#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qil s THR 2 N 0.00 2.30 0.56 2.46 -4.23 -1.26 -4.60 115.64 110.87 2qil s THR 2 Ca 0.00 -1.65 -0.03 0.00 -1.18 0.00 0.00 61.69 58.83 2qil s THR 2 Cb 0.00 -2.95 0.02 0.00 1.34 0.00 0.00 72.50 70.91 2qil s THR 2 CO 0.00 0.00 0.83 0.54 -0.54 0.00 0.00 174.62 175.45 2qil s ASN 3 N -3.94 5.45 0.53 3.99 2.20 -1.26 -4.95 114.94 116.95 2qil s ASN 3 Ca 0.41 0.38 0.18 0.00 -0.94 0.00 0.00 52.86 52.89 2qil s ASN 3 Cb 0.03 -1.36 1.33 0.00 -2.00 0.00 0.00 41.25 39.25 2qil s ASN 3 CO 0.23 -1.08 2.16 0.44 -2.94 0.00 0.00 177.10 175.90 2qil h ASP 4 N -0.04 0.00 -0.30 3.54 5.19 -2.00 -2.23 116.42 120.57 2qil h ASP 4 Ca -0.45 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 55.87 2qil h ASP 4 Cb 1.28 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.78 2qil h ASP 4 CO 0.58 0.00 -0.20 -1.13 -3.12 0.00 0.00 179.24 175.37 2qil h ASN 5 N 0.00 0.70 -0.04 6.45 -1.24 -1.99 -2.22 115.58 117.24 2qil h ASN 5 Ca 0.01 -0.43 -0.04 0.00 0.71 0.00 0.00 56.30 56.55 2qil h ASN 5 Cb 0.03 -0.19 -0.01 0.00 0.73 0.00 0.00 38.32 38.88 2qil h ASN 5 CO -0.00 0.98 -0.06 0.40 -1.29 0.00 0.00 177.43 177.45 2qil h ILE 6 N 0.42 1.15 -0.52 2.57 1.08 -1.79 -2.33 117.51 118.09 2qil h ILE 6 Ca 0.06 -0.62 -0.11 0.00 -0.39 0.00 0.00 64.86 63.81 2qil h ILE 6 Cb 0.74 1.10 -0.02 0.00 -3.07 0.00 0.00 36.82 35.57 2qil h ILE 6 CO 0.05 0.20 -0.10 0.11 -0.69 0.00 0.00 178.15 177.72 2qil h LYS 7 N 0.24 0.98 -0.79 2.37 1.57 -1.16 -2.08 116.57 117.71 2qil h LYS 7 Ca 0.05 -0.37 -0.04 0.00 -1.87 0.00 0.00 60.65 58.43 2qil h LYS 7 Cb 0.28 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.49 2qil h LYS 7 CO 0.01 1.04 0.34 -0.44 -0.57 0.00 0.00 179.45 179.83 2qil h ASP 8 N 0.85 1.07 -0.49 0.86 3.32 -0.90 -2.57 116.42 118.56 2qil h ASP 8 Ca 0.13 -0.16 -0.09 0.00 0.02 0.00 0.00 57.03 56.93 2qil h ASP 8 Cb 0.66 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 2qil h ASP 8 CO 0.05 0.93 -0.03 -0.07 -1.72 0.00 0.00 179.24 178.40 2qil h LEU 9 N 1.13 0.91 -0.50 1.55 3.38 -1.22 -1.65 115.31 118.92 2qil h LEU 9 Ca 0.27 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2qil h LEU 9 Cb 0.18 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2qil h LEU 9 CO -0.03 0.99 0.22 0.25 0.09 0.00 0.00 178.44 179.96 2qil h LEU 10 N 0.86 0.66 -0.65 1.67 6.46 -1.21 -1.17 115.31 121.93 2qil h LEU 10 Ca 0.15 -0.14 -0.06 0.00 -0.12 0.00 0.00 57.88 57.71 2qil h LEU 10 Cb 0.54 -0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 40.27 2qil h LEU 10 CO 0.03 0.62 0.19 0.44 -0.62 0.00 0.00 178.44 179.10 2qil h ASP 11 N 0.66 0.95 0.17 1.25 5.19 -1.24 -2.11 116.42 121.28 2qil h ASP 11 Ca 0.17 -0.22 -0.01 0.00 -0.62 0.00 0.00 57.03 56.35 2qil h ASP 11 Cb 0.15 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 39.41 2qil h ASP 11 CO -0.02 0.92 -0.08 -0.25 -3.12 0.00 0.00 179.24 176.69 2qil h TRP 12 N 0.94 -0.21 0.00 4.55 2.91 -1.13 -3.26 115.95 119.75 2qil h TRP 12 Ca 0.21 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.22 2qil h TRP 12 Cb 0.32 0.07 0.00 0.00 -0.51 0.00 0.00 29.16 29.04 2qil h TRP 12 CO 0.02 0.13 -0.00 0.66 -1.03 0.00 0.00 178.44 178.23 2qil n TYR 13 N -5.03 0.85 0.03 2.65 4.01 -0.46 -3.59 117.16 115.62 2qil n TYR 13 Ca -0.09 0.25 -0.05 0.00 -0.16 0.00 0.00 57.90 57.85 2qil n TYR 13 Cb 0.23 -0.90 -0.10 0.00 -0.31 0.00 0.00 39.34 38.25 2qil n TYR 13 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2qil h SER 14 N 0.00 0.00 -3.78 7.72 4.64 -1.50 -3.38 113.55 117.25 2qil h SER 14 Ca 0.00 0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 60.88 2qil h SER 14 Cb 0.72 0.00 0.17 0.00 -0.31 0.00 0.00 62.40 62.98 2qil h SER 14 CO 0.00 0.85 0.20 -0.94 -0.87 0.00 0.00 176.83 176.07 2qil s SER 15 N -6.21 2.04 0.36 4.97 1.04 -1.23 -5.05 113.70 109.61 2qil s SER 15 Ca -0.02 0.83 0.00 0.00 0.48 0.00 0.00 55.95 57.24 2qil s SER 15 Cb 0.09 -1.25 0.00 0.00 0.10 0.00 0.00 66.02 64.95 2qil s SER 15 CO 0.81 -3.45 0.00 0.61 0.98 0.00 0.00 173.24 172.19 2qil n GLY 16 N -1.42 0.20 3.44 7.32 0.00 -1.26 -5.04 105.19 108.43 2qil n GLY 16 Ca 0.09 -1.83 -0.21 0.00 0.00 0.00 0.00 46.02 44.07 2qil n GLY 16 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qil s SER 17 N -1.00 2.38 -0.13 1.61 1.04 -1.26 -4.82 113.70 111.52 2qil s SER 17 Ca 0.00 -1.34 -0.02 0.00 0.48 0.00 0.00 55.95 55.07 2qil s SER 17 Cb 0.00 -0.09 -0.03 0.00 0.10 0.00 0.00 66.02 66.01 2qil s SER 17 CO 0.00 -0.56 -0.06 -1.81 0.98 0.00 0.00 173.24 171.79 2qil s ASP 18 N -3.47 4.64 -0.12 7.02 1.01 0.53 -4.97 116.67 121.31 2qil s ASP 18 Ca 0.35 -0.14 0.01 0.00 0.71 0.00 0.00 52.55 53.48 2qil s ASP 18 Cb 0.08 -1.62 0.02 0.00 1.01 0.00 0.00 42.92 42.41 2qil s ASP 18 CO 0.14 0.21 -0.12 -0.89 0.21 0.00 0.00 175.17 174.73 2qil s THR 19 N 0.09 1.33 -0.01 -1.27 2.01 -1.26 -1.31 115.64 115.23 2qil s THR 19 Ca -0.02 -0.51 0.01 0.00 0.31 0.00 0.00 61.69 61.48 2qil s THR 19 Cb -0.14 -1.26 0.00 0.00 0.01 0.00 0.00 72.50 71.11 2qil s THR 19 CO 0.03 0.41 -0.03 -0.36 -0.69 0.00 0.00 174.62 173.98 2qil s PHE 20 N 1.34 0.32 -0.01 4.92 0.08 -0.60 -5.00 117.98 119.03 2qil s PHE 20 Ca -0.00 -0.06 0.06 0.00 0.12 0.00 0.00 56.93 57.06 2qil s PHE 20 Cb -0.14 -0.23 -0.03 0.00 -0.57 0.00 0.00 43.02 42.05 2qil s PHE 20 CO -0.06 -0.02 -0.20 0.95 -0.10 0.00 0.00 175.22 175.79 2qil s THR 21 N 0.05 2.57 -1.05 0.64 -4.23 -1.26 -0.79 115.64 111.58 2qil s THR 21 Ca -0.00 -1.03 -0.06 0.00 -1.18 0.00 0.00 61.69 59.42 2qil s THR 21 Cb -0.03 -1.99 0.01 0.00 1.34 0.00 0.00 72.50 71.83 2qil s THR 21 CO -0.00 0.51 0.82 -3.20 -0.54 0.00 0.00 174.62 172.20 2qil n ASN 22 N 2.12 -5.26 -4.84 3.99 5.15 -1.04 -4.69 115.26 110.69 2qil n ASN 22 Ca -0.17 -0.37 -0.29 0.00 -0.60 0.00 0.00 54.58 53.15 2qil n ASN 22 Cb 0.52 -3.91 0.11 0.00 -0.53 0.00 0.00 39.78 35.97 2qil n ASN 22 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 2qil s SER 23 N -3.16 4.03 -0.04 1.20 0.01 -0.48 -4.69 113.70 110.57 2qil s SER 23 Ca 0.40 0.86 0.07 0.00 1.31 0.00 0.00 55.95 58.59 2qil s SER 23 Cb -0.18 -1.38 -0.01 0.00 0.21 0.00 0.00 66.02 64.66 2qil s SER 23 CO 0.50 -2.21 -0.25 -0.70 0.41 0.00 0.00 173.24 170.99 2qil s GLU 24 N -5.45 2.29 -0.13 12.44 2.12 0.00 -1.69 118.70 128.28 2qil s GLU 24 Ca 0.63 -0.90 -0.29 0.00 0.36 0.00 0.00 54.97 54.77 2qil s GLU 24 Cb -0.13 -2.06 -0.02 0.00 0.26 0.00 0.00 34.13 32.19 2qil s GLU 24 CO 0.51 0.45 1.23 0.08 -0.54 0.00 0.00 175.26 176.99 2qil s VAL 25 N -0.36 4.30 -0.19 3.70 1.01 0.21 -0.59 120.40 128.48 2qil s VAL 25 Ca 0.03 1.59 0.03 0.00 0.00 0.00 0.00 61.98 63.63 2qil s VAL 25 Cb -0.12 -4.03 -0.21 0.00 0.00 0.00 0.00 36.38 32.02 2qil s VAL 25 CO 0.01 -0.09 0.07 0.18 0.00 0.00 0.00 175.10 175.27 2qil n LEU 26 N 6.12 2.23 -3.54 3.92 4.32 -0.32 -0.67 117.00 129.06 2qil n LEU 26 Ca 0.13 0.03 -0.16 0.00 -0.02 0.00 0.00 56.01 55.99 2qil n LEU 26 Cb 0.45 -0.66 -0.06 0.00 -1.62 0.00 0.00 43.42 41.54 2qil n LEU 26 CO 0.55 0.80 0.52 -0.62 -1.22 0.00 0.00 177.39 177.42 2qil s ASP 27 N -6.47 -0.60 -0.07 -1.43 2.15 -0.90 -4.83 116.67 104.52 2qil s ASP 27 Ca -0.25 0.71 -0.01 0.00 0.43 0.00 0.00 52.55 53.44 2qil s ASP 27 Cb 0.08 0.57 0.03 0.00 -0.30 0.00 0.00 42.92 43.29 2qil s ASP 27 CO 0.71 -0.51 -0.00 0.21 -0.17 0.00 0.00 175.17 175.40 2qil s ASN 28 N -1.02 1.45 0.35 -0.34 3.84 -1.26 -1.07 114.94 116.90 2qil s ASN 28 Ca -0.08 -0.08 0.06 0.00 0.21 0.00 0.00 52.86 52.97 2qil s ASN 28 Cb -0.01 -0.42 -0.03 0.00 -0.55 0.00 0.00 41.25 40.24 2qil s ASN 28 CO 0.07 -0.18 0.22 -0.94 -2.79 0.00 0.00 177.10 173.48 2qil s SER 29 N 1.82 2.02 0.02 -4.21 1.04 -0.19 -5.02 113.70 109.18 2qil s SER 29 Ca 0.03 -1.72 -0.30 0.00 0.48 0.00 0.00 55.95 54.44 2qil s SER 29 Cb -0.12 0.54 -0.08 0.00 0.10 0.00 0.00 66.02 66.45 2qil s SER 29 CO -0.04 -1.01 1.91 -0.22 0.98 0.00 0.00 173.24 174.86 2qil s LEU 30 N -3.45 4.42 0.00 2.42 2.96 -1.26 -2.19 118.68 121.58 2qil s LEU 30 Ca 0.34 2.60 0.00 0.00 -0.22 0.00 0.00 54.13 56.85 2qil s LEU 30 Cb 0.02 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.18 2qil s LEU 30 CO 0.22 -1.03 0.00 0.61 -1.32 0.00 0.00 176.35 174.83 2qil n GLY 31 N 4.47 0.96 3.37 7.98 0.00 -1.26 -4.99 105.19 115.72 2qil n GLY 31 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.09 2qil n GLY 31 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qil s SER 32 N -2.90 -0.40 0.02 1.61 1.04 -0.93 0.17 113.70 112.31 2qil s SER 32 Ca 0.00 0.00 0.02 0.00 0.48 0.00 0.00 55.95 56.46 2qil s SER 32 Cb 0.00 0.50 -0.02 0.00 0.10 0.00 0.00 66.02 66.61 2qil s SER 32 CO 0.00 -0.80 -0.08 -0.04 0.98 0.00 0.00 173.24 173.30 2qil s MET 33 N -3.05 0.57 -0.21 4.02 -1.94 -0.33 -1.02 119.30 117.34 2qil s MET 33 Ca -0.02 -0.55 -0.04 0.00 -1.71 0.00 0.00 55.69 53.37 2qil s MET 33 Cb -0.00 -0.46 -0.01 0.00 2.01 0.00 0.00 34.83 36.36 2qil s MET 33 CO -0.07 0.11 -0.03 0.50 -0.01 0.00 0.00 175.02 175.52 2qil s ARG 34 N -0.95 3.47 0.04 2.03 3.52 -0.23 -1.74 118.95 125.09 2qil s ARG 34 Ca -0.03 -0.59 0.07 0.00 -0.13 0.00 0.00 55.73 55.04 2qil s ARG 34 Cb -0.07 -3.00 -0.02 0.00 -1.56 0.00 0.00 34.95 30.29 2qil s ARG 34 CO 0.00 -0.08 -0.20 0.42 -0.81 0.00 0.00 175.30 174.63 2qil s ILE 35 N 1.21 1.57 -0.23 4.11 1.01 0.30 -1.17 121.20 128.00 2qil s ILE 35 Ca 0.03 -1.16 -0.06 0.00 0.00 0.00 0.00 60.65 59.46 2qil s ILE 35 Cb -0.14 -1.37 -0.02 0.00 0.01 0.00 0.00 42.46 40.93 2qil s ILE 35 CO -0.00 0.17 0.02 -0.75 0.00 0.00 0.00 174.94 174.38 2qil s LYS 36 N -1.17 3.58 0.42 2.79 2.20 0.24 -0.29 119.74 127.51 2qil s LYS 36 Ca 0.06 -0.53 -0.08 0.00 -0.36 0.00 0.00 55.97 55.07 2qil s LYS 36 Cb -0.09 -3.17 -0.05 0.00 -1.51 0.00 0.00 37.83 33.01 2qil s LYS 36 CO 0.02 -0.13 0.75 -0.80 -0.36 0.00 0.00 175.35 174.82 2qil s ASN 37 N 1.40 6.41 0.53 1.43 0.02 -0.30 -0.82 114.94 123.61 2qil s ASN 37 Ca 0.05 1.00 0.21 0.00 -1.02 0.00 0.00 52.86 53.10 2qil s ASN 37 Cb -0.15 -2.27 1.36 0.00 0.02 0.00 0.00 41.25 40.21 2qil s ASN 37 CO 0.01 -0.45 2.07 0.71 0.02 0.00 0.00 177.10 179.47 2qil h THR 38 N 0.78 0.84 0.00 1.60 1.35 -1.83 -0.41 112.91 115.23 2qil h THR 38 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 2qil h THR 38 Cb 1.19 0.86 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 2qil h THR 38 CO 0.63 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 175.00 2qil n ASP 39 N -4.41 0.00 0.00 5.36 5.68 -1.26 -4.91 116.55 117.01 2qil n ASP 39 Ca 0.03 -0.50 0.00 0.00 -0.50 0.00 0.00 54.79 53.82 2qil n ASP 39 Cb 0.35 -0.16 0.00 0.00 -1.14 0.00 0.00 41.12 40.17 2qil n ASP 39 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2qil n GLY 40 N 1.10 0.54 3.82 6.12 0.00 -0.16 -5.09 105.19 111.52 2qil n GLY 40 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 2qil n GLY 40 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qil s SER 41 N -1.90 3.82 -0.04 1.61 1.04 -1.26 -4.74 113.70 112.22 2qil s SER 41 Ca 0.00 0.93 0.06 0.00 0.48 0.00 0.00 55.95 57.42 2qil s SER 41 Cb 0.00 -1.49 -0.02 0.00 0.10 0.00 0.00 66.02 64.61 2qil s SER 41 CO 0.00 -2.35 -0.22 -0.63 0.98 0.00 0.00 173.24 171.02 2qil s ILE 42 N -3.35 2.36 -0.13 -1.02 -1.09 -0.52 -1.15 121.20 116.29 2qil s ILE 42 Ca 0.63 -0.98 0.01 0.00 -2.23 0.00 0.00 60.65 58.08 2qil s ILE 42 Cb -0.14 -1.87 -0.01 0.00 -1.58 0.00 0.00 42.46 38.87 2qil s ILE 42 CO 0.52 0.58 -0.15 -0.44 -1.23 0.00 0.00 174.94 174.22 2qil s SER 43 N -0.45 3.78 -0.39 3.58 0.01 0.61 -0.79 113.70 120.04 2qil s SER 43 Ca 0.05 -0.40 -0.08 0.00 1.31 0.00 0.00 55.95 56.83 2qil s SER 43 Cb -0.12 -1.57 0.07 0.00 0.21 0.00 0.00 66.02 64.61 2qil s SER 43 CO 0.01 0.15 0.21 -0.76 0.41 0.00 0.00 173.24 173.26 2qil s LEU 44 N 0.46 4.92 -0.13 2.44 1.43 -0.06 -0.54 118.68 127.19 2qil s LEU 44 Ca -0.11 -1.42 -0.01 0.00 -1.03 0.00 0.00 54.13 51.56 2qil s LEU 44 Cb -0.16 -1.94 -0.02 0.00 0.03 0.00 0.00 46.19 44.09 2qil s LEU 44 CO 0.05 -0.47 -0.09 -0.63 0.23 0.00 0.00 176.35 175.43 2qil s ILE 45 N 1.40 3.40 0.09 -0.59 1.01 -0.71 -1.66 121.20 124.14 2qil s ILE 45 Ca 0.02 -0.55 -0.05 0.00 0.00 0.00 0.00 60.65 60.08 2qil s ILE 45 Cb -0.22 -2.44 -0.05 0.00 0.01 0.00 0.00 42.46 39.76 2qil s ILE 45 CO 0.02 0.53 0.32 0.27 0.00 0.00 0.00 174.94 176.08 2qil s ILE 46 N 0.17 5.24 -0.42 2.92 -4.36 -0.93 -1.19 121.20 122.63 2qil s ILE 46 Ca -0.05 0.01 0.02 0.00 -0.26 0.00 0.00 60.65 60.36 2qil s ILE 46 Cb -0.15 -3.61 0.14 0.00 1.25 0.00 0.00 42.46 40.09 2qil s ILE 46 CO 0.04 0.15 0.24 -0.36 0.24 0.00 0.00 174.94 175.25 2qil s PHE 47 N -1.53 1.64 -2.00 1.37 0.08 0.13 -1.50 117.98 116.16 2qil s PHE 47 Ca 0.36 -2.22 0.21 0.00 0.12 0.00 0.00 56.93 55.41 2qil s PHE 47 Cb -0.13 -1.61 1.28 0.00 -0.57 0.00 0.00 43.02 41.99 2qil s PHE 47 CO 0.23 -0.79 1.67 -0.35 -0.10 0.00 0.00 175.22 175.87 2qil n PRO 48 N 3.63 0.70 -4.73 0.24 -0.04 -1.26 -4.35 135.00 129.20 2qil n PRO 48 Ca 0.10 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.23 2qil n PRO 48 Cb 0.36 -1.47 -0.13 0.00 -0.04 0.00 0.00 33.50 32.22 2qil n PRO 48 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2qil s SER 49 N -1.96 4.32 0.39 3.54 0.15 -1.26 -4.67 113.70 114.21 2qil s SER 49 Ca 0.32 -0.15 0.27 0.00 0.70 0.00 0.00 55.95 57.09 2qil s SER 49 Cb 0.15 -1.20 0.93 0.00 -1.71 0.00 0.00 66.02 64.19 2qil s SER 49 CO 0.25 0.30 1.79 1.55 1.20 0.00 0.00 173.24 178.33 2qil h PRO 50 N 5.70 0.00 0.00 5.44 0.13 -1.88 -3.17 132.00 138.21 2qil h PRO 50 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2qil h PRO 50 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2qil h PRO 50 CO 0.53 0.00 -0.70 0.66 -0.23 0.00 0.00 178.00 178.27 2qil n TYR 51 N -2.74 0.47 -3.59 1.56 4.01 -1.26 -4.48 117.16 111.13 2qil n TYR 51 Ca 0.03 0.14 -0.29 0.00 -0.16 0.00 0.00 57.90 57.62 2qil n TYR 51 Cb 0.37 -0.59 -0.12 0.00 -0.31 0.00 0.00 39.34 38.68 2qil n TYR 51 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 2qil s TYR 52 N -3.16 1.57 -0.31 -0.72 5.04 -1.20 -3.71 117.35 114.85 2qil s TYR 52 Ca 0.06 -2.26 0.03 0.00 -2.44 0.00 0.00 57.07 52.46 2qil s TYR 52 Cb 0.14 -1.47 0.09 0.00 0.35 0.00 0.00 41.96 41.07 2qil s TYR 52 CO 0.73 -0.78 0.01 0.45 -1.34 0.00 0.00 175.55 174.62 2qil s SER 53 N 0.31 4.59 0.26 4.32 0.15 -1.26 -4.53 113.70 117.54 2qil s SER 53 Ca 0.22 -1.88 -0.31 0.00 0.70 0.00 0.00 55.95 54.68 2qil s SER 53 Cb -0.15 -1.54 -0.12 0.00 -1.71 0.00 0.00 66.02 62.49 2qil s SER 53 CO -0.06 -0.33 1.54 -2.65 1.20 0.00 0.00 173.24 172.94 2qil n PRO 54 N 4.36 2.44 -0.62 5.44 -0.02 -1.26 -4.92 135.00 140.42 2qil n PRO 54 Ca -0.02 0.87 0.08 0.00 -2.02 0.00 0.00 63.50 62.41 2qil n PRO 54 Cb 0.42 -2.61 0.32 0.00 -0.02 0.00 0.00 33.50 31.61 2qil n PRO 54 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qil n ALA 55 N 2.26 3.25 -1.76 3.55 0.00 -1.26 -5.00 120.51 121.54 2qil n ALA 55 Ca 0.11 -1.92 -0.38 0.00 0.00 0.00 0.00 53.44 51.25 2qil n ALA 55 Cb 0.34 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 18.90 2qil n ALA 55 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2qil s PHE 56 N -2.42 2.72 0.29 0.00 0.08 -1.26 -5.02 117.98 112.37 2qil s PHE 56 Ca 0.47 1.45 0.07 0.00 0.12 0.00 0.00 56.93 59.05 2qil s PHE 56 Cb 0.35 -3.59 -0.03 0.00 -0.57 0.00 0.00 43.02 39.18 2qil s PHE 56 CO 0.16 -2.05 0.22 0.95 -0.10 0.00 0.00 175.22 174.40 2qil s THR 57 N -1.38 3.94 0.06 0.64 -4.23 -1.26 -4.81 115.64 108.60 2qil s THR 57 Ca 0.63 -1.44 -0.37 0.00 -1.18 0.00 0.00 61.69 59.33 2qil s THR 57 Cb -0.35 -3.26 -0.16 0.00 1.34 0.00 0.00 72.50 70.07 2qil s THR 57 CO 0.43 -0.27 1.39 1.17 -0.54 0.00 0.00 174.62 176.80 2qil n LYS 58 N -1.24 1.21 0.00 3.99 4.81 -1.26 -1.83 118.16 123.84 2qil n LYS 58 Ca -0.05 0.44 0.00 0.00 -0.87 0.00 0.00 58.31 57.83 2qil n LYS 58 Cb 0.59 -2.09 0.00 0.00 0.02 0.00 0.00 35.03 33.55 2qil n LYS 58 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2qil n GLY 59 N 2.73 2.93 3.79 3.14 0.00 0.15 -4.97 105.19 112.96 2qil n GLY 59 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 2qil n GLY 59 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qil s GLU 60 N -0.42 3.05 -0.12 1.61 2.02 -0.76 -4.67 118.70 119.41 2qil s GLU 60 Ca 0.00 1.26 -0.04 0.00 0.02 0.00 0.00 54.97 56.20 2qil s GLU 60 Cb 0.00 -1.99 -0.04 0.00 0.10 0.00 0.00 34.13 32.20 2qil s GLU 60 CO 0.00 -1.03 0.04 0.15 0.02 0.00 0.00 175.26 174.44 2qil s LYS 61 N -4.18 3.38 0.20 1.61 -0.14 -1.26 -0.62 119.74 118.73 2qil s LYS 61 Ca 0.64 -0.34 0.01 0.00 -1.36 0.00 0.00 55.97 54.92 2qil s LYS 61 Cb -0.18 -2.99 -0.05 0.00 -1.68 0.00 0.00 37.83 32.94 2qil s LYS 61 CO 0.41 0.57 0.06 0.14 -0.76 0.00 0.00 175.35 175.77 2qil s VAL 62 N -0.50 0.50 0.02 3.17 -7.23 -0.68 -4.42 120.40 111.26 2qil s VAL 62 Ca 0.10 -1.98 0.04 0.00 -1.81 0.00 0.00 61.98 58.33 2qil s VAL 62 Cb -0.12 -2.34 -0.03 0.00 0.56 0.00 0.00 36.38 34.45 2qil s VAL 62 CO 0.02 -0.25 -0.09 -1.81 -0.31 0.00 0.00 175.10 172.66 2qil s ASP 63 N -3.21 4.46 -0.16 4.85 1.01 -0.01 -1.38 116.67 122.23 2qil s ASP 63 Ca 0.31 -0.21 0.00 0.00 0.71 0.00 0.00 52.55 53.36 2qil s ASP 63 Cb 0.07 -0.98 0.00 0.00 1.01 0.00 0.00 42.92 43.02 2qil s ASP 63 CO 0.08 0.27 -0.17 -0.76 0.21 0.00 0.00 175.17 174.80 2qil s LEU 64 N -1.49 2.38 -0.42 1.23 1.02 0.03 -2.18 118.68 119.25 2qil s LEU 64 Ca 0.17 -0.52 0.03 0.00 0.02 0.00 0.00 54.13 53.83 2qil s LEU 64 Cb -0.11 -1.54 0.16 0.00 0.02 0.00 0.00 46.19 44.72 2qil s LEU 64 CO 0.08 0.06 0.32 0.20 0.02 0.00 0.00 176.35 177.03 2qil s ASN 65 N 0.95 2.03 0.33 2.29 0.01 -0.81 -1.56 114.94 118.18 2qil s ASN 65 Ca -0.03 -2.94 0.04 0.00 -0.71 0.00 0.00 52.86 49.22 2qil s ASN 65 Cb -0.15 -0.54 -0.02 0.00 0.41 0.00 0.00 41.25 40.96 2qil s ASN 65 CO -0.03 -0.19 0.15 1.07 -1.51 0.00 0.00 177.10 176.58 2qil n THR 66 N 3.03 0.00 -4.90 1.60 5.66 -0.43 -4.44 114.28 114.79 2qil n THR 66 Ca 0.25 -2.00 -0.27 0.00 -3.05 0.00 0.00 64.05 58.98 2qil n THR 66 Cb 0.44 0.78 -0.15 0.00 -1.55 0.00 0.00 70.33 69.85 2qil n THR 66 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2qil s LYS 67 N -3.26 1.60 0.26 1.09 -0.14 -1.26 -0.35 119.74 117.68 2qil s LYS 67 Ca 0.21 -0.82 -0.19 0.00 -1.36 0.00 0.00 55.97 53.81 2qil s LYS 67 Cb 0.01 -1.61 -0.09 0.00 -1.68 0.00 0.00 37.83 34.46 2qil s LYS 67 CO 0.15 0.43 0.75 -0.98 -0.76 0.00 0.00 175.35 174.94 2qil s ARG 68 N -0.73 4.22 -0.01 1.68 1.70 -1.26 -2.01 118.95 122.54 2qil s ARG 68 Ca 0.08 0.86 0.22 0.00 -0.47 0.00 0.00 55.73 56.42 2qil s ARG 68 Cb -0.08 -2.76 -0.29 0.00 -0.57 0.00 0.00 34.95 31.25 2qil s ARG 68 CO 0.00 0.32 0.58 0.25 -1.08 0.00 0.00 175.30 175.38 2qil n THR 69 N 0.44 0.05 -3.82 4.99 -2.24 0.41 -4.92 114.28 109.18 2qil n THR 69 Ca -0.01 -0.44 -0.06 0.00 -2.27 0.00 0.00 64.05 61.28 2qil n THR 69 Cb 0.52 0.10 -0.01 0.00 -2.10 0.00 0.00 70.33 68.84 2qil n THR 69 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 2qil s LYS 70 N -3.44 1.66 0.41 -0.78 -2.85 -1.25 -5.09 119.74 108.40 2qil s LYS 70 Ca -0.05 -0.96 -0.26 0.00 -1.00 0.00 0.00 55.97 53.70 2qil s LYS 70 Cb 0.14 0.54 -0.09 0.00 -2.06 0.00 0.00 37.83 36.36 2qil s LYS 70 CO 0.89 -0.77 1.34 0.15 0.10 0.00 0.00 175.35 177.07 2qil s LYS 71 N -3.32 3.91 0.69 1.78 1.02 -1.26 -4.48 119.74 118.08 2qil s LYS 71 Ca 0.13 2.24 -0.14 0.00 0.02 0.00 0.00 55.97 58.22 2qil s LYS 71 Cb -0.04 -2.74 0.02 0.00 -0.52 0.00 0.00 37.83 34.54 2qil s LYS 71 CO 0.06 -0.57 1.11 -1.12 -0.92 0.00 0.00 175.35 173.91 2qil s SER 72 N -0.66 4.90 0.11 2.83 0.01 -1.26 -4.80 113.70 114.83 2qil s SER 72 Ca 0.58 1.97 0.10 0.00 1.31 0.00 0.00 55.95 59.91 2qil s SER 72 Cb -0.40 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.25 2qil s SER 72 CO 0.51 -1.77 -0.25 -1.10 0.41 0.00 0.00 173.24 171.04 2qil s GLN 73 N -4.29 1.40 -0.23 12.44 -0.21 -0.36 -4.94 119.66 123.48 2qil s GLN 73 Ca 0.66 -1.25 -0.09 0.00 0.02 0.00 0.00 55.36 54.70 2qil s GLN 73 Cb -0.20 -1.78 -0.04 0.00 1.00 0.00 0.00 33.01 31.99 2qil s GLN 73 CO 0.45 0.43 0.11 -1.01 -2.12 0.00 0.00 175.29 173.15 2qil s HIS 74 N -1.03 3.22 0.66 0.91 3.76 -1.26 -0.02 115.29 121.53 2qil s HIS 74 Ca 0.12 -0.01 -0.03 0.00 -0.15 0.00 0.00 55.06 54.99 2qil s HIS 74 Cb -0.10 -2.21 0.07 0.00 1.11 0.00 0.00 32.58 31.45 2qil s HIS 74 CO 0.05 -0.05 0.93 0.95 -0.85 0.00 0.00 174.74 175.77 2qil s THR 75 N 1.06 2.39 0.22 1.30 -4.23 -0.08 -4.93 115.64 111.38 2qil s THR 75 Ca 0.05 -0.48 -0.08 0.00 -1.18 0.00 0.00 61.69 60.00 2qil s THR 75 Cb -0.14 -2.91 0.18 0.00 1.34 0.00 0.00 72.50 70.97 2qil s THR 75 CO 0.04 0.00 1.83 0.77 -0.54 0.00 0.00 174.62 176.72 2qil h SER 76 N -0.36 1.06 0.10 3.99 4.64 -1.99 -1.07 113.55 119.92 2qil h SER 76 Ca -0.42 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 60.79 2qil h SER 76 Cb 1.30 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 2qil h SER 76 CO 0.52 0.87 0.00 -0.62 -0.87 0.00 0.00 176.83 176.73 2qil n GLU 77 N -4.37 0.34 -1.67 4.77 4.71 -1.26 -4.83 120.64 118.34 2qil n GLU 77 Ca 0.08 0.06 0.00 0.00 -0.01 0.00 0.00 57.16 57.30 2qil n GLU 77 Cb 0.11 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.04 2qil n GLU 77 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2qil n GLY 78 N -0.13 0.51 3.74 0.62 0.00 -0.41 -5.07 105.19 104.45 2qil n GLY 78 Ca 0.09 -0.84 -0.34 0.00 0.00 0.00 0.00 46.02 44.93 2qil n GLY 78 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qil s THR 79 N -2.00 4.52 -0.27 2.61 -4.23 -1.26 -4.85 115.64 110.16 2qil s THR 79 Ca 0.00 -0.37 -0.14 0.00 -1.18 0.00 0.00 61.69 60.01 2qil s THR 79 Cb 0.00 -3.00 -0.04 0.00 1.34 0.00 0.00 72.50 70.80 2qil s THR 79 CO 0.00 0.45 0.31 -0.47 -0.54 0.00 0.00 174.62 174.37 2qil s TYR 80 N -1.07 3.25 -0.16 3.99 5.04 -1.26 -0.90 117.35 126.24 2qil s TYR 80 Ca 0.19 0.33 -0.02 0.00 -2.44 0.00 0.00 57.07 55.13 2qil s TYR 80 Cb -0.12 -2.50 -0.02 0.00 0.35 0.00 0.00 41.96 39.67 2qil s TYR 80 CO 0.09 -0.19 -0.08 0.42 -1.34 0.00 0.00 175.55 174.45 2qil s ILE 81 N 1.91 3.34 -0.04 3.14 1.01 0.97 -1.44 121.20 130.09 2qil s ILE 81 Ca 0.13 -0.54 -0.05 0.00 0.00 0.00 0.00 60.65 60.18 2qil s ILE 81 Cb -0.16 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.82 2qil s ILE 81 CO 0.10 0.49 0.19 -1.00 0.00 0.00 0.00 174.94 174.73 2qil s HIS 82 N 0.64 3.58 -0.29 3.97 3.76 0.03 -1.22 115.29 125.75 2qil s HIS 82 Ca -0.05 0.48 0.01 0.00 -0.15 0.00 0.00 55.06 55.35 2qil s HIS 82 Cb -0.15 -1.91 0.06 0.00 1.11 0.00 0.00 32.58 31.69 2qil s HIS 82 CO 0.03 0.67 -0.03 -0.06 -0.85 0.00 0.00 174.74 174.49 2qil s PHE 83 N -1.22 3.33 0.41 1.40 0.40 -1.26 -0.88 117.98 120.16 2qil s PHE 83 Ca 0.23 -2.20 0.04 0.00 -0.60 0.00 0.00 56.93 54.40 2qil s PHE 83 Cb -0.13 -2.17 -0.04 0.00 0.51 0.00 0.00 43.02 41.20 2qil s PHE 83 CO 0.13 -0.86 0.06 -0.65 0.70 0.00 0.00 175.22 174.60 2qil s GLN 84 N 1.15 1.93 -0.05 0.44 -0.21 -0.66 -0.45 119.66 121.81 2qil s GLN 84 Ca -0.05 -2.16 -0.01 0.00 0.02 0.00 0.00 55.36 53.17 2qil s GLN 84 Cb -0.20 -1.07 0.03 0.00 1.00 0.00 0.00 33.01 32.76 2qil s GLN 84 CO -0.04 -0.31 0.02 -1.50 -2.12 0.00 0.00 175.29 171.34 2qil s ILE 85 N -3.07 0.19 0.00 1.08 2.07 -0.85 -2.19 121.20 118.43 2qil s ILE 85 Ca 0.24 0.19 0.00 0.00 -1.41 0.00 0.00 60.65 59.67 2qil s ILE 85 Cb 0.05 -0.35 0.00 0.00 0.13 0.00 0.00 42.46 42.29 2qil s ILE 85 CO 0.12 0.20 0.00 -0.24 -1.91 0.00 0.00 174.94 173.12 2qil n SER 86 N 4.85 -4.39 -1.52 4.50 2.88 -0.57 -4.07 113.62 115.30 2qil n SER 86 Ca -0.12 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.33 2qil n SER 86 Cb 0.50 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 63.99 2qil n SER 86 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2qil n GLY 87 N 0.00 0.39 3.30 0.46 0.00 -1.26 -4.65 105.19 103.44 2qil n GLY 87 Ca 0.00 -0.37 -0.34 0.00 0.00 0.00 0.00 46.02 45.31 2qil n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qil s VAL 88 N -3.04 3.17 0.36 1.61 1.01 -1.26 -1.93 120.40 120.32 2qil s VAL 88 Ca 0.19 -0.57 0.04 0.00 0.00 0.00 0.00 61.98 61.63 2qil s VAL 88 Cb -0.08 -2.41 -0.03 0.00 0.00 0.00 0.00 36.38 33.85 2qil s VAL 88 CO 0.23 0.46 0.14 0.42 0.00 0.00 0.00 175.10 176.35 2qil s THR 89 N 1.21 0.53 0.88 3.92 -4.23 -0.93 -4.92 115.64 112.10 2qil s THR 89 Ca 0.02 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.41 2qil s THR 89 Cb -0.14 -2.46 0.12 0.00 1.34 0.00 0.00 72.50 71.36 2qil s THR 89 CO -0.03 0.00 1.17 0.54 -0.54 0.00 0.00 174.62 175.76 2qil s ASN 90 N -3.50 3.86 -0.06 3.99 2.20 -1.26 -0.83 114.94 119.33 2qil s ASN 90 Ca 0.30 0.83 0.10 0.00 -0.94 0.00 0.00 52.86 53.15 2qil s ASN 90 Cb 0.04 -1.33 0.41 0.00 -2.00 0.00 0.00 41.25 38.37 2qil s ASN 90 CO 0.17 -2.32 1.25 0.35 -2.94 0.00 0.00 177.10 173.61 2qil n THR 91 N -3.59 1.04 -2.11 0.54 -2.24 -1.26 -4.36 114.28 102.30 2qil n THR 91 Ca 0.08 -0.66 -0.41 0.00 -2.27 0.00 0.00 64.05 60.79 2qil n THR 91 Cb 0.60 -0.04 -0.02 0.00 -2.10 0.00 0.00 70.33 68.76 2qil n THR 91 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2qil s GLU 92 N -1.71 4.34 0.23 -0.78 2.02 -1.26 -4.97 118.70 116.57 2qil s GLU 92 Ca 0.29 2.21 0.08 0.00 0.02 0.00 0.00 54.97 57.57 2qil s GLU 92 Cb 0.19 -3.11 -0.04 0.00 0.10 0.00 0.00 34.13 31.26 2qil s GLU 92 CO 0.14 -0.28 0.04 0.15 0.02 0.00 0.00 175.26 175.33 2qil s LYS 93 N -0.95 2.46 0.31 1.61 -0.14 -1.26 -0.95 119.74 120.82 2qil s LYS 93 Ca 0.54 -1.23 -0.13 0.00 -1.36 0.00 0.00 55.97 53.79 2qil s LYS 93 Cb -0.40 -2.31 -0.08 0.00 -1.68 0.00 0.00 37.83 33.36 2qil s LYS 93 CO 0.46 0.41 0.69 -0.51 -0.76 0.00 0.00 175.35 175.64 2qil s LEU 94 N -3.44 4.06 0.29 3.17 1.02 0.27 -4.65 118.68 119.41 2qil s LEU 94 Ca 0.30 1.17 0.01 0.00 0.02 0.00 0.00 54.13 55.63 2qil s LEU 94 Cb -0.08 -3.97 0.55 0.00 0.02 0.00 0.00 46.19 42.71 2qil s LEU 94 CO 0.20 -0.19 1.87 -0.65 0.02 0.00 0.00 176.35 177.60 2qil h PRO 95 N 2.21 0.98 -3.16 1.29 0.11 -2.00 -3.41 132.00 128.02 2qil h PRO 95 Ca -0.48 -0.06 -0.20 0.00 0.11 0.00 0.00 66.00 65.38 2qil h PRO 95 Cb 1.17 -0.22 -0.29 0.00 0.11 0.00 0.00 31.00 31.77 2qil h PRO 95 CO 0.66 0.65 -0.51 -0.08 -0.21 0.00 0.00 178.00 178.51 2qil s THR 96 N -5.93 -0.03 0.35 -1.15 -1.32 -1.26 -5.14 115.64 101.16 2qil s THR 96 Ca -0.12 0.10 -0.29 0.00 -1.21 0.00 0.00 61.69 60.18 2qil s THR 96 Cb 0.21 -0.31 -0.11 0.00 -1.51 0.00 0.00 72.50 70.78 2qil s THR 96 CO 0.81 0.04 1.52 -2.16 -2.21 0.00 0.00 174.62 172.61 2qil s PRO 97 N 0.81 4.11 0.28 7.08 0.04 -1.26 -4.91 135.00 141.15 2qil s PRO 97 Ca -0.06 2.57 0.11 0.00 0.04 0.00 0.00 61.00 63.67 2qil s PRO 97 Cb -0.07 -2.98 -0.05 0.00 0.04 0.00 0.00 34.50 31.43 2qil s PRO 97 CO -0.05 -0.56 -0.13 0.96 0.04 0.00 0.00 177.00 177.26 2qil s ILE 98 N -0.81 2.75 -0.18 0.56 -4.36 0.38 -4.84 121.20 114.71 2qil s ILE 98 Ca 0.56 -2.24 -0.06 0.00 -0.26 0.00 0.00 60.65 58.65 2qil s ILE 98 Cb -0.47 -2.49 -0.03 0.00 1.25 0.00 0.00 42.46 40.72 2qil s ILE 98 CO 0.59 -0.38 0.02 -0.70 0.24 0.00 0.00 174.94 174.71 2qil s GLU 99 N -3.57 3.81 0.07 0.37 2.12 -1.26 -0.09 118.70 120.15 2qil s GLU 99 Ca 0.31 -0.43 -0.30 0.00 0.36 0.00 0.00 54.97 54.90 2qil s GLU 99 Cb -0.05 -3.10 -0.05 0.00 0.26 0.00 0.00 34.13 31.20 2qil s GLU 99 CO 0.17 0.21 1.00 -0.51 -0.54 0.00 0.00 175.26 175.59 2qil s LEU 100 N 0.49 4.44 -0.52 2.70 1.43 -1.26 -4.98 118.68 120.99 2qil s LEU 100 Ca 0.00 1.79 -0.28 0.00 -1.03 0.00 0.00 54.13 54.62 2qil s LEU 100 Cb -0.13 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.50 2qil s LEU 100 CO 0.02 -0.18 1.58 -2.16 0.23 0.00 0.00 176.35 175.84 2qil s PRO 101 N 0.39 3.19 -0.11 1.29 0.04 -1.26 -4.98 135.00 133.56 2qil s PRO 101 Ca 0.50 0.70 0.03 0.00 0.04 0.00 0.00 61.00 62.27 2qil s PRO 101 Cb -0.24 -4.18 0.00 0.00 0.04 0.00 0.00 34.50 30.12 2qil s PRO 101 CO 0.30 -2.06 -0.22 -1.17 0.04 0.00 0.00 177.00 173.88 2qil s LEU 102 N 6.79 2.05 -0.08 -3.56 2.96 -1.26 -1.25 118.68 124.33 2qil s LEU 102 Ca 0.61 -0.55 0.04 0.00 -0.22 0.00 0.00 54.13 54.01 2qil s LEU 102 Cb -0.13 -1.37 -0.01 0.00 0.50 0.00 0.00 46.19 45.18 2qil s LEU 102 CO 0.26 0.12 -0.22 -0.54 -1.32 0.00 0.00 176.35 174.65 2qil s LYS 103 N 0.55 2.85 -0.08 1.98 -0.14 -0.74 -4.96 119.74 119.20 2qil s LYS 103 Ca -0.14 -0.84 0.05 0.00 -1.36 0.00 0.00 55.97 53.67 2qil s LYS 103 Cb -0.17 -2.30 -0.01 0.00 -1.68 0.00 0.00 37.83 33.67 2qil s LYS 103 CO 0.04 0.31 -0.22 0.08 -0.76 0.00 0.00 175.35 174.80 2qil s VAL 104 N 0.03 2.27 -0.10 3.17 1.01 -1.26 -1.31 120.40 124.22 2qil s VAL 104 Ca -0.08 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 60.94 2qil s VAL 104 Cb -0.15 -1.86 0.01 0.00 0.00 0.00 0.00 36.38 34.38 2qil s VAL 104 CO 0.05 0.56 -0.16 -0.54 0.00 0.00 0.00 175.10 175.02 2qil s LYS 105 N -0.02 2.26 -0.27 2.72 1.02 -0.84 -1.00 119.74 123.62 2qil s LYS 105 Ca -0.07 -0.59 -0.06 0.00 0.02 0.00 0.00 55.97 55.27 2qil s LYS 105 Cb -0.15 -1.86 0.00 0.00 -0.52 0.00 0.00 37.83 35.30 2qil s LYS 105 CO 0.05 0.00 0.04 0.08 -0.92 0.00 0.00 175.35 174.60 2qil s VAL 106 N 0.79 3.77 -1.51 3.17 1.01 0.11 -1.67 120.40 126.08 2qil s VAL 106 Ca -0.11 -0.60 -0.12 0.00 0.00 0.00 0.00 61.98 61.16 2qil s VAL 106 Cb -0.16 -2.87 0.08 0.00 0.00 0.00 0.00 36.38 33.43 2qil s VAL 106 CO 0.01 0.21 0.90 1.41 0.00 0.00 0.00 175.10 177.63 2qil n HIS 107 N 4.84 -2.16 0.00 5.22 8.25 -0.49 -1.21 115.22 129.67 2qil n HIS 107 Ca -0.16 0.88 0.00 0.00 -0.26 0.00 0.00 57.72 58.18 2qil n HIS 107 Cb 0.49 -3.93 0.00 0.00 1.12 0.00 0.00 29.99 27.67 2qil n HIS 107 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qil n GLY 108 N -1.66 2.57 3.88 -1.41 0.00 -1.26 -5.02 105.19 102.28 2qil n GLY 108 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 2qil n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qil s LYS 109 N -0.26 3.54 0.36 1.61 1.02 -0.35 -5.02 119.74 120.63 2qil s LYS 109 Ca 0.00 -0.08 -0.28 0.00 0.02 0.00 0.00 55.97 55.63 2qil s LYS 109 Cb 0.00 -3.14 -0.10 0.00 -0.52 0.00 0.00 37.83 34.07 2qil s LYS 109 CO 0.00 0.71 1.35 0.34 -0.92 0.00 0.00 175.35 176.83 2qil s ASP 110 N -1.39 6.54 -0.28 2.83 2.15 -1.26 0.08 116.67 125.34 2qil s ASP 110 Ca 0.22 2.77 -0.00 0.00 0.43 0.00 0.00 52.55 55.97 2qil s ASP 110 Cb -0.13 -2.65 0.08 0.00 -0.30 0.00 0.00 42.92 39.92 2qil s ASP 110 CO 0.11 -0.70 0.05 -0.55 -0.17 0.00 0.00 175.17 173.91 2qil s SER 111 N -0.46 3.89 0.44 -0.34 0.15 -0.17 -4.78 113.70 112.43 2qil s SER 111 Ca 0.52 -1.46 -0.25 0.00 0.70 0.00 0.00 55.95 55.46 2qil s SER 111 Cb -0.41 -0.98 -0.09 0.00 -1.71 0.00 0.00 66.02 62.83 2qil s SER 111 CO 0.55 -0.35 1.27 -0.81 1.20 0.00 0.00 173.24 175.09 2qil n PRO 112 N 4.77 1.86 -1.81 5.44 -0.04 -1.26 -4.27 135.00 139.69 2qil n PRO 112 Ca -0.05 0.66 -0.31 0.00 -0.04 0.00 0.00 63.50 63.77 2qil n PRO 112 Cb 0.43 -2.39 0.03 0.00 -0.04 0.00 0.00 33.50 31.53 2qil n PRO 112 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2qil s LEU 113 N -1.89 3.08 -0.15 1.53 1.43 -1.26 -5.03 118.68 116.39 2qil s LEU 113 Ca 0.63 1.36 -0.07 0.00 -1.03 0.00 0.00 54.13 55.01 2qil s LEU 113 Cb -0.49 -4.28 0.06 0.00 0.03 0.00 0.00 46.19 41.50 2qil s LEU 113 CO 0.57 -1.16 0.34 -0.75 0.23 0.00 0.00 176.35 175.58 2qil s LYS 114 N -5.21 0.29 -1.46 1.70 2.20 -1.26 -4.91 119.74 111.09 2qil s LYS 114 Ca 0.57 0.74 -0.06 0.00 -0.36 0.00 0.00 55.97 56.86 2qil s LYS 114 Cb -0.12 -0.01 0.01 0.00 -1.51 0.00 0.00 37.83 36.20 2qil s LYS 114 CO 0.54 -0.19 0.78 0.66 -0.36 0.00 0.00 175.35 176.78 2qil n TYR 115 N 4.57 -2.22 -2.90 4.03 4.01 -1.26 -4.96 117.16 118.42 2qil n TYR 115 Ca -0.19 0.67 -0.42 0.00 -0.16 0.00 0.00 57.90 57.80 2qil n TYR 115 Cb 0.53 -4.61 -0.04 0.00 -0.31 0.00 0.00 39.34 34.91 2qil n TYR 115 CO 0.00 0.00 0.00 -0.46 -0.46 0.00 0.00 176.86 175.94 2qil s TRP 116 N -3.22 3.28 0.67 -0.72 -0.00 -1.26 -5.03 118.94 112.66 2qil s TRP 116 Ca 0.39 1.05 -0.07 0.00 -0.00 0.00 0.00 56.10 57.47 2qil s TRP 116 Cb -0.17 -3.12 0.04 0.00 -0.00 0.00 0.00 33.47 30.22 2qil s TRP 116 CO 0.48 -0.46 0.99 -1.25 -0.00 0.00 0.00 176.95 176.71 2qil s PRO 117 N 2.90 2.52 0.28 5.86 0.04 -1.26 -5.05 135.00 140.28 2qil s PRO 117 Ca 0.35 -0.08 0.01 0.00 0.04 0.00 0.00 61.00 61.32 2qil s PRO 117 Cb -0.15 -2.18 -0.04 0.00 0.04 0.00 0.00 34.50 32.17 2qil s PRO 117 CO 0.09 -1.04 0.46 0.15 0.04 0.00 0.00 177.00 176.70 2qil s LYS 118 N -5.18 3.49 0.05 4.56 1.02 -1.26 -4.55 119.74 117.86 2qil s LYS 118 Ca 0.58 -0.43 0.07 0.00 0.02 0.00 0.00 55.97 56.21 2qil s LYS 118 Cb -0.11 -2.77 -0.03 0.00 -0.52 0.00 0.00 37.83 34.41 2qil s LYS 118 CO 0.46 0.29 -0.21 -0.06 -0.92 0.00 0.00 175.35 174.91 2qil s PHE 119 N -2.10 1.80 -0.18 3.18 0.08 0.87 -4.89 117.98 116.74 2qil s PHE 119 Ca 0.38 -0.38 0.02 0.00 0.12 0.00 0.00 56.93 57.07 2qil s PHE 119 Cb -0.10 -1.07 0.03 0.00 -0.57 0.00 0.00 43.02 41.31 2qil s PHE 119 CO 0.32 0.10 0.77 -0.40 -0.10 0.00 0.00 175.22 175.91 2qil n ASP 120 N 1.81 1.60 -4.87 1.36 5.75 -1.26 -0.47 116.55 120.47 2qil n ASP 120 Ca -0.17 -1.49 -0.33 0.00 -0.01 0.00 0.00 54.79 52.78 2qil n ASP 120 Cb 0.53 -0.02 -0.05 0.00 -1.03 0.00 0.00 41.12 40.55 2qil n ASP 120 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2qil s LYS 121 N -0.53 3.82 0.08 0.11 1.02 -1.26 0.94 119.74 123.91 2qil s LYS 121 Ca 0.03 0.27 -0.16 0.00 0.02 0.00 0.00 55.97 56.13 2qil s LYS 121 Cb 0.02 -2.79 -0.13 0.00 -0.52 0.00 0.00 37.83 34.40 2qil s LYS 121 CO 0.02 0.41 1.33 -0.22 -0.92 0.00 0.00 175.35 175.98 2qil h LYS 122 N 3.01 0.65 -6.38 1.68 1.63 -1.31 -3.43 116.57 112.42 2qil h LYS 122 Ca -0.47 -0.43 -0.63 0.00 -0.85 0.00 0.00 60.65 58.27 2qil h LYS 122 Cb 1.18 0.06 -0.25 0.00 -0.60 0.00 0.00 32.23 32.61 2qil h LYS 122 CO 0.68 1.05 -0.86 -0.65 -3.45 0.00 0.00 179.45 176.23 2qil s GLN 123 N -4.01 1.51 0.01 1.90 -0.21 -1.26 -1.86 119.66 115.73 2qil s GLN 123 Ca -0.12 -1.05 0.00 0.00 0.02 0.00 0.00 55.36 54.21 2qil s GLN 123 Cb 0.07 -1.69 -0.01 0.00 1.00 0.00 0.00 33.01 32.39 2qil s GLN 123 CO 0.84 0.43 -0.02 -0.51 -2.12 0.00 0.00 175.29 173.91 2qil s LEU 124 N -1.32 2.07 0.46 2.90 1.43 -0.68 -4.87 118.68 118.67 2qil s LEU 124 Ca 0.09 -0.16 -0.23 0.00 -1.03 0.00 0.00 54.13 52.80 2qil s LEU 124 Cb -0.09 -0.02 -0.07 0.00 0.03 0.00 0.00 46.19 46.03 2qil s LEU 124 CO 0.02 -0.08 1.14 0.00 0.23 0.00 0.00 176.35 177.67 2qil s ALA 125 N -0.45 2.95 0.42 4.21 0.00 -1.26 -1.79 121.76 125.84 2qil s ALA 125 Ca -0.04 0.88 0.09 0.00 0.00 0.00 0.00 51.96 52.88 2qil s ALA 125 Cb -0.03 -3.36 0.91 0.00 0.00 0.00 0.00 23.12 20.64 2qil s ALA 125 CO -0.00 -0.59 2.04 0.82 0.00 0.00 0.00 175.76 178.02 2qil h ILE 126 N 1.83 1.05 0.00 0.00 2.04 -1.83 -1.34 117.51 119.25 2qil h ILE 126 Ca -0.49 -0.18 -0.07 0.00 1.00 0.00 0.00 64.86 65.12 2qil h ILE 126 Cb 1.24 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 2qil h ILE 126 CO 0.60 0.09 -0.33 0.77 0.00 0.00 0.00 178.15 179.28 2qil h SER 127 N 0.51 0.00 -0.13 1.72 4.64 -1.91 0.10 113.55 118.48 2qil h SER 127 Ca 0.18 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.32 2qil h SER 127 Cb 0.10 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.20 2qil h SER 127 CO -0.05 0.33 -0.65 0.74 -0.87 0.00 0.00 176.83 176.34 2qil h THR 128 N 0.00 1.32 -0.70 2.95 2.02 -1.54 -2.05 112.91 114.90 2qil h THR 128 Ca -0.00 -1.90 -0.04 0.00 0.77 0.00 0.00 66.41 65.23 2qil h THR 128 Cb 0.64 2.07 -0.03 0.00 -1.74 0.00 0.00 68.15 69.09 2qil h THR 128 CO 0.04 0.59 0.27 -0.07 0.37 0.00 0.00 175.52 176.72 2qil h LEU 129 N 0.35 0.98 0.32 2.58 -0.00 -0.94 -1.26 115.31 117.34 2qil h LEU 129 Ca -0.04 -0.18 -0.01 0.00 -0.00 0.00 0.00 57.88 57.65 2qil h LEU 129 Cb 1.29 -0.26 -0.01 0.00 -0.00 0.00 0.00 40.66 41.68 2qil h LEU 129 CO 0.13 0.90 -0.22 -0.78 -0.00 0.00 0.00 178.44 178.47 2qil h ASP 130 N 1.01 -0.56 0.39 -0.43 3.58 -0.75 -1.59 116.42 118.08 2qil h ASP 130 Ca 0.23 0.04 -0.08 0.00 0.42 0.00 0.00 57.03 57.65 2qil h ASP 130 Cb 0.23 0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.44 2qil h ASP 130 CO -0.02 -0.34 -0.36 2.19 -2.88 0.00 0.00 179.24 177.83 2qil h PHE 131 N -0.53 0.00 -0.44 0.28 -5.15 -1.18 -1.13 116.94 108.79 2qil h PHE 131 Ca -0.03 0.00 -0.10 0.00 -0.20 0.00 0.00 57.97 57.64 2qil h PHE 131 Cb 0.45 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.61 2qil h PHE 131 CO -0.11 0.36 -0.13 0.93 -2.00 0.00 0.00 178.31 177.36 2qil h GLU 132 N 0.00 0.87 0.13 6.09 4.39 -1.14 0.09 114.58 125.00 2qil h GLU 132 Ca -0.00 -0.35 -0.01 0.00 0.34 0.00 0.00 59.36 59.34 2qil h GLU 132 Cb 0.65 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 2qil h GLU 132 CO 0.05 0.99 -0.06 0.82 -1.16 0.00 0.00 179.01 179.64 2qil h ILE 133 N 0.70 1.03 0.00 3.13 2.04 -1.07 -2.88 117.51 120.46 2qil h ILE 133 Ca 0.11 -0.77 -0.05 0.00 1.00 0.00 0.00 64.86 65.14 2qil h ILE 133 Cb 0.68 1.51 -0.01 0.00 -0.74 0.00 0.00 36.82 38.26 2qil h ILE 133 CO 0.05 0.18 -0.26 0.03 0.00 0.00 0.00 178.15 178.15 2qil h ARG 134 N -0.55 0.00 -0.50 2.37 3.08 -1.20 -2.14 114.38 115.44 2qil h ARG 134 Ca -0.02 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.91 2qil h ARG 134 Cb 0.43 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 2qil h ARG 134 CO 0.03 0.26 -0.18 1.25 -1.07 0.00 0.00 179.97 180.26 2qil h HIS 135 N 0.00 1.14 -0.62 3.04 2.76 -1.01 0.29 115.15 120.76 2qil h HIS 135 Ca -0.00 -0.27 -0.06 0.00 -2.20 0.00 0.00 60.37 57.84 2qil h HIS 135 Cb 0.49 -0.27 -0.03 0.00 1.55 0.00 0.00 27.41 29.15 2qil h HIS 135 CO 0.00 1.09 0.15 0.37 -1.30 0.00 0.00 177.93 178.24 2qil h GLN 136 N 0.86 0.97 -0.34 5.26 5.75 -1.24 -1.79 115.11 124.59 2qil h GLN 136 Ca 0.12 -0.21 -0.16 0.00 -0.15 0.00 0.00 58.65 58.24 2qil h GLN 136 Cb 0.76 -0.14 -0.00 0.00 1.07 0.00 0.00 27.48 29.17 2qil h GLN 136 CO 0.06 0.86 -0.42 -0.07 -2.65 0.00 0.00 178.83 176.61 2qil h LEU 137 N 0.93 0.95 -0.17 -2.39 3.38 -0.97 -0.89 115.31 116.15 2qil h LEU 137 Ca 0.20 -0.49 -0.17 0.00 0.09 0.00 0.00 57.88 57.51 2qil h LEU 137 Cb 0.33 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 40.82 2qil h LEU 137 CO -0.00 1.25 -0.56 0.71 0.09 0.00 0.00 178.44 179.93 2qil h THR 138 N 0.67 1.32 0.01 0.22 1.35 -0.90 -1.60 112.91 113.98 2qil h THR 138 Ca 0.04 -1.81 -0.21 0.00 -0.55 0.00 0.00 66.41 63.88 2qil h THR 138 Cb 1.02 1.98 0.02 0.00 -1.73 0.00 0.00 68.15 69.43 2qil h THR 138 CO 0.10 0.56 -0.83 1.56 -0.25 0.00 0.00 175.52 176.66 2qil h GLN 139 N 0.36 0.55 0.00 4.72 1.08 -1.39 -3.30 115.11 117.13 2qil h GLN 139 Ca -0.02 -0.60 -0.36 0.00 -1.45 0.00 0.00 58.65 56.21 2qil h GLN 139 Cb 1.19 0.17 -0.07 0.00 -0.05 0.00 0.00 27.48 28.72 2qil h GLN 139 CO 0.12 1.22 -2.36 -0.89 -0.95 0.00 0.00 178.83 175.97 2qil n ILE 140 N -4.04 1.37 -0.05 2.54 2.08 -0.34 -4.68 119.36 116.25 2qil n ILE 140 Ca -0.11 -0.85 0.04 0.00 0.56 0.00 0.00 62.75 62.39 2qil n ILE 140 Cb 0.78 -0.47 0.10 0.00 -0.75 0.00 0.00 39.64 39.30 2qil n ILE 140 CO 0.00 0.00 0.00 1.41 0.56 0.00 0.00 176.55 178.52 2qil n HIS 141 N -2.75 0.27 -0.97 1.39 8.25 -0.67 -5.02 115.22 115.72 2qil n HIS 141 Ca -0.32 -0.41 0.00 0.00 -0.26 0.00 0.00 57.72 56.73 2qil n HIS 141 Cb 1.15 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 32.23 2qil n HIS 141 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qil n GLY 142 N 0.26 0.53 3.69 -1.41 0.00 -0.78 -4.95 105.19 102.52 2qil n GLY 142 Ca 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 2qil n GLY 142 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2qil n LEU 143 N 0.00 3.41 0.00 0.99 0.00 -0.79 -2.08 117.00 118.53 2qil n LEU 143 Ca 0.00 1.13 0.00 0.00 0.00 0.00 0.00 56.01 57.14 2qil n LEU 143 Cb 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 43.42 41.95 2qil n LEU 143 CO 0.00 -0.30 0.00 -1.22 0.00 0.00 0.00 177.39 175.87 2qil n TYR 144 N 2.21 0.00 0.10 1.96 4.01 -0.06 -4.50 117.16 120.89 2qil n TYR 144 Ca 0.12 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.94 2qil n TYR 144 Cb 0.32 -0.88 0.00 0.00 -0.31 0.00 0.00 39.34 38.47 2qil n TYR 144 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2qil h ARG 145 N 1.21 0.00 -4.50 -0.72 3.08 -1.63 -3.46 114.38 108.37 2qil h ARG 145 Ca 0.00 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.84 2qil h ARG 145 Cb 0.03 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 29.94 2qil h ARG 145 CO 0.00 0.10 -0.64 -1.54 -1.07 0.00 0.00 179.97 176.82 2qil s SER 146 N -5.64 0.35 0.56 7.04 1.04 -1.26 -5.01 113.70 110.78 2qil s SER 146 Ca 0.00 -1.25 0.36 0.00 0.48 0.00 0.00 55.95 55.54 2qil s SER 146 Cb 0.09 0.30 1.64 0.00 0.10 0.00 0.00 66.02 68.14 2qil s SER 146 CO 0.78 -0.74 2.06 0.77 0.98 0.00 0.00 173.24 177.09 2qil h SER 147 N 2.79 0.00 -0.43 7.02 4.64 -1.92 -2.64 113.55 123.01 2qil h SER 147 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 2qil h SER 147 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2qil h SER 147 CO 0.58 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.64 2qil n ASP 148 N -2.99 2.28 -3.24 4.97 5.75 -1.26 -4.48 116.55 117.58 2qil n ASP 148 Ca -0.00 -2.00 -0.23 0.00 -0.01 0.00 0.00 54.79 52.54 2qil n ASP 148 Cb 0.22 -0.28 -0.07 0.00 -1.03 0.00 0.00 41.12 39.96 2qil n ASP 148 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2qil n LYS 149 N 0.75 0.45 -0.03 0.11 5.02 -1.00 -4.75 118.16 118.71 2qil n LYS 149 Ca 0.14 -3.04 0.00 0.00 -2.02 0.00 0.00 58.31 53.39 2qil n LYS 149 Cb 0.36 -1.46 0.01 0.00 -0.02 0.00 0.00 35.03 33.91 2qil n LYS 149 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2qil n THR 150 N 2.21 0.46 -3.82 -0.18 -2.24 -1.15 -0.88 114.28 108.70 2qil n THR 150 Ca 0.25 -0.48 -0.08 0.00 -2.27 0.00 0.00 64.05 61.46 2qil n THR 150 Cb 0.51 0.73 0.02 0.00 -2.10 0.00 0.00 70.33 69.49 2qil n THR 150 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2qil s GLY 151 N -0.56 0.30 0.00 3.38 0.00 -1.02 -4.26 107.32 105.15 2qil s GLY 151 Ca 0.01 -0.67 0.00 0.00 0.00 0.00 0.00 44.72 44.06 2qil s GLY 151 CO 0.00 -0.13 0.00 0.61 0.00 0.00 0.00 173.10 173.58 2qil n GLY 152 N -0.53 0.66 3.79 0.20 0.00 -1.26 -0.71 105.19 107.34 2qil n GLY 152 Ca -0.08 -1.67 -0.04 0.00 0.00 0.00 0.00 46.02 44.23 2qil n GLY 152 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2qil s TYR 153 N -3.32 -0.13 0.07 1.61 1.13 -0.86 -1.68 117.35 114.16 2qil s TYR 153 Ca 0.00 -0.22 0.06 0.00 -1.41 0.00 0.00 57.07 55.50 2qil s TYR 153 Cb 0.00 0.66 -0.03 0.00 -1.10 0.00 0.00 41.96 41.49 2qil s TYR 153 CO 0.00 -0.95 -0.16 1.67 -2.51 0.00 0.00 175.55 173.60 2qil s TRP 154 N -3.41 1.40 -0.04 -3.49 1.48 -0.99 -1.29 118.94 112.61 2qil s TRP 154 Ca 0.12 -0.42 -0.01 0.00 -1.06 0.00 0.00 56.10 54.73 2qil s TRP 154 Cb -0.03 -0.79 0.03 0.00 -1.16 0.00 0.00 33.47 31.52 2qil s TRP 154 CO 0.04 0.09 0.09 0.21 -4.06 0.00 0.00 176.95 173.31 2qil s LYS 155 N -1.59 0.03 -0.17 3.25 2.20 0.50 -2.14 119.74 121.81 2qil s LYS 155 Ca 0.02 0.27 -0.06 0.00 -0.36 0.00 0.00 55.97 55.84 2qil s LYS 155 Cb -0.09 -0.20 -0.03 0.00 -1.51 0.00 0.00 37.83 35.99 2qil s LYS 155 CO 0.02 -0.16 0.01 0.42 -0.36 0.00 0.00 175.35 175.29 2qil s ILE 156 N 1.06 4.31 -0.19 5.43 1.01 0.10 -1.00 121.20 131.93 2qil s ILE 156 Ca -0.09 -0.20 -0.01 0.00 0.00 0.00 0.00 60.65 60.35 2qil s ILE 156 Cb -0.12 -2.93 -0.00 0.00 0.01 0.00 0.00 42.46 39.43 2qil s ILE 156 CO -0.04 0.47 -0.12 -0.89 0.00 0.00 0.00 174.94 174.36 2qil s THR 157 N 0.46 2.85 0.70 2.92 2.01 -0.49 -0.80 115.64 123.28 2qil s THR 157 Ca -0.00 -0.69 -0.09 0.00 0.31 0.00 0.00 61.69 61.22 2qil s THR 157 Cb -0.13 -2.24 0.04 0.00 0.01 0.00 0.00 72.50 70.17 2qil s THR 157 CO 0.02 0.48 1.05 -0.04 -0.69 0.00 0.00 174.62 175.44 2qil s MET 158 N 1.15 2.56 0.37 4.92 1.00 0.26 -0.58 119.30 128.98 2qil s MET 158 Ca 0.01 0.14 0.08 0.00 0.00 0.00 0.00 55.69 55.92 2qil s MET 158 Cb -0.14 -2.10 0.79 0.00 0.00 0.00 0.00 34.83 33.38 2qil s MET 158 CO -0.04 -1.11 1.94 -0.91 0.00 0.00 0.00 175.02 174.89 2qil h ASN 159 N -0.61 0.63 0.00 3.03 2.35 -1.49 -1.41 115.58 118.08 2qil h ASN 159 Ca -0.45 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 2qil h ASN 159 Cb 1.28 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 39.53 2qil h ASN 159 CO 0.63 0.38 0.00 -0.90 -1.65 0.00 0.00 177.43 175.89 2qil n ASP 160 N -4.50 0.00 0.00 5.81 5.75 -1.26 -4.90 116.55 117.46 2qil n ASP 160 Ca 0.12 -1.01 0.00 0.00 -0.01 0.00 0.00 54.79 53.89 2qil n ASP 160 Cb 0.31 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.40 2qil n ASP 160 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2qil n GLY 161 N 0.97 0.70 3.72 6.12 0.00 -0.53 -5.07 105.19 111.10 2qil n GLY 161 Ca 0.23 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.90 2qil n GLY 161 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qil s SER 162 N -1.94 4.32 0.14 1.61 0.01 -1.26 -4.71 113.70 111.87 2qil s SER 162 Ca 0.00 2.49 0.01 0.00 1.31 0.00 0.00 55.95 59.76 2qil s SER 162 Cb 0.00 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.58 2qil s SER 162 CO 0.00 -2.19 -0.02 0.42 0.41 0.00 0.00 173.24 171.86 2qil s THR 163 N -1.72 0.62 -0.00 1.44 -4.23 -1.26 -0.58 115.64 109.92 2qil s THR 163 Ca 0.78 -1.95 0.00 0.00 -1.18 0.00 0.00 61.69 59.34 2qil s THR 163 Cb -0.33 -1.93 -0.00 0.00 1.34 0.00 0.00 72.50 71.58 2qil s THR 163 CO 0.43 -0.64 -0.01 -0.31 -0.54 0.00 0.00 174.62 173.54 2qil s TYR 164 N -3.69 0.12 0.04 3.99 2.02 0.02 -4.97 117.35 114.89 2qil s TYR 164 Ca 0.19 -0.04 -0.10 0.00 -0.37 0.00 0.00 57.07 56.75 2qil s TYR 164 Cb 0.06 -0.08 0.01 0.00 -0.40 0.00 0.00 41.96 41.55 2qil s TYR 164 CO 0.00 -0.01 0.22 -1.14 -1.57 0.00 0.00 175.55 173.06 2qil s GLN 165 N -0.07 0.72 -0.00 -0.62 0.74 -1.26 0.03 119.66 119.19 2qil s GLN 165 Ca 0.00 -0.60 -0.03 0.00 0.05 0.00 0.00 55.36 54.79 2qil s GLN 165 Cb -0.01 0.30 -0.00 0.00 1.10 0.00 0.00 33.01 34.40 2qil s GLN 165 CO -0.00 -0.21 0.05 0.45 -0.55 0.00 0.00 175.29 175.02 2qil s SER 166 N -2.08 0.06 -0.20 6.67 0.15 -0.91 -4.99 113.70 112.40 2qil s SER 166 Ca -0.05 -0.16 -0.22 0.00 0.70 0.00 0.00 55.95 56.22 2qil s SER 166 Cb -0.01 0.14 -0.02 0.00 -1.71 0.00 0.00 66.02 64.42 2qil s SER 166 CO -0.04 -0.20 0.69 -0.62 1.20 0.00 0.00 173.24 174.27 2qil s ASP 167 N -0.81 6.74 0.16 5.45 2.15 -1.26 -2.33 116.67 126.77 2qil s ASP 167 Ca -0.09 0.91 0.20 0.00 0.43 0.00 0.00 52.55 54.00 2qil s ASP 167 Cb -0.05 -2.38 0.84 0.00 -0.30 0.00 0.00 42.92 41.03 2qil s ASP 167 CO 0.00 -0.34 1.62 0.18 -0.17 0.00 0.00 175.17 176.46 2qil n LEU 168 N 5.27 0.42 -0.17 -1.34 4.77 -0.68 -2.85 117.00 122.42 2qil n LEU 168 Ca 0.01 0.60 0.14 0.00 -0.03 0.00 0.00 56.01 56.73 2qil n LEU 168 Cb 0.49 -0.54 0.58 0.00 -2.33 0.00 0.00 43.42 41.62 2qil n LEU 168 CO 0.45 -0.44 0.85 -1.54 -1.33 0.00 0.00 177.39 175.38 2qil n SER 169 N -1.96 0.66 -4.33 -1.43 3.41 -1.26 -4.74 113.62 103.96 2qil n SER 169 Ca 0.03 -0.77 -0.17 0.00 -0.26 0.00 0.00 58.87 57.69 2qil n SER 169 Cb 0.21 -0.02 -0.10 0.00 -0.26 0.00 0.00 64.21 64.03 2qil n SER 169 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2qil s LYS 170 N -2.39 1.35 0.61 4.33 1.02 -1.13 -4.92 119.74 118.61 2qil s LYS 170 Ca 0.30 -1.69 -0.14 0.00 0.02 0.00 0.00 55.97 54.47 2qil s LYS 170 Cb 0.20 -0.60 -0.03 0.00 -0.52 0.00 0.00 37.83 36.88 2qil s LYS 170 CO 0.46 -0.11 1.04 0.21 -0.92 0.00 0.00 175.35 176.03 2qil s LYS 171 N -3.87 3.35 0.26 1.68 2.20 -1.26 -4.85 119.74 117.25 2qil s LYS 171 Ca 0.29 1.05 -0.30 0.00 -0.36 0.00 0.00 55.97 56.65 2qil s LYS 171 Cb 0.06 -2.04 -0.14 0.00 -1.51 0.00 0.00 37.83 34.20 2qil s LYS 171 CO 0.09 -0.77 1.23 0.34 -0.36 0.00 0.00 175.35 175.88 2qil n PHE 172 N -2.31 1.78 -2.59 4.03 7.35 -1.26 -4.85 117.46 119.61 2qil n PHE 172 Ca 0.08 0.57 -0.43 0.00 -0.76 0.00 0.00 57.45 56.92 2qil n PHE 172 Cb 0.53 -2.36 -0.01 0.00 0.35 0.00 0.00 39.48 38.00 2qil n PHE 172 CO 0.00 0.00 0.00 -2.00 -0.76 0.00 0.00 176.76 174.00 2qil s GLU 173 N -0.98 3.91 0.52 -4.13 2.12 -1.26 -4.81 118.70 114.07 2qil s GLU 173 Ca 0.64 -1.85 0.18 0.00 0.36 0.00 0.00 54.97 54.30 2qil s GLU 173 Cb -0.69 -5.49 1.31 0.00 0.26 0.00 0.00 34.13 29.52 2qil s GLU 173 CO 0.55 -2.23 2.14 1.88 -0.54 0.00 0.00 175.26 177.06 2qil h TYR 174 N 7.99 0.00 0.00 5.30 0.05 -2.00 -2.61 116.97 125.71 2qil h TYR 174 Ca 0.40 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.18 2qil h TYR 174 Cb 0.90 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.64 2qil h TYR 174 CO 1.39 0.03 0.00 0.27 -1.05 0.00 0.00 178.16 178.80 2qil n ASN 175 N -4.40 0.23 -0.22 3.88 6.94 -1.26 -2.82 115.26 117.61 2qil n ASN 175 Ca -0.03 0.56 0.04 0.00 -0.02 0.00 0.00 54.58 55.13 2qil n ASN 175 Cb 0.11 -0.61 0.05 0.00 -2.36 0.00 0.00 39.78 36.97 2qil n ASN 175 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 2qil n THR 176 N -1.76 0.79 -1.68 5.53 -2.24 -0.99 -4.21 114.28 109.72 2qil n THR 176 Ca 0.02 -0.92 -0.44 0.00 -2.27 0.00 0.00 64.05 60.44 2qil n THR 176 Cb 0.16 0.30 -0.02 0.00 -2.10 0.00 0.00 70.33 68.67 2qil n THR 176 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2qil n GLU 177 N -0.57 2.06 -2.70 -0.78 2.13 -1.13 -4.92 120.64 114.74 2qil n GLU 177 Ca 0.06 0.73 -0.23 0.00 0.66 0.00 0.00 57.16 58.38 2qil n GLU 177 Cb 0.60 -2.39 0.03 0.00 0.27 0.00 0.00 31.44 29.95 2qil n GLU 177 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2qil s LYS 178 N -0.55 2.80 0.82 5.31 -0.14 -1.26 -3.40 119.74 123.32 2qil s LYS 178 Ca 0.67 -0.47 -0.13 0.00 -1.36 0.00 0.00 55.97 54.68 2qil s LYS 178 Cb -0.64 -2.45 0.09 0.00 -1.68 0.00 0.00 37.83 33.16 2qil s LYS 178 CO 0.51 -0.57 1.20 -2.30 -0.76 0.00 0.00 175.35 173.43 2qil n PRO 179 N -2.33 0.10 -1.64 -1.68 -0.02 -1.24 -4.61 135.00 123.58 2qil n PRO 179 Ca 0.05 0.11 -0.37 0.00 -2.02 0.00 0.00 63.50 61.27 2qil n PRO 179 Cb 0.58 -2.44 0.07 0.00 -0.02 0.00 0.00 33.50 31.70 2qil n PRO 179 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2qil n PRO 180 N -3.42 0.95 -4.46 0.52 -0.02 -1.26 -4.68 135.00 122.64 2qil n PRO 180 Ca 0.13 0.38 -0.24 0.00 -2.02 0.00 0.00 63.50 61.75 2qil n PRO 180 Cb 0.51 -2.39 -0.10 0.00 -0.02 0.00 0.00 33.50 31.50 2qil n PRO 180 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 2qil s ILE 181 N -1.49 2.54 -0.34 4.25 -4.36 -0.74 -4.90 121.20 116.16 2qil s ILE 181 Ca 0.80 -2.27 -0.24 0.00 -0.26 0.00 0.00 60.65 58.68 2qil s ILE 181 Cb -0.38 -2.49 0.01 0.00 1.25 0.00 0.00 42.46 40.84 2qil s ILE 181 CO 0.43 -0.33 0.80 0.20 0.24 0.00 0.00 174.94 176.29 2qil s ASN 182 N -3.57 6.62 0.58 4.36 0.01 -1.26 -1.69 114.94 119.99 2qil s ASN 182 Ca 0.31 0.52 0.37 0.00 -0.71 0.00 0.00 52.86 53.35 2qil s ASN 182 Cb -0.03 -2.41 1.73 0.00 0.41 0.00 0.00 41.25 40.95 2qil s ASN 182 CO 0.16 -0.70 2.11 0.16 -1.51 0.00 0.00 177.10 177.33 2qil h ILE 183 N 5.69 0.00 0.00 0.60 3.07 -1.65 -1.59 117.51 123.63 2qil h ILE 183 Ca -0.24 -0.32 0.00 0.00 1.55 0.00 0.00 64.86 65.85 2qil h ILE 183 Cb 1.09 1.30 0.00 0.00 -0.27 0.00 0.00 36.82 38.94 2qil h ILE 183 CO 0.91 0.00 0.00 -0.90 -1.05 0.00 0.00 178.15 177.11 2qil n ASP 184 N -3.05 0.00 -0.70 2.16 5.75 -1.26 -2.56 116.55 116.89 2qil n ASP 184 Ca -0.01 -0.35 0.07 0.00 -0.01 0.00 0.00 54.79 54.49 2qil n ASP 184 Cb 0.22 -0.13 0.14 0.00 -1.03 0.00 0.00 41.12 40.31 2qil n ASP 184 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2qil n GLU 185 N -1.13 2.09 -2.66 0.11 1.02 -0.60 -4.96 120.64 114.51 2qil n GLU 185 Ca 0.13 -1.85 -0.42 0.00 -0.02 0.00 0.00 57.16 55.00 2qil n GLU 185 Cb 0.11 -1.31 -0.03 0.00 -0.02 0.00 0.00 31.44 30.20 2qil n GLU 185 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2qil s ILE 186 N -1.06 4.73 -0.18 -3.67 1.01 -1.06 -1.23 121.20 119.74 2qil s ILE 186 Ca 0.24 1.97 -0.17 0.00 0.00 0.00 0.00 60.65 62.69 2qil s ILE 186 Cb 0.14 -4.26 -0.14 0.00 0.01 0.00 0.00 42.46 38.21 2qil s ILE 186 CO 0.19 0.12 0.13 0.50 0.00 0.00 0.00 174.94 175.87 2qil h LYS 187 N 6.89 0.00 -3.44 2.79 3.64 -1.09 -3.45 116.57 121.91 2qil h LYS 187 Ca -0.39 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 58.89 2qil h LYS 187 Cb 1.20 0.00 -0.17 0.00 -0.41 0.00 0.00 32.23 32.85 2qil h LYS 187 CO 0.78 0.65 -0.31 0.95 -2.27 0.00 0.00 179.45 179.25 2qil s THR 188 N -2.28 0.10 -0.10 1.00 -4.23 -1.11 -4.84 115.64 104.18 2qil s THR 188 Ca -0.23 -0.79 0.01 0.00 -1.18 0.00 0.00 61.69 59.50 2qil s THR 188 Cb 0.04 -0.95 0.02 0.00 1.34 0.00 0.00 72.50 72.95 2qil s THR 188 CO 0.46 -0.44 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.36 2qil s ILE 189 N -2.63 1.23 -0.02 2.99 1.01 -0.38 -1.40 121.20 121.99 2qil s ILE 189 Ca -0.04 -0.47 0.08 0.00 0.00 0.00 0.00 60.65 60.22 2qil s ILE 189 Cb -0.01 -1.17 -0.02 0.00 0.01 0.00 0.00 42.46 41.28 2qil s ILE 189 CO -0.04 0.39 -0.25 -1.61 0.00 0.00 0.00 174.94 173.43 2qil s GLU 190 N 1.20 2.08 0.00 2.79 2.02 -0.17 -1.79 118.70 124.83 2qil s GLU 190 Ca -0.04 -0.90 0.03 0.00 0.02 0.00 0.00 54.97 54.08 2qil s GLU 190 Cb -0.14 -1.99 -0.01 0.00 0.10 0.00 0.00 34.13 32.09 2qil s GLU 190 CO -0.03 0.53 -0.08 0.00 0.02 0.00 0.00 175.26 175.70 2qil s ALA 191 N -0.56 0.66 -0.03 5.21 0.00 -0.43 -0.37 121.76 126.25 2qil s ALA 191 Ca 0.09 -0.40 -0.01 0.00 0.00 0.00 0.00 51.96 51.64 2qil s ALA 191 Cb -0.10 -0.14 0.03 0.00 0.00 0.00 0.00 23.12 22.91 2qil s ALA 191 CO -0.01 0.14 0.05 -2.00 0.00 0.00 0.00 175.76 173.95 2qil s GLU 192 N -0.36 -0.04 -0.11 0.00 2.12 -0.41 -1.99 118.70 117.91 2qil s GLU 192 Ca 0.02 0.26 -0.05 0.00 0.36 0.00 0.00 54.97 55.56 2qil s GLU 192 Cb -0.04 -0.31 -0.04 0.00 0.26 0.00 0.00 34.13 34.00 2qil s GLU 192 CO -0.00 -0.22 0.09 0.42 -0.54 0.00 0.00 175.26 175.01 2qil s ILE 193 N 1.40 5.08 0.00 -3.70 1.01 -0.67 -2.03 121.20 122.30 2qil s ILE 193 Ca -0.05 0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.65 2qil s ILE 193 Cb -0.13 -3.20 0.00 0.00 0.01 0.00 0.00 42.46 39.15 2qil s ILE 193 CO -0.03 0.61 0.32 0.59 0.00 0.00 0.00 174.94 176.43