iem s PRO 78 CO 0.19 -0.75 0.72 0.09 0.04 0.00 0.00 177.00 177.29 2iem n ASN 79 N -1.99 -5.65 -4.76 6.66 4.13 -1.26 -3.16 115.26 109.23 2iem n ASN 79 Ca 0.08 -0.83 -0.39 0.00 1.68 0.00 0.00 54.58 55.12 2iem n ASN 79 Cb 0.53 -3.20 -0.04 0.00 -1.54 0.00 0.00 39.78 35.53 2iem n ASN 79 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 2iem s PRO 80 N -5.17 4.55 0.30 3.52 0.04 -1.26 -4.31 135.00 132.68 2iem s PRO 80 Ca 0.25 1.72 0.08 0.00 0.04 0.00 0.00 61.00 63.09 2iem s PRO 80 Cb -0.10 -3.06 -0.04 0.00 0.04 0.00 0.00 34.50 31.35 2iem s PRO 80 CO 0.86 0.16 0.11 0.99 0.04 0.00 0.00 177.00 179.16 2iem s THR 81 N -1.27 3.37 0.16 1.26 2.01 -1.26 -4.92 115.64 114.98 2iem s THR 81 Ca 0.47 -1.71 -0.16 0.00 0.31 0.00 0.00 61.69 60.60 2iem s THR 81 Cb -0.29 -3.00 0.04 0.00 0.01 0.00 0.00 72.50 69.26 2iem s THR 81 CO 0.37 -0.26 1.72 0.22 -0.69 0.00 0.00 174.62 175.98 2iem h TYR 82 N 1.63 0.07 -0.03 4.92 3.20 -1.98 0.17 116.97 124.95 2iem h TYR 82 Ca -0.45 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.31 2iem h TYR 82 Cb 1.25 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 39.53 2iem h TYR 82 CO 0.63 -0.02 -0.60 0.07 -1.64 0.00 0.00 178.16 176.61 2iem h ARG 83 N 0.16 0.11 -0.56 1.82 0.11 -1.98 -2.19 114.38 111.85 2iem h ARG 83 Ca 0.18 -0.07 -0.03 0.00 0.10 0.00 0.00 59.98 60.15 2iem h ARG 83 Cb 0.22 0.01 -0.02 0.00 1.11 0.00 0.00 29.97 31.29 2iem h ARG 83 CO -0.25 0.67 0.21 1.49 0.10 0.00 0.00 179.97 182.19 2iem h GLU 84 N 0.08 0.84 -0.39 0.08 4.81 -1.63 -2.42 114.58 115.95 2iem h GLU 84 Ca -0.01 -0.16 -0.11 0.00 -0.13 0.00 0.00 59.36 58.95 2iem h GLU 84 Cb 1.07 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.31 2iem h GLU 84 CO 0.08 0.73 -0.20 0.28 -0.73 0.00 0.00 179.01 179.17 2iem h VAL 85 N 0.76 1.28 -0.22 0.32 2.07 -0.62 -2.40 116.25 117.44 2iem h VAL 85 Ca 0.18 -1.34 0.07 0.00 0.82 0.00 0.00 66.70 66.43 2iem h VAL 85 Cb 0.21 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 2iem h VAL 85 CO -0.01 0.45 0.31 -1.28 0.02 0.00 0.00 177.57 177.05 2iem h SER 86 N 0.63 0.00 -0.34 0.57 0.87 -1.09 0.29 113.55 114.49 2iem h SER 86 Ca 0.09 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.50 2iem h SER 86 Cb 0.76 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.71 2iem h SER 86 CO 0.06 0.00 -0.35 -1.28 -0.53 0.00 0.00 176.83 174.73 2iem h SER 87 N 0.00 0.93 0.00 6.23 0.87 -0.94 -3.47 113.55 117.17 2iem h SER 87 Ca 0.11 -0.41 0.00 0.00 -1.23 0.00 0.00 61.79 60.26 2iem h SER 87 Cb 0.72 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.42 2iem h SER 87 CO -0.00 1.19 0.00 0.61 -0.53 0.00 0.00 176.83 178.10 2iem n GLY 88 N 0.05 0.51 1.31 5.77 0.00 0.10 -4.87 105.19 108.06 2iem n GLY 88 Ca -0.02 -0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.08 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 0.08 3.83 -0.01 1.61 8.00 -1.26 -3.98 116.55 124.82 2iem n ASP 89 Ca 0.00 -2.00 0.08 0.00 0.71 0.00 0.00 54.79 53.58 2iem n ASP 89 Cb 0.00 -0.42 -0.12 0.00 -0.02 0.00 0.00 41.12 40.56 2iem n ASP 89 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2iem n THR 90 N 1.63 0.00 -1.23 -3.53 -2.24 -1.26 -3.06 114.28 104.59 2iem n THR 90 Ca 0.23 -0.32 -0.08 0.00 -2.27 0.00 0.00 64.05 61.61 2iem n THR 90 Cb 0.62 0.34 -0.03 0.00 -2.10 0.00 0.00 70.33 69.16 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 1.49 0.94 3.86 3.38 0.00 -1.26 -1.76 105.19 111.85 2iem n GLY 91 Ca -0.02 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.12 3.48 0.11 1.61 3.76 -1.26 -2.16 115.29 118.71 2iem s HIS 92 Ca 0.00 1.29 0.06 0.00 -0.15 0.00 0.00 55.06 56.26 2iem s HIS 92 Cb 0.00 -2.66 -0.04 0.00 1.11 0.00 0.00 32.58 31.00 2iem s HIS 92 CO 0.00 -0.32 -0.15 0.00 -0.85 0.00 0.00 174.74 173.42 2iem s ALA 93 N -2.62 1.45 -0.05 -1.40 0.00 0.13 -4.82 121.76 114.45 2iem s ALA 93 Ca 0.56 -1.22 -0.30 0.00 0.00 0.00 0.00 51.96 51.00 2iem s ALA 93 Cb -0.10 -0.10 -0.04 0.00 0.00 0.00 0.00 23.12 22.88 2iem s ALA 93 CO 0.35 0.14 1.35 -1.21 0.00 0.00 0.00 175.76 176.38 2iem s GLU 94 N -2.38 4.28 0.08 0.00 0.41 -0.52 -2.16 118.70 118.41 2iem s GLU 94 Ca 0.06 1.85 -0.05 0.00 -0.41 0.00 0.00 54.97 56.42 2iem s GLU 94 Cb -0.07 -3.65 -0.02 0.00 -1.78 0.00 0.00 34.13 28.62 2iem s GLU 94 CO 0.03 -0.59 0.11 0.00 -0.49 0.00 0.00 175.26 174.31 2iem s ALA 95 N 2.73 0.12 0.04 5.21 0.00 -1.08 -4.38 121.76 124.39 2iem s ALA 95 Ca 0.61 -0.90 0.03 0.00 0.00 0.00 0.00 51.96 51.70 2iem s ALA 95 Cb -0.28 0.45 -0.02 0.00 0.00 0.00 0.00 23.12 23.27 2iem s ALA 95 CO 0.23 -0.47 -0.09 0.14 0.00 0.00 0.00 175.76 175.57 2iem s VAL 96 N -3.90 0.69 0.02 0.00 -7.23 -0.01 -2.34 120.40 107.63 2iem s VAL 96 Ca 0.07 -0.96 -0.06 0.00 -1.81 0.00 0.00 61.98 59.23 2iem s VAL 96 Cb 0.06 -0.69 -0.05 0.00 0.56 0.00 0.00 36.38 36.26 2iem s VAL 96 CO -0.09 -0.22 0.27 -0.60 -0.31 0.00 0.00 175.10 174.15 2iem s ARG 97 N -1.29 3.58 -0.05 4.82 3.52 0.48 -2.26 118.95 127.75 2iem s ARG 97 Ca -0.05 -0.10 0.01 0.00 -0.13 0.00 0.00 55.73 55.46 2iem s ARG 97 Cb -0.08 -3.06 0.02 0.00 -1.56 0.00 0.00 34.95 30.27 2iem s ARG 97 CO 0.01 0.63 -0.06 0.42 -0.81 0.00 0.00 175.30 175.49 2iem s ILE 98 N -1.34 0.65 -0.27 4.11 1.09 0.80 -1.71 121.20 124.53 2iem s ILE 98 Ca 0.29 -0.19 0.01 0.00 -1.10 0.00 0.00 60.65 59.66 2iem s ILE 98 Cb -0.13 -0.65 0.07 0.00 -1.06 0.00 0.00 42.46 40.69 2iem s ILE 98 CO 0.18 0.25 -0.01 -0.69 -0.10 0.00 0.00 174.94 174.56 2iem s VAL 99 N 0.87 1.57 0.40 2.92 1.01 0.55 0.22 120.40 127.94 2iem s VAL 99 Ca -0.12 -1.46 0.05 0.00 0.00 0.00 0.00 61.98 60.46 2iem s VAL 99 Cb -0.15 -1.94 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 2iem s VAL 99 CO 0.01 -0.28 0.20 -0.72 0.00 0.00 0.00 175.10 174.31 2iem s TYR 100 N 1.34 1.79 -0.09 5.22 -0.85 -0.62 0.19 117.35 124.33 2iem s TYR 100 Ca -0.01 -1.47 0.01 0.00 -0.52 0.00 0.00 57.07 55.09 2iem s TYR 100 Cb -0.19 -1.00 -0.02 0.00 0.38 0.00 0.00 41.96 41.13 2iem s TYR 100 CO -0.09 -0.54 -0.12 -0.51 -1.52 0.00 0.00 175.55 172.76 2iem s ASP 101 N -3.56 4.13 0.00 -0.18 1.01 -1.02 -1.78 116.67 115.28 2iem s ASP 101 Ca 0.28 -0.23 0.23 0.00 0.71 0.00 0.00 52.55 53.54 2iem s ASP 101 Cb 0.01 -1.26 1.36 0.00 1.01 0.00 0.00 42.92 44.04 2iem s ASP 101 CO 0.20 0.26 1.74 -0.81 0.21 0.00 0.00 175.17 176.77 2iem n PRO 102 N 2.88 0.75 0.05 8.23 -0.04 -1.23 -0.61 135.00 145.03 2iem n PRO 102 Ca -0.18 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.40 2iem n PRO 102 Cb 0.52 -1.47 0.04 0.00 -0.04 0.00 0.00 33.50 32.55 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 -0.97 0.65 -0.03 3.54 2.88 -1.26 -4.45 113.62 113.97 2iem n SER 103 Ca 0.17 0.01 -0.05 0.00 -1.33 0.00 0.00 58.87 57.67 2iem n SER 103 Cb 0.08 0.64 -0.02 0.00 -0.75 0.00 0.00 64.21 64.15 2iem n SER 103 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2iem n VAL 104 N -2.19 0.30 -4.69 2.46 0.31 -0.91 -5.02 118.33 108.59 2iem n VAL 104 Ca 0.01 -0.09 -0.25 0.00 -0.01 0.00 0.00 64.34 64.00 2iem n VAL 104 Cb 0.47 -1.31 -0.16 0.00 -0.91 0.00 0.00 33.84 31.93 2iem n VAL 104 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 2iem s ILE 105 N -2.10 1.27 0.28 2.52 -1.16 0.22 -4.91 121.20 117.31 2iem s ILE 105 Ca -0.08 -0.57 0.00 0.00 -0.51 0.00 0.00 60.65 59.50 2iem s ILE 105 Cb 0.03 -1.14 -0.04 0.00 0.61 0.00 0.00 42.46 41.92 2iem s ILE 105 CO 0.10 0.38 0.48 -0.94 -2.81 0.00 0.00 174.94 172.15 2iem s SER 106 N 0.52 6.34 0.26 4.50 1.04 -1.26 -3.47 113.70 121.63 2iem s SER 106 Ca -0.13 0.40 -0.01 0.00 0.48 0.00 0.00 55.95 56.69 2iem s SER 106 Cb -0.15 -2.01 0.33 0.00 0.10 0.00 0.00 66.02 64.29 2iem s SER 106 CO 0.04 -0.18 1.72 0.10 0.98 0.00 0.00 173.24 175.90 2iem h TYR 107 N 1.25 0.73 -1.00 5.02 -0.00 -1.95 -2.44 116.97 118.58 2iem h TYR 107 Ca -0.49 -0.14 0.11 0.00 0.00 0.00 0.00 58.73 58.21 2iem h TYR 107 Cb 1.21 -0.19 -0.08 0.00 0.00 0.00 0.00 36.73 37.67 2iem h TYR 107 CO 0.52 0.78 0.64 1.49 -0.00 0.00 0.00 178.16 181.58 2iem h GLU 108 N 0.60 1.00 -0.24 0.10 4.81 -1.97 -0.17 114.58 118.72 2iem h GLU 108 Ca 0.10 -0.06 -0.20 0.00 -0.13 0.00 0.00 59.36 59.07 2iem h GLU 108 Cb 0.59 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.75 2iem h GLU 108 CO 0.04 0.66 -0.64 1.96 -0.73 0.00 0.00 179.01 180.30 2iem h GLN 109 N 1.03 0.85 -0.75 1.92 4.20 -1.90 -2.59 115.11 117.87 2iem h GLN 109 Ca 0.49 -0.60 0.08 0.00 0.06 0.00 0.00 58.65 58.67 2iem h GLN 109 Cb 0.43 0.09 -0.07 0.00 0.30 0.00 0.00 27.48 28.24 2iem h GLN 109 CO -0.25 1.22 0.42 -0.07 -0.67 0.00 0.00 178.83 179.49 2iem h LEU 110 N 0.63 0.61 -1.16 1.46 3.38 -0.71 0.13 115.31 119.65 2iem h LEU 110 Ca -0.01 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 2iem h LEU 110 Cb 1.26 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 2iem h LEU 110 CO 0.14 0.37 -0.15 -0.07 0.09 0.00 0.00 178.44 178.82 2iem h LEU 111 N 0.74 0.39 -0.02 1.67 3.38 -1.02 0.31 115.31 120.76 2iem h LEU 111 Ca 0.35 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.24 2iem h LEU 111 Cb 0.28 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2iem h LEU 111 CO -0.22 0.57 -0.07 -0.61 0.09 0.00 0.00 178.44 178.20 2iem h GLN 112 N 0.37 -0.11 -0.04 1.13 4.15 -0.37 -0.52 115.11 119.72 2iem h GLN 112 Ca 0.07 0.01 -0.18 0.00 0.77 0.00 0.00 58.65 59.32 2iem h GLN 112 Cb 0.49 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.20 2iem h GLN 112 CO 0.03 -0.07 -0.74 -0.24 -1.93 0.00 0.00 178.83 175.88 2iem h VAL 113 N -0.11 1.42 -0.41 2.39 3.04 -1.09 -3.10 116.25 118.39 2iem h VAL 113 Ca 0.03 -2.25 0.07 0.00 -1.01 0.00 0.00 66.70 63.54 2iem h VAL 113 Cb 0.16 2.20 -0.06 0.00 -2.01 0.00 0.00 31.29 31.57 2iem h VAL 113 CO -0.08 0.67 0.01 0.15 -1.01 0.00 0.00 177.57 177.30 2iem h PHE 114 N 0.18 -0.00 0.00 3.17 3.04 0.14 0.72 116.94 124.19 2iem h PHE 114 Ca -0.03 0.03 -0.00 0.00 3.98 0.00 0.00 57.97 61.95 2iem h PHE 114 Cb 1.31 0.06 -0.00 0.00 2.56 0.00 0.00 35.95 39.88 2iem h PHE 114 CO 0.03 -0.07 -0.01 -1.49 -2.02 0.00 0.00 178.31 174.76 2iem h TRP 115 N 0.12 0.00 0.21 0.41 6.55 -1.11 1.49 115.95 123.62 2iem h TRP 115 Ca 0.20 0.00 -0.32 0.00 0.95 0.00 0.00 58.89 59.72 2iem h TRP 115 Cb 0.28 0.00 0.02 0.00 -0.86 0.00 0.00 29.16 28.60 2iem h TRP 115 CO -0.26 0.01 -1.42 1.49 -1.05 0.00 0.00 178.44 177.21 2iem h GLU 116 N 0.00 0.43 -0.00 0.49 4.81 0.12 -3.26 114.58 117.18 2iem h GLU 116 Ca -0.00 -0.74 0.00 0.00 -0.13 0.00 0.00 59.36 58.49 2iem h GLU 116 Cb 0.33 0.28 0.00 0.00 0.63 0.00 0.00 28.75 29.99 2iem h GLU 116 CO 0.00 1.35 -0.57 -1.71 -0.73 0.00 0.00 179.01 177.35 2iem n ASN 117 N -3.64 0.76 -4.76 1.04 2.85 0.20 -4.92 115.26 106.79 2iem n ASN 117 Ca -0.14 -0.57 -0.30 0.00 -0.11 0.00 0.00 54.58 53.45 2iem n ASN 117 Cb 1.08 0.41 0.10 0.00 1.24 0.00 0.00 39.78 42.61 2iem n ASN 117 CO 0.00 0.00 0.00 -2.28 -2.11 0.00 0.00 177.26 172.87 2iem s HIS 118 N -2.90 2.58 -0.13 1.20 2.46 0.50 -4.65 115.29 114.35 2iem s HIS 118 Ca 0.13 1.41 -0.05 0.00 0.47 0.00 0.00 55.06 57.01 2iem s HIS 118 Cb 0.17 -3.07 -0.04 0.00 -0.13 0.00 0.00 32.58 29.52 2iem s HIS 118 CO 0.70 -1.92 0.06 -0.51 -2.47 0.00 0.00 174.74 170.61 2iem s ASP 119 N -3.49 5.72 0.69 9.88 1.11 -1.26 -4.95 116.67 124.36 2iem s ASP 119 Ca 0.61 0.22 -0.11 0.00 0.18 0.00 0.00 52.55 53.46 2iem s ASP 119 Cb -0.17 -1.82 0.01 0.00 1.07 0.00 0.00 42.92 42.01 2iem s ASP 119 CO 0.56 0.32 1.06 -2.16 1.18 0.00 0.00 175.17 176.13 2iem s PRO 120 N -0.50 2.96 -0.11 8.23 0.04 -1.26 -4.96 135.00 139.40 2iem s PRO 120 Ca 0.10 0.96 -0.25 0.00 0.04 0.00 0.00 61.00 61.86 2iem s PRO 120 Cb -0.12 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.40 2iem s PRO 120 CO 0.02 -1.08 0.77 0.00 0.04 0.00 0.00 177.00 176.75 2iem s ALA 121 N -3.03 3.41 -0.27 8.56 0.00 -1.26 -4.93 121.76 124.23 2iem s ALA 121 Ca 0.58 0.10 0.18 0.00 0.00 0.00 0.00 51.96 52.82 2iem s ALA 121 Cb -0.14 -3.10 0.49 0.00 0.00 0.00 0.00 23.12 20.38 2iem s ALA 121 CO 0.54 -0.37 1.13 0.94 0.00 0.00 0.00 175.76 178.01 2iem n GLN 122 N 4.46 2.26 -1.84 0.00 7.27 -1.26 -4.85 117.38 123.43 2iem n GLN 122 Ca 0.02 -3.70 0.00 0.00 0.07 0.00 0.00 57.00 53.39 2iem n GLN 122 Cb 0.50 -1.79 0.00 0.00 2.41 0.00 0.00 30.24 31.36 2iem n GLN 122 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2iem n GLY 123 N -0.62 0.49 3.51 1.69 0.00 -1.26 -4.93 105.19 104.06 2iem n GLY 123 Ca 0.18 -0.83 -0.43 0.00 0.00 0.00 0.00 46.02 44.93 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 -1.04 0.97 -3.30 1.61 1.56 -1.26 -4.92 117.12 110.73 2iem n MET 124 Ca 0.00 0.16 -0.27 0.00 -0.27 0.00 0.00 57.70 57.33 2iem n MET 124 Cb 0.45 -2.71 -0.02 0.00 2.15 0.00 0.00 33.22 33.09 2iem n MET 124 CO 0.00 0.00 0.00 1.03 -0.73 0.00 0.00 175.97 176.27 2iem s ARG 125 N 7.43 3.57 0.38 2.12 1.81 -1.26 -5.03 118.95 127.97 2iem s ARG 125 Ca 1.10 -0.11 0.08 0.00 -1.72 0.00 0.00 55.73 55.07 2iem s ARG 125 Cb -0.64 -2.64 -0.03 0.00 -0.45 0.00 0.00 34.95 31.19 2iem s ARG 125 CO 0.40 0.16 0.28 -1.14 -0.68 0.00 0.00 175.30 174.31 2iem s GLN 126 N -3.92 2.49 0.00 3.54 0.74 -1.26 -4.82 119.66 116.43 2iem s GLN 126 Ca 0.43 -1.54 0.00 0.00 0.05 0.00 0.00 55.36 54.29 2iem s GLN 126 Cb -0.10 -2.29 0.00 0.00 1.10 0.00 0.00 33.01 31.72 2iem s GLN 126 CO 0.33 -0.06 0.00 0.41 -0.55 0.00 0.00 175.29 175.43 2iem n GLY 127 N -1.38 1.24 3.59 2.59 0.00 -1.26 -4.94 105.19 105.04 2iem n GLY 127 Ca 0.00 -0.77 -0.30 0.00 0.00 0.00 0.00 46.02 44.96 2iem n GLY 127 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2iem s ASN 128 N -4.00 2.02 -0.35 1.61 -0.87 -1.26 -4.79 114.94 107.30 2iem s ASN 128 Ca 0.00 1.91 -0.28 0.00 -1.57 0.00 0.00 52.86 52.92 2iem s ASN 128 Cb 0.00 -2.46 -0.06 0.00 -0.02 0.00 0.00 41.25 38.70 2iem s ASN 128 CO 0.00 -3.62 2.31 0.47 -2.57 0.00 0.00 177.10 173.69 2iem n ASP 129 N -4.56 2.78 -2.81 -1.22 8.00 -1.26 -4.77 116.55 112.72 2iem n ASP 129 Ca 0.08 -0.09 -0.10 0.00 0.71 0.00 0.00 54.79 55.38 2iem n ASP 129 Cb 0.53 -1.55 0.05 0.00 -0.02 0.00 0.00 41.12 40.13 2iem n ASP 129 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2iem n HIS 130 N 13.43 -2.67 -2.26 1.24 8.25 -1.26 -4.72 115.22 127.23 2iem n HIS 130 Ca 0.34 -2.20 -0.14 0.00 -0.26 0.00 0.00 57.72 55.46 2iem n HIS 130 Cb 0.48 1.30 -0.01 0.00 1.12 0.00 0.00 29.99 32.88 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 1.01 -0.20 0.20 -1.41 0.00 -1.26 -4.87 105.19 98.66 2iem n GLY 131 Ca 0.10 -0.30 0.08 0.00 0.00 0.00 0.00 46.02 45.89 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 0.00 0.66 -0.02 2.61 1.35 -1.91 -3.19 112.91 112.41 2iem h THR 132 Ca -0.33 -1.41 -0.01 0.00 -0.55 0.00 0.00 66.41 64.12 2iem h THR 132 Cb 1.24 1.93 -0.00 0.00 -1.73 0.00 0.00 68.15 69.60 2iem h THR 132 CO 0.39 0.30 -0.01 1.56 -0.25 0.00 0.00 175.52 177.50 2iem h GLN 133 N 0.00 0.04 -5.26 4.72 1.08 -1.90 -3.43 115.11 110.36 2iem h GLN 133 Ca -0.00 -0.02 -0.65 0.00 -1.45 0.00 0.00 58.65 56.53 2iem h GLN 133 Cb 0.91 -0.00 -0.26 0.00 -0.05 0.00 0.00 27.48 28.08 2iem h GLN 133 CO 0.04 0.46 -0.74 1.52 -0.95 0.00 0.00 178.83 179.16 2iem s TYR 134 N -4.48 2.88 0.32 2.96 -0.85 -1.20 -1.44 117.35 115.54 2iem s TYR 134 Ca -0.15 -0.63 0.03 0.00 -0.52 0.00 0.00 57.07 55.80 2iem s TYR 134 Cb 0.02 -1.91 -0.04 0.00 0.38 0.00 0.00 41.96 40.41 2iem s TYR 134 CO 0.68 -0.23 0.11 0.50 -1.52 0.00 0.00 175.55 175.09 2iem s ARG 135 N 0.53 1.65 -0.24 -3.49 3.52 -1.26 -4.81 118.95 114.84 2iem s ARG 135 Ca -0.07 -1.94 -0.08 0.00 -0.13 0.00 0.00 55.73 53.51 2iem s ARG 135 Cb -0.15 -0.46 -0.04 0.00 -1.56 0.00 0.00 34.95 32.74 2iem s ARG 135 CO 0.04 -0.36 0.10 -1.12 -0.81 0.00 0.00 175.30 173.15 2iem s SER 136 N -3.45 5.49 -0.03 -2.12 0.01 -1.26 -3.51 113.70 108.83 2iem s SER 136 Ca 0.33 -0.09 -0.25 0.00 1.31 0.00 0.00 55.95 57.26 2iem s SER 136 Cb 0.06 -1.99 0.05 0.00 0.21 0.00 0.00 66.02 64.35 2iem s SER 136 CO 0.15 0.01 0.54 0.00 0.41 0.00 0.00 173.24 174.35 2iem s ALA 137 N 1.39 -1.41 -0.13 1.44 0.00 -1.02 -2.84 121.76 119.18 2iem s ALA 137 Ca 0.06 0.95 -0.01 0.00 0.00 0.00 0.00 51.96 52.96 2iem s ALA 137 Cb -0.15 0.04 -0.02 0.00 0.00 0.00 0.00 23.12 22.99 2iem s ALA 137 CO 0.05 -0.33 -0.11 0.42 0.00 0.00 0.00 175.76 175.79 2iem s ILE 138 N -1.27 3.24 -0.55 0.00 1.01 -0.21 -1.70 121.20 121.72 2iem s ILE 138 Ca -0.12 -0.60 0.05 0.00 0.00 0.00 0.00 60.65 59.98 2iem s ILE 138 Cb -0.02 -2.37 0.18 0.00 0.01 0.00 0.00 42.46 40.27 2iem s ILE 138 CO 0.08 0.52 0.46 -1.22 0.00 0.00 0.00 174.94 174.78 2iem n TYR 139 N 3.43 1.21 -1.55 3.97 4.01 -0.18 -2.64 117.16 125.41 2iem n TYR 139 Ca -0.18 -3.81 -0.29 0.00 -0.16 0.00 0.00 57.90 53.46 2iem n TYR 139 Cb 0.53 -0.22 0.11 0.00 -0.31 0.00 0.00 39.34 39.44 2iem n TYR 139 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2iem s PRO 140 N -0.90 1.74 -0.10 -0.72 0.04 -1.26 -2.61 135.00 131.19 2iem s PRO 140 Ca 0.31 0.51 0.01 0.00 0.04 0.00 0.00 61.00 61.86 2iem s PRO 140 Cb 0.03 -1.89 -0.06 0.00 0.04 0.00 0.00 34.50 32.62 2iem s PRO 140 CO -0.16 -1.83 -0.09 -0.11 0.04 0.00 0.00 177.00 174.85 2iem n LEU 141 N -3.55 2.96 -4.90 -3.56 7.94 -1.26 -3.47 117.00 111.15 2iem n LEU 141 Ca 0.07 -0.05 -0.28 0.00 -1.11 0.00 0.00 56.01 54.63 2iem n LEU 141 Cb 0.57 -0.35 0.02 0.00 0.53 0.00 0.00 43.42 44.20 2iem n LEU 141 CO 0.57 0.66 0.58 0.42 -1.11 0.00 0.00 177.39 178.51 2iem s THR 142 N -2.20 4.23 0.17 1.96 -4.23 -1.26 -5.00 115.64 109.32 2iem s THR 142 Ca -0.13 0.32 0.01 0.00 -1.18 0.00 0.00 61.69 60.71 2iem s THR 142 Cb 0.03 -3.67 -0.13 0.00 1.34 0.00 0.00 72.50 70.07 2iem s THR 142 CO 0.23 -0.75 1.40 1.55 -0.54 0.00 0.00 174.62 176.50 2iem h PRO 143 N -0.16 0.28 -0.02 3.99 0.13 -2.00 -2.94 132.00 131.29 2iem h PRO 143 Ca -0.45 -0.27 -0.00 0.00 -0.87 0.00 0.00 66.00 64.40 2iem h PRO 143 Cb 1.23 0.07 -0.00 0.00 0.13 0.00 0.00 31.00 32.43 2iem h PRO 143 CO 0.62 0.96 0.00 0.93 -0.23 0.00 0.00 178.00 180.28 2iem h GLU 144 N 0.17 0.02 -0.52 0.86 5.08 -1.99 -1.43 114.58 116.78 2iem h GLU 144 Ca -0.04 -0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.38 2iem h GLU 144 Cb 1.43 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.62 2iem h GLU 144 CO 0.13 0.26 0.18 1.96 -1.00 0.00 0.00 179.01 180.55 2iem h GLN 145 N -0.22 0.35 -0.28 2.33 4.20 -1.97 0.37 115.11 119.89 2iem h GLN 145 Ca 0.00 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.73 2iem h GLN 145 Cb 0.25 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.92 2iem h GLN 145 CO 0.00 0.23 0.08 0.22 -0.67 0.00 0.00 178.83 178.69 2iem h ASP 146 N 0.36 0.06 -0.76 1.46 1.82 -1.39 1.59 116.42 119.56 2iem h ASP 146 Ca 0.25 0.04 0.02 0.00 -0.39 0.00 0.00 57.03 56.95 2iem h ASP 146 Cb 0.29 0.04 -0.04 0.00 0.68 0.00 0.00 39.33 40.29 2iem h ASP 146 CO -0.26 0.07 0.49 0.00 -1.61 0.00 0.00 179.24 177.93 2iem h ALA 147 N 1.19 0.97 -0.16 -0.78 0.00 -0.19 0.47 119.26 120.76 2iem h ALA 147 Ca 0.12 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2iem h ALA 147 Cb 0.11 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2iem h ALA 147 CO -0.14 0.34 -0.03 0.00 0.00 0.00 0.00 179.25 179.41 2iem h ALA 148 N 1.29 0.22 0.24 0.00 0.00 0.70 0.57 119.26 122.29 2iem h ALA 148 Ca 0.29 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.97 2iem h ALA 148 Cb -0.06 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2iem h ALA 148 CO -0.08 -0.03 -0.29 0.00 0.00 0.00 0.00 179.25 178.85 2iem h ALA 149 N 0.72 -0.57 -0.84 0.00 0.00 0.28 0.22 119.26 119.06 2iem h ALA 149 Ca 0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2iem h ALA 149 Cb 0.46 0.43 -0.04 0.00 0.00 0.00 0.00 17.79 18.63 2iem h ALA 149 CO 0.01 -0.86 0.45 -0.09 0.00 0.00 0.00 179.25 178.77 2iem h ARG 150 N -0.58 1.19 -0.82 0.00 9.65 -0.06 0.97 114.38 124.73 2iem h ARG 150 Ca -0.00 -0.15 0.06 0.00 -1.10 0.00 0.00 59.98 58.80 2iem h ARG 150 Cb 0.55 -0.23 -0.05 0.00 -1.39 0.00 0.00 29.97 28.85 2iem h ARG 150 CO -0.09 0.88 0.53 0.00 2.80 0.00 0.00 179.97 184.10 2iem h ALA 151 N 1.24 1.61 -0.07 2.80 0.00 0.77 0.85 119.26 126.45 2iem h ALA 151 Ca 0.30 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.98 2iem h ALA 151 Cb 0.05 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 17.62 2iem h ALA 151 CO -0.05 0.27 -0.74 0.66 0.00 0.00 0.00 179.25 179.39 2iem h SER 152 N 0.89 0.78 0.07 0.00 4.64 0.37 -2.13 113.55 118.17 2iem h SER 152 Ca 0.35 -0.68 -0.00 0.00 -0.47 0.00 0.00 61.79 60.98 2iem h SER 152 Cb 0.23 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2iem h SER 152 CO -0.13 1.35 -0.03 0.25 -0.87 0.00 0.00 176.83 177.40 2iem h LEU 153 N 0.28 -0.08 -1.27 5.97 6.46 0.21 1.23 115.31 128.10 2iem h LEU 153 Ca -0.07 -0.14 0.08 0.00 -0.12 0.00 0.00 57.88 57.63 2iem h LEU 153 Cb 1.40 0.02 -0.06 0.00 -0.73 0.00 0.00 40.66 41.29 2iem h LEU 153 CO 0.15 0.09 0.54 -0.08 -0.62 0.00 0.00 178.44 178.52 2iem h GLU 154 N -0.25 0.81 0.11 1.25 4.57 0.61 0.01 114.58 121.70 2iem h GLU 154 Ca -0.01 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 2iem h GLU 154 Cb 0.22 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 28.63 2iem h GLU 154 CO 0.02 0.54 -0.05 0.00 -1.18 0.00 0.00 179.01 178.33 2iem h ARG 155 N 0.84 -0.15 -0.81 1.92 2.47 -0.97 -2.85 114.38 114.82 2iem h ARG 155 Ca 0.37 0.01 0.20 0.00 -1.26 0.00 0.00 59.98 59.30 2iem h ARG 155 Cb 0.35 0.03 -0.14 0.00 -1.65 0.00 0.00 29.97 28.56 2iem h ARG 155 CO -0.14 0.28 0.08 0.35 0.56 0.00 0.00 179.97 181.09 2iem h PHE 156 N -0.94 0.07 -0.69 3.04 3.04 0.18 1.56 116.94 123.22 2iem h PHE 156 Ca -0.02 0.06 -0.01 0.00 3.98 0.00 0.00 57.97 61.98 2iem h PHE 156 Cb 0.50 0.10 -0.03 0.00 2.56 0.00 0.00 35.95 39.07 2iem h PHE 156 CO 0.10 -0.24 0.38 0.37 -2.02 0.00 0.00 178.31 176.90 2iem h GLN 157 N 0.13 0.95 -0.04 1.11 4.15 -1.09 -0.27 115.11 120.05 2iem h GLN 157 Ca 0.47 -0.11 -0.13 0.00 0.77 0.00 0.00 58.65 59.65 2iem h GLN 157 Cb 0.88 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.36 2iem h GLN 157 CO -0.68 0.71 -0.56 0.00 -1.93 0.00 0.00 178.83 176.37 2iem h ALA 158 N 1.19 0.98 -0.10 3.38 0.00 0.07 -1.08 119.26 123.71 2iem h ALA 158 Ca 0.24 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 2iem h ALA 158 Cb 0.03 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2iem h ALA 158 CO -0.04 0.70 0.04 0.00 0.00 0.00 0.00 179.25 179.95 2iem h ALA 159 N 1.33 0.13 -0.14 0.00 0.00 0.28 0.75 119.26 121.60 2iem h ALA 159 Ca -0.00 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 2iem h ALA 159 Cb 1.02 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2iem h ALA 159 CO 0.08 -0.29 -0.35 0.00 0.00 0.00 0.00 179.25 178.69 2iem h MET 160 N 0.01 0.30 -0.56 0.00 -0.00 -0.98 -2.76 114.93 110.93 2iem h MET 160 Ca 0.03 -0.12 -0.08 0.00 -0.00 0.00 0.00 59.70 59.52 2iem h MET 160 Cb 0.15 -0.01 -0.02 0.00 -0.00 0.00 0.00 31.60 31.72 2iem h MET 160 CO -0.00 0.61 0.02 1.25 -0.00 0.00 0.00 176.91 178.79 2iem h LEU 161 N 0.26 0.95 -2.28 -0.10 7.12 -0.86 -1.35 115.31 119.05 2iem h LEU 161 Ca 0.03 -0.30 -0.01 0.00 0.13 0.00 0.00 57.88 57.73 2iem h LEU 161 Cb 0.74 -0.26 -0.00 0.00 -0.53 0.00 0.00 40.66 40.61 2iem h LEU 161 CO 0.06 1.02 -0.05 0.00 -0.13 0.00 0.00 178.44 179.34 2iem h ALA 162 N 0.97 1.23 -0.00 1.25 0.00 -0.58 0.35 119.26 122.48 2iem h ALA 162 Ca 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2iem h ALA 162 Cb 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2iem h ALA 162 CO 0.02 0.06 -0.11 0.00 0.00 0.00 0.00 179.25 179.22 2iem n ALA 163 N -2.21 2.73 -2.35 0.00 0.00 -0.64 -4.89 120.51 113.15 2iem n ALA 163 Ca -0.02 -0.23 -0.05 0.00 0.00 0.00 0.00 53.44 53.14 2iem n ALA 163 Cb 0.16 -1.36 0.01 0.00 0.00 0.00 0.00 19.45 18.26 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 -1.14 -2.43 -4.57 0.00 -0.08 0.12 -5.02 116.55 103.43 2iem n ASP 164 Ca 0.12 -0.05 -0.37 0.00 -1.51 0.00 0.00 54.79 52.98 2iem n ASP 164 Cb 0.29 -1.47 -0.11 0.00 2.34 0.00 0.00 41.12 42.16 2iem n ASP 164 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 2iem s ASP 165 N -2.91 5.79 -0.06 1.67 1.11 -0.60 -4.94 116.67 116.73 2iem s ASP 165 Ca 0.05 -0.03 0.08 0.00 0.18 0.00 0.00 52.55 52.83 2iem s ASP 165 Cb -0.02 -2.06 0.34 0.00 1.07 0.00 0.00 42.92 42.25 2iem s ASP 165 CO 0.06 -0.01 1.15 -0.90 1.18 0.00 0.00 175.17 176.65 2iem n ASP 166 N 4.78 2.59 -4.44 0.27 5.68 -1.26 -4.31 116.55 119.86 2iem n ASP 166 Ca -0.15 -2.24 -0.44 0.00 -0.50 0.00 0.00 54.79 51.45 2iem n ASP 166 Cb 0.52 -0.43 -0.01 0.00 -1.14 0.00 0.00 41.12 40.05 2iem n ASP 166 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 2iem s ARG 167 N -1.70 3.88 0.31 0.11 0.52 -1.26 -5.01 118.95 115.81 2iem s ARG 167 Ca 0.24 -2.31 -0.29 0.00 -0.52 0.00 0.00 55.73 52.85 2iem s ARG 167 Cb 0.16 -4.93 -0.11 0.00 0.52 0.00 0.00 34.95 30.59 2iem s ARG 167 CO 0.11 -1.70 1.53 -1.58 0.02 0.00 0.00 175.30 173.68 2iem s HIS 168 N 1.69 2.77 0.33 -0.53 5.65 -1.26 -4.69 115.29 119.25 2iem s HIS 168 Ca 0.36 0.95 -0.28 0.00 0.25 0.00 0.00 55.06 56.34 2iem s HIS 168 Cb -0.05 -4.00 -0.10 0.00 -1.18 0.00 0.00 32.58 27.26 2iem s HIS 168 CO -0.05 -3.21 1.24 0.96 -0.65 0.00 0.00 174.74 173.03 2iem s ILE 169 N -0.34 2.96 -0.49 0.89 -4.36 -1.26 -4.80 121.20 113.79 2iem s ILE 169 Ca 0.59 0.93 0.00 0.00 -0.26 0.00 0.00 60.65 61.92 2iem s ILE 169 Cb -0.46 -3.58 0.45 0.00 1.25 0.00 0.00 42.46 40.12 2iem s ILE 169 CO 0.51 0.20 1.94 1.07 0.24 0.00 0.00 174.94 178.90 2iem n THR 170 N 0.74 3.19 -3.33 8.37 5.66 -1.26 -4.93 114.28 122.71 2iem n THR 170 Ca 0.01 -2.20 -0.38 0.00 -3.05 0.00 0.00 64.05 58.43 2iem n THR 170 Cb 0.43 -0.96 -0.06 0.00 -1.55 0.00 0.00 70.33 68.19 2iem n THR 170 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 2iem s THR 171 N -3.58 5.19 -0.03 1.09 -1.32 -1.26 -4.54 115.64 111.19 2iem s THR 171 Ca 0.52 0.87 0.07 0.00 -1.21 0.00 0.00 61.69 61.95 2iem s THR 171 Cb 0.42 -3.79 -0.02 0.00 -1.51 0.00 0.00 72.50 67.60 2iem s THR 171 CO 0.03 0.29 -0.24 -1.83 -2.21 0.00 0.00 174.62 170.66 2iem s GLU 172 N 0.92 2.22 -0.10 7.08 -1.05 -1.13 -5.00 118.70 121.64 2iem s GLU 172 Ca 0.23 -0.89 0.02 0.00 -0.15 0.00 0.00 54.97 54.19 2iem s GLU 172 Cb -0.15 -2.11 0.01 0.00 -0.44 0.00 0.00 34.13 31.45 2iem s GLU 172 CO 0.09 0.55 -0.17 0.42 0.95 0.00 0.00 175.26 177.10 2iem s ILE 173 N -0.57 1.55 0.26 1.83 1.01 -1.26 -1.04 121.20 122.97 2iem s ILE 173 Ca 0.09 -0.70 -0.10 0.00 0.00 0.00 0.00 60.65 59.94 2iem s ILE 173 Cb -0.11 -1.39 -0.01 0.00 0.01 0.00 0.00 42.46 40.97 2iem s ILE 173 CO -0.00 0.45 0.44 0.00 0.00 0.00 0.00 174.94 175.82 2iem s ALA 174 N 0.75 0.07 1.01 9.38 0.00 -1.08 -4.99 121.76 126.89 2iem s ALA 174 Ca -0.12 -1.07 -0.20 0.00 0.00 0.00 0.00 51.96 50.58 2iem s ALA 174 Cb -0.16 1.12 -0.11 0.00 0.00 0.00 0.00 23.12 23.97 2iem s ALA 174 CO 0.02 -0.81 -0.79 -1.71 0.00 0.00 0.00 175.76 172.47 2iem n ASN 175 N -0.51 -4.06 -4.52 0.00 2.85 -1.26 -4.33 115.26 103.43 2iem n ASN 175 Ca -0.01 0.10 -0.43 0.00 -0.11 0.00 0.00 54.58 54.14 2iem n ASN 175 Cb 0.62 -0.76 -0.02 0.00 1.24 0.00 0.00 39.78 40.86 2iem n ASN 175 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2iem s ALA 176 N -2.08 3.16 1.07 5.20 0.00 -1.23 -4.79 121.76 123.09 2iem s ALA 176 Ca 0.43 -2.64 -0.12 0.00 0.00 0.00 0.00 51.96 49.63 2iem s ALA 176 Cb -0.08 -4.34 0.22 0.00 0.00 0.00 0.00 23.12 18.92 2iem s ALA 176 CO 0.73 -3.27 0.98 0.25 0.00 0.00 0.00 175.76 174.45 2iem n THR 177 N 6.11 0.00 -2.40 0.00 -2.24 -1.26 -4.90 114.28 109.59 2iem n THR 177 Ca 0.33 -0.27 -0.43 0.00 -2.27 0.00 0.00 64.05 61.41 2iem n THR 177 Cb 0.49 -0.96 -0.02 0.00 -2.10 0.00 0.00 70.33 67.74 2iem n THR 177 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2iem s PRO 178 N -4.39 4.13 0.38 -0.78 0.04 -1.26 -5.00 135.00 128.11 2iem s PRO 178 Ca 0.67 1.56 -0.25 0.00 0.04 0.00 0.00 61.00 63.03 2iem s PRO 178 Cb -0.24 -3.81 -0.09 0.00 0.04 0.00 0.00 34.50 30.40 2iem s PRO 178 CO 0.63 -0.85 1.02 0.12 0.04 0.00 0.00 177.00 177.96 2iem s PHE 179 N 3.82 3.38 -0.52 0.56 5.36 -1.26 -4.83 117.98 124.49 2iem s PHE 179 Ca 0.56 1.67 0.03 0.00 -0.96 0.00 0.00 56.93 58.24 2iem s PHE 179 Cb -0.21 -3.07 0.13 0.00 -0.34 0.00 0.00 43.02 39.53 2iem s PHE 179 CO 0.18 -0.41 0.27 0.71 -1.46 0.00 0.00 175.22 174.51 2iem s TYR 180 N -1.66 3.29 0.12 10.12 2.02 -1.05 -4.94 117.35 125.25 2iem s TYR 180 Ca 0.56 -3.08 -0.18 0.00 -0.37 0.00 0.00 57.07 54.00 2iem s TYR 180 Cb -0.21 -2.90 -0.11 0.00 -0.40 0.00 0.00 41.96 38.34 2iem s TYR 180 CO 0.26 -0.78 0.35 0.66 -1.57 0.00 0.00 175.55 174.47 2iem n TYR 181 N 3.31 -0.29 -3.03 2.71 4.01 -1.26 -2.39 117.16 120.22 2iem n TYR 181 Ca 0.05 0.63 -0.19 0.00 -0.16 0.00 0.00 57.90 58.23 2iem n TYR 181 Cb 0.34 -1.26 0.04 0.00 -0.31 0.00 0.00 39.34 38.15 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 -0.62 4.65 0.23 -0.72 0.00 0.43 -4.80 121.76 120.93 2iem s ALA 182 Ca 0.42 -1.98 -0.30 0.00 0.00 0.00 0.00 51.96 50.10 2iem s ALA 182 Cb -0.60 -1.52 -0.15 0.00 0.00 0.00 0.00 23.12 20.84 2iem s ALA 182 CO 0.36 -0.66 0.97 0.39 0.00 0.00 0.00 175.76 176.82 2iem n GLU 183 N -2.10 1.00 0.30 0.00 1.02 -1.26 -4.72 120.64 114.87 2iem n GLU 183 Ca 0.13 0.35 0.18 0.00 -0.02 0.00 0.00 57.16 57.80 2iem n GLU 183 Cb 0.61 -1.70 1.00 0.00 -0.02 0.00 0.00 31.44 31.33 2iem n GLU 183 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 2iem h ASP 184 N 2.28 0.00 -0.71 1.62 3.58 -1.93 0.27 116.42 121.53 2iem h ASP 184 Ca -0.39 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.04 2iem h ASP 184 Cb 1.36 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.38 2iem h ASP 184 CO 0.63 0.00 0.35 0.44 -2.88 0.00 0.00 179.24 177.78 2iem h ASP 185 N 0.00 0.92 1.11 2.28 5.19 -1.93 -2.16 116.42 121.83 2iem h ASP 185 Ca 0.01 -0.13 -0.16 0.00 -0.62 0.00 0.00 57.03 56.13 2iem h ASP 185 Cb 0.11 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 39.36 2iem h ASP 185 CO -0.00 0.79 -0.76 0.45 -3.12 0.00 0.00 179.24 176.60 2iem h HIS 186 N 0.99 0.00 -1.64 4.55 3.86 -1.32 -3.39 115.15 118.20 2iem h HIS 186 Ca 0.24 0.00 -0.63 0.00 -1.16 0.00 0.00 60.37 58.83 2iem h HIS 186 Cb 0.11 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.58 2iem h HIS 186 CO 0.01 0.76 1.39 0.94 0.86 0.00 0.00 177.93 181.89 2iem n GLN 187 N -3.37 1.66 -3.84 2.45 -0.06 -0.59 -1.89 117.38 111.74 2iem n GLN 187 Ca 0.00 0.49 -0.31 0.00 -2.00 0.00 0.00 57.00 55.19 2iem n GLN 187 Cb 0.81 -2.82 0.01 0.00 -4.06 0.00 0.00 30.24 24.18 2iem n GLN 187 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 2iem n GLN 188 N 8.16 -1.94 -0.02 3.69 3.00 -1.26 -4.90 117.38 124.11 2iem n GLN 188 Ca 0.33 0.39 -0.20 0.00 -0.01 0.00 0.00 57.00 57.50 2iem n GLN 188 Cb 0.33 -4.09 -0.13 0.00 0.00 0.00 0.00 30.24 26.35 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 -1.96 0.29 -0.71 1.08 3.20 -1.57 -3.26 116.97 114.04 2iem h TYR 189 Ca -0.66 -0.21 -0.04 0.00 3.14 0.00 0.00 58.73 60.96 2iem h TYR 189 Cb 1.37 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 39.60 2iem h TYR 189 CO 0.40 1.45 0.30 1.25 -1.64 0.00 0.00 178.16 179.92 2iem h LEU 190 N -0.55 0.97 -2.07 2.82 5.85 -1.83 -1.14 115.31 119.36 2iem h LEU 190 Ca -0.26 -0.16 0.06 0.00 0.84 0.00 0.00 57.88 58.35 2iem h LEU 190 Cb 1.55 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.32 2iem h LEU 190 CO -0.00 0.87 0.16 0.45 -0.34 0.00 0.00 178.44 179.58 2iem h HIS 191 N 1.01 0.00 -0.13 1.25 3.86 -1.86 -0.40 115.15 118.89 2iem h HIS 191 Ca 0.24 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.33 2iem h HIS 191 Cb 0.19 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.66 2iem h HIS 191 CO 0.01 0.00 -0.38 -0.22 0.86 0.00 0.00 177.93 178.20 2iem h LYS 192 N 0.00 0.48 -3.19 2.45 3.64 -1.26 -3.43 116.57 115.26 2iem h LYS 192 Ca 0.10 -0.35 -0.41 0.00 -1.27 0.00 0.00 60.65 58.72 2iem h LYS 192 Cb 0.41 0.06 -0.40 0.00 -0.41 0.00 0.00 32.23 31.89 2iem h LYS 192 CO -0.00 0.97 -0.74 0.54 -2.27 0.00 0.00 179.45 177.95 2iem s ASN 193 N -6.52 1.66 0.00 4.20 6.03 -0.18 -4.99 114.94 115.15 2iem s ASN 193 Ca -0.13 -0.22 0.22 0.00 -1.03 0.00 0.00 52.86 51.70 2iem s ASN 193 Cb 0.05 -0.17 1.34 0.00 -3.03 0.00 0.00 41.25 39.44 2iem s ASN 193 CO 0.81 -0.29 1.73 -0.81 -2.03 0.00 0.00 177.10 176.50 2iem n PRO 194 N 5.29 0.75 -0.65 3.55 -0.04 -1.10 -3.19 135.00 139.61 2iem n PRO 194 Ca -0.05 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.30 2iem n PRO 194 Cb 0.50 -1.47 0.11 0.00 -0.04 0.00 0.00 33.50 32.60 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 -0.97 1.60 -3.03 0.54 4.01 -1.26 -4.90 117.16 113.16 2iem n TYR 195 Ca 0.17 -1.13 -0.19 0.00 -0.16 0.00 0.00 57.90 56.59 2iem n TYR 195 Cb 0.08 -0.59 0.07 0.00 -0.31 0.00 0.00 39.34 38.58 2iem n TYR 195 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2iem n GLY 196 N -0.30 1.93 3.30 2.72 0.00 -1.19 -5.07 105.19 106.57 2iem n GLY 196 Ca 0.30 -2.22 -0.34 0.00 0.00 0.00 0.00 46.02 43.76 2iem n GLY 196 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2iem n TYR 197 N -2.26 -2.44 -1.44 1.61 4.02 -1.26 -4.74 117.16 110.65 2iem n TYR 197 Ca 0.16 0.16 -0.51 0.00 -0.01 0.00 0.00 57.90 57.70 2iem n TYR 197 Cb 0.59 -1.68 -0.05 0.00 -0.02 0.00 0.00 39.34 38.18 2iem n TYR 197 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2iem n GLY 199 N 1.84 1.55 0.47 0.00 0.00 -1.26 -4.53 105.19 103.25 2iem n GLY 199 Ca 0.18 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.65 2iem n GLY 199 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2iem n ILE 200 N -0.61 0.00 0.00 -0.61 0.13 -1.26 -4.21 119.36 112.80 2iem n ILE 200 Ca -0.01 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.64 2iem n ILE 200 Cb 0.84 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 39.64 2iem n ILE 200 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2iem n GLY 201 N -1.12 -0.68 3.49 4.50 0.00 -1.26 -4.90 105.19 105.23 2iem n GLY 201 Ca 0.00 0.15 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 2iem n GLY 201 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2iem n GLY 202 N 0.00 -0.58 0.29 -0.02 0.00 -1.26 -4.80 105.19 98.82 2iem n GLY 202 Ca 0.00 0.95 0.16 0.00 0.00 0.00 0.00 46.02 47.13 2iem n GLY 202 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2iem h ILE 203 N 1.19 0.35 0.00 -0.61 2.10 -2.03 -3.45 117.51 115.06 2iem h ILE 203 Ca -0.49 -0.36 0.00 0.00 1.08 0.00 0.00 64.86 65.10 2iem h ILE 203 Cb 1.33 1.26 0.00 0.00 -1.09 0.00 0.00 36.82 38.32 2iem h ILE 203 CO 0.28 0.06 0.00 0.61 -1.08 0.00 0.00 178.15 178.02 2iem n GLY 204 N -0.73 0.78 2.82 8.18 0.00 -1.26 -4.09 105.19 110.90 2iem n GLY 204 Ca -0.02 0.78 -0.16 0.00 0.00 0.00 0.00 46.02 46.62 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 0.11 -0.02 1.61 -7.23 -1.26 -5.14 120.40 108.46 2iem s VAL 205 Ca 0.00 0.09 -0.13 0.00 -1.81 0.00 0.00 61.98 60.13 2iem s VAL 205 Cb 0.00 -0.20 -0.05 0.00 0.56 0.00 0.00 36.38 36.69 2iem s VAL 205 CO 0.00 0.11 0.36 -0.55 -0.31 0.00 0.00 175.10 174.72 2iem s SER 206 N 0.87 6.73 0.46 4.85 0.15 -1.26 -5.06 113.70 120.44 2iem s SER 206 Ca -0.08 0.87 -0.23 0.00 0.70 0.00 0.00 55.95 57.21 2iem s SER 206 Cb -0.12 -2.22 -0.07 0.00 -1.71 0.00 0.00 66.02 61.90 2iem s SER 206 CO -0.02 0.34 1.16 -0.76 1.20 0.00 0.00 173.24 175.16 2iem s LEU 207 N -1.04 4.01 0.52 3.45 2.01 -1.26 -5.00 118.68 121.37 2iem s LEU 207 Ca 0.22 2.29 -0.19 0.00 0.01 0.00 0.00 54.13 56.46 2iem s LEU 207 Cb -0.16 -4.24 -0.07 0.00 0.01 0.00 0.00 46.19 41.73 2iem s LEU 207 CO 0.12 -0.90 1.04 -2.16 1.01 0.00 0.00 176.35 175.46 2iem s PRO 208 N -2.70 3.67 0.46 1.29 0.04 -1.26 -5.02 135.00 131.48 2iem s PRO 208 Ca 0.63 1.30 -0.21 0.00 0.04 0.00 0.00 61.00 62.76 2iem s PRO 208 Cb -0.28 -2.08 -0.09 0.00 0.04 0.00 0.00 34.50 32.09 2iem s PRO 208 CO 0.34 -0.53 1.04 -1.25 0.04 0.00 0.00 177.00 176.64 2iem s PRO 209 N -3.51 3.91 0.09 0.56 0.04 -1.26 -4.98 135.00 129.86 2iem s PRO 209 Ca 0.66 1.41 -0.34 0.00 0.04 0.00 0.00 61.00 62.77 2iem s PRO 209 Cb -0.16 -2.23 -0.15 0.00 0.04 0.00 0.00 34.50 32.00 2iem s PRO 209 CO 0.25 -0.34 1.58 1.49 0.04 0.00 0.00 177.00 180.02 2iem h GLU 210 N 1.85 -0.83 0.00 4.56 4.81 -1.95 -3.52 114.58 119.50 2iem h GLU 210 Ca -0.49 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 2iem h GLU 210 Cb 1.22 0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.79 2iem h GLU 210 CO 0.60 -0.55 0.00 0.00 -0.73 0.00 0.00 179.01 178.33