#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wqk s THR 3 N 0.00 0.64 -0.05 3.45 2.01 -1.26 -0.89 115.64 119.54 2wqk s THR 3 Ca 0.00 -0.27 0.05 0.00 0.31 0.00 0.00 61.69 61.78 2wqk s THR 3 Cb 0.00 -0.58 -0.02 0.00 0.01 0.00 0.00 72.50 71.91 2wqk s THR 3 CO 0.00 0.21 -0.21 -0.36 -0.69 0.00 0.00 174.62 173.57 2wqk s PHE 4 N 0.27 2.52 -0.31 4.92 0.08 0.34 -0.23 117.98 125.56 2wqk s PHE 4 Ca -0.04 -0.47 -0.11 0.00 0.12 0.00 0.00 56.93 56.43 2wqk s PHE 4 Cb -0.08 -1.60 -0.03 0.00 -0.57 0.00 0.00 43.02 40.74 2wqk s PHE 4 CO 0.00 -0.05 0.19 -1.17 -0.10 0.00 0.00 175.22 174.10 2wqk s LEU 5 N -0.41 4.20 -0.17 -0.37 2.96 -0.58 -0.61 118.68 123.70 2wqk s LEU 5 Ca 0.04 -0.30 -0.01 0.00 -0.22 0.00 0.00 54.13 53.64 2wqk s LEU 5 Cb -0.12 -2.09 -0.00 0.00 0.50 0.00 0.00 46.19 44.48 2wqk s LEU 5 CO 0.02 -0.16 -0.13 -0.22 -1.32 0.00 0.00 176.35 174.54 2wqk s LEU 6 N 1.70 2.55 0.34 -0.68 2.96 0.05 -0.71 118.68 124.89 2wqk s LEU 6 Ca 0.06 -0.47 0.04 0.00 -0.22 0.00 0.00 54.13 53.54 2wqk s LEU 6 Cb -0.17 -1.60 -0.06 0.00 0.50 0.00 0.00 46.19 44.86 2wqk s LEU 6 CO 0.09 0.05 0.06 0.68 -1.32 0.00 0.00 176.35 175.92 2wqk s VAL 7 N 1.02 1.18 0.17 1.68 -7.23 -0.19 -1.39 120.40 115.64 2wqk s VAL 7 Ca -0.01 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.12 2wqk s VAL 7 Cb -0.15 -2.75 0.02 0.00 0.56 0.00 0.00 36.38 34.06 2wqk s VAL 7 CO -0.03 0.00 0.29 -0.46 -0.31 0.00 0.00 175.10 174.59 2wqk n ASN 8 N -0.78 -0.82 -0.00 4.85 6.94 -1.26 -1.25 115.26 122.94 2wqk n ASN 8 Ca -0.03 -1.78 0.03 0.00 -0.02 0.00 0.00 54.58 52.78 2wqk n ASN 8 Cb 0.66 1.42 -0.03 0.00 -2.36 0.00 0.00 39.78 39.48 2wqk n ASN 8 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 2wqk n ASP 9 N -1.56 1.08 0.05 0.53 2.03 -1.26 -4.37 116.55 113.04 2wqk n ASP 9 Ca -0.02 -0.48 0.12 0.00 0.52 0.00 0.00 54.79 54.93 2wqk n ASP 9 Cb 0.26 1.06 0.09 0.00 -0.72 0.00 0.00 41.12 41.81 2wqk n ASP 9 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2wqk n ASP 10 N -1.26 0.65 0.00 1.67 8.00 -1.26 -0.93 116.55 123.42 2wqk n ASP 10 Ca 0.01 -0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.48 2wqk n ASP 10 Cb 0.10 0.51 0.00 0.00 -0.02 0.00 0.00 41.12 41.70 2wqk n ASP 10 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wqk n GLY 11 N 1.34 3.19 0.30 0.44 0.00 -1.24 -3.24 105.19 105.98 2wqk n GLY 11 Ca 0.02 -1.79 0.18 0.00 0.00 0.00 0.00 46.02 44.44 2wqk n GLY 11 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 2wqk h TYR 12 N 0.00 0.00 -0.01 1.61 -0.00 -1.18 -2.10 116.97 115.29 2wqk h TYR 12 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 2wqk h TYR 12 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.73 2wqk h TYR 12 CO 0.00 0.03 -0.19 1.97 -0.00 0.00 0.00 178.16 179.97 2wqk n PHE 13 N -3.26 0.00 -2.20 0.10 1.16 -1.26 -4.71 117.46 107.28 2wqk n PHE 13 Ca -0.02 0.00 -0.37 0.00 -1.87 0.00 0.00 57.45 55.19 2wqk n PHE 13 Cb 0.18 -0.11 -0.00 0.00 -1.61 0.00 0.00 39.48 37.93 2wqk n PHE 13 CO 0.00 0.00 0.00 -1.54 -1.87 0.00 0.00 176.76 173.35 2wqk s SER 14 N -2.42 6.07 0.52 5.98 1.04 -0.79 -4.90 113.70 119.20 2wqk s SER 14 Ca 0.27 2.36 0.17 0.00 0.48 0.00 0.00 55.95 59.23 2wqk s SER 14 Cb 0.20 -2.61 1.29 0.00 0.10 0.00 0.00 66.02 65.00 2wqk s SER 14 CO 0.48 -0.99 2.15 1.55 0.98 0.00 0.00 173.24 177.42 2wqk h PRO 15 N 1.99 0.00 -0.27 4.02 0.13 -1.93 -2.68 132.00 133.25 2wqk h PRO 15 Ca -0.49 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.53 2wqk h PRO 15 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 2wqk h PRO 15 CO 0.60 0.00 -0.22 0.78 -0.23 0.00 0.00 178.00 178.93 2wqk h GLY 16 N 0.01 0.69 1.46 1.56 0.00 -1.91 -0.28 103.07 104.60 2wqk h GLY 16 Ca -0.00 -0.68 -0.20 0.00 0.00 0.00 0.00 47.33 46.46 2wqk h GLY 16 CO 0.00 0.61 -0.74 1.19 0.00 0.00 0.00 176.54 177.60 2wqk h ILE 17 N 0.36 1.34 -0.47 2.60 2.10 -1.66 -2.61 117.51 119.18 2wqk h ILE 17 Ca 0.05 -2.08 -0.13 0.00 1.08 0.00 0.00 64.86 63.78 2wqk h ILE 17 Cb 0.77 2.06 -0.01 0.00 -1.09 0.00 0.00 36.82 38.55 2wqk h ILE 17 CO 0.06 0.64 -0.20 0.78 -1.08 0.00 0.00 178.15 178.34 2wqk h ASN 18 N 0.36 0.99 -0.80 2.19 2.35 -1.45 0.02 115.58 119.25 2wqk h ASN 18 Ca -0.04 -0.40 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 2wqk h ASN 18 Cb 1.33 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 39.39 2wqk h ASN 18 CO 0.14 1.16 0.52 0.00 -1.65 0.00 0.00 177.43 177.60 2wqk h ALA 19 N 0.86 1.01 -0.19 -0.83 0.00 -1.04 -1.09 119.26 117.98 2wqk h ALA 19 Ca 0.11 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 2wqk h ALA 19 Cb 0.78 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 2wqk h ALA 19 CO 0.06 0.44 -0.18 1.25 0.00 0.00 0.00 179.25 180.83 2wqk h LEU 20 N 1.09 0.49 -0.32 0.00 5.85 -1.32 -2.32 115.31 118.79 2wqk h LEU 20 Ca 0.29 -0.47 0.07 0.00 0.84 0.00 0.00 57.88 58.61 2wqk h LEU 20 Cb -0.10 -0.14 -0.08 0.00 0.37 0.00 0.00 40.66 40.71 2wqk h LEU 20 CO -0.06 0.86 -0.26 -0.09 -0.34 0.00 0.00 178.44 178.55 2wqk h ARG 21 N 0.13 -0.22 -0.13 1.25 2.43 -0.81 -1.02 114.38 116.01 2wqk h ARG 21 Ca 0.03 0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.24 2wqk h ARG 21 Cb 0.71 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.29 2wqk h ARG 21 CO 0.04 -0.15 0.00 1.49 -1.51 0.00 0.00 179.97 179.85 2wqk h GLU 22 N -0.23 0.05 -0.57 0.20 4.57 -1.11 -2.74 114.58 114.75 2wqk h GLU 22 Ca 0.16 -0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.30 2wqk h GLU 22 Cb 0.48 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.03 2wqk h GLU 22 CO -0.45 0.03 0.20 0.00 -1.18 0.00 0.00 179.01 177.61 2wqk h ALA 23 N 1.11 1.28 0.00 2.92 0.00 -1.21 -2.99 119.26 120.37 2wqk h ALA 23 Ca 0.06 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2wqk h ALA 23 Cb 0.07 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2wqk h ALA 23 CO -0.10 0.52 0.00 -0.07 0.00 0.00 0.00 179.25 179.60 2wqk h LEU 24 N 0.83 0.00 -1.81 0.00 3.38 -0.89 -3.22 115.31 113.59 2wqk h LEU 24 Ca 0.19 0.00 0.19 0.00 0.09 0.00 0.00 57.88 58.35 2wqk h LEU 24 Cb 0.21 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 2wqk h LEU 24 CO -0.01 0.00 0.51 0.11 0.09 0.00 0.00 178.44 179.14 2wqk h LYS 25 N 0.00 0.17 0.00 1.13 1.57 -1.36 0.11 116.57 118.18 2wqk h LYS 25 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2wqk h LYS 25 Cb 0.58 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2wqk h LYS 25 CO 0.00 0.11 0.00 0.77 -0.57 0.00 0.00 179.45 179.76 2wqk h SER 26 N 0.17 0.00 0.00 0.86 0.02 -1.79 -3.14 113.55 109.67 2wqk h SER 26 Ca 0.36 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.31 2wqk h SER 26 Cb 1.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2wqk h SER 26 CO -0.06 0.00 -1.73 0.18 -1.14 0.00 0.00 176.83 174.07 2wqk n LEU 27 N -2.87 0.12 0.00 5.07 4.77 0.01 -5.10 117.00 119.00 2wqk n LEU 27 Ca -0.00 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 2wqk n LEU 27 Cb 0.20 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 2wqk n LEU 27 CO 0.22 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 2wqk n GLY 28 N 1.42 -0.88 3.66 -0.72 0.00 -1.14 -4.26 105.19 103.26 2wqk n GLY 28 Ca -0.03 -0.92 -0.40 0.00 0.00 0.00 0.00 46.02 44.67 2wqk n GLY 28 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2wqk s ARG 29 N -0.98 4.21 -0.28 1.61 3.52 -0.07 -4.40 118.95 122.56 2wqk s ARG 29 Ca 0.00 0.65 -0.11 0.00 -0.13 0.00 0.00 55.73 56.15 2wqk s ARG 29 Cb 0.00 -3.58 -0.04 0.00 -1.56 0.00 0.00 34.95 29.77 2wqk s ARG 29 CO 0.00 -0.26 0.17 0.08 -0.81 0.00 0.00 175.30 174.49 2wqk s VAL 30 N 1.97 5.09 -0.29 7.11 1.01 -1.26 -0.50 120.40 133.52 2wqk s VAL 30 Ca 0.30 0.02 -0.06 0.00 0.00 0.00 0.00 61.98 62.24 2wqk s VAL 30 Cb -0.16 -3.45 0.02 0.00 0.00 0.00 0.00 36.38 32.78 2wqk s VAL 30 CO 0.10 0.22 0.05 -0.69 0.00 0.00 0.00 175.10 174.78 2wqk s VAL 31 N 1.72 3.70 -0.15 2.92 1.01 0.22 -4.86 120.40 124.96 2wqk s VAL 31 Ca 0.07 -0.81 -0.13 0.00 0.00 0.00 0.00 61.98 61.11 2wqk s VAL 31 Cb -0.16 -2.93 -0.05 0.00 0.00 0.00 0.00 36.38 33.25 2wqk s VAL 31 CO 0.09 0.08 0.26 -0.69 0.00 0.00 0.00 175.10 174.84 2wqk s VAL 32 N 1.45 5.32 -0.11 2.92 1.01 -0.24 -0.77 120.40 129.97 2wqk s VAL 32 Ca 0.02 0.48 -0.02 0.00 0.00 0.00 0.00 61.98 62.45 2wqk s VAL 32 Cb -0.17 -3.59 0.04 0.00 0.00 0.00 0.00 36.38 32.66 2wqk s VAL 32 CO 0.01 0.44 0.03 -0.69 0.00 0.00 0.00 175.10 174.89 2wqk s VAL 33 N 0.18 0.26 0.06 2.92 1.01 -0.48 -0.59 120.40 123.75 2wqk s VAL 33 Ca 0.15 -0.05 -0.05 0.00 0.00 0.00 0.00 61.98 62.03 2wqk s VAL 33 Cb -0.13 -0.60 -0.02 0.00 0.00 0.00 0.00 36.38 35.63 2wqk s VAL 33 CO 0.04 0.04 0.10 0.00 0.00 0.00 0.00 175.10 175.27 2wqk s ALA 34 N 2.00 0.03 0.89 5.51 0.00 -0.76 -4.15 121.76 125.28 2wqk s ALA 34 Ca 0.03 -0.75 -0.10 0.00 0.00 0.00 0.00 51.96 51.14 2wqk s ALA 34 Cb -0.14 0.34 0.13 0.00 0.00 0.00 0.00 23.12 23.45 2wqk s ALA 34 CO -0.06 -0.40 1.12 -2.14 0.00 0.00 0.00 175.76 174.28 2wqk s PRO 35 N -3.42 1.28 0.00 0.00 0.02 -1.26 -1.42 135.00 130.20 2wqk s PRO 35 Ca 0.02 1.37 0.16 0.00 0.02 0.00 0.00 61.00 62.56 2wqk s PRO 35 Cb 0.04 -1.77 0.50 0.00 0.02 0.00 0.00 34.50 33.28 2wqk s PRO 35 CO -0.08 -2.39 1.39 -0.40 -0.33 0.00 0.00 177.00 175.19 2wqk n ASP 36 N -4.05 2.00 -3.62 2.53 5.75 -1.10 -0.72 116.55 117.35 2wqk n ASP 36 Ca 0.10 -1.89 -0.09 0.00 -0.01 0.00 0.00 54.79 52.90 2wqk n ASP 36 Cb 0.53 -0.20 -0.02 0.00 -1.03 0.00 0.00 41.12 40.39 2wqk n ASP 36 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2wqk s ARG 37 N -1.59 1.46 -0.32 0.11 1.70 -1.26 -4.86 118.95 114.19 2wqk s ARG 37 Ca 0.29 -0.68 -0.29 0.00 -0.47 0.00 0.00 55.73 54.58 2wqk s ARG 37 Cb 0.15 0.58 0.01 0.00 -0.57 0.00 0.00 34.95 35.13 2wqk s ARG 37 CO 0.21 -0.66 1.12 1.21 -1.08 0.00 0.00 175.30 176.11 2wqk s ASN 38 N -2.81 6.88 -0.12 -2.89 3.84 -1.20 -3.65 114.94 114.99 2wqk s ASN 38 Ca 0.06 1.08 0.16 0.00 0.21 0.00 0.00 52.86 54.37 2wqk s ASN 38 Cb -0.03 -2.54 0.57 0.00 -0.55 0.00 0.00 41.25 38.70 2wqk s ASN 38 CO -0.04 -0.92 1.49 0.18 -2.79 0.00 0.00 177.10 175.01 2wqk n LEU 39 N 7.02 4.15 -0.30 3.21 4.77 -0.11 -4.69 117.00 131.05 2wqk n LEU 39 Ca 0.13 -2.59 0.07 0.00 -0.03 0.00 0.00 56.01 53.58 2wqk n LEU 39 Cb 0.47 -0.50 0.28 0.00 -2.33 0.00 0.00 43.42 41.34 2wqk n LEU 39 CO 0.60 0.73 1.24 0.28 -1.33 0.00 0.00 177.39 178.91 2wqk h SER 40 N 2.83 0.83 0.15 -1.43 0.02 -1.91 -2.64 113.55 111.40 2wqk h SER 40 Ca 0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2wqk h SER 40 Cb 1.34 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.74 2wqk h SER 40 CO 0.20 0.48 -0.09 0.61 -1.14 0.00 0.00 176.83 176.90 2wqk n GLY 41 N -1.40 -0.55 0.00 -3.77 0.00 -1.26 -4.86 105.19 93.36 2wqk n GLY 41 Ca 0.16 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2wqk n GLY 41 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2wqk n VAL 42 N -0.50 0.00 -2.29 1.61 0.24 -1.00 -5.13 118.33 111.27 2wqk n VAL 42 Ca 0.17 0.00 -0.34 0.00 -2.04 0.00 0.00 64.34 62.13 2wqk n VAL 42 Cb 0.30 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.66 2wqk n VAL 42 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2wqk s GLY 43 N -0.36 2.39 0.00 7.63 0.00 -1.26 -4.98 107.32 110.74 2wqk s GLY 43 Ca 0.00 0.58 0.00 0.00 0.00 0.00 0.00 44.72 45.30 2wqk s GLY 43 CO 0.00 0.90 0.68 1.42 0.00 0.00 0.00 173.10 176.10 2wqk n HIS 44 N -1.44 0.00 -1.36 1.90 -0.00 -1.26 -4.89 115.22 108.16 2wqk n HIS 44 Ca 0.10 -0.22 -0.29 0.00 -0.00 0.00 0.00 57.72 57.31 2wqk n HIS 44 Cb 0.52 -0.02 0.14 0.00 -0.00 0.00 0.00 29.99 30.63 2wqk n HIS 44 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 2wqk s SER 45 N -0.43 3.34 0.14 0.41 1.04 -1.26 -4.31 113.70 112.62 2wqk s SER 45 Ca 0.00 1.17 -0.30 0.00 0.48 0.00 0.00 55.95 57.30 2wqk s SER 45 Cb 0.00 -1.82 -0.07 0.00 0.10 0.00 0.00 66.02 64.23 2wqk s SER 45 CO 0.00 -2.68 1.25 -0.22 0.98 0.00 0.00 173.24 172.57 2wqk s LEU 46 N -6.17 4.41 -0.43 2.42 2.96 -1.26 -4.67 118.68 115.94 2wqk s LEU 46 Ca 0.64 2.21 -0.23 0.00 -0.22 0.00 0.00 54.13 56.53 2wqk s LEU 46 Cb -0.16 -3.59 0.02 0.00 0.50 0.00 0.00 46.19 42.95 2wqk s LEU 46 CO 0.55 -0.47 0.75 -0.89 -1.32 0.00 0.00 176.35 174.98 2wqk s THR 47 N 0.52 4.70 -0.30 3.68 2.01 -1.26 -4.91 115.64 120.08 2wqk s THR 47 Ca 0.57 0.46 0.14 0.00 0.31 0.00 0.00 61.69 63.16 2wqk s THR 47 Cb -0.33 -4.27 -0.18 0.00 0.01 0.00 0.00 72.50 67.72 2wqk s THR 47 CO 0.33 -0.64 0.43 0.49 -0.69 0.00 0.00 174.62 174.54 2wqk n PHE 48 N 6.57 0.00 -0.39 4.92 3.01 -1.26 -4.67 117.46 125.64 2wqk n PHE 48 Ca 0.02 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.48 2wqk n PHE 48 Cb 0.48 -0.17 0.01 0.00 -0.01 0.00 0.00 39.48 39.79 2wqk n PHE 48 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 2wqk n THR 49 N -1.68 0.81 -3.96 4.37 -2.24 -1.26 -4.97 114.28 105.35 2wqk n THR 49 Ca -0.00 -0.84 -0.09 0.00 -2.27 0.00 0.00 64.05 60.85 2wqk n THR 49 Cb 0.29 0.56 -0.10 0.00 -2.10 0.00 0.00 70.33 68.98 2wqk n THR 49 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2wqk s GLU 50 N -0.89 0.50 0.76 -0.78 0.41 -1.26 -5.16 118.70 112.28 2wqk s GLU 50 Ca 0.03 -0.73 -0.11 0.00 -0.41 0.00 0.00 54.97 53.75 2wqk s GLU 50 Cb 0.02 0.19 0.06 0.00 -1.78 0.00 0.00 34.13 32.62 2wqk s GLU 50 CO 0.00 -0.11 1.13 -1.25 -0.49 0.00 0.00 175.26 174.54 2wqk s PRO 51 N -2.30 2.29 -0.05 0.39 0.04 -1.26 -4.96 135.00 129.14 2wqk s PRO 51 Ca -0.08 0.19 0.01 0.00 0.04 0.00 0.00 61.00 61.16 2wqk s PRO 51 Cb -0.03 -2.00 0.02 0.00 0.04 0.00 0.00 34.50 32.53 2wqk s PRO 51 CO -0.03 -1.37 -0.05 -0.51 0.04 0.00 0.00 177.00 175.08 2wqk s LEU 52 N -5.47 1.23 0.18 -3.56 1.43 -1.26 -5.12 118.68 106.12 2wqk s LEU 52 Ca 0.60 -0.15 -0.30 0.00 -1.03 0.00 0.00 54.13 53.26 2wqk s LEU 52 Cb -0.11 -0.50 -0.08 0.00 0.03 0.00 0.00 46.19 45.53 2wqk s LEU 52 CO 0.49 -0.07 0.98 -0.54 0.23 0.00 0.00 176.35 177.44 2wqk s LYS 53 N 1.11 4.75 -0.06 1.70 1.02 -1.26 -4.96 119.74 122.04 2wqk s LYS 53 Ca -0.08 1.53 0.01 0.00 0.02 0.00 0.00 55.97 57.45 2wqk s LYS 53 Cb -0.14 -3.31 0.02 0.00 -0.52 0.00 0.00 37.83 33.88 2wqk s LYS 53 CO -0.01 0.32 -0.06 1.41 -0.92 0.00 0.00 175.35 176.09 2wqk s MET 54 N -0.63 1.11 -0.04 1.68 1.75 -1.26 -0.94 119.30 120.96 2wqk s MET 54 Ca 0.45 -0.18 0.07 0.00 -1.25 0.00 0.00 55.69 54.77 2wqk s MET 54 Cb -0.26 -1.08 -0.02 0.00 2.84 0.00 0.00 34.83 36.32 2wqk s MET 54 CO 0.32 -0.09 -0.25 1.03 -0.65 0.00 0.00 175.02 175.38 2wqk s ARG 55 N 1.03 2.37 -0.22 4.11 1.81 0.18 -4.97 118.95 123.26 2wqk s ARG 55 Ca -0.09 -0.90 -0.23 0.00 -1.72 0.00 0.00 55.73 52.79 2wqk s ARG 55 Cb -0.14 -2.13 -0.01 0.00 -0.45 0.00 0.00 34.95 32.21 2wqk s ARG 55 CO -0.00 0.47 0.74 0.21 -0.68 0.00 0.00 175.30 176.04 2wqk s LYS 56 N -0.39 4.20 -0.11 3.54 2.20 -1.26 -0.96 119.74 126.97 2wqk s LYS 56 Ca 0.03 0.80 -0.04 0.00 -0.36 0.00 0.00 55.97 56.40 2wqk s LYS 56 Cb -0.12 -3.61 -0.26 0.00 -1.51 0.00 0.00 37.83 32.33 2wqk s LYS 56 CO 0.01 -0.38 0.42 -0.89 -0.36 0.00 0.00 175.35 174.16 2wqk n ILE 57 N 4.97 1.77 -3.85 5.43 5.41 0.45 -4.98 119.36 128.56 2wqk n ILE 57 Ca 0.02 -0.68 -0.06 0.00 1.00 0.00 0.00 62.75 63.04 2wqk n ILE 57 Cb 0.49 -1.66 0.02 0.00 -0.71 0.00 0.00 39.64 37.78 2wqk n ILE 57 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2wqk s ASP 58 N -6.94 0.02 0.16 4.38 -1.08 -0.93 -5.03 116.67 107.24 2wqk s ASP 58 Ca -0.20 -0.94 -0.34 0.00 -0.52 0.00 0.00 52.55 50.55 2wqk s ASP 58 Cb 0.07 0.69 -0.14 0.00 -1.46 0.00 0.00 42.92 42.07 2wqk s ASP 58 CO 0.78 -1.37 1.52 0.35 0.52 0.00 0.00 175.17 176.98 2wqk n THR 59 N -0.62 0.09 -2.24 1.71 -2.24 -1.26 -1.32 114.28 108.40 2wqk n THR 59 Ca -0.06 -0.02 -0.18 0.00 -2.27 0.00 0.00 64.05 61.52 2wqk n THR 59 Cb 0.60 -1.41 -0.02 0.00 -2.10 0.00 0.00 70.33 67.39 2wqk n THR 59 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2wqk n ASP 60 N 3.16 -5.16 -3.52 3.42 8.00 -1.26 -4.94 116.55 116.26 2wqk n ASP 60 Ca 0.17 0.13 -0.22 0.00 0.71 0.00 0.00 54.79 55.58 2wqk n ASP 60 Cb 0.27 -4.37 -0.14 0.00 -0.02 0.00 0.00 41.12 36.86 2wqk n ASP 60 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2wqk s PHE 61 N -2.83 -0.10 0.10 1.24 5.36 -0.43 -1.08 117.98 120.24 2wqk s PHE 61 Ca 0.00 -0.11 0.07 0.00 -0.96 0.00 0.00 56.93 55.93 2wqk s PHE 61 Cb 0.00 -0.53 -0.03 0.00 -0.34 0.00 0.00 43.02 42.11 2wqk s PHE 61 CO 0.00 -0.65 -0.18 0.71 -1.46 0.00 0.00 175.22 173.64 2wqk s TYR 62 N 2.25 1.56 0.05 10.12 2.02 0.24 -0.41 117.35 133.18 2wqk s TYR 62 Ca 0.06 -0.45 0.08 0.00 -0.37 0.00 0.00 57.07 56.39 2wqk s TYR 62 Cb -0.16 -0.85 -0.03 0.00 -0.40 0.00 0.00 41.96 40.53 2wqk s TYR 62 CO -0.17 0.16 -0.23 -0.08 -1.57 0.00 0.00 175.55 173.66 2wqk s THR 63 N -1.39 1.88 -0.27 -0.71 -1.32 -0.13 -1.83 115.64 111.87 2wqk s THR 63 Ca 0.05 -1.29 -0.07 0.00 -1.21 0.00 0.00 61.69 59.16 2wqk s THR 63 Cb -0.09 -1.62 -0.01 0.00 -1.51 0.00 0.00 72.50 69.26 2wqk s THR 63 CO 0.04 0.27 0.07 -0.69 -2.21 0.00 0.00 174.62 172.10 2wqk s VAL 64 N -0.81 4.18 -0.20 5.08 1.01 -0.51 -0.65 120.40 128.50 2wqk s VAL 64 Ca 0.09 -0.37 -0.29 0.00 0.00 0.00 0.00 61.98 61.41 2wqk s VAL 64 Cb -0.09 -3.03 -0.02 0.00 0.00 0.00 0.00 36.38 33.24 2wqk s VAL 64 CO 0.02 0.24 1.50 -0.63 0.00 0.00 0.00 175.10 176.23 2wqk s ILE 65 N 1.57 3.87 -1.66 2.22 -1.09 -0.12 -2.00 121.20 123.99 2wqk s ILE 65 Ca 0.05 1.00 0.00 0.00 -2.23 0.00 0.00 60.65 59.47 2wqk s ILE 65 Cb -0.16 -3.81 0.00 0.00 -1.58 0.00 0.00 42.46 36.91 2wqk s ILE 65 CO 0.03 -0.27 0.00 -0.67 -1.23 0.00 0.00 174.94 172.80 2wqk n ASP 66 N 7.79 -5.33 -4.74 3.58 2.03 -1.26 -4.47 116.55 114.14 2wqk n ASP 66 Ca 0.17 0.11 -0.39 0.00 0.52 0.00 0.00 54.79 55.19 2wqk n ASP 66 Cb 0.45 -4.50 -0.05 0.00 -0.72 0.00 0.00 41.12 36.30 2wqk n ASP 66 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2wqk s GLY 67 N -2.13 2.65 0.79 0.27 0.00 -0.85 -5.05 107.32 103.00 2wqk s GLY 67 Ca 0.00 0.12 -0.11 0.00 0.00 0.00 0.00 44.72 44.73 2wqk s GLY 67 CO 0.00 1.00 1.09 -0.51 0.00 0.00 0.00 173.10 174.67 2wqk s THR 68 N 0.26 3.24 0.30 0.90 -4.23 -1.26 -4.29 115.64 110.56 2wqk s THR 68 Ca 0.35 0.40 0.05 0.00 -1.18 0.00 0.00 61.69 61.32 2wqk s THR 68 Cb -0.18 -3.01 0.29 0.00 1.34 0.00 0.00 72.50 70.93 2wqk s THR 68 CO 0.19 -0.53 1.75 -0.65 -0.54 0.00 0.00 174.62 174.83 2wqk h PRO 69 N -1.14 0.60 -0.36 3.99 0.11 -1.82 0.01 132.00 133.39 2wqk h PRO 69 Ca -0.46 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.64 2wqk h PRO 69 Cb 1.25 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 2wqk h PRO 69 CO 0.55 0.40 0.17 0.00 -0.21 0.00 0.00 178.00 178.91 2wqk h ALA 70 N 1.66 0.44 -0.54 -0.75 0.00 -1.86 0.27 119.26 118.49 2wqk h ALA 70 Ca 0.57 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.53 2wqk h ALA 70 Cb 0.97 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 2wqk h ALA 70 CO -0.43 -0.20 0.32 -0.44 0.00 0.00 0.00 179.25 178.49 2wqk h ASP 71 N 0.35 0.51 -0.49 0.00 3.32 -1.45 -1.34 116.42 117.32 2wqk h ASP 71 Ca 0.16 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.21 2wqk h ASP 71 Cb 0.08 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 2wqk h ASP 71 CO -0.12 0.36 0.31 0.00 -1.72 0.00 0.00 179.24 178.07 2wqk h VAL 73 N 0.66 1.13 -0.33 0.00 2.07 -0.63 0.17 116.25 119.31 2wqk h VAL 73 Ca 0.18 -0.37 -0.11 0.00 0.82 0.00 0.00 66.70 67.22 2wqk h VAL 73 Cb -0.03 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 2wqk h VAL 73 CO -0.03 0.13 -0.23 0.45 0.02 0.00 0.00 177.57 177.91 2wqk h HIS 74 N 0.23 0.87 -0.34 1.57 -0.00 -1.05 -0.61 115.15 115.82 2wqk h HIS 74 Ca 0.08 -0.24 -0.15 0.00 -0.00 0.00 0.00 60.37 60.06 2wqk h HIS 74 Cb 0.10 -0.19 -0.01 0.00 -0.00 0.00 0.00 27.41 27.31 2wqk h HIS 74 CO -0.03 0.98 -0.38 -0.07 -0.00 0.00 0.00 177.93 178.43 2wqk h LEU 75 N 0.52 0.86 -0.62 2.43 3.38 -0.78 -0.79 115.31 120.31 2wqk h LEU 75 Ca 0.07 -0.38 0.05 0.00 0.09 0.00 0.00 57.88 57.70 2wqk h LEU 75 Cb 0.78 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.24 2wqk h LEU 75 CO 0.06 1.14 0.34 1.23 0.09 0.00 0.00 178.44 181.30 2wqk h GLY 76 N 0.89 0.90 0.31 0.83 0.00 -0.49 0.58 103.07 106.08 2wqk h GLY 76 Ca 0.06 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 2wqk h GLY 76 CO 0.09 0.15 -0.01 -1.82 0.00 0.00 0.00 176.54 174.95 2wqk h TYR 77 N 0.64 0.01 0.18 5.60 3.20 -1.01 0.68 116.97 126.27 2wqk h TYR 77 Ca 0.27 -0.01 -0.30 0.00 3.14 0.00 0.00 58.73 61.84 2wqk h TYR 77 Cb 0.15 -0.00 0.02 0.00 1.54 0.00 0.00 36.73 38.44 2wqk h TYR 77 CO -0.08 0.71 -1.33 0.00 -1.64 0.00 0.00 178.16 175.82 2wqk h ARG 78 N -0.69 0.42 0.00 1.82 3.08 -1.13 0.11 114.38 117.99 2wqk h ARG 78 Ca -0.00 -0.69 0.00 0.00 0.07 0.00 0.00 59.98 59.36 2wqk h ARG 78 Cb 0.72 0.25 0.00 0.00 0.08 0.00 0.00 29.97 31.02 2wqk h ARG 78 CO 0.00 1.32 -0.78 0.28 -1.07 0.00 0.00 179.97 179.72 2wqk n VAL 79 N -3.64 1.35 -0.04 2.04 0.31 0.15 -3.62 118.33 114.89 2wqk n VAL 79 Ca -0.12 0.19 -0.12 0.00 -0.01 0.00 0.00 64.34 64.28 2wqk n VAL 79 Cb 1.05 -2.29 -0.07 0.00 -0.91 0.00 0.00 33.84 31.62 2wqk n VAL 79 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2wqk h ILE 80 N -0.91 1.31 -0.09 2.52 1.08 -1.24 -2.82 117.51 117.36 2wqk h ILE 80 Ca 0.00 -1.03 0.00 0.00 -0.39 0.00 0.00 64.86 63.44 2wqk h ILE 80 Cb 0.78 1.75 0.00 0.00 -3.07 0.00 0.00 36.82 36.29 2wqk h ILE 80 CO 0.00 0.29 0.00 0.18 -0.69 0.00 0.00 178.15 177.93 2wqk n LEU 81 N -4.72 1.42 -3.83 1.44 4.77 0.21 -4.95 117.00 111.33 2wqk n LEU 81 Ca -0.06 -0.54 -0.29 0.00 -0.03 0.00 0.00 56.01 55.09 2wqk n LEU 81 Cb 0.26 -0.05 0.03 0.00 -2.33 0.00 0.00 43.42 41.33 2wqk n LEU 81 CO 0.36 0.27 0.12 -0.62 -1.33 0.00 0.00 177.39 176.20 2wqk n GLU 82 N 0.13 -5.81 -1.40 3.23 1.02 -1.07 -1.31 120.64 115.42 2wqk n GLU 82 Ca 0.18 0.63 -0.14 0.00 -0.02 0.00 0.00 57.16 57.81 2wqk n GLU 82 Cb 0.31 -5.55 -0.06 0.00 -0.02 0.00 0.00 31.44 26.12 2wqk n GLU 82 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2wqk n GLU 83 N -4.69 -1.15 -3.34 3.49 1.02 0.38 -4.98 120.64 111.37 2wqk n GLU 83 Ca 0.04 0.98 -0.41 0.00 -0.02 0.00 0.00 57.16 57.75 2wqk n GLU 83 Cb 0.53 -5.14 -0.09 0.00 -0.02 0.00 0.00 31.44 26.72 2wqk n GLU 83 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2wqk s LYS 84 N -3.12 3.69 0.21 3.49 2.20 -0.43 -5.04 119.74 120.74 2wqk s LYS 84 Ca 0.00 -0.21 -0.31 0.00 -0.36 0.00 0.00 55.97 55.09 2wqk s LYS 84 Cb 0.00 -3.77 -0.11 0.00 -1.51 0.00 0.00 37.83 32.44 2wqk s LYS 84 CO 0.00 -0.51 1.59 0.15 -0.36 0.00 0.00 175.35 176.22 2wqk s LYS 85 N 2.17 4.19 0.96 4.03 1.02 -1.26 -4.87 119.74 125.97 2wqk s LYS 85 Ca 0.15 2.44 -0.13 0.00 0.02 0.00 0.00 55.97 58.45 2wqk s LYS 85 Cb -0.16 -3.11 0.17 0.00 -0.52 0.00 0.00 37.83 34.21 2wqk s LYS 85 CO 0.12 -0.61 1.14 -1.25 -0.92 0.00 0.00 175.35 173.83 2wqk s PRO 86 N 0.63 0.72 0.21 -1.68 0.04 -1.26 -4.97 135.00 128.69 2wqk s PRO 86 Ca 0.68 0.22 -0.04 0.00 0.04 0.00 0.00 61.00 61.90 2wqk s PRO 86 Cb -0.45 -1.80 0.18 0.00 0.04 0.00 0.00 34.50 32.47 2wqk s PRO 86 CO 0.36 -2.47 1.60 -0.44 0.04 0.00 0.00 177.00 176.09 2wqk h ASP 87 N -1.69 0.73 -4.72 6.66 3.32 -1.00 -3.46 116.42 116.26 2wqk h ASP 87 Ca -0.50 -0.29 -0.15 0.00 0.02 0.00 0.00 57.03 56.11 2wqk h ASP 87 Cb 1.32 -0.20 -0.22 0.00 0.22 0.00 0.00 39.33 40.45 2wqk h ASP 87 CO 0.56 0.99 -0.48 -0.76 -1.72 0.00 0.00 179.24 177.84 2wqk s LEU 88 N -8.74 1.44 -0.17 1.55 1.43 -1.22 -4.32 118.68 108.65 2wqk s LEU 88 Ca -0.09 -0.06 -0.07 0.00 -1.03 0.00 0.00 54.13 52.89 2wqk s LEU 88 Cb 0.13 0.71 -0.04 0.00 0.03 0.00 0.00 46.19 47.02 2wqk s LEU 88 CO 0.83 -0.31 0.06 -0.69 0.23 0.00 0.00 176.35 176.48 2wqk s VAL 89 N -1.06 4.80 0.01 -1.59 1.01 -0.61 -1.52 120.40 121.44 2wqk s VAL 89 Ca -0.11 -0.03 0.06 0.00 0.00 0.00 0.00 61.98 61.90 2wqk s VAL 89 Cb -0.06 -3.15 -0.02 0.00 0.00 0.00 0.00 36.38 33.15 2wqk s VAL 89 CO 0.02 0.48 -0.20 -0.76 0.00 0.00 0.00 175.10 174.64 2wqk s LEU 90 N 0.19 2.09 -0.06 3.92 1.43 0.11 -1.57 118.68 124.79 2wqk s LEU 90 Ca 0.04 -0.42 -0.00 0.00 -1.03 0.00 0.00 54.13 52.72 2wqk s LEU 90 Cb -0.12 -0.99 0.03 0.00 0.03 0.00 0.00 46.19 45.13 2wqk s LEU 90 CO 0.00 0.21 -0.02 -0.55 0.23 0.00 0.00 176.35 176.22 2wqk s SER 91 N -0.73 1.36 0.00 2.29 0.15 -0.50 -1.02 113.70 115.25 2wqk s SER 91 Ca 0.07 -0.12 0.00 0.00 0.70 0.00 0.00 55.95 56.60 2wqk s SER 91 Cb -0.08 -0.48 0.00 0.00 -1.71 0.00 0.00 66.02 63.75 2wqk s SER 91 CO 0.00 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 174.92 2wqk n GLY 92 N 4.67 0.81 3.67 9.45 0.00 -0.38 -0.58 105.19 122.82 2wqk n GLY 92 Ca -0.15 -2.02 -0.43 0.00 0.00 0.00 0.00 46.02 43.42 2wqk n GLY 92 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wqk s ILE 93 N -1.81 4.48 0.51 -0.61 1.01 -1.11 -3.93 121.20 119.73 2wqk s ILE 93 Ca 0.00 1.78 -0.23 0.00 0.00 0.00 0.00 60.65 62.20 2wqk s ILE 93 Cb 0.00 -4.15 -0.06 0.00 0.01 0.00 0.00 42.46 38.27 2wqk s ILE 93 CO 0.00 -0.09 1.33 0.21 0.00 0.00 0.00 174.94 176.39 2wqk s ASN 94 N 1.48 5.57 -1.28 3.58 2.47 -0.09 -4.17 114.94 122.50 2wqk s ASN 94 Ca 0.51 2.69 -0.14 0.00 0.42 0.00 0.00 52.86 56.34 2wqk s ASN 94 Cb -0.20 -2.63 0.13 0.00 -1.45 0.00 0.00 41.25 37.10 2wqk s ASN 94 CO 0.15 -1.36 1.71 1.21 -3.72 0.00 0.00 177.10 175.09 2wqk n GLU 95 N -0.76 3.33 0.00 0.43 0.00 -1.26 -1.99 120.64 120.39 2wqk n GLU 95 Ca 0.09 -3.49 0.00 0.00 0.00 0.00 0.00 57.16 53.75 2wqk n GLU 95 Cb 0.45 -3.15 0.00 0.00 0.00 0.00 0.00 31.44 28.74 2wqk n GLU 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2wqk n GLY 96 N 4.08 3.37 3.82 8.31 0.00 -1.19 -4.99 105.19 118.58 2wqk n GLY 96 Ca 0.42 -1.81 -0.31 0.00 0.00 0.00 0.00 46.02 44.32 2wqk n GLY 96 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wqk s PRO 97 N -2.42 2.67 -0.38 1.61 0.04 -0.49 -3.36 135.00 132.67 2wqk s PRO 97 Ca 0.00 0.79 0.01 0.00 0.04 0.00 0.00 61.00 61.84 2wqk s PRO 97 Cb 0.00 -1.97 0.14 0.00 0.04 0.00 0.00 34.50 32.71 2wqk s PRO 97 CO 0.00 -1.24 0.24 -0.80 0.04 0.00 0.00 177.00 175.24 2wqk s ASN 98 N -3.90 2.84 0.19 6.66 0.01 -1.26 -4.99 114.94 114.49 2wqk s ASN 98 Ca 0.59 -2.41 0.11 0.00 -0.71 0.00 0.00 52.86 50.43 2wqk s ASN 98 Cb -0.14 -0.51 -0.04 0.00 0.41 0.00 0.00 41.25 40.97 2wqk s ASN 98 CO 0.54 -0.28 -0.22 -0.76 -1.51 0.00 0.00 177.10 174.87 2wqk s LEU 99 N 0.77 2.44 0.00 0.60 1.43 -1.26 -4.80 118.68 117.86 2wqk s LEU 99 Ca 0.20 -0.88 0.00 0.00 -1.03 0.00 0.00 54.13 52.43 2wqk s LEU 99 Cb -0.19 -1.08 0.00 0.00 0.03 0.00 0.00 46.19 44.95 2wqk s LEU 99 CO -0.03 0.08 0.00 0.61 0.23 0.00 0.00 176.35 177.24 2wqk n GLY 100 N 0.22 2.56 0.24 -3.19 0.00 -1.26 -2.53 105.19 101.23 2wqk n GLY 100 Ca -0.12 -0.42 0.16 0.00 0.00 0.00 0.00 46.02 45.63 2wqk n GLY 100 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2wqk h GLU 101 N 0.00 0.00 0.00 1.61 5.08 -1.89 -2.52 114.58 116.86 2wqk h GLU 101 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2wqk h GLU 101 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2wqk h GLU 101 CO 0.00 0.00 0.00 -0.25 -1.00 0.00 0.00 179.01 177.76 2wqk n ASP 102 N -2.83 0.00 -0.26 1.42 8.00 -1.05 -3.45 116.55 118.37 2wqk n ASP 102 Ca 0.01 0.23 0.06 0.00 0.71 0.00 0.00 54.79 55.80 2wqk n ASP 102 Cb 0.26 -0.39 0.29 0.00 -0.02 0.00 0.00 41.12 41.27 2wqk n ASP 102 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2wqk h ILE 103 N 0.00 1.02 0.00 0.53 2.04 -1.54 -2.05 117.51 117.50 2wqk h ILE 103 Ca 0.00 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.55 2wqk h ILE 103 Cb 0.28 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.40 2wqk h ILE 103 CO 0.00 0.16 0.00 0.71 0.00 0.00 0.00 178.15 179.02 2wqk h THR 104 N 0.90 0.00 -0.02 -0.27 1.35 -1.82 -2.12 112.91 110.92 2wqk h THR 104 Ca 0.38 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.90 2wqk h THR 104 Cb 0.29 1.24 0.00 0.00 -1.73 0.00 0.00 68.15 67.96 2wqk h THR 104 CO -0.14 0.00 -0.04 -1.22 -0.25 0.00 0.00 175.52 173.87 2wqk n TYR 105 N -2.86 0.00 -2.94 4.73 4.01 -0.78 -4.97 117.16 114.35 2wqk n TYR 105 Ca 0.00 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.34 2wqk n TYR 105 Cb 0.23 -0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.22 2wqk n TYR 105 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2wqk s SER 106 N -2.04 7.06 0.22 7.72 0.15 -0.80 -4.94 113.70 121.07 2wqk s SER 106 Ca 0.30 1.28 0.01 0.00 0.70 0.00 0.00 55.95 58.24 2wqk s SER 106 Cb 0.20 -2.45 0.22 0.00 -1.71 0.00 0.00 66.02 62.28 2wqk s SER 106 CO 0.33 -0.20 1.57 1.23 1.20 0.00 0.00 173.24 177.36 2wqk h GLY 107 N 7.09 0.47 0.92 9.45 0.00 -1.89 -1.53 103.07 117.59 2wqk h GLY 107 Ca -0.39 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.41 2wqk h GLY 107 CO 0.77 0.47 0.11 -0.84 0.00 0.00 0.00 176.54 177.05 2wqk h THR 108 N 0.34 1.15 -0.72 4.70 2.02 -1.92 -2.15 112.91 116.32 2wqk h THR 108 Ca 0.01 -0.42 -0.06 0.00 0.77 0.00 0.00 66.41 66.71 2wqk h THR 108 Cb 1.01 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 68.37 2wqk h THR 108 CO 0.09 0.14 0.23 0.58 0.37 0.00 0.00 175.52 176.93 2wqk h VAL 109 N 0.26 1.26 -0.07 3.16 2.07 -1.87 -2.71 116.25 118.36 2wqk h VAL 109 Ca 0.08 -0.90 -0.04 0.00 0.82 0.00 0.00 66.70 66.66 2wqk h VAL 109 Cb 0.13 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 2wqk h VAL 109 CO -0.01 0.35 -0.15 0.77 0.02 0.00 0.00 177.57 178.55 2wqk h SER 110 N 1.07 0.10 -0.24 0.57 4.64 -1.08 -1.00 113.55 117.61 2wqk h SER 110 Ca 0.23 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2wqk h SER 110 Cb 0.30 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 2wqk h SER 110 CO -0.01 0.26 0.15 1.23 -0.87 0.00 0.00 176.83 177.59 2wqk h GLY 111 N 0.61 0.34 0.99 -0.77 0.00 -1.06 0.22 103.07 103.41 2wqk h GLY 111 Ca 0.02 -0.13 -0.03 0.00 0.00 0.00 0.00 47.33 47.18 2wqk h GLY 111 CO 0.02 0.13 0.25 0.00 0.00 0.00 0.00 176.54 176.94 2wqk h ALA 112 N 1.06 0.77 -0.57 3.60 0.00 -1.31 -2.16 119.26 120.65 2wqk h ALA 112 Ca 0.09 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 54.91 2wqk h ALA 112 Cb -0.00 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.49 2wqk h ALA 112 CO -0.02 0.37 0.25 1.98 0.00 0.00 0.00 179.25 181.84 2wqk h MET 113 N 0.82 0.45 -0.75 0.00 -1.53 -0.82 -1.61 114.93 111.49 2wqk h MET 113 Ca 0.20 -0.03 0.00 0.00 -3.44 0.00 0.00 59.70 56.43 2wqk h MET 113 Cb 0.19 -0.10 -0.04 0.00 -0.55 0.00 0.00 31.60 31.10 2wqk h MET 113 CO -0.02 0.30 0.48 0.93 0.14 0.00 0.00 176.91 178.74 2wqk h GLU 114 N 0.47 1.01 -0.73 0.39 4.39 -0.75 0.89 114.58 120.24 2wqk h GLU 114 Ca 0.27 -0.08 0.06 0.00 0.34 0.00 0.00 59.36 59.96 2wqk h GLU 114 Cb 0.26 -0.22 -0.06 0.00 -0.10 0.00 0.00 28.75 28.64 2wqk h GLU 114 CO -0.24 0.69 0.42 0.78 -1.16 0.00 0.00 179.01 179.51 2wqk h GLY 115 N 1.02 1.08 1.81 -3.84 0.00 -0.72 -1.73 103.07 100.69 2wqk h GLY 115 Ca 0.27 -0.30 -0.12 0.00 0.00 0.00 0.00 47.33 47.18 2wqk h GLY 115 CO -0.06 0.19 -0.50 -0.09 0.00 0.00 0.00 176.54 176.09 2wqk h ARG 116 N 0.78 0.20 -0.81 4.80 9.65 -0.42 -1.28 114.38 127.30 2wqk h ARG 116 Ca 0.32 -0.11 0.02 0.00 -1.10 0.00 0.00 59.98 59.11 2wqk h ARG 116 Cb 0.18 0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 28.73 2wqk h ARG 116 CO -0.18 0.66 0.53 0.82 2.80 0.00 0.00 179.97 184.60 2wqk h ILE 117 N 0.16 1.17 0.00 1.20 2.04 -0.46 -0.78 117.51 120.85 2wqk h ILE 117 Ca 0.01 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.51 2wqk h ILE 117 Cb 0.94 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 2wqk h ILE 117 CO 0.08 0.19 0.00 0.18 0.00 0.00 0.00 178.15 178.60 2wqk n LEU 118 N -4.43 0.00 0.00 1.44 4.77 -0.69 -4.88 117.00 113.21 2wqk n LEU 118 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 2wqk n LEU 118 Cb 0.07 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2wqk n LEU 118 CO 0.36 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 2wqk n GLY 119 N 0.90 0.79 3.29 -0.72 0.00 -0.30 -5.07 105.19 104.09 2wqk n GLY 119 Ca 0.22 -0.61 -0.32 0.00 0.00 0.00 0.00 46.02 45.31 2wqk n GLY 119 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wqk s ILE 120 N -2.00 2.33 0.42 -0.61 1.01 -0.54 -5.01 121.20 116.80 2wqk s ILE 120 Ca 0.00 -0.95 -0.26 0.00 0.00 0.00 0.00 60.65 59.44 2wqk s ILE 120 Cb 0.00 -1.89 -0.09 0.00 0.01 0.00 0.00 42.46 40.49 2wqk s ILE 120 CO 0.00 0.56 1.43 -2.84 0.00 0.00 0.00 174.94 174.09 2wqk s PRO 121 N 0.03 3.84 -0.01 2.79 0.02 -1.26 -2.99 135.00 137.42 2wqk s PRO 121 Ca -0.08 2.44 -0.11 0.00 0.02 0.00 0.00 61.00 63.27 2wqk s PRO 121 Cb -0.15 -2.76 0.01 0.00 0.02 0.00 0.00 34.50 31.62 2wqk s PRO 121 CO 0.05 -0.70 0.22 -1.12 -0.33 0.00 0.00 177.00 175.13 2wqk s SER 122 N -0.42 -0.09 -0.06 2.53 0.01 -1.26 -1.57 113.70 112.84 2wqk s SER 122 Ca 0.58 -0.03 -0.03 0.00 1.31 0.00 0.00 55.95 57.78 2wqk s SER 122 Cb -0.44 0.27 0.03 0.00 0.21 0.00 0.00 66.02 66.10 2wqk s SER 122 CO 0.58 -0.39 0.14 -0.63 0.41 0.00 0.00 173.24 173.35 2wqk s ILE 123 N -1.26 -0.04 -0.12 1.44 1.01 -0.61 -2.04 121.20 119.59 2wqk s ILE 123 Ca -0.13 0.13 -0.06 0.00 0.00 0.00 0.00 60.65 60.59 2wqk s ILE 123 Cb -0.06 -0.23 -0.04 0.00 0.01 0.00 0.00 42.46 42.14 2wqk s ILE 123 CO 0.03 0.05 0.11 0.00 0.00 0.00 0.00 174.94 175.13 2wqk s ALA 124 N 0.89 3.73 -0.07 9.38 0.00 -0.09 -1.41 121.76 134.19 2wqk s ALA 124 Ca -0.07 -0.68 0.03 0.00 0.00 0.00 0.00 51.96 51.24 2wqk s ALA 124 Cb -0.09 -1.87 0.01 0.00 0.00 0.00 0.00 23.12 21.17 2wqk s ALA 124 CO -0.04 0.58 -0.15 -0.06 0.00 0.00 0.00 175.76 176.08 2wqk s PHE 125 N -0.88 1.70 0.01 0.00 0.08 0.25 -0.35 117.98 118.79 2wqk s PHE 125 Ca 0.14 -0.62 0.02 0.00 0.12 0.00 0.00 56.93 56.58 2wqk s PHE 125 Cb -0.12 -1.20 -0.01 0.00 -0.57 0.00 0.00 43.02 41.12 2wqk s PHE 125 CO 0.03 -0.28 -0.06 -1.12 -0.10 0.00 0.00 175.22 173.69 2wqk s SER 126 N 0.49 0.67 -0.15 1.36 0.01 -0.19 -0.92 113.70 114.98 2wqk s SER 126 Ca -0.13 -0.20 -0.21 0.00 1.31 0.00 0.00 55.95 56.71 2wqk s SER 126 Cb -0.15 -0.04 -0.03 0.00 0.21 0.00 0.00 66.02 66.00 2wqk s SER 126 CO 0.04 0.00 0.64 0.00 0.41 0.00 0.00 173.24 174.34 2wqk s ALA 127 N -0.41 3.48 -0.99 1.44 0.00 -0.84 -0.92 121.76 123.51 2wqk s ALA 127 Ca -0.01 -0.13 -0.17 0.00 0.00 0.00 0.00 51.96 51.65 2wqk s ALA 127 Cb -0.04 -2.94 0.15 0.00 0.00 0.00 0.00 23.12 20.29 2wqk s ALA 127 CO -0.00 -0.36 1.17 0.12 0.00 0.00 0.00 175.76 176.68 2wqk s PHE 128 N 1.45 3.27 0.03 0.00 5.36 0.27 -1.40 117.98 126.96 2wqk s PHE 128 Ca 0.31 -1.62 -0.29 0.00 -0.96 0.00 0.00 56.93 54.37 2wqk s PHE 128 Cb -0.16 -4.25 0.10 0.00 -0.34 0.00 0.00 43.02 38.37 2wqk s PHE 128 CO 0.12 -1.42 1.20 0.20 -1.46 0.00 0.00 175.22 173.86 2wqk s GLY 129 N 3.31 -0.34 0.05 13.12 0.00 -1.26 -2.29 107.32 119.91 2wqk s GLY 129 Ca 0.34 0.48 0.00 0.00 0.00 0.00 0.00 44.72 45.54 2wqk s GLY 129 CO -0.07 0.46 0.00 0.54 0.00 0.00 0.00 173.10 174.03 2wqk n ARG 130 N -0.52 0.00 -4.14 2.90 1.74 -1.26 -4.44 116.66 110.94 2wqk n ARG 130 Ca -0.07 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 56.68 2wqk n ARG 130 Cb 0.62 -0.48 -0.07 0.00 -1.02 0.00 0.00 32.46 31.50 2wqk n ARG 130 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2wqk s GLU 131 N -2.00 2.99 -1.20 5.56 0.41 -1.26 -4.70 118.70 118.50 2wqk s GLU 131 Ca 0.00 -0.52 -0.17 0.00 -0.41 0.00 0.00 54.97 53.87 2wqk s GLU 131 Cb 0.00 -2.81 -0.00 0.00 -1.78 0.00 0.00 34.13 29.54 2wqk s GLU 131 CO 0.00 0.64 0.71 0.09 -0.49 0.00 0.00 175.26 176.21 2wqk n ASN 132 N 1.22 -4.09 -4.71 -0.19 3.02 -1.26 -4.88 115.26 104.37 2wqk n ASN 132 Ca -0.13 -1.02 -0.42 0.00 -0.03 0.00 0.00 54.58 52.98 2wqk n ASN 132 Cb 0.53 -3.27 -0.03 0.00 -0.61 0.00 0.00 39.78 36.39 2wqk n ASN 132 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2wqk s ILE 133 N -3.57 4.66 -1.27 2.41 1.01 -1.26 -4.95 121.20 118.22 2wqk s ILE 133 Ca 0.36 1.93 -0.12 0.00 0.00 0.00 0.00 60.65 62.82 2wqk s ILE 133 Cb -0.13 -4.24 0.15 0.00 0.01 0.00 0.00 42.46 38.25 2wqk s ILE 133 CO 0.87 0.16 1.74 0.23 0.00 0.00 0.00 174.94 177.94 2wqk n MET 134 N 3.79 3.42 -0.02 2.79 2.81 -1.26 -4.83 117.12 123.82 2wqk n MET 134 Ca 0.06 -3.54 0.01 0.00 -1.81 0.00 0.00 57.70 52.42 2wqk n MET 134 Cb 0.50 -3.05 0.32 0.00 -0.71 0.00 0.00 33.22 30.28 2wqk n MET 134 CO 0.00 0.00 0.00 0.74 1.51 0.00 0.00 175.97 178.22 2wqk h PHE 135 N 6.43 0.58 -0.18 2.03 0.04 -1.92 -1.10 116.94 122.82 2wqk h PHE 135 Ca 0.39 -0.03 -0.13 0.00 2.80 0.00 0.00 57.97 60.99 2wqk h PHE 135 Cb 0.74 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.70 2wqk h PHE 135 CO 1.23 0.49 -0.45 0.93 -0.60 0.00 0.00 178.31 179.91 2wqk h GLU 136 N 0.57 0.45 -0.22 1.51 5.08 -1.90 0.05 114.58 120.11 2wqk h GLU 136 Ca 0.13 -0.24 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 2wqk h GLU 136 Cb 0.20 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 2wqk h GLU 136 CO -0.01 0.81 0.09 0.93 -1.00 0.00 0.00 179.01 179.84 2wqk h GLU 137 N 0.36 0.33 -0.94 2.33 4.39 -1.77 -3.12 114.58 116.16 2wqk h GLU 137 Ca 0.02 -0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.67 2wqk h GLU 137 Cb 0.94 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 29.49 2wqk h GLU 137 CO 0.08 0.38 0.61 0.82 -1.16 0.00 0.00 179.01 179.74 2wqk h ILE 138 N 0.21 1.24 -0.06 3.13 2.04 -1.02 -2.43 117.51 120.62 2wqk h ILE 138 Ca 0.07 -0.45 0.01 0.00 1.00 0.00 0.00 64.86 65.49 2wqk h ILE 138 Cb 0.17 -0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 36.12 2wqk h ILE 138 CO -0.01 0.24 0.04 0.00 0.00 0.00 0.00 178.15 178.42 2wqk h ALA 139 N 1.40 2.02 -0.62 1.87 0.00 -0.93 -2.05 119.26 120.96 2wqk h ALA 139 Ca 0.34 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 2wqk h ALA 139 Cb -0.14 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2wqk h ALA 139 CO -0.07 -0.03 0.35 0.87 0.00 0.00 0.00 179.25 180.37 2wqk h LYS 140 N 0.03 0.85 -0.01 0.00 1.57 -1.42 -0.55 116.57 117.04 2wqk h LYS 140 Ca 0.02 -0.09 -0.17 0.00 -1.87 0.00 0.00 60.65 58.54 2wqk h LYS 140 Cb 0.06 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 2wqk h LYS 140 CO -0.00 0.64 -0.75 -0.24 -0.57 0.00 0.00 179.45 178.53 2wqk h VAL 141 N 0.84 1.48 -0.54 0.50 3.04 -1.48 -2.38 116.25 117.70 2wqk h VAL 141 Ca 0.22 -2.42 0.03 0.00 -1.01 0.00 0.00 66.70 63.52 2wqk h VAL 141 Cb 0.03 2.31 -0.04 0.00 -2.01 0.00 0.00 31.29 31.57 2wqk h VAL 141 CO -0.04 0.70 0.31 0.00 -1.01 0.00 0.00 177.57 177.53 2wqk h VAL 143 N 0.60 1.24 -0.59 0.00 2.07 -0.98 -0.75 116.25 117.84 2wqk h VAL 143 Ca 0.23 -0.97 0.05 0.00 0.82 0.00 0.00 66.70 66.83 2wqk h VAL 143 Cb 0.07 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 30.61 2wqk h VAL 143 CO -0.12 0.35 0.31 0.44 0.02 0.00 0.00 177.57 178.56 2wqk h ASP 144 N 0.77 0.44 -0.29 0.57 3.32 -0.88 -0.11 116.42 120.24 2wqk h ASP 144 Ca 0.15 0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.19 2wqk h ASP 144 Cb 0.42 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 2wqk h ASP 144 CO 0.02 0.29 0.01 0.40 -1.72 0.00 0.00 179.24 178.24 2wqk h ILE 145 N 0.58 1.25 -0.76 0.35 2.04 -0.89 -2.55 117.51 117.52 2wqk h ILE 145 Ca 0.26 -0.90 -0.02 0.00 1.00 0.00 0.00 64.86 65.21 2wqk h ILE 145 Cb 0.18 1.27 -0.04 0.00 -0.74 0.00 0.00 36.82 37.49 2wqk h ILE 145 CO -0.18 0.29 0.41 0.58 0.00 0.00 0.00 178.15 179.25 2wqk h VAL 146 N 0.30 1.23 -0.62 1.67 2.07 -0.79 -0.11 116.25 120.00 2wqk h VAL 146 Ca 0.08 -0.59 0.05 0.00 0.82 0.00 0.00 66.70 67.07 2wqk h VAL 146 Cb 0.41 0.22 -0.05 0.00 -1.52 0.00 0.00 31.29 30.35 2wqk h VAL 146 CO 0.01 0.26 0.34 0.50 0.02 0.00 0.00 177.57 178.70 2wqk h LYS 147 N 1.06 0.63 -0.49 1.57 3.64 -0.88 -0.20 116.57 121.89 2wqk h LYS 147 Ca 0.27 -0.04 -0.12 0.00 -1.27 0.00 0.00 60.65 59.49 2wqk h LYS 147 Cb 0.04 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 2wqk h LYS 147 CO -0.04 0.42 -0.15 0.87 -2.27 0.00 0.00 179.45 178.27 2wqk h LYS 148 N 0.65 0.97 -0.50 1.90 1.57 -0.99 -2.84 116.57 117.33 2wqk h LYS 148 Ca 0.27 -0.39 -0.07 0.00 -1.87 0.00 0.00 60.65 58.59 2wqk h LYS 148 Cb 0.14 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 2wqk h LYS 148 CO -0.16 1.06 0.01 0.28 -0.57 0.00 0.00 179.45 180.07 2wqk h VAL 149 N 0.83 1.24 -0.16 0.50 2.07 -0.58 -0.30 116.25 119.85 2wqk h VAL 149 Ca 0.12 -1.00 -0.03 0.00 0.82 0.00 0.00 66.70 66.62 2wqk h VAL 149 Cb 0.72 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 2wqk h VAL 149 CO 0.05 0.35 -0.02 -0.07 0.02 0.00 0.00 177.57 177.91 2wqk h LEU 150 N 0.77 0.21 0.13 2.57 3.38 -0.90 0.98 115.31 122.45 2wqk h LEU 150 Ca 0.15 -0.02 -0.30 0.00 0.09 0.00 0.00 57.88 57.79 2wqk h LEU 150 Cb 0.44 -0.05 0.03 0.00 0.09 0.00 0.00 40.66 41.17 2wqk h LEU 150 CO 0.02 0.27 -1.28 -1.13 0.09 0.00 0.00 178.44 176.41 2wqk h ASN 151 N 0.23 0.84 0.00 -0.43 -1.24 -1.09 -3.42 115.58 110.47 2wqk h ASN 151 Ca 0.05 -0.80 -0.03 0.00 0.71 0.00 0.00 56.30 56.24 2wqk h ASN 151 Cb 0.19 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 38.97 2wqk h ASN 151 CO 0.01 1.60 -1.22 -0.62 -1.29 0.00 0.00 177.43 175.91 2wqk n GLU 152 N -3.76 1.48 0.00 6.67 -0.58 -0.21 -5.12 120.64 119.12 2wqk n GLU 152 Ca -0.14 -0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.58 2wqk n GLU 152 Cb 1.01 -1.10 0.00 0.00 -0.57 0.00 0.00 31.44 30.78 2wqk n GLU 152 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2wqk n GLY 153 N 2.48 -0.86 3.42 0.62 0.00 0.32 -5.01 105.19 106.15 2wqk n GLY 153 Ca -0.03 -1.67 -0.31 0.00 0.00 0.00 0.00 46.02 44.02 2wqk n GLY 153 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wqk s ILE 154 N -1.92 2.59 0.88 -0.61 1.01 -1.26 -4.92 121.20 116.97 2wqk s ILE 154 Ca 0.00 -1.23 -0.11 0.00 0.00 0.00 0.00 60.65 59.31 2wqk s ILE 154 Cb 0.00 -2.06 0.13 0.00 0.01 0.00 0.00 42.46 40.53 2wqk s ILE 154 CO 0.00 0.36 1.15 -2.84 0.00 0.00 0.00 174.94 173.61 2wqk s PRO 155 N -1.34 1.27 -0.01 2.79 0.02 -1.26 -4.98 135.00 131.48 2wqk s PRO 155 Ca 0.14 1.53 -0.24 0.00 0.02 0.00 0.00 61.00 62.45 2wqk s PRO 155 Cb -0.10 -1.76 -0.17 0.00 0.02 0.00 0.00 34.50 32.49 2wqk s PRO 155 CO 0.04 -2.45 1.14 0.93 -0.33 0.00 0.00 177.00 176.33 2wqk h GLU 156 N -1.63 -0.27 -2.09 5.54 5.08 -2.02 -3.15 114.58 116.03 2wqk h GLU 156 Ca -0.44 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 57.91 2wqk h GLU 156 Cb 1.27 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.57 2wqk h GLU 156 CO 0.43 0.10 -0.01 -3.47 -1.00 0.00 0.00 179.01 175.06 2wqk n ASP 157 N -5.03 3.32 -3.86 1.42 2.03 -1.26 -4.84 116.55 108.34 2wqk n ASP 157 Ca -0.09 -1.94 -0.12 0.00 0.52 0.00 0.00 54.79 53.17 2wqk n ASP 157 Cb 0.26 -0.75 -0.11 0.00 -0.72 0.00 0.00 41.12 39.80 2wqk n ASP 157 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2wqk s THR 158 N 1.00 0.05 0.11 5.18 2.01 -1.19 -3.05 115.64 119.74 2wqk s THR 158 Ca 0.10 -0.41 0.02 0.00 0.31 0.00 0.00 61.69 61.71 2wqk s THR 158 Cb 0.05 -0.33 -0.04 0.00 0.01 0.00 0.00 72.50 72.18 2wqk s THR 158 CO 0.00 -0.23 -0.06 -0.72 -0.69 0.00 0.00 174.62 172.93 2wqk s TYR 159 N -0.78 0.92 -0.11 4.92 -0.85 -0.83 -4.77 117.35 115.86 2wqk s TYR 159 Ca -0.09 -0.93 -0.04 0.00 -0.52 0.00 0.00 57.07 55.49 2wqk s TYR 159 Cb -0.05 -0.53 -0.04 0.00 0.38 0.00 0.00 41.96 41.72 2wqk s TYR 159 CO 0.01 -0.16 0.05 -0.51 -1.52 0.00 0.00 175.55 173.41 2wqk s LEU 160 N -3.06 3.82 -0.30 -3.49 1.43 -0.87 -0.96 118.68 115.27 2wqk s LEU 160 Ca 0.13 0.22 -0.03 0.00 -1.03 0.00 0.00 54.13 53.42 2wqk s LEU 160 Cb 0.05 -1.90 0.04 0.00 0.03 0.00 0.00 46.19 44.41 2wqk s LEU 160 CO -0.04 0.35 0.01 0.21 0.23 0.00 0.00 176.35 177.11 2wqk s ASN 161 N -0.73 4.87 -0.12 2.29 2.47 -0.27 -0.91 114.94 122.54 2wqk s ASN 161 Ca 0.12 -1.17 0.00 0.00 0.42 0.00 0.00 52.86 52.24 2wqk s ASN 161 Cb -0.12 -1.73 -0.02 0.00 -1.45 0.00 0.00 41.25 37.94 2wqk s ASN 161 CO 0.02 -0.25 -0.14 -0.69 -3.72 0.00 0.00 177.10 172.33 2wqk s VAL 162 N 1.29 3.00 -0.05 -5.21 1.01 0.53 -0.94 120.40 120.03 2wqk s VAL 162 Ca -0.04 -0.69 0.06 0.00 0.00 0.00 0.00 61.98 61.31 2wqk s VAL 162 Cb -0.19 -2.24 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 2wqk s VAL 162 CO -0.01 0.53 -0.22 0.20 0.00 0.00 0.00 175.10 175.60 2wqk s ASN 163 N 0.25 2.76 -0.12 3.32 0.01 -0.32 -1.02 114.94 119.81 2wqk s ASN 163 Ca -0.09 -0.46 0.03 0.00 -0.71 0.00 0.00 52.86 51.63 2wqk s ASN 163 Cb -0.16 -0.75 0.01 0.00 0.41 0.00 0.00 41.25 40.76 2wqk s ASN 163 CO 0.05 0.21 -0.22 -0.63 -1.51 0.00 0.00 177.10 175.01 2wqk s ILE 164 N -0.10 1.99 0.67 0.60 1.09 -0.10 -1.19 121.20 124.16 2wqk s ILE 164 Ca -0.04 -0.95 -0.17 0.00 -1.10 0.00 0.00 60.65 58.39 2wqk s ILE 164 Cb -0.13 -1.75 -0.00 0.00 -1.06 0.00 0.00 42.46 39.52 2wqk s ILE 164 CO 0.03 0.54 1.19 -2.65 -0.10 0.00 0.00 174.94 173.96 2wqk n PRO 165 N 3.90 0.91 -2.37 2.79 -0.02 -1.26 -0.56 135.00 138.38 2wqk n PRO 165 Ca -0.20 0.37 -0.43 0.00 -2.02 0.00 0.00 63.50 61.22 2wqk n PRO 165 Cb 0.52 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 2wqk n PRO 165 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2wqk n ASN 166 N -1.85 4.69 -4.15 2.55 5.15 -0.97 -4.78 115.26 115.90 2wqk n ASN 166 Ca 0.15 -2.92 -0.13 0.00 -0.60 0.00 0.00 54.58 51.08 2wqk n ASN 166 Cb 0.48 -1.68 -0.11 0.00 -0.53 0.00 0.00 39.78 37.95 2wqk n ASN 166 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2wqk s LEU 167 N 2.91 2.39 0.60 1.20 1.43 -1.26 -4.93 118.68 121.02 2wqk s LEU 167 Ca 0.49 -0.78 -0.20 0.00 -1.03 0.00 0.00 54.13 52.61 2wqk s LEU 167 Cb 0.06 -0.22 -0.03 0.00 0.03 0.00 0.00 46.19 46.03 2wqk s LEU 167 CO 0.01 -0.29 1.33 -0.13 0.23 0.00 0.00 176.35 177.51 2wqk s ARG 168 N -2.68 2.82 0.26 1.70 0.52 -1.26 -4.62 118.95 115.68 2wqk s ARG 168 Ca 0.03 2.17 -0.03 0.00 -0.52 0.00 0.00 55.73 57.38 2wqk s ARG 168 Cb -0.03 -2.04 0.53 0.00 0.52 0.00 0.00 34.95 33.93 2wqk s ARG 168 CO -0.01 -1.42 1.69 -0.92 0.02 0.00 0.00 175.30 174.66 2wqk h TYR 169 N 0.98 0.40 0.00 -0.53 3.20 -1.97 0.95 116.97 120.00 2wqk h TYR 169 Ca -0.51 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.40 2wqk h TYR 169 Cb 1.32 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 39.53 2wqk h TYR 169 CO 0.43 -0.06 0.00 0.93 -1.64 0.00 0.00 178.16 177.83 2wqk h GLU 170 N 0.33 0.00 0.00 1.82 3.07 -1.96 -2.52 114.58 115.32 2wqk h GLU 170 Ca 0.45 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.31 2wqk h GLU 170 Cb 0.79 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.70 2wqk h GLU 170 CO -0.50 0.00 -0.65 0.39 -1.40 0.00 0.00 179.01 176.84 2wqk n GLU 171 N -2.44 0.06 -1.88 2.33 -0.58 0.30 -4.89 120.64 113.54 2wqk n GLU 171 Ca 0.02 0.01 -0.42 0.00 -0.42 0.00 0.00 57.16 56.35 2wqk n GLU 171 Cb 0.27 -1.53 -0.03 0.00 -0.57 0.00 0.00 31.44 29.59 2wqk n GLU 171 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2wqk s ILE 172 N -3.04 2.56 0.15 -3.67 -1.09 -0.95 -4.89 121.20 110.26 2wqk s ILE 172 Ca 0.09 0.35 0.15 0.00 -2.23 0.00 0.00 60.65 59.01 2wqk s ILE 172 Cb 0.17 -3.22 0.05 0.00 -1.58 0.00 0.00 42.46 37.88 2wqk s ILE 172 CO 0.74 0.02 1.63 0.11 -1.23 0.00 0.00 174.94 176.21 2wqk h LYS 173 N 7.10 0.00 0.00 2.79 1.57 -1.41 -3.49 116.57 123.13 2wqk h LYS 173 Ca -0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 2wqk h LYS 173 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.51 2wqk h LYS 173 CO 0.93 0.51 0.00 0.41 -0.57 0.00 0.00 179.45 180.72 2wqk n GLY 174 N 0.46 -1.75 3.23 3.86 0.00 -1.26 -5.01 105.19 104.71 2wqk n GLY 174 Ca -0.00 -1.28 -0.31 0.00 0.00 0.00 0.00 46.02 44.42 2wqk n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wqk s ILE 175 N -2.66 1.97 -0.06 -0.61 1.01 -1.26 -1.00 121.20 118.58 2wqk s ILE 175 Ca 0.00 -1.00 0.04 0.00 0.00 0.00 0.00 60.65 59.69 2wqk s ILE 175 Cb 0.00 -1.68 0.00 0.00 0.01 0.00 0.00 42.46 40.79 2wqk s ILE 175 CO 0.00 0.55 -0.16 -0.54 0.00 0.00 0.00 174.94 174.78 2wqk s LYS 176 N 0.04 1.93 0.04 2.79 1.02 0.10 -4.94 119.74 120.72 2wqk s LYS 176 Ca -0.09 -0.58 -0.30 0.00 0.02 0.00 0.00 55.97 55.02 2wqk s LYS 176 Cb -0.15 -1.60 -0.05 0.00 -0.52 0.00 0.00 37.83 35.51 2wqk s LYS 176 CO 0.05 0.16 1.14 0.08 -0.92 0.00 0.00 175.35 175.87 2wqk s VAL 177 N 0.28 4.27 0.14 3.17 1.01 -1.26 -1.01 120.40 126.99 2wqk s VAL 177 Ca -0.09 1.63 0.02 0.00 0.00 0.00 0.00 61.98 63.54 2wqk s VAL 177 Cb -0.14 -4.04 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 2wqk s VAL 177 CO 0.04 0.12 -0.05 0.42 0.00 0.00 0.00 175.10 175.62 2wqk s THR 178 N 1.11 0.80 0.30 3.92 -4.23 -0.31 -4.90 115.64 112.34 2wqk s THR 178 Ca 0.57 -1.98 -0.00 0.00 -1.18 0.00 0.00 61.69 59.10 2wqk s THR 178 Cb -0.27 -1.88 -0.04 0.00 1.34 0.00 0.00 72.50 71.66 2wqk s THR 178 CO 0.28 -0.70 0.50 0.00 -0.54 0.00 0.00 174.62 174.16 2wqk s ARG 179 N -3.84 3.51 0.04 3.99 1.70 -0.60 -4.23 118.95 119.52 2wqk s ARG 179 Ca 0.17 -0.32 -0.30 0.00 -0.47 0.00 0.00 55.73 54.81 2wqk s ARG 179 Cb 0.05 -2.72 -0.08 0.00 -0.57 0.00 0.00 34.95 31.64 2wqk s ARG 179 CO -0.00 0.24 1.65 -1.14 -1.08 0.00 0.00 175.30 174.97 2wqk s GLN 180 N -3.96 4.20 0.79 3.89 0.74 -1.26 -1.06 119.66 123.00 2wqk s GLN 180 Ca 0.40 2.29 -0.12 0.00 0.05 0.00 0.00 55.36 57.98 2wqk s GLN 180 Cb -0.10 -3.71 0.07 0.00 1.10 0.00 0.00 33.01 30.37 2wqk s GLN 180 CO 0.33 -0.76 1.16 0.20 -0.55 0.00 0.00 175.29 175.68 2wqk s GLY 181 N 2.68 1.60 0.33 2.59 0.00 -1.26 -4.87 107.32 108.39 2wqk s GLY 181 Ca 0.74 -0.62 -0.06 0.00 0.00 0.00 0.00 44.72 44.78 2wqk s GLY 181 CO 0.32 -0.15 0.62 0.54 0.00 0.00 0.00 173.10 174.43 2wqk s LYS 182 N -5.54 3.66 -0.12 2.90 1.02 -1.26 -3.39 119.74 117.00 2wqk s LYS 182 Ca 0.61 0.12 -0.36 0.00 0.02 0.00 0.00 55.97 56.36 2wqk s LYS 182 Cb -0.11 -2.57 -0.14 0.00 -0.52 0.00 0.00 37.83 34.50 2wqk s LYS 182 CO 0.49 0.12 1.77 0.54 -0.92 0.00 0.00 175.35 177.36 2wqk n ARG 183 N -1.16 1.74 -1.68 1.68 1.74 -1.26 -4.81 116.66 112.91 2wqk n ARG 183 Ca -0.01 0.64 -0.35 0.00 -0.77 0.00 0.00 57.85 57.36 2wqk n ARG 183 Cb 0.54 -2.41 -0.03 0.00 -1.02 0.00 0.00 32.46 29.54 2wqk n ARG 183 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wqk n ALA 184 N 5.65 6.88 -3.67 7.54 0.00 -1.26 -4.81 120.51 130.85 2wqk n ALA 184 Ca 0.23 -3.60 -0.07 0.00 0.00 0.00 0.00 53.44 50.00 2wqk n ALA 184 Cb 0.23 -2.75 -0.02 0.00 0.00 0.00 0.00 19.45 16.91 2wqk n ALA 184 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2wqk s TYR 185 N -0.39 -0.26 -0.18 0.00 -0.85 -1.26 -0.18 117.35 114.23 2wqk s TYR 185 Ca 0.59 -0.02 -0.08 0.00 -0.52 0.00 0.00 57.07 57.04 2wqk s TYR 185 Cb 0.23 0.62 -0.04 0.00 0.38 0.00 0.00 41.96 43.15 2wqk s TYR 185 CO -0.10 -0.86 0.07 0.15 -1.52 0.00 0.00 175.55 173.29 2wqk s LYS 186 N -3.47 3.98 -0.13 -3.49 1.02 0.32 -4.90 119.74 113.08 2wqk s LYS 186 Ca 0.08 -0.32 -0.17 0.00 0.02 0.00 0.00 55.97 55.58 2wqk s LYS 186 Cb -0.02 -3.24 -0.04 0.00 -0.52 0.00 0.00 37.83 34.01 2wqk s LYS 186 CO -0.02 0.30 0.44 -2.00 -0.92 0.00 0.00 175.35 173.15 2wqk s GLU 187 N 0.30 4.32 -0.03 1.68 2.12 -1.26 -0.15 118.70 125.69 2wqk s GLU 187 Ca 0.04 0.38 0.02 0.00 0.36 0.00 0.00 54.97 55.77 2wqk s GLU 187 Cb -0.12 -3.44 0.01 0.00 0.26 0.00 0.00 34.13 30.84 2wqk s GLU 187 CO -0.00 0.17 -0.07 0.50 -0.54 0.00 0.00 175.26 175.32 2wqk s ARG 188 N 0.61 0.81 -0.21 4.30 3.52 -0.29 -4.99 118.95 122.71 2wqk s ARG 188 Ca 0.24 -0.22 -0.09 0.00 -0.13 0.00 0.00 55.73 55.53 2wqk s ARG 188 Cb -0.15 -0.78 -0.05 0.00 -1.56 0.00 0.00 34.95 32.42 2wqk s ARG 188 CO 0.09 0.05 0.11 0.08 -0.81 0.00 0.00 175.30 174.82 2wqk s VAL 189 N 0.35 5.10 -0.13 7.11 1.01 -1.26 -0.08 120.40 132.51 2wqk s VAL 189 Ca -0.05 0.08 -0.05 0.00 0.00 0.00 0.00 61.98 61.96 2wqk s VAL 189 Cb -0.09 -3.34 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 2wqk s VAL 189 CO 0.00 0.41 0.07 -0.36 0.00 0.00 0.00 175.10 175.23 2wqk s PHE 190 N 0.64 3.36 -0.09 5.22 0.08 -0.06 -4.94 117.98 122.19 2wqk s PHE 190 Ca 0.06 0.29 -0.02 0.00 0.12 0.00 0.00 56.93 57.38 2wqk s PHE 190 Cb -0.12 -1.93 -0.03 0.00 -0.57 0.00 0.00 43.02 40.36 2wqk s PHE 190 CO 0.01 0.49 0.01 0.21 -0.10 0.00 0.00 175.22 175.84 2wqk s LYS 191 N -0.59 3.03 0.20 0.44 2.20 -1.26 -0.78 119.74 122.98 2wqk s LYS 191 Ca 0.11 -0.40 0.03 0.00 -0.36 0.00 0.00 55.97 55.35 2wqk s LYS 191 Cb -0.12 -2.82 -0.05 0.00 -1.51 0.00 0.00 37.83 33.34 2wqk s LYS 191 CO 0.02 0.69 -0.01 0.71 -0.36 0.00 0.00 175.35 176.40 2wqk s TYR 192 N -0.84 1.41 -0.14 4.03 2.02 0.44 -5.01 117.35 119.28 2wqk s TYR 192 Ca 0.13 -0.95 0.02 0.00 -0.37 0.00 0.00 57.07 55.90 2wqk s TYR 192 Cb -0.11 -0.81 0.00 0.00 -0.40 0.00 0.00 41.96 40.65 2wqk s TYR 192 CO 0.02 -0.09 -0.20 0.42 -1.57 0.00 0.00 175.55 174.13 2wqk s ILE 193 N -3.50 2.24 0.94 2.71 -1.09 -1.26 -1.22 121.20 120.02 2wqk s ILE 193 Ca 0.26 -0.93 -0.13 0.00 -2.23 0.00 0.00 60.65 57.62 2wqk s ILE 193 Cb 0.05 -1.90 0.16 0.00 -1.58 0.00 0.00 42.46 39.19 2wqk s ILE 193 CO 0.06 0.54 1.14 1.51 -1.23 0.00 0.00 174.94 176.97 2wqk s ASP 194 N 0.71 3.23 0.60 3.58 1.47 0.45 -4.88 116.67 121.84 2wqk s ASP 194 Ca -0.09 0.92 0.34 0.00 1.18 0.00 0.00 52.55 54.90 2wqk s ASP 194 Cb -0.16 -1.45 1.87 0.00 -0.34 0.00 0.00 42.92 42.84 2wqk s ASP 194 CO 0.01 -2.72 2.05 -0.65 0.68 0.00 0.00 175.17 174.53 2wqk h PRO 195 N -1.61 0.00 -0.49 2.11 0.11 -2.01 -1.11 132.00 128.99 2wqk h PRO 195 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2wqk h PRO 195 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2wqk h PRO 195 CO 0.58 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.03 2wqk n TYR 196 N -2.83 0.65 -0.67 0.65 4.01 -1.26 -4.98 117.16 112.73 2wqk n TYR 196 Ca -0.02 -0.36 0.00 0.00 -0.16 0.00 0.00 57.90 57.35 2wqk n TYR 196 Cb 0.19 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.22 2wqk n TYR 196 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wqk n GLY 197 N 1.39 0.66 3.73 2.72 0.00 -0.42 -5.07 105.19 108.21 2wqk n GLY 197 Ca 0.20 -0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 2wqk n GLY 197 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wqk s LYS 198 N -0.37 2.79 0.46 1.61 1.02 -1.26 -4.79 119.74 119.20 2wqk s LYS 198 Ca 0.00 -0.69 -0.21 0.00 0.02 0.00 0.00 55.97 55.09 2wqk s LYS 198 Cb 0.00 -2.68 -0.10 0.00 -0.52 0.00 0.00 37.83 34.53 2wqk s LYS 198 CO 0.00 0.58 1.00 -1.25 -0.92 0.00 0.00 175.35 174.76 2wqk s PRO 199 N -2.12 4.00 0.16 -1.68 0.04 -1.26 -0.41 135.00 133.73 2wqk s PRO 199 Ca 0.26 1.25 -0.06 0.00 0.04 0.00 0.00 61.00 62.49 2wqk s PRO 199 Cb -0.12 -2.14 -0.02 0.00 0.04 0.00 0.00 34.50 32.26 2wqk s PRO 199 CO 0.18 -0.24 0.22 -0.59 0.04 0.00 0.00 177.00 176.61 2wqk s PHE 200 N -2.07 0.59 0.05 0.56 -0.12 -0.35 -4.87 117.98 111.78 2wqk s PHE 200 Ca 0.65 -0.94 0.02 0.00 -0.05 0.00 0.00 56.93 56.60 2wqk s PHE 200 Cb -0.13 -0.20 -0.03 0.00 -0.63 0.00 0.00 43.02 42.03 2wqk s PHE 200 CO 0.17 -0.68 -0.08 0.71 -0.05 0.00 0.00 175.22 175.29 2wqk s TYR 201 N -4.01 0.70 -0.11 3.49 2.02 -1.26 -0.42 117.35 117.76 2wqk s TYR 201 Ca 0.21 -0.57 -0.01 0.00 -0.37 0.00 0.00 57.07 56.33 2wqk s TYR 201 Cb 0.04 -0.42 0.03 0.00 -0.40 0.00 0.00 41.96 41.22 2wqk s TYR 201 CO 0.02 -0.10 -0.03 -0.46 -1.57 0.00 0.00 175.55 173.41 2wqk s TRP 202 N -1.77 1.13 -0.29 2.71 -0.11 0.04 -4.96 118.94 115.69 2wqk s TRP 202 Ca -0.06 -0.54 -0.25 0.00 1.22 0.00 0.00 56.10 56.46 2wqk s TRP 202 Cb -0.07 -1.05 0.00 0.00 -1.50 0.00 0.00 33.47 30.85 2wqk s TRP 202 CO -0.01 -0.45 0.89 0.42 -4.62 0.00 0.00 176.95 173.18 2wqk s ILE 203 N 1.82 4.72 -0.01 5.86 1.01 -1.26 -0.88 121.20 132.47 2wqk s ILE 203 Ca 0.04 1.46 0.03 0.00 0.00 0.00 0.00 60.65 62.18 2wqk s ILE 203 Cb -0.13 -4.22 -0.03 0.00 0.01 0.00 0.00 42.46 38.09 2wqk s ILE 203 CO -0.07 -0.26 -0.06 0.00 0.00 0.00 0.00 174.94 174.55 2wqk s ALA 204 N 3.12 3.05 -0.25 9.38 0.00 0.89 -4.98 121.76 132.96 2wqk s ALA 204 Ca 0.37 -1.00 -0.10 0.00 0.00 0.00 0.00 51.96 51.23 2wqk s ALA 204 Cb -0.14 -1.17 -0.05 0.00 0.00 0.00 0.00 23.12 21.77 2wqk s ALA 204 CO 0.12 0.61 0.15 0.00 0.00 0.00 0.00 175.76 176.63 2wqk s ALA 205 N -0.99 3.47 0.22 0.00 0.00 -1.26 -1.14 121.76 122.06 2wqk s ALA 205 Ca 0.17 -1.01 0.11 0.00 0.00 0.00 0.00 51.96 51.23 2wqk s ALA 205 Cb -0.11 -2.31 -0.04 0.00 0.00 0.00 0.00 23.12 20.66 2wqk s ALA 205 CO 0.07 -0.37 -0.17 -1.21 0.00 0.00 0.00 175.76 174.08 2wqk s GLU 206 N 1.40 1.77 -1.34 0.00 0.41 0.79 -4.84 118.70 116.88 2wqk s GLU 206 Ca 0.07 -1.51 -0.02 0.00 -0.41 0.00 0.00 54.97 53.10 2wqk s GLU 206 Cb -0.15 -1.94 0.01 0.00 -1.78 0.00 0.00 34.13 30.28 2wqk s GLU 206 CO 0.07 0.39 0.74 0.39 -0.49 0.00 0.00 175.26 176.35 2wqk n GLU 207 N -0.11 -4.98 -1.68 1.61 1.02 -1.26 -0.52 120.64 114.72 2wqk n GLU 207 Ca -0.10 0.61 -0.43 0.00 -0.02 0.00 0.00 57.16 57.22 2wqk n GLU 207 Cb 0.57 -5.21 -0.03 0.00 -0.02 0.00 0.00 31.44 26.75 2wqk n GLU 207 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2wqk n PHE 208 N -4.34 2.56 -0.88 -0.32 7.35 -1.26 -2.68 117.46 117.89 2wqk n PHE 208 Ca -0.25 -0.18 0.00 0.00 -0.76 0.00 0.00 57.45 56.26 2wqk n PHE 208 Cb 0.66 -2.74 0.00 0.00 0.35 0.00 0.00 39.48 37.75 2wqk n PHE 208 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2wqk n GLY 209 N 4.30 0.72 0.30 7.13 0.00 0.75 -4.89 105.19 113.50 2wqk n GLY 209 Ca 0.19 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.37 2wqk n GLY 209 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2wqk h TRP 210 N 0.00 0.00 0.00 1.61 4.06 -1.76 -2.93 115.95 116.93 2wqk h TRP 210 Ca 0.00 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.91 2wqk h TRP 210 Cb 0.01 0.00 -0.10 0.00 -1.00 0.00 0.00 29.16 28.08 2wqk h TRP 210 CO 0.01 0.01 -0.55 0.72 -3.56 0.00 0.00 178.44 175.07 2wqk n HIS 211 N -3.70 0.00 -1.81 0.49 8.25 -1.26 -5.09 115.22 112.10 2wqk n HIS 211 Ca -0.03 -1.04 -0.42 0.00 -0.26 0.00 0.00 57.72 55.97 2wqk n HIS 211 Cb 0.09 -0.19 -0.03 0.00 1.12 0.00 0.00 29.99 30.98 2wqk n HIS 211 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2wqk s ALA 212 N -2.10 3.83 -0.15 -1.41 0.00 -1.11 -4.97 121.76 115.84 2wqk s ALA 212 Ca 0.33 1.51 -0.19 0.00 0.00 0.00 0.00 51.96 53.61 2wqk s ALA 212 Cb 0.33 -3.65 -0.04 0.00 0.00 0.00 0.00 23.12 19.76 2wqk s ALA 212 CO -0.07 -0.89 0.52 -1.21 0.00 0.00 0.00 175.76 174.11 2wqk s GLU 213 N 0.59 4.28 0.27 0.00 0.41 -1.26 -4.92 118.70 118.08 2wqk s GLU 213 Ca 0.69 0.48 -0.31 0.00 -0.41 0.00 0.00 54.97 55.43 2wqk s GLU 213 Cb -0.47 -3.50 -0.12 0.00 -1.78 0.00 0.00 34.13 28.26 2wqk s GLU 213 CO 0.37 0.00 1.55 -1.91 -0.49 0.00 0.00 175.26 174.79 2wqk n GLU 214 N 4.21 2.52 0.00 1.61 2.13 -1.26 -1.99 120.64 127.87 2wqk n GLU 214 Ca -0.05 0.90 0.00 0.00 0.66 0.00 0.00 57.16 58.67 2wqk n GLU 214 Cb 0.51 -2.65 0.00 0.00 0.27 0.00 0.00 31.44 29.57 2wqk n GLU 214 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2wqk n GLY 215 N 2.29 2.78 3.92 8.31 0.00 -1.26 -5.09 105.19 116.13 2wqk n GLY 215 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 2wqk n GLY 215 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wqk s THR 216 N -2.49 4.54 0.15 2.61 -4.23 -0.84 -1.55 115.64 113.83 2wqk s THR 216 Ca 0.00 0.03 -0.17 0.00 -1.18 0.00 0.00 61.69 60.37 2wqk s THR 216 Cb 0.00 -3.73 0.01 0.00 1.34 0.00 0.00 72.50 70.12 2wqk s THR 216 CO 0.00 -0.69 1.75 -2.24 -0.54 0.00 0.00 174.62 172.90 2wqk h ASP 217 N 0.19 0.10 -0.36 3.99 3.04 -1.42 -2.23 116.42 119.73 2wqk h ASP 217 Ca -0.47 0.04 0.05 0.00 -3.24 0.00 0.00 57.03 53.41 2wqk h ASP 217 Cb 1.22 0.03 -0.05 0.00 -1.04 0.00 0.00 39.33 39.50 2wqk h ASP 217 CO 0.61 0.09 0.08 1.88 -2.04 0.00 0.00 179.24 179.86 2wqk h TYR 218 N 0.24 0.14 -0.67 4.15 0.05 -1.92 -2.54 116.97 116.42 2wqk h TYR 218 Ca 0.15 0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.92 2wqk h TYR 218 Cb 0.13 -0.01 -0.03 0.00 1.01 0.00 0.00 36.73 37.83 2wqk h TYR 218 CO -0.15 0.03 0.31 2.35 -1.05 0.00 0.00 178.16 179.65 2wqk h TRP 219 N 0.21 0.97 0.20 4.88 7.01 -1.70 -1.04 115.95 126.48 2wqk h TRP 219 Ca 0.17 -0.05 0.01 0.00 2.11 0.00 0.00 58.89 61.12 2wqk h TRP 219 Cb 0.18 -0.30 -0.02 0.00 -2.10 0.00 0.00 29.16 26.93 2wqk h TRP 219 CO -0.18 0.74 -0.22 0.00 -2.79 0.00 0.00 178.44 175.99 2wqk h ALA 220 N 1.14 -0.43 -0.13 2.65 0.00 -1.13 -1.90 119.26 119.46 2wqk h ALA 220 Ca 0.23 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 2wqk h ALA 220 Cb 0.14 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2wqk h ALA 220 CO -0.03 -0.77 -0.57 -0.39 0.00 0.00 0.00 179.25 177.49 2wqk h VAL 221 N -0.45 1.35 0.00 0.00 -1.51 -1.25 -0.11 116.25 114.26 2wqk h VAL 221 Ca 0.00 -1.87 -0.02 0.00 -1.23 0.00 0.00 66.70 63.59 2wqk h VAL 221 Cb 0.43 1.87 -0.00 0.00 -2.13 0.00 0.00 31.29 31.47 2wqk h VAL 221 CO -0.06 0.57 -0.08 -0.07 -1.23 0.00 0.00 177.57 176.70 2wqk h LEU 222 N 0.31 0.00 -2.94 4.19 3.38 -1.03 -2.55 115.31 116.67 2wqk h LEU 222 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2wqk h LEU 222 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 2wqk h LEU 222 CO 0.10 0.08 0.00 0.59 0.09 0.00 0.00 178.44 179.30 2wqk n ASN 223 N -4.03 3.96 0.00 -0.43 3.02 -0.73 -4.96 115.26 112.09 2wqk n ASN 223 Ca -0.03 -2.20 0.00 0.00 -0.03 0.00 0.00 54.58 52.32 2wqk n ASN 223 Cb 0.16 -0.46 0.00 0.00 -0.61 0.00 0.00 39.78 38.87 2wqk n ASN 223 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wqk n GLY 224 N 1.08 0.68 3.70 7.41 0.00 -0.96 -4.90 105.19 112.20 2wqk n GLY 224 Ca 0.22 -0.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 2wqk n GLY 224 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wqk s TYR 225 N -2.00 3.04 0.26 1.61 2.02 -0.10 -0.99 117.35 121.19 2wqk s TYR 225 Ca 0.00 0.01 -0.30 0.00 -0.37 0.00 0.00 57.07 56.41 2wqk s TYR 225 Cb 0.00 -1.57 -0.09 0.00 -0.40 0.00 0.00 41.96 39.89 2wqk s TYR 225 CO 0.00 0.48 1.28 0.08 -1.57 0.00 0.00 175.55 175.82 2wqk s VAL 226 N -1.29 3.06 -0.19 0.71 1.01 -0.17 -3.10 120.40 120.43 2wqk s VAL 226 Ca 0.26 0.96 -0.07 0.00 0.00 0.00 0.00 61.98 63.13 2wqk s VAL 226 Cb -0.12 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 2wqk s VAL 226 CO 0.18 0.19 0.05 -0.55 0.00 0.00 0.00 175.10 174.97 2wqk s SER 227 N -0.14 5.48 -0.21 3.32 0.15 -0.33 -0.72 113.70 121.23 2wqk s SER 227 Ca 0.52 0.02 0.01 0.00 0.70 0.00 0.00 55.95 57.20 2wqk s SER 227 Cb -0.37 -1.94 0.05 0.00 -1.71 0.00 0.00 66.02 62.05 2wqk s SER 227 CO 0.44 0.14 -0.10 -0.69 1.20 0.00 0.00 173.24 174.24 2wqk s VAL 228 N 0.54 1.72 -0.17 4.45 1.01 -0.18 -1.17 120.40 126.60 2wqk s VAL 228 Ca 0.03 -1.14 -0.03 0.00 0.00 0.00 0.00 61.98 60.83 2wqk s VAL 228 Cb -0.13 -1.82 -0.02 0.00 0.00 0.00 0.00 36.38 34.40 2wqk s VAL 228 CO 0.01 0.10 -0.05 -0.89 0.00 0.00 0.00 175.10 174.28 2wqk s THR 229 N 1.35 3.70 -0.19 3.92 2.01 -0.12 -1.16 115.64 125.14 2wqk s THR 229 Ca -0.03 -0.42 -0.27 0.00 0.31 0.00 0.00 61.69 61.28 2wqk s THR 229 Cb -0.17 -2.63 -0.00 0.00 0.01 0.00 0.00 72.50 69.70 2wqk s THR 229 CO -0.08 0.48 0.93 -2.16 -0.69 0.00 0.00 174.62 173.10 2wqk s PRO 230 N 0.61 4.28 -0.06 4.92 0.04 -1.26 -1.11 135.00 142.42 2wqk s PRO 230 Ca -0.03 1.17 -0.02 0.00 0.04 0.00 0.00 61.00 62.16 2wqk s PRO 230 Cb -0.15 -3.61 -0.04 0.00 0.04 0.00 0.00 34.50 30.75 2wqk s PRO 230 CO 0.03 -0.47 0.06 -0.51 0.04 0.00 0.00 177.00 176.15 2wqk s LEU 231 N 2.62 3.88 0.29 -3.56 1.43 -0.13 -4.96 118.68 118.26 2wqk s LEU 231 Ca 0.41 0.22 -0.29 0.00 -1.03 0.00 0.00 54.13 53.43 2wqk s LEU 231 Cb -0.16 -2.06 -0.10 0.00 0.03 0.00 0.00 46.19 43.90 2wqk s LEU 231 CO 0.10 0.34 1.33 -1.00 0.23 0.00 0.00 176.35 177.35 2wqk s HIS 232 N -1.04 3.09 -0.02 0.29 3.76 -1.26 -1.96 115.29 118.15 2wqk s HIS 232 Ca 0.18 1.32 -0.20 0.00 -0.15 0.00 0.00 55.06 56.20 2wqk s HIS 232 Cb -0.12 -3.68 -0.30 0.00 1.11 0.00 0.00 32.58 29.59 2wqk s HIS 232 CO 0.07 -1.98 0.96 1.25 -0.85 0.00 0.00 174.74 174.20 2wqk h LEU 233 N 4.05 0.55 -8.98 0.89 5.85 -1.89 -3.44 115.31 112.33 2wqk h LEU 233 Ca -0.48 -0.90 -0.60 0.00 0.84 0.00 0.00 57.88 56.74 2wqk h LEU 233 Cb 1.22 -0.18 -0.10 0.00 0.37 0.00 0.00 40.66 41.98 2wqk h LEU 233 CO 0.70 1.41 0.42 -0.62 -0.34 0.00 0.00 178.44 180.01 2wqk s ASP 234 N -7.03 6.74 0.00 1.25 -1.08 -1.26 -4.92 116.67 110.37 2wqk s ASP 234 Ca -0.13 0.86 0.28 0.00 -0.52 0.00 0.00 52.55 53.05 2wqk s ASP 234 Cb 0.02 -2.42 1.11 0.00 -1.46 0.00 0.00 42.92 40.17 2wqk s ASP 234 CO 0.85 -0.54 1.82 0.18 0.52 0.00 0.00 175.17 178.00 2wqk n LEU 235 N 6.07 0.17 -4.73 -1.34 4.77 -1.26 -4.91 117.00 115.77 2wqk n LEU 235 Ca 0.04 0.30 -0.42 0.00 -0.03 0.00 0.00 56.01 55.91 2wqk n LEU 235 Cb 0.48 -0.38 -0.03 0.00 -2.33 0.00 0.00 43.42 41.16 2wqk n LEU 235 CO 0.48 0.04 1.16 -0.89 -1.33 0.00 0.00 177.39 176.85 2wqk s THR 236 N -2.89 2.74 -1.13 -5.08 2.01 -1.26 -4.93 115.64 105.10 2wqk s THR 236 Ca 0.17 0.56 -0.16 0.00 0.31 0.00 0.00 61.69 62.56 2wqk s THR 236 Cb 0.19 -3.36 0.14 0.00 0.01 0.00 0.00 72.50 69.48 2wqk s THR 236 CO 0.55 0.06 1.39 0.21 -0.69 0.00 0.00 174.62 176.14 2wqk s ASN 237 N 0.88 6.89 0.30 3.53 3.84 -1.26 -4.87 114.94 124.25 2wqk s ASN 237 Ca 0.66 -2.58 -0.02 0.00 0.21 0.00 0.00 52.86 51.13 2wqk s ASN 237 Cb -0.42 -2.43 0.44 0.00 -0.55 0.00 0.00 41.25 38.29 2wqk s ASN 237 CO 0.35 -0.93 1.97 1.88 -2.79 0.00 0.00 177.10 177.58 2wqk h TYR 238 N 7.82 1.04 -0.99 0.43 0.05 -1.99 -2.97 116.97 120.36 2wqk h TYR 238 Ca 0.28 0.02 0.10 0.00 0.05 0.00 0.00 58.73 59.19 2wqk h TYR 238 Cb 0.92 -0.35 -0.08 0.00 1.01 0.00 0.00 36.73 38.23 2wqk h TYR 238 CO 1.17 0.66 0.63 -0.22 -1.05 0.00 0.00 178.16 179.35 2wqk h LYS 239 N 1.13 1.02 -0.13 4.88 3.64 -2.04 -2.75 116.57 122.32 2wqk h LYS 239 Ca 0.30 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.62 2wqk h LYS 239 Cb -0.13 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.46 2wqk h LYS 239 CO -0.07 0.67 0.00 1.33 -2.27 0.00 0.00 179.45 179.12 2wqk n VAL 240 N -4.57 0.16 -0.32 2.00 0.24 -1.12 -4.28 118.33 110.45 2wqk n VAL 240 Ca 0.17 -0.38 0.04 0.00 -2.04 0.00 0.00 64.34 62.13 2wqk n VAL 240 Cb 0.29 0.60 0.18 0.00 -1.47 0.00 0.00 33.84 33.44 2wqk n VAL 240 CO 0.00 0.00 0.00 0.24 -2.14 0.00 0.00 176.83 174.93 2wqk h MET 241 N 2.79 0.88 -0.08 7.34 2.86 -1.55 0.16 114.93 127.34 2wqk h MET 241 Ca 0.00 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.61 2wqk h MET 241 Cb 0.60 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 32.06 2wqk h MET 241 CO 0.00 0.58 0.07 1.57 1.06 0.00 0.00 176.91 180.19 2wqk h LYS 242 N 0.90 0.00 -0.00 1.72 2.10 -1.82 -1.66 116.57 117.81 2wqk h LYS 242 Ca 0.42 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.07 2wqk h LYS 242 Cb 0.34 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.67 2wqk h LYS 242 CO -0.23 0.00 -0.10 0.43 -2.00 0.00 0.00 179.45 177.54 2wqk n SER 243 N -4.10 0.56 -0.03 7.07 7.64 0.04 -3.20 113.62 121.61 2wqk n SER 243 Ca -0.01 -0.70 0.02 0.00 1.01 0.00 0.00 58.87 59.18 2wqk n SER 243 Cb 0.17 -0.05 0.03 0.00 -1.01 0.00 0.00 64.21 63.35 2wqk n SER 243 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 2wqk n ILE 244 N -0.84 1.16 0.32 0.44 -5.35 -0.64 -4.68 119.36 109.76 2wqk n ILE 244 Ca 0.15 -1.22 0.15 0.00 -0.27 0.00 0.00 62.75 61.57 2wqk n ILE 244 Cb 0.28 0.37 0.66 0.00 -1.74 0.00 0.00 39.64 39.21 2wqk n ILE 244 CO 0.00 0.00 0.00 0.11 -1.76 0.00 0.00 176.55 174.90 2wqk h LYS 245 N 0.04 0.00 -0.18 6.28 1.79 -1.47 -1.51 116.57 121.52 2wqk h LYS 245 Ca 0.00 0.00 0.05 0.00 -2.18 0.00 0.00 60.65 58.52 2wqk h LYS 245 Cb 0.59 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.24 2wqk h LYS 245 CO 0.00 0.00 0.29 0.10 -1.08 0.00 0.00 179.45 178.76 2wqk h TYR 246 N 0.00 0.00 0.00 -1.35 -0.00 -1.83 -0.84 116.97 112.95 2wqk h TYR 246 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 2wqk h TYR 246 Cb 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.08 2wqk h TYR 246 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 178.16 178.09 2wqk h LEU 247 N 0.00 0.00 0.00 0.10 3.38 -1.65 -2.58 115.31 114.56 2wqk h LEU 247 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2wqk h LEU 247 Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 2wqk h LEU 247 CO -0.00 0.00 -0.26 -0.62 0.09 0.00 0.00 178.44 177.65 2wqk n GLU 248 N -2.61 0.23 0.00 1.13 1.02 -0.32 -5.23 120.64 114.86 2wqk n GLU 248 Ca 0.02 0.13 0.09 0.00 -0.02 0.00 0.00 57.16 57.38 2wqk n GLU 248 Cb 0.27 -1.71 0.55 0.00 -0.02 0.00 0.00 31.44 30.53 2wqk n GLU 248 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06