#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 -0.75 115.64 119.68 2wqk s THR 3 Ca 0.00 -0.27 0.06 0.00 0.31 0.00 0.00 61.69 61.79 2wqk s THR 3 Cb 0.00 -0.58 -0.01 0.00 0.01 0.00 0.00 72.50 71.91 2wqk s THR 3 CO 0.00 0.21 -0.24 -0.36 -0.69 0.00 0.00 174.62 173.54 2wqk s PHE 4 N 0.29 2.45 -0.34 4.92 0.08 0.47 -0.34 117.98 125.51 2wqk s PHE 4 Ca -0.04 -0.60 -0.13 0.00 0.12 0.00 0.00 56.93 56.29 2wqk s PHE 4 Cb -0.08 -1.59 -0.02 0.00 -0.57 0.00 0.00 43.02 40.76 2wqk s PHE 4 CO 0.00 -0.14 0.23 -1.17 -0.10 0.00 0.00 175.22 174.05 2wqk s LEU 5 N -0.31 4.48 -0.17 -0.37 2.96 -0.63 -0.43 118.68 124.22 2wqk s LEU 5 Ca 0.01 -0.41 -0.01 0.00 -0.22 0.00 0.00 54.13 53.49 2wqk s LEU 5 Cb -0.13 -2.13 -0.01 0.00 0.50 0.00 0.00 46.19 44.43 2wqk s LEU 5 CO 0.02 -0.23 -0.11 -0.22 -1.32 0.00 0.00 176.35 174.50 2wqk s LEU 6 N 1.72 2.71 0.33 -0.68 2.96 0.11 -0.73 118.68 125.11 2wqk s LEU 6 Ca 0.06 -0.38 0.03 0.00 -0.22 0.00 0.00 54.13 53.62 2wqk s LEU 6 Cb -0.17 -1.64 -0.05 0.00 0.50 0.00 0.00 46.19 44.82 2wqk s LEU 6 CO 0.10 0.08 0.08 0.68 -1.32 0.00 0.00 176.35 175.98 2wqk s VAL 7 N 0.84 0.97 0.21 1.68 -7.23 -0.29 -1.60 120.40 114.97 2wqk s VAL 7 Ca -0.03 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.08 2wqk s VAL 7 Cb -0.15 -2.67 0.02 0.00 0.56 0.00 0.00 36.38 34.14 2wqk s VAL 7 CO 0.01 0.00 0.37 -0.46 -0.31 0.00 0.00 175.10 174.70 2wqk n ASN 8 N -0.79 -1.05 -0.00 4.85 6.94 -1.26 -1.28 115.26 122.67 2wqk n ASN 8 Ca -0.03 -1.94 0.04 0.00 -0.02 0.00 0.00 54.58 52.63 2wqk n ASN 8 Cb 0.66 1.81 -0.05 0.00 -2.36 0.00 0.00 39.78 39.84 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 -1.51 1.17 0.05 0.53 2.03 -1.26 -4.37 116.55 113.19 2wqk n ASP 9 Ca -0.03 -0.49 0.12 0.00 0.52 0.00 0.00 54.79 54.91 2wqk n ASP 9 Cb 0.32 1.11 0.14 0.00 -0.72 0.00 0.00 41.12 41.97 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 -1.35 0.67 0.00 1.67 8.00 -1.26 -0.81 116.55 123.47 2wqk n ASP 10 Ca 0.01 0.04 0.00 0.00 0.71 0.00 0.00 54.79 55.55 2wqk n ASP 10 Cb 0.15 0.30 0.00 0.00 -0.02 0.00 0.00 41.12 41.55 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 1.35 3.02 0.31 0.44 0.00 -1.24 -3.33 105.19 105.75 2wqk n GLY 11 Ca 0.03 -1.78 0.19 0.00 0.00 0.00 0.00 46.02 44.46 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 -1.22 -2.05 116.97 115.30 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 0.02 -0.17 1.97 -0.00 0.00 0.00 178.16 179.97 2wqk n PHE 13 N -3.36 0.00 -2.07 0.10 1.16 -1.26 -4.72 117.46 107.32 2wqk n PHE 13 Ca -0.03 0.00 -0.38 0.00 -1.87 0.00 0.00 57.45 55.17 2wqk n PHE 13 Cb 0.12 -0.09 0.00 0.00 -1.61 0.00 0.00 39.48 37.90 2wqk n PHE 13 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 2wqk s SER 14 N -2.35 6.05 0.52 5.98 0.15 -0.77 -4.91 113.70 118.36 2wqk s SER 14 Ca 0.29 2.55 0.21 0.00 0.70 0.00 0.00 55.95 59.71 2wqk s SER 14 Cb 0.20 -2.63 1.37 0.00 -1.71 0.00 0.00 66.02 63.25 2wqk s SER 14 CO 0.46 -1.02 2.11 1.55 1.20 0.00 0.00 173.24 177.55 2wqk h PRO 15 N 2.21 0.00 -0.21 5.44 0.13 -1.93 -2.66 132.00 134.98 2wqk h PRO 15 Ca -0.50 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.55 2wqk h PRO 15 Cb 1.26 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 2wqk h PRO 15 CO 0.61 0.08 -0.17 0.78 -0.23 0.00 0.00 178.00 179.06 2wqk h GLY 16 N 0.34 0.53 1.33 1.56 0.00 -1.91 -0.38 103.07 104.53 2wqk h GLY 16 Ca -0.00 -0.52 -0.17 0.00 0.00 0.00 0.00 47.33 46.64 2wqk h GLY 16 CO 0.01 0.47 -0.51 1.19 0.00 0.00 0.00 176.54 177.71 2wqk h ILE 17 N 0.17 1.30 -0.32 2.60 2.10 -1.66 -2.57 117.51 119.12 2wqk h ILE 17 Ca 0.04 -1.72 -0.17 0.00 1.08 0.00 0.00 64.86 64.09 2wqk h ILE 17 Cb 0.71 1.64 -0.00 0.00 -1.09 0.00 0.00 36.82 38.08 2wqk h ILE 17 CO 0.04 0.55 -0.48 0.78 -1.08 0.00 0.00 178.15 177.96 2wqk h ASN 18 N 0.56 0.97 -0.57 2.19 2.35 -1.45 -0.19 115.58 119.44 2wqk h ASN 18 Ca 0.02 -0.49 0.02 0.00 -0.55 0.00 0.00 56.30 55.30 2wqk h ASN 18 Cb 1.08 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 39.14 2wqk h ASN 18 CO 0.11 1.28 0.35 0.00 -1.65 0.00 0.00 177.43 177.52 2wqk h ALA 19 N 0.74 0.73 -0.35 -0.83 0.00 -1.07 -0.83 119.26 117.64 2wqk h ALA 19 Ca 0.03 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2wqk h ALA 19 Cb 1.08 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2wqk h ALA 19 CO 0.11 0.09 -0.08 1.25 0.00 0.00 0.00 179.25 180.62 2wqk h LEU 20 N 0.71 0.69 -0.16 0.00 5.85 -1.29 -2.33 115.31 118.77 2wqk h LEU 20 Ca 0.22 -0.36 0.04 0.00 0.84 0.00 0.00 57.88 58.62 2wqk h LEU 20 Cb -0.01 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.79 2wqk h LEU 20 CO -0.08 0.89 -0.13 -0.09 -0.34 0.00 0.00 178.44 178.69 2wqk h ARG 21 N 0.47 -0.13 -0.24 1.25 2.43 -0.77 -1.12 114.38 116.27 2wqk h ARG 21 Ca 0.09 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.29 2wqk h ARG 21 Cb 0.59 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.15 2wqk h ARG 21 CO 0.03 -0.09 0.11 0.93 -1.51 0.00 0.00 179.97 179.45 2wqk h GLU 22 N -0.14 0.24 -0.69 0.20 4.39 -1.07 -2.79 114.58 114.72 2wqk h GLU 22 Ca 0.10 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.76 2wqk h GLU 22 Cb 0.28 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.85 2wqk h GLU 22 CO -0.24 0.16 0.34 0.00 -1.16 0.00 0.00 179.01 178.11 2wqk h ALA 23 N 1.13 1.30 0.00 3.43 0.00 -1.24 -3.02 119.26 120.86 2wqk h ALA 23 Ca 0.10 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2wqk h ALA 23 Cb 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2wqk h ALA 23 CO -0.07 0.55 0.00 -0.07 0.00 0.00 0.00 179.25 179.66 2wqk h LEU 24 N 0.98 0.00 -1.87 0.00 3.38 -0.94 -3.23 115.31 113.63 2wqk h LEU 24 Ca 0.24 0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.38 2wqk h LEU 24 Cb 0.09 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2wqk h LEU 24 CO -0.03 0.00 0.46 0.11 0.09 0.00 0.00 178.44 179.07 2wqk h LYS 25 N 0.00 0.12 0.00 1.13 1.57 -1.38 0.40 116.57 118.41 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 0.52 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.80 2wqk h LYS 25 CO 0.00 0.08 0.00 0.77 -0.57 0.00 0.00 179.45 179.73 2wqk h SER 26 N 0.12 0.00 0.00 0.86 0.02 -1.79 -3.18 113.55 109.59 2wqk h SER 26 Ca 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 2wqk h SER 26 Cb 1.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.62 2wqk h SER 26 CO -0.04 0.00 -1.92 0.18 -1.14 0.00 0.00 176.83 173.91 2wqk n LEU 27 N -3.03 0.05 0.00 5.07 4.77 0.12 -5.10 117.00 118.89 2wqk n LEU 27 Ca -0.01 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 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 0.23 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 2wqk n GLY 28 N 1.30 -0.72 3.66 -0.72 0.00 -1.14 -4.21 105.19 103.36 2wqk n GLY 28 Ca -0.03 -0.90 -0.40 0.00 0.00 0.00 0.00 46.02 44.69 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 -1.01 4.22 -0.26 1.61 3.52 0.07 -4.40 118.95 122.70 2wqk s ARG 29 Ca 0.00 0.56 -0.10 0.00 -0.13 0.00 0.00 55.73 56.06 2wqk s ARG 29 Cb 0.00 -3.56 -0.04 0.00 -1.56 0.00 0.00 34.95 29.78 2wqk s ARG 29 CO 0.00 -0.19 0.15 0.08 -0.81 0.00 0.00 175.30 174.53 2wqk s VAL 30 N 1.74 5.07 -0.26 7.11 1.01 -1.26 -0.40 120.40 133.41 2wqk s VAL 30 Ca 0.28 0.08 -0.04 0.00 0.00 0.00 0.00 61.98 62.30 2wqk s VAL 30 Cb -0.16 -3.39 0.01 0.00 0.00 0.00 0.00 36.38 32.85 2wqk s VAL 30 CO 0.10 0.31 -0.00 -0.69 0.00 0.00 0.00 175.10 174.82 2wqk s VAL 31 N 1.47 3.38 -0.16 2.92 1.01 0.42 -4.87 120.40 124.57 2wqk s VAL 31 Ca 0.07 -0.82 -0.11 0.00 0.00 0.00 0.00 61.98 61.11 2wqk s VAL 31 Cb -0.15 -2.70 -0.05 0.00 0.00 0.00 0.00 36.38 33.48 2wqk s VAL 31 CO 0.07 0.18 0.20 -0.69 0.00 0.00 0.00 175.10 174.86 2wqk s VAL 32 N 1.41 5.37 -0.13 2.92 1.01 -0.32 -0.71 120.40 129.96 2wqk s VAL 32 Ca 0.02 0.34 -0.03 0.00 0.00 0.00 0.00 61.98 62.31 2wqk s VAL 32 Cb -0.17 -3.52 0.04 0.00 0.00 0.00 0.00 36.38 32.74 2wqk s VAL 32 CO -0.02 0.46 0.04 -0.69 0.00 0.00 0.00 175.10 174.89 2wqk s VAL 33 N 0.09 0.29 0.05 2.92 1.01 -0.63 -0.54 120.40 123.59 2wqk s VAL 33 Ca 0.13 -0.12 -0.04 0.00 0.00 0.00 0.00 61.98 61.94 2wqk s VAL 33 Cb -0.12 -0.66 -0.02 0.00 0.00 0.00 0.00 36.38 35.58 2wqk s VAL 33 CO 0.02 -0.00 0.07 0.00 0.00 0.00 0.00 175.10 175.18 2wqk s ALA 34 N 1.99 0.09 0.87 5.51 0.00 -0.73 -4.16 121.76 125.33 2wqk s ALA 34 Ca 0.02 -0.77 -0.11 0.00 0.00 0.00 0.00 51.96 51.10 2wqk s ALA 34 Cb -0.14 0.30 0.12 0.00 0.00 0.00 0.00 23.12 23.39 2wqk s ALA 34 CO -0.07 -0.36 1.16 -2.14 0.00 0.00 0.00 175.76 174.35 2wqk s PRO 35 N -3.20 1.32 0.00 0.00 0.02 -1.26 -1.39 135.00 130.48 2wqk s PRO 35 Ca 0.00 1.58 0.16 0.00 0.02 0.00 0.00 61.00 62.77 2wqk s PRO 35 Cb 0.02 -1.76 0.58 0.00 0.02 0.00 0.00 34.50 33.36 2wqk s PRO 35 CO -0.07 -2.42 1.43 -0.40 -0.33 0.00 0.00 177.00 175.21 2wqk n ASP 36 N -3.88 1.64 -3.64 2.53 5.75 -1.09 -0.80 116.55 117.06 2wqk n ASP 36 Ca 0.12 -1.82 -0.09 0.00 -0.01 0.00 0.00 54.79 52.99 2wqk n ASP 36 Cb 0.52 -0.15 -0.02 0.00 -1.03 0.00 0.00 41.12 40.44 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 -1.70 1.48 -0.24 0.11 1.70 -1.26 -4.87 118.95 114.17 2wqk s ARG 37 Ca 0.28 -0.71 -0.29 0.00 -0.47 0.00 0.00 55.73 54.55 2wqk s ARG 37 Cb 0.15 0.57 0.01 0.00 -0.57 0.00 0.00 34.95 35.11 2wqk s ARG 37 CO 0.21 -0.66 1.03 1.21 -1.08 0.00 0.00 175.30 176.01 2wqk s ASN 38 N -2.82 7.07 -0.12 -2.89 3.84 -1.21 -3.64 114.94 115.17 2wqk s ASN 38 Ca 0.06 1.34 0.15 0.00 0.21 0.00 0.00 52.86 54.62 2wqk s ASN 38 Cb -0.03 -2.53 0.50 0.00 -0.55 0.00 0.00 41.25 38.63 2wqk s ASN 38 CO -0.03 -0.67 1.41 0.18 -2.79 0.00 0.00 177.10 175.20 2wqk n LEU 39 N 6.34 3.78 -0.33 3.21 4.77 0.01 -4.70 117.00 130.08 2wqk n LEU 39 Ca 0.12 -2.61 0.07 0.00 -0.03 0.00 0.00 56.01 53.56 2wqk n LEU 39 Cb 0.46 -0.45 0.27 0.00 -2.33 0.00 0.00 43.42 41.36 2wqk n LEU 39 CO 0.52 0.71 1.24 0.28 -1.33 0.00 0.00 177.39 178.81 2wqk h SER 40 N 2.27 0.88 0.05 -1.43 0.02 -1.91 -2.62 113.55 110.80 2wqk h SER 40 Ca 0.00 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 2wqk h SER 40 Cb 1.24 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.64 2wqk h SER 40 CO 0.17 0.49 -0.04 0.61 -1.14 0.00 0.00 176.83 176.91 2wqk n GLY 41 N -1.38 -0.31 0.00 -3.77 0.00 -1.26 -4.86 105.19 93.61 2wqk n GLY 41 Ca 0.17 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.20 0.00 -2.19 1.61 0.24 -0.99 -5.13 118.33 111.67 2wqk n VAL 42 Ca 0.19 0.00 -0.34 0.00 -2.04 0.00 0.00 64.34 62.15 2wqk n VAL 42 Cb 0.31 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.68 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 -0.50 2.42 0.00 7.63 0.00 -1.26 -4.98 107.32 110.62 2wqk s GLY 43 Ca 0.00 0.64 0.00 0.00 0.00 0.00 0.00 44.72 45.36 2wqk s GLY 43 CO 0.00 0.98 0.69 1.42 0.00 0.00 0.00 173.10 176.19 2wqk n HIS 44 N -1.57 0.00 -1.25 1.90 -0.00 -1.26 -4.90 115.22 108.13 2wqk n HIS 44 Ca 0.10 -0.23 -0.29 0.00 -0.00 0.00 0.00 57.72 57.30 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 -0.45 3.38 0.18 0.41 1.04 -1.26 -4.32 113.70 112.68 2wqk s SER 45 Ca 0.00 1.36 -0.30 0.00 0.48 0.00 0.00 55.95 57.49 2wqk s SER 45 Cb 0.00 -2.04 -0.08 0.00 0.10 0.00 0.00 66.02 64.00 2wqk s SER 45 CO 0.00 -2.68 1.26 -0.22 0.98 0.00 0.00 173.24 172.59 2wqk s LEU 46 N -6.22 4.42 -0.42 2.42 2.96 -1.26 -4.67 118.68 115.92 2wqk s LEU 46 Ca 0.64 2.30 -0.21 0.00 -0.22 0.00 0.00 54.13 56.64 2wqk s LEU 46 Cb -0.17 -3.61 0.02 0.00 0.50 0.00 0.00 46.19 42.93 2wqk s LEU 46 CO 0.57 -0.47 0.69 -0.89 -1.32 0.00 0.00 176.35 174.93 2wqk s THR 47 N 0.17 4.79 -0.03 3.68 2.01 -1.26 -4.88 115.64 120.11 2wqk s THR 47 Ca 0.56 0.36 0.12 0.00 0.31 0.00 0.00 61.69 63.04 2wqk s THR 47 Cb -0.34 -4.21 -0.18 0.00 0.01 0.00 0.00 72.50 67.78 2wqk s THR 47 CO 0.36 -0.56 0.24 0.49 -0.69 0.00 0.00 174.62 174.47 2wqk n PHE 48 N 6.35 0.00 0.85 4.92 3.01 -1.26 -4.69 117.46 126.64 2wqk n PHE 48 Ca -0.00 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.56 2wqk n PHE 48 Cb 0.48 -0.31 0.05 0.00 -0.01 0.00 0.00 39.48 39.69 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 -1.98 0.00 -3.84 4.37 -2.24 -1.26 -4.93 114.28 104.39 2wqk n THR 49 Ca -0.04 -0.43 -0.11 0.00 -2.27 0.00 0.00 64.05 61.20 2wqk n THR 49 Cb 0.38 1.35 -0.09 0.00 -2.10 0.00 0.00 70.33 69.87 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 -1.87 0.65 0.77 -0.78 0.41 -1.26 -5.16 118.70 111.46 2wqk s GLU 50 Ca 0.21 -0.55 -0.12 0.00 -0.41 0.00 0.00 54.97 54.10 2wqk s GLU 50 Cb 0.16 0.27 0.05 0.00 -1.78 0.00 0.00 34.13 32.84 2wqk s GLU 50 CO 0.34 -0.18 1.14 -1.25 -0.49 0.00 0.00 175.26 174.82 2wqk s PRO 51 N -2.23 2.31 -0.06 0.39 0.04 -1.26 -4.96 135.00 129.22 2wqk s PRO 51 Ca -0.08 0.27 0.00 0.00 0.04 0.00 0.00 61.00 61.24 2wqk s PRO 51 Cb -0.03 -1.98 0.02 0.00 0.04 0.00 0.00 34.50 32.56 2wqk s PRO 51 CO -0.02 -1.39 -0.05 -0.51 0.04 0.00 0.00 177.00 175.08 2wqk s LEU 52 N -5.51 1.14 0.20 -3.56 1.43 -1.26 -5.12 118.68 106.00 2wqk s LEU 52 Ca 0.60 -0.16 -0.30 0.00 -1.03 0.00 0.00 54.13 53.24 2wqk s LEU 52 Cb -0.11 -0.55 -0.08 0.00 0.03 0.00 0.00 46.19 45.48 2wqk s LEU 52 CO 0.50 -0.09 0.97 -0.54 0.23 0.00 0.00 176.35 177.42 2wqk s LYS 53 N 1.30 4.77 -0.07 1.70 1.02 -1.26 -4.96 119.74 122.24 2wqk s LYS 53 Ca -0.05 1.52 0.01 0.00 0.02 0.00 0.00 55.97 57.47 2wqk s LYS 53 Cb -0.14 -3.30 0.02 0.00 -0.52 0.00 0.00 37.83 33.89 2wqk s LYS 53 CO -0.02 0.37 -0.08 1.41 -0.92 0.00 0.00 175.35 176.11 2wqk s MET 54 N -0.78 1.26 -0.03 1.68 1.75 -1.26 -0.98 119.30 120.94 2wqk s MET 54 Ca 0.44 -0.23 0.07 0.00 -1.25 0.00 0.00 55.69 54.71 2wqk s MET 54 Cb -0.26 -1.19 -0.02 0.00 2.84 0.00 0.00 34.83 36.21 2wqk s MET 54 CO 0.32 -0.09 -0.24 0.50 -0.65 0.00 0.00 175.02 174.86 2wqk s ARG 55 N 1.03 2.12 -0.20 4.11 3.52 0.21 -4.97 118.95 124.78 2wqk s ARG 55 Ca -0.09 -0.87 -0.26 0.00 -0.13 0.00 0.00 55.73 54.39 2wqk s ARG 55 Cb -0.14 -1.96 -0.01 0.00 -1.56 0.00 0.00 34.95 31.28 2wqk s ARG 55 CO -0.00 0.47 0.89 0.21 -0.81 0.00 0.00 175.30 176.05 2wqk s LYS 56 N -0.42 4.26 -0.11 5.12 2.20 -1.26 -0.84 119.74 128.68 2wqk s LYS 56 Ca 0.05 1.09 -0.08 0.00 -0.36 0.00 0.00 55.97 56.67 2wqk s LYS 56 Cb -0.11 -3.61 -0.27 0.00 -1.51 0.00 0.00 37.83 32.34 2wqk s LYS 56 CO 0.01 -0.45 0.42 0.82 -0.36 0.00 0.00 175.35 175.78 2wqk h ILE 57 N 5.32 0.69 -2.61 5.43 2.04 -0.95 -3.49 117.51 123.94 2wqk h ILE 57 Ca -0.25 -2.36 0.08 0.00 1.00 0.00 0.00 64.86 63.33 2wqk h ILE 57 Cb 1.10 2.55 -0.01 0.00 -0.74 0.00 0.00 36.82 39.72 2wqk h ILE 57 CO 0.88 0.88 0.43 -0.67 0.00 0.00 0.00 178.15 179.67 2wqk n ASP 58 N -3.53 -1.73 -4.67 1.72 2.03 -0.92 -5.03 116.55 104.42 2wqk n ASP 58 Ca -0.31 -2.03 -0.46 0.00 0.52 0.00 0.00 54.79 52.51 2wqk n ASP 58 Cb 1.04 2.85 -0.04 0.00 -0.72 0.00 0.00 41.12 44.24 2wqk n ASP 58 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2wqk n THR 59 N -0.59 0.07 -2.44 5.18 -1.04 -1.26 -1.32 114.28 112.89 2wqk n THR 59 Ca -0.04 -0.01 -0.18 0.00 -2.04 0.00 0.00 64.05 61.78 2wqk n THR 59 Cb 0.52 -1.56 -0.01 0.00 -1.82 0.00 0.00 70.33 67.47 2wqk n THR 59 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2wqk n ASP 60 N 3.77 -5.19 -3.52 8.00 8.00 -1.26 -4.94 116.55 121.40 2wqk n ASP 60 Ca 0.18 0.05 -0.21 0.00 0.71 0.00 0.00 54.79 55.52 2wqk n ASP 60 Cb 0.29 -4.35 -0.14 0.00 -0.02 0.00 0.00 41.12 36.90 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 -2.89 -0.13 0.09 1.24 5.36 -0.43 -1.17 117.98 120.05 2wqk s PHE 61 Ca 0.01 -0.00 0.06 0.00 -0.96 0.00 0.00 56.93 56.04 2wqk s PHE 61 Cb -0.00 -0.49 -0.03 0.00 -0.34 0.00 0.00 43.02 42.16 2wqk s PHE 61 CO 0.01 -0.60 -0.16 0.71 -1.46 0.00 0.00 175.22 173.72 2wqk s TYR 62 N 2.26 1.40 0.04 10.12 2.02 0.30 -0.21 117.35 133.29 2wqk s TYR 62 Ca 0.06 -0.47 0.08 0.00 -0.37 0.00 0.00 57.07 56.37 2wqk s TYR 62 Cb -0.16 -0.77 -0.03 0.00 -0.40 0.00 0.00 41.96 40.61 2wqk s TYR 62 CO -0.13 0.12 -0.23 -0.08 -1.57 0.00 0.00 175.55 173.65 2wqk s THR 63 N -1.43 1.88 -0.28 -0.71 -1.32 -0.02 -1.78 115.64 111.98 2wqk s THR 63 Ca 0.03 -1.29 -0.08 0.00 -1.21 0.00 0.00 61.69 59.14 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 0.03 0.28 0.09 -0.69 -2.21 0.00 0.00 174.62 172.12 2wqk s VAL 64 N -0.80 4.31 -0.21 5.08 1.01 -0.49 -0.62 120.40 128.68 2wqk s VAL 64 Ca 0.09 -0.36 -0.29 0.00 0.00 0.00 0.00 61.98 61.42 2wqk s VAL 64 Cb -0.09 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.15 2wqk s VAL 64 CO 0.02 0.20 1.58 -0.63 0.00 0.00 0.00 175.10 176.27 2wqk s ILE 65 N 1.59 3.75 -1.60 2.22 -1.09 -0.16 -1.85 121.20 124.06 2wqk s ILE 65 Ca 0.05 0.85 -0.00 0.00 -2.23 0.00 0.00 60.65 59.32 2wqk s ILE 65 Cb -0.16 -3.73 0.00 0.00 -1.58 0.00 0.00 42.46 36.98 2wqk s ILE 65 CO 0.04 -0.28 0.02 -0.67 -1.23 0.00 0.00 174.94 172.81 2wqk n ASP 66 N 8.21 -5.42 -4.71 3.58 2.03 -1.26 -4.48 116.55 114.50 2wqk n ASP 66 Ca 0.18 0.03 -0.39 0.00 0.52 0.00 0.00 54.79 55.13 2wqk n ASP 66 Cb 0.45 -4.52 -0.05 0.00 -0.72 0.00 0.00 41.12 36.27 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 -2.06 2.43 0.87 0.27 0.00 -0.77 -5.04 107.32 103.00 2wqk s GLY 67 Ca 0.01 -0.08 -0.11 0.00 0.00 0.00 0.00 44.72 44.54 2wqk s GLY 67 CO 0.01 1.02 1.09 -0.51 0.00 0.00 0.00 173.10 174.72 2wqk s THR 68 N 0.91 2.82 0.29 0.90 -4.23 -1.26 -4.26 115.64 110.80 2wqk s THR 68 Ca 0.31 0.27 0.03 0.00 -1.18 0.00 0.00 61.69 61.12 2wqk s THR 68 Cb -0.16 -2.71 0.28 0.00 1.34 0.00 0.00 72.50 71.25 2wqk s THR 68 CO 0.13 -0.35 1.78 -0.65 -0.54 0.00 0.00 174.62 174.99 2wqk h PRO 69 N -1.47 0.72 -0.40 3.99 0.11 -1.82 0.16 132.00 133.30 2wqk h PRO 69 Ca -0.48 -0.04 0.06 0.00 0.11 0.00 0.00 66.00 65.65 2wqk h PRO 69 Cb 1.27 -0.16 -0.05 0.00 0.11 0.00 0.00 31.00 32.16 2wqk h PRO 69 CO 0.53 0.48 0.09 0.00 -0.21 0.00 0.00 178.00 178.89 2wqk h ALA 70 N 1.61 0.44 -0.57 -0.75 0.00 -1.86 -0.03 119.26 118.10 2wqk h ALA 70 Ca 0.53 0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.55 2wqk h ALA 70 Cb 0.77 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 2wqk h ALA 70 CO -0.36 -0.31 0.32 -0.44 0.00 0.00 0.00 179.25 178.46 2wqk h ASP 71 N 0.23 0.50 -0.46 0.00 3.32 -1.41 -1.25 116.42 117.35 2wqk h ASP 71 Ca 0.19 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.23 2wqk h ASP 71 Cb 0.21 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 2wqk h ASP 71 CO -0.23 0.34 0.20 0.00 -1.72 0.00 0.00 179.24 177.83 2wqk h VAL 73 N 0.61 1.16 -0.31 0.00 2.07 -0.74 0.21 116.25 119.24 2wqk h VAL 73 Ca 0.16 -0.46 -0.10 0.00 0.82 0.00 0.00 66.70 67.11 2wqk h VAL 73 Cb 0.16 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 2wqk h VAL 73 CO -0.02 0.17 -0.21 0.45 0.02 0.00 0.00 177.57 177.98 2wqk h HIS 74 N 0.42 0.82 -0.34 1.57 -0.00 -1.01 -0.49 115.15 116.11 2wqk h HIS 74 Ca 0.12 -0.22 -0.14 0.00 -0.00 0.00 0.00 60.37 60.12 2wqk h HIS 74 Cb 0.12 -0.18 -0.01 0.00 -0.00 0.00 0.00 27.41 27.34 2wqk h HIS 74 CO -0.02 0.94 -0.36 -0.07 -0.00 0.00 0.00 177.93 178.43 2wqk h LEU 75 N 0.45 0.84 -0.52 2.43 3.38 -0.78 -0.38 115.31 120.72 2wqk h LEU 75 Ca 0.06 -0.37 0.04 0.00 0.09 0.00 0.00 57.88 57.70 2wqk h LEU 75 Cb 0.76 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 2wqk h LEU 75 CO 0.06 1.11 0.29 1.23 0.09 0.00 0.00 178.44 181.21 2wqk h GLY 76 N 0.91 0.74 0.38 0.83 0.00 -0.42 0.32 103.07 105.82 2wqk h GLY 76 Ca 0.06 -0.20 -0.00 0.00 0.00 0.00 0.00 47.33 47.19 2wqk h GLY 76 CO 0.08 0.15 -0.01 -1.82 0.00 0.00 0.00 176.54 174.94 2wqk h TYR 77 N 0.56 -0.02 0.13 5.60 3.20 -0.98 0.85 116.97 126.30 2wqk h TYR 77 Ca 0.22 -0.00 -0.29 0.00 3.14 0.00 0.00 58.73 61.80 2wqk h TYR 77 Cb 0.09 0.01 0.02 0.00 1.54 0.00 0.00 36.73 38.39 2wqk h TYR 77 CO -0.09 0.58 -1.24 0.00 -1.64 0.00 0.00 178.16 175.77 2wqk h ARG 78 N -0.65 0.49 0.00 1.82 3.08 -1.07 0.73 114.38 118.78 2wqk h ARG 78 Ca -0.00 -0.70 -0.01 0.00 0.07 0.00 0.00 59.98 59.33 2wqk h ARG 78 Cb 0.61 0.24 -0.00 0.00 0.08 0.00 0.00 29.97 30.90 2wqk h ARG 78 CO 0.00 1.31 -0.85 0.28 -1.07 0.00 0.00 179.97 179.65 2wqk n VAL 79 N -3.71 1.47 -0.05 2.04 0.31 0.06 -3.67 118.33 114.79 2wqk n VAL 79 Ca -0.12 0.16 -0.13 0.00 -0.01 0.00 0.00 64.34 64.24 2wqk n VAL 79 Cb 0.99 -2.36 -0.08 0.00 -0.91 0.00 0.00 33.84 31.49 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 -1.00 1.35 -0.06 2.52 1.08 -1.21 -2.90 117.51 117.29 2wqk h ILE 80 Ca -0.01 -1.23 0.00 0.00 -0.39 0.00 0.00 64.86 63.23 2wqk h ILE 80 Cb 0.84 1.91 0.00 0.00 -3.07 0.00 0.00 36.82 36.49 2wqk h ILE 80 CO -0.01 0.35 0.00 0.18 -0.69 0.00 0.00 178.15 177.99 2wqk n LEU 81 N -4.64 1.33 -3.82 1.44 4.77 0.27 -4.95 117.00 111.39 2wqk n LEU 81 Ca -0.07 -0.48 -0.29 0.00 -0.03 0.00 0.00 56.01 55.14 2wqk n LEU 81 Cb 0.32 -0.03 0.03 0.00 -2.33 0.00 0.00 43.42 41.42 2wqk n LEU 81 CO 0.38 0.24 0.12 -0.62 -1.33 0.00 0.00 177.39 176.18 2wqk n GLU 82 N 0.05 -5.79 -1.37 3.23 1.02 -1.10 -1.38 120.64 115.31 2wqk n GLU 82 Ca 0.18 0.64 -0.13 0.00 -0.02 0.00 0.00 57.16 57.83 2wqk n GLU 82 Cb 0.31 -5.55 -0.05 0.00 -0.02 0.00 0.00 31.44 26.13 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 -4.68 -1.05 -3.31 3.49 1.02 0.24 -4.97 120.64 111.37 2wqk n GLU 83 Ca 0.03 0.93 -0.41 0.00 -0.02 0.00 0.00 57.16 57.69 2wqk n GLU 83 Cb 0.53 -5.03 -0.08 0.00 -0.02 0.00 0.00 31.44 26.84 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 -2.99 3.63 0.20 3.49 2.20 -0.48 -5.04 119.74 120.75 2wqk s LYS 84 Ca 0.00 -0.23 -0.32 0.00 -0.36 0.00 0.00 55.97 55.06 2wqk s LYS 84 Cb 0.00 -3.79 -0.11 0.00 -1.51 0.00 0.00 37.83 32.41 2wqk s LYS 84 CO 0.00 -0.57 1.65 0.15 -0.36 0.00 0.00 175.35 176.21 2wqk s LYS 85 N 2.23 4.16 0.95 4.03 1.02 -1.26 -4.87 119.74 126.00 2wqk s LYS 85 Ca 0.16 2.51 -0.13 0.00 0.02 0.00 0.00 55.97 58.52 2wqk s LYS 85 Cb -0.16 -3.10 0.16 0.00 -0.52 0.00 0.00 37.83 34.22 2wqk s LYS 85 CO 0.12 -0.68 1.15 -1.25 -0.92 0.00 0.00 175.35 173.77 2wqk s PRO 86 N 0.93 0.79 0.22 -1.68 0.04 -1.26 -4.96 135.00 129.07 2wqk s PRO 86 Ca 0.71 0.20 -0.03 0.00 0.04 0.00 0.00 61.00 61.92 2wqk s PRO 86 Cb -0.47 -1.81 0.19 0.00 0.04 0.00 0.00 34.50 32.46 2wqk s PRO 86 CO 0.34 -2.42 1.61 -0.44 0.04 0.00 0.00 177.00 176.13 2wqk h ASP 87 N -1.65 0.71 -4.89 6.66 3.32 -1.08 -3.46 116.42 116.03 2wqk h ASP 87 Ca -0.50 -0.28 -0.13 0.00 0.02 0.00 0.00 57.03 56.14 2wqk h ASP 87 Cb 1.32 -0.20 -0.21 0.00 0.22 0.00 0.00 39.33 40.47 2wqk h ASP 87 CO 0.57 0.97 -0.38 -0.76 -1.72 0.00 0.00 179.24 177.92 2wqk s LEU 88 N -8.74 1.18 -0.18 1.55 1.43 -1.21 -4.34 118.68 108.35 2wqk s LEU 88 Ca -0.09 -0.01 -0.07 0.00 -1.03 0.00 0.00 54.13 52.93 2wqk s LEU 88 Cb 0.13 0.97 -0.04 0.00 0.03 0.00 0.00 46.19 47.28 2wqk s LEU 88 CO 0.83 -0.39 0.05 -0.69 0.23 0.00 0.00 176.35 176.39 2wqk s VAL 89 N -1.24 4.68 -0.00 -1.59 1.01 -0.56 -1.60 120.40 121.09 2wqk s VAL 89 Ca -0.13 -0.07 0.06 0.00 0.00 0.00 0.00 61.98 61.84 2wqk s VAL 89 Cb -0.06 -3.11 -0.02 0.00 0.00 0.00 0.00 36.38 33.20 2wqk s VAL 89 CO 0.03 0.46 -0.20 -0.76 0.00 0.00 0.00 175.10 174.62 2wqk s LEU 90 N 0.44 2.07 -0.07 3.92 1.43 0.09 -1.57 118.68 124.99 2wqk s LEU 90 Ca 0.02 -0.40 -0.01 0.00 -1.03 0.00 0.00 54.13 52.72 2wqk s LEU 90 Cb -0.13 -1.02 0.03 0.00 0.03 0.00 0.00 46.19 45.10 2wqk s LEU 90 CO 0.01 0.23 -0.02 -0.55 0.23 0.00 0.00 176.35 176.25 2wqk s SER 91 N -0.64 1.41 0.00 2.29 0.15 -0.44 -1.14 113.70 115.34 2wqk s SER 91 Ca 0.08 -0.11 0.00 0.00 0.70 0.00 0.00 55.95 56.61 2wqk s SER 91 Cb -0.08 -0.47 0.00 0.00 -1.71 0.00 0.00 66.02 63.76 2wqk s SER 91 CO -0.00 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 174.90 2wqk n GLY 92 N 4.79 0.84 3.68 9.45 0.00 -0.40 -0.47 105.19 123.07 2wqk n GLY 92 Ca -0.13 -2.00 -0.43 0.00 0.00 0.00 0.00 46.02 43.46 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 -2.00 4.48 0.47 -0.61 1.01 -1.10 -3.94 121.20 119.50 2wqk s ILE 93 Ca 0.00 1.78 -0.24 0.00 0.00 0.00 0.00 60.65 62.19 2wqk s ILE 93 Cb 0.00 -4.15 -0.07 0.00 0.01 0.00 0.00 42.46 38.25 2wqk s ILE 93 CO 0.00 -0.06 1.31 0.21 0.00 0.00 0.00 174.94 176.40 2wqk s ASN 94 N 1.43 5.86 -1.30 3.58 2.47 -0.02 -4.15 114.94 122.81 2wqk s ASN 94 Ca 0.51 2.66 -0.16 0.00 0.42 0.00 0.00 52.86 56.30 2wqk s ASN 94 Cb -0.21 -2.63 0.10 0.00 -1.45 0.00 0.00 41.25 37.06 2wqk s ASN 94 CO 0.16 -1.16 1.74 1.21 -3.72 0.00 0.00 177.10 175.33 2wqk n GLU 95 N -0.44 3.23 0.00 0.43 0.00 -1.26 -2.05 120.64 120.55 2wqk n GLU 95 Ca 0.07 -3.36 0.00 0.00 0.00 0.00 0.00 57.16 53.87 2wqk n GLU 95 Cb 0.45 -3.30 0.00 0.00 0.00 0.00 0.00 31.44 28.59 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 4.66 3.53 3.83 8.31 0.00 -1.18 -4.99 105.19 119.35 2wqk n GLY 96 Ca 0.45 -1.80 -0.31 0.00 0.00 0.00 0.00 46.02 44.36 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 -2.68 3.05 -0.42 1.61 0.04 -0.49 -3.36 135.00 132.75 2wqk s PRO 97 Ca 0.00 0.92 0.02 0.00 0.04 0.00 0.00 61.00 61.98 2wqk s PRO 97 Cb 0.00 -2.01 0.15 0.00 0.04 0.00 0.00 34.50 32.68 2wqk s PRO 97 CO 0.00 -1.01 0.27 -0.80 0.04 0.00 0.00 177.00 175.50 2wqk s ASN 98 N -3.86 3.01 0.20 6.66 0.01 -1.26 -4.99 114.94 114.70 2wqk s ASN 98 Ca 0.57 -2.65 0.11 0.00 -0.71 0.00 0.00 52.86 50.19 2wqk s ASN 98 Cb -0.13 -0.72 -0.04 0.00 0.41 0.00 0.00 41.25 40.76 2wqk s ASN 98 CO 0.55 -0.25 -0.23 -0.76 -1.51 0.00 0.00 177.10 174.90 2wqk s LEU 99 N 0.42 2.44 0.00 0.60 1.43 -1.26 -4.79 118.68 117.52 2wqk s LEU 99 Ca 0.22 -0.88 0.00 0.00 -1.03 0.00 0.00 54.13 52.44 2wqk s LEU 99 Cb -0.16 -1.15 0.00 0.00 0.03 0.00 0.00 46.19 44.91 2wqk s LEU 99 CO -0.05 0.11 0.00 0.61 0.23 0.00 0.00 176.35 177.25 2wqk n GLY 100 N 0.21 2.69 0.26 -3.19 0.00 -1.26 -2.51 105.19 101.39 2wqk n GLY 100 Ca -0.12 -0.39 0.16 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.41 -2.58 114.58 117.28 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 -2.98 0.00 -0.27 1.42 8.00 -1.04 -3.30 116.55 118.38 2wqk n ASP 102 Ca 0.01 0.11 0.07 0.00 0.71 0.00 0.00 54.79 55.69 2wqk n ASP 102 Cb 0.31 -0.32 0.31 0.00 -0.02 0.00 0.00 41.12 41.40 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 0.97 0.00 0.53 2.04 -1.55 -2.19 117.51 117.31 2wqk h ILE 103 Ca 0.00 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.57 2wqk h ILE 103 Cb 0.18 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.30 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 0.86 0.00 -0.02 -0.27 1.35 -1.82 -2.15 112.91 110.85 2wqk h THR 104 Ca 0.40 -0.31 0.00 0.00 -0.55 0.00 0.00 66.41 65.94 2wqk h THR 104 Cb 0.40 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 68.03 2wqk h THR 104 CO -0.17 0.00 -0.03 -1.22 -0.25 0.00 0.00 175.52 173.85 2wqk n TYR 105 N -2.83 0.00 -2.97 4.73 4.01 -0.83 -4.97 117.16 114.30 2wqk n TYR 105 Ca 0.00 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.34 2wqk n TYR 105 Cb 0.22 -0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.21 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 -2.03 6.98 0.23 7.72 0.15 -0.81 -4.94 113.70 121.00 2wqk s SER 106 Ca 0.30 1.19 -0.02 0.00 0.70 0.00 0.00 55.95 58.12 2wqk s SER 106 Cb 0.20 -2.43 0.23 0.00 -1.71 0.00 0.00 66.02 62.31 2wqk s SER 106 CO 0.33 -0.23 1.63 1.23 1.20 0.00 0.00 173.24 177.40 2wqk h GLY 107 N 7.39 0.71 0.93 9.45 0.00 -1.89 -1.60 103.07 118.06 2wqk h GLY 107 Ca -0.36 -0.63 -0.01 0.00 0.00 0.00 0.00 47.33 46.32 2wqk h GLY 107 CO 0.78 0.58 0.12 -0.84 0.00 0.00 0.00 176.54 177.18 2wqk h THR 108 N 0.56 1.14 -0.69 4.70 2.02 -1.92 -1.99 112.91 116.74 2wqk h THR 108 Ca 0.07 -0.40 -0.04 0.00 0.77 0.00 0.00 66.41 66.80 2wqk h THR 108 Cb 0.78 0.95 -0.03 0.00 -1.74 0.00 0.00 68.15 68.11 2wqk h THR 108 CO 0.06 0.14 0.26 0.58 0.37 0.00 0.00 175.52 176.93 2wqk h VAL 109 N 0.27 1.25 -0.03 3.16 2.07 -1.87 -2.73 116.25 118.37 2wqk h VAL 109 Ca 0.09 -0.80 -0.05 0.00 0.82 0.00 0.00 66.70 66.76 2wqk h VAL 109 Cb 0.11 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 2wqk h VAL 109 CO -0.01 0.32 -0.20 0.77 0.02 0.00 0.00 177.57 178.47 2wqk h SER 110 N 0.99 0.05 -0.32 0.57 4.64 -1.08 -0.59 113.55 117.81 2wqk h SER 110 Ca 0.23 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2wqk h SER 110 Cb 0.24 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.30 2wqk h SER 110 CO -0.02 0.25 0.21 1.23 -0.87 0.00 0.00 176.83 177.63 2wqk h GLY 111 N 0.66 0.44 1.04 -0.77 0.00 -1.05 0.38 103.07 103.77 2wqk h GLY 111 Ca 0.01 -0.16 -0.06 0.00 0.00 0.00 0.00 47.33 47.11 2wqk h GLY 111 CO 0.03 0.16 0.15 0.00 0.00 0.00 0.00 176.54 176.87 2wqk h ALA 112 N 1.12 0.84 -0.59 3.60 0.00 -1.29 -2.25 119.26 120.69 2wqk h ALA 112 Ca 0.12 -0.24 0.08 0.00 0.00 0.00 0.00 54.91 54.86 2wqk h ALA 112 Cb -0.04 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.44 2wqk h ALA 112 CO -0.03 0.56 0.26 1.98 0.00 0.00 0.00 179.25 182.02 2wqk h MET 113 N 0.95 0.46 -0.86 0.00 -1.53 -0.76 -1.87 114.93 111.32 2wqk h MET 113 Ca 0.20 -0.03 -0.02 0.00 -3.44 0.00 0.00 59.70 56.41 2wqk h MET 113 Cb 0.37 -0.10 -0.04 0.00 -0.55 0.00 0.00 31.60 31.27 2wqk h MET 113 CO 0.00 0.31 0.47 0.93 0.14 0.00 0.00 176.91 178.76 2wqk h GLU 114 N 0.48 1.20 -0.55 0.39 4.39 -0.71 0.36 114.58 120.14 2wqk h GLU 114 Ca 0.29 -0.14 0.05 0.00 0.34 0.00 0.00 59.36 59.89 2wqk h GLU 114 Cb 0.29 -0.23 -0.05 0.00 -0.10 0.00 0.00 28.75 28.66 2wqk h GLU 114 CO -0.25 0.89 0.28 0.78 -1.16 0.00 0.00 179.01 179.55 2wqk h GLY 115 N 1.20 0.78 1.63 -3.84 0.00 -0.78 -1.63 103.07 100.44 2wqk h GLY 115 Ca 0.30 -0.19 -0.10 0.00 0.00 0.00 0.00 47.33 47.34 2wqk h GLY 115 CO -0.05 0.12 -0.32 -0.09 0.00 0.00 0.00 176.54 176.20 2wqk h ARG 116 N 0.54 0.42 -0.76 4.80 9.65 -0.58 -1.37 114.38 127.08 2wqk h ARG 116 Ca 0.24 -0.18 0.01 0.00 -1.10 0.00 0.00 59.98 58.95 2wqk h ARG 116 Cb 0.15 -0.02 -0.04 0.00 -1.39 0.00 0.00 29.97 28.68 2wqk h ARG 116 CO -0.17 0.70 0.50 0.82 2.80 0.00 0.00 179.97 184.62 2wqk h ILE 117 N 0.37 1.20 0.00 1.20 2.04 -0.55 -0.95 117.51 120.82 2wqk h ILE 117 Ca 0.05 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.55 2wqk h ILE 117 Cb 0.74 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.91 2wqk h ILE 117 CO 0.06 0.19 0.00 0.18 0.00 0.00 0.00 178.15 178.58 2wqk n LEU 118 N -4.42 0.00 0.00 1.44 4.77 -0.65 -4.88 117.00 113.26 2wqk n LEU 118 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 2wqk n LEU 118 Cb 0.03 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 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 0.91 0.78 3.25 -0.72 0.00 -0.36 -5.07 105.19 103.97 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 2.12 0.39 -0.61 1.01 -0.59 -5.01 121.20 116.51 2wqk s ILE 120 Ca 0.00 -1.02 -0.27 0.00 0.00 0.00 0.00 60.65 59.36 2wqk s ILE 120 Cb 0.00 -1.79 -0.11 0.00 0.01 0.00 0.00 42.46 40.57 2wqk s ILE 120 CO 0.00 0.56 1.45 -2.65 0.00 0.00 0.00 174.94 174.30 2wqk n PRO 121 N 3.28 2.51 -3.83 2.79 -0.02 -1.26 -2.98 135.00 135.49 2wqk n PRO 121 Ca -0.18 0.88 -0.12 0.00 -2.02 0.00 0.00 63.50 62.06 2wqk n PRO 121 Cb 0.53 -2.61 -0.10 0.00 -0.02 0.00 0.00 33.50 31.30 2wqk n PRO 121 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2wqk s SER 122 N -0.22 -0.06 -0.06 2.55 0.01 -1.26 -1.50 113.70 113.16 2wqk s SER 122 Ca 0.55 -0.08 -0.03 0.00 1.31 0.00 0.00 55.95 57.69 2wqk s SER 122 Cb -0.48 0.25 0.03 0.00 0.21 0.00 0.00 66.02 66.02 2wqk s SER 122 CO 0.62 -0.38 0.13 -0.63 0.41 0.00 0.00 173.24 173.40 2wqk s ILE 123 N -1.30 -0.03 -0.11 1.44 1.01 -0.61 -2.01 121.20 119.59 2wqk s ILE 123 Ca -0.14 0.10 -0.05 0.00 0.00 0.00 0.00 60.65 60.56 2wqk s ILE 123 Cb -0.07 -0.21 -0.04 0.00 0.01 0.00 0.00 42.46 42.16 2wqk s ILE 123 CO 0.02 0.04 0.07 0.00 0.00 0.00 0.00 174.94 175.07 2wqk s ALA 124 N 0.65 3.56 -0.06 9.38 0.00 -0.09 -1.33 121.76 133.87 2wqk s ALA 124 Ca -0.05 -0.73 0.03 0.00 0.00 0.00 0.00 51.96 51.22 2wqk s ALA 124 Cb -0.07 -1.75 0.01 0.00 0.00 0.00 0.00 23.12 21.31 2wqk s ALA 124 CO -0.03 0.55 -0.16 -0.06 0.00 0.00 0.00 175.76 176.06 2wqk s PHE 125 N -0.79 1.73 0.01 0.00 0.08 0.38 -0.32 117.98 119.07 2wqk s PHE 125 Ca 0.13 -0.61 0.02 0.00 0.12 0.00 0.00 56.93 56.58 2wqk s PHE 125 Cb -0.12 -1.21 -0.01 0.00 -0.57 0.00 0.00 43.02 41.11 2wqk s PHE 125 CO 0.03 -0.27 -0.07 -1.12 -0.10 0.00 0.00 175.22 173.70 2wqk s SER 126 N 0.40 0.75 -0.16 1.36 0.01 -0.11 -0.84 113.70 115.11 2wqk s SER 126 Ca -0.12 -0.25 -0.21 0.00 1.31 0.00 0.00 55.95 56.68 2wqk s SER 126 Cb -0.15 -0.04 -0.03 0.00 0.21 0.00 0.00 66.02 66.01 2wqk s SER 126 CO 0.04 -0.02 0.62 0.00 0.41 0.00 0.00 173.24 174.30 2wqk s ALA 127 N -0.53 3.49 -1.00 1.44 0.00 -0.87 -0.95 121.76 123.35 2wqk s ALA 127 Ca -0.02 -0.18 -0.17 0.00 0.00 0.00 0.00 51.96 51.60 2wqk s ALA 127 Cb -0.05 -2.93 0.15 0.00 0.00 0.00 0.00 23.12 20.30 2wqk s ALA 127 CO 0.00 -0.39 1.17 0.12 0.00 0.00 0.00 175.76 176.66 2wqk s PHE 128 N 1.52 3.31 0.02 0.00 5.36 0.23 -1.40 117.98 127.02 2wqk s PHE 128 Ca 0.30 -1.68 -0.29 0.00 -0.96 0.00 0.00 56.93 54.30 2wqk s PHE 128 Cb -0.16 -4.23 0.10 0.00 -0.34 0.00 0.00 43.02 38.39 2wqk s PHE 128 CO 0.12 -1.40 1.12 0.20 -1.46 0.00 0.00 175.22 173.80 2wqk s GLY 129 N 3.22 -0.34 0.02 13.12 0.00 -1.26 -2.13 107.32 119.94 2wqk s GLY 129 Ca 0.34 0.68 -0.02 0.00 0.00 0.00 0.00 44.72 45.71 2wqk s GLY 129 CO -0.07 0.17 -0.04 0.54 0.00 0.00 0.00 173.10 173.69 2wqk n ARG 130 N -0.40 0.07 -4.26 2.90 1.74 -1.26 -4.40 116.66 111.05 2wqk n ARG 130 Ca -0.06 0.03 -0.30 0.00 -0.77 0.00 0.00 57.85 56.75 2wqk n ARG 130 Cb 0.61 -0.62 -0.10 0.00 -1.02 0.00 0.00 32.46 31.33 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 -2.09 2.08 -1.28 5.56 2.02 -1.26 -4.72 118.70 119.01 2wqk s GLU 131 Ca -0.04 -1.04 -0.10 0.00 0.02 0.00 0.00 54.97 53.81 2wqk s GLU 131 Cb 0.01 -2.28 -0.00 0.00 0.10 0.00 0.00 34.13 31.96 2wqk s GLU 131 CO 0.06 0.51 0.61 0.09 0.02 0.00 0.00 175.26 176.55 2wqk n ASN 132 N 0.76 -2.60 -4.71 -0.19 3.02 -1.26 -4.88 115.26 105.41 2wqk n ASN 132 Ca -0.14 -1.00 -0.42 0.00 -0.03 0.00 0.00 54.58 52.99 2wqk n ASN 132 Cb 0.52 -3.28 -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 -3.71 4.25 -1.30 2.41 1.01 -1.26 -4.95 121.20 117.65 2wqk s ILE 133 Ca 0.21 1.61 -0.11 0.00 0.00 0.00 0.00 60.65 62.35 2wqk s ILE 133 Cb -0.08 -4.03 0.14 0.00 0.01 0.00 0.00 42.46 38.50 2wqk s ILE 133 CO 0.87 0.10 1.85 0.23 0.00 0.00 0.00 174.94 178.00 2wqk n MET 134 N 4.14 3.42 -0.07 2.79 2.81 -1.26 -4.82 117.12 124.12 2wqk n MET 134 Ca 0.09 -3.41 0.05 0.00 -1.81 0.00 0.00 57.70 52.62 2wqk n MET 134 Cb 0.47 -3.04 0.40 0.00 -0.71 0.00 0.00 33.22 30.34 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 6.14 0.60 -0.16 2.03 0.04 -1.92 -0.98 116.94 122.70 2wqk h PHE 135 Ca 0.42 0.01 -0.13 0.00 2.80 0.00 0.00 57.97 61.07 2wqk h PHE 135 Cb 0.69 -0.20 -0.01 0.00 2.20 0.00 0.00 35.95 38.63 2wqk h PHE 135 CO 1.27 0.35 -0.45 0.93 -0.60 0.00 0.00 178.31 179.81 2wqk h GLU 136 N 0.63 0.39 -0.32 1.51 5.08 -1.90 -0.42 114.58 119.54 2wqk h GLU 136 Ca 0.22 -0.21 -0.05 0.00 -1.00 0.00 0.00 59.36 58.32 2wqk h GLU 136 Cb 0.09 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2wqk h GLU 136 CO -0.06 0.77 -0.01 0.93 -1.00 0.00 0.00 179.01 179.64 2wqk h GLU 137 N 0.31 0.56 -0.81 2.33 4.39 -1.72 -3.13 114.58 116.52 2wqk h GLU 137 Ca 0.02 -0.18 -0.00 0.00 0.34 0.00 0.00 59.36 59.53 2wqk h GLU 137 Cb 0.92 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 29.48 2wqk h GLU 137 CO 0.08 0.70 0.49 0.82 -1.16 0.00 0.00 179.01 179.95 2wqk h ILE 138 N 0.36 1.22 -0.03 3.13 2.04 -1.01 -2.41 117.51 120.81 2wqk h ILE 138 Ca 0.09 -0.48 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 2wqk h ILE 138 Cb 0.45 0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.61 2wqk h ILE 138 CO 0.02 0.23 -0.02 0.00 0.00 0.00 0.00 178.15 178.38 2wqk h ALA 139 N 1.43 1.91 -0.71 1.87 0.00 -1.02 -1.99 119.26 120.75 2wqk h ALA 139 Ca 0.29 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2wqk h ALA 139 Cb -0.06 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2wqk h ALA 139 CO -0.06 0.07 0.45 0.87 0.00 0.00 0.00 179.25 180.59 2wqk h LYS 140 N 0.04 0.95 -0.00 0.00 1.57 -1.41 -0.96 116.57 116.76 2wqk h LYS 140 Ca 0.01 -0.07 -0.16 0.00 -1.87 0.00 0.00 60.65 58.56 2wqk h LYS 140 Cb 0.06 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 2wqk h LYS 140 CO 0.00 0.64 -0.77 -0.24 -0.57 0.00 0.00 179.45 178.52 2wqk h VAL 141 N 0.96 1.54 -0.58 0.50 3.04 -1.47 -2.46 116.25 117.78 2wqk h VAL 141 Ca 0.26 -2.61 0.02 0.00 -1.01 0.00 0.00 66.70 63.36 2wqk h VAL 141 Cb -0.08 2.41 -0.04 0.00 -2.01 0.00 0.00 31.29 31.57 2wqk h VAL 141 CO -0.05 0.75 0.36 0.00 -1.01 0.00 0.00 177.57 177.61 2wqk h VAL 143 N 0.71 1.26 -0.61 0.00 2.07 -1.09 -0.41 116.25 118.18 2wqk h VAL 143 Ca 0.23 -1.19 0.05 0.00 0.82 0.00 0.00 66.70 66.60 2wqk h VAL 143 Cb 0.00 1.19 -0.05 0.00 -1.52 0.00 0.00 31.29 30.92 2wqk h VAL 143 CO -0.09 0.39 0.35 0.44 0.02 0.00 0.00 177.57 178.68 2wqk h ASP 144 N 0.56 0.53 -0.22 0.57 3.32 -0.91 -0.03 116.42 120.23 2wqk h ASP 144 Ca 0.09 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.13 2wqk h ASP 144 Cb 0.61 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 2wqk h ASP 144 CO 0.04 0.36 0.01 0.40 -1.72 0.00 0.00 179.24 178.33 2wqk h ILE 145 N 0.66 1.25 -0.72 0.35 2.04 -0.80 -2.61 117.51 117.68 2wqk h ILE 145 Ca 0.27 -0.85 0.04 0.00 1.00 0.00 0.00 64.86 65.32 2wqk h ILE 145 Cb 0.12 1.38 -0.05 0.00 -0.74 0.00 0.00 36.82 37.53 2wqk h ILE 145 CO -0.15 0.26 0.44 0.58 0.00 0.00 0.00 178.15 179.28 2wqk h VAL 146 N 0.15 1.07 -0.58 1.67 2.07 -0.75 -0.21 116.25 119.67 2wqk h VAL 146 Ca 0.06 -0.29 0.03 0.00 0.82 0.00 0.00 66.70 67.32 2wqk h VAL 146 Cb 0.38 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 30.25 2wqk h VAL 146 CO 0.01 0.16 0.34 0.50 0.02 0.00 0.00 177.57 178.60 2wqk h LYS 147 N 0.85 0.65 -0.58 1.57 3.64 -0.88 0.19 116.57 122.00 2wqk h LYS 147 Ca 0.30 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.54 2wqk h LYS 147 Cb 0.07 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 2wqk h LYS 147 CO -0.13 0.43 -0.03 0.87 -2.27 0.00 0.00 179.45 178.32 2wqk h LYS 148 N 0.67 1.04 -0.47 1.90 1.57 -1.04 -2.76 116.57 117.47 2wqk h LYS 148 Ca 0.24 -0.34 -0.09 0.00 -1.87 0.00 0.00 60.65 58.58 2wqk h LYS 148 Cb 0.06 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 2wqk h LYS 148 CO -0.12 1.04 -0.08 0.28 -0.57 0.00 0.00 179.45 180.00 2wqk h VAL 149 N 0.93 1.26 -0.13 0.50 2.07 -0.53 0.33 116.25 120.68 2wqk h VAL 149 Ca 0.16 -1.16 -0.02 0.00 0.82 0.00 0.00 66.70 66.50 2wqk h VAL 149 Cb 0.58 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 2wqk h VAL 149 CO 0.03 0.40 -0.00 -0.07 0.02 0.00 0.00 177.57 177.96 2wqk h LEU 150 N 0.76 0.16 0.25 2.57 3.38 -0.78 0.88 115.31 122.53 2wqk h LEU 150 Ca 0.13 -0.01 -0.33 0.00 0.09 0.00 0.00 57.88 57.76 2wqk h LEU 150 Cb 0.58 -0.04 0.04 0.00 0.09 0.00 0.00 40.66 41.33 2wqk h LEU 150 CO 0.04 0.20 -1.45 -1.13 0.09 0.00 0.00 178.44 176.18 2wqk h ASN 151 N 0.18 0.82 0.00 -0.43 -1.24 -1.06 -3.42 115.58 110.44 2wqk h ASN 151 Ca 0.04 -0.92 -0.10 0.00 0.71 0.00 0.00 56.30 56.03 2wqk h ASN 151 Cb 0.13 -0.27 -0.02 0.00 0.73 0.00 0.00 38.32 38.89 2wqk h ASN 151 CO 0.00 1.70 -1.53 -0.62 -1.29 0.00 0.00 177.43 175.70 2wqk n GLU 152 N -3.74 1.86 0.00 6.67 -0.58 0.02 -5.12 120.64 119.76 2wqk n GLU 152 Ca -0.17 -0.03 0.00 0.00 -0.42 0.00 0.00 57.16 56.54 2wqk n GLU 152 Cb 1.09 -1.22 0.00 0.00 -0.57 0.00 0.00 31.44 30.74 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 2.32 -0.50 3.45 0.62 0.00 0.29 -5.02 105.19 106.35 2wqk n GLY 153 Ca -0.10 -1.72 -0.30 0.00 0.00 0.00 0.00 46.02 43.90 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 -1.98 2.69 0.64 -0.61 1.01 -1.26 -4.91 121.20 116.76 2wqk s ILE 154 Ca 0.00 -1.34 -0.18 0.00 0.00 0.00 0.00 60.65 59.13 2wqk s ILE 154 Cb 0.00 -2.15 -0.02 0.00 0.01 0.00 0.00 42.46 40.30 2wqk s ILE 154 CO 0.00 0.26 1.22 -2.65 0.00 0.00 0.00 174.94 173.77 2wqk n PRO 155 N 1.33 1.08 0.25 2.79 -0.02 -1.26 -4.89 135.00 134.28 2wqk n PRO 155 Ca -0.16 0.42 0.16 0.00 -2.02 0.00 0.00 63.50 61.90 2wqk n PRO 155 Cb 0.52 -2.45 0.65 0.00 -0.02 0.00 0.00 33.50 32.21 2wqk n PRO 155 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2wqk h GLU 156 N 0.54 0.00 -0.60 -0.52 4.81 -2.03 -3.04 114.58 113.74 2wqk h GLU 156 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2wqk h GLU 156 Cb 1.35 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.73 2wqk h GLU 156 CO 0.53 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.41 2wqk n ASP 157 N -2.91 4.39 -4.20 1.04 5.75 -1.26 -4.96 116.55 114.40 2wqk n ASP 157 Ca 0.01 -2.37 -0.20 0.00 -0.01 0.00 0.00 54.79 52.22 2wqk n ASP 157 Cb 0.29 -0.53 -0.12 0.00 -1.03 0.00 0.00 41.12 39.73 2wqk n ASP 157 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2wqk s THR 158 N -1.70 1.26 0.06 2.12 2.01 -1.15 -1.78 115.64 116.46 2wqk s THR 158 Ca 0.47 -1.38 0.00 0.00 0.31 0.00 0.00 61.69 61.10 2wqk s THR 158 Cb 0.30 -1.20 -0.04 0.00 0.01 0.00 0.00 72.50 71.57 2wqk s THR 158 CO 0.24 -0.20 -0.05 -0.72 -0.69 0.00 0.00 174.62 173.21 2wqk s TYR 159 N -1.29 0.63 -0.12 4.92 -0.85 -0.79 -4.77 117.35 115.09 2wqk s TYR 159 Ca 0.00 -0.93 -0.06 0.00 -0.52 0.00 0.00 57.07 55.57 2wqk s TYR 159 Cb -0.10 -0.41 -0.04 0.00 0.38 0.00 0.00 41.96 41.79 2wqk s TYR 159 CO 0.03 -0.27 0.11 -0.51 -1.52 0.00 0.00 175.55 173.39 2wqk s LEU 160 N -2.73 4.18 -0.29 -3.49 1.43 -0.85 -0.92 118.68 116.01 2wqk s LEU 160 Ca 0.05 0.38 -0.01 0.00 -1.03 0.00 0.00 54.13 53.52 2wqk s LEU 160 Cb 0.04 -2.01 0.05 0.00 0.03 0.00 0.00 46.19 44.30 2wqk s LEU 160 CO -0.07 0.39 -0.02 0.21 0.23 0.00 0.00 176.35 177.10 2wqk s ASN 161 N -0.92 4.83 -0.14 2.29 2.47 -0.27 -0.91 114.94 122.30 2wqk s ASN 161 Ca 0.14 -1.29 -0.01 0.00 0.42 0.00 0.00 52.86 52.13 2wqk s ASN 161 Cb -0.12 -1.69 -0.02 0.00 -1.45 0.00 0.00 41.25 37.98 2wqk s ASN 161 CO 0.03 -0.25 -0.12 -0.69 -3.72 0.00 0.00 177.10 172.35 2wqk s VAL 162 N 1.23 3.11 -0.05 -5.21 1.01 0.56 -1.06 120.40 120.01 2wqk s VAL 162 Ca -0.06 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.35 2wqk s VAL 162 Cb -0.20 -2.32 -0.01 0.00 0.00 0.00 0.00 36.38 33.85 2wqk s VAL 162 CO -0.02 0.52 -0.25 0.20 0.00 0.00 0.00 175.10 175.56 2wqk s ASN 163 N 0.40 2.98 -0.11 3.32 0.01 -0.39 -0.93 114.94 120.22 2wqk s ASN 163 Ca -0.10 -0.49 0.03 0.00 -0.71 0.00 0.00 52.86 51.59 2wqk s ASN 163 Cb -0.16 -0.69 0.01 0.00 0.41 0.00 0.00 41.25 40.83 2wqk s ASN 163 CO 0.05 0.26 -0.20 -0.63 -1.51 0.00 0.00 177.10 175.07 2wqk s ILE 164 N -0.27 1.84 0.67 0.60 1.09 -0.12 -1.30 121.20 123.70 2wqk s ILE 164 Ca 0.00 -0.86 -0.17 0.00 -1.10 0.00 0.00 60.65 58.51 2wqk s ILE 164 Cb -0.13 -1.63 -0.00 0.00 -1.06 0.00 0.00 42.46 39.64 2wqk s ILE 164 CO 0.02 0.51 1.21 -2.65 -0.10 0.00 0.00 174.94 173.93 2wqk n PRO 165 N 3.91 0.93 -2.12 2.79 -0.02 -1.26 -0.60 135.00 138.62 2wqk n PRO 165 Ca -0.20 0.37 -0.42 0.00 -2.02 0.00 0.00 63.50 61.23 2wqk n PRO 165 Cb 0.52 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 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 -1.86 4.40 -4.24 2.55 5.15 -0.90 -4.79 115.26 115.56 2wqk n ASN 166 Ca 0.15 -2.90 -0.16 0.00 -0.60 0.00 0.00 54.58 51.08 2wqk n ASN 166 Cb 0.48 -1.67 -0.11 0.00 -0.53 0.00 0.00 39.78 37.96 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 2.62 2.47 0.59 1.20 1.43 -1.26 -4.92 118.68 120.80 2wqk s LEU 167 Ca 0.48 -0.91 -0.20 0.00 -1.03 0.00 0.00 54.13 52.48 2wqk s LEU 167 Cb 0.10 -0.43 -0.03 0.00 0.03 0.00 0.00 46.19 45.85 2wqk s LEU 167 CO -0.02 -0.24 1.32 0.54 0.23 0.00 0.00 176.35 178.18 2wqk n ARG 168 N 0.18 1.44 -0.26 1.70 1.74 -1.26 -4.61 116.66 115.58 2wqk n ARG 168 Ca -0.13 0.54 0.07 0.00 -0.77 0.00 0.00 57.85 57.56 2wqk n ARG 168 Cb 0.59 -2.55 0.21 0.00 -1.02 0.00 0.00 32.46 29.69 2wqk n ARG 168 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 2wqk h TYR 169 N 1.04 0.40 0.00 -1.55 3.20 -1.97 0.67 116.97 118.76 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 -0.05 0.00 0.93 -1.64 0.00 0.00 178.16 177.84 2wqk h GLU 170 N 0.33 0.00 0.00 1.82 3.07 -1.96 -2.61 114.58 115.23 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 0.77 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.68 2wqk h GLU 170 CO -0.49 0.00 -0.62 0.39 -1.40 0.00 0.00 179.01 176.89 2wqk n GLU 171 N -2.38 0.05 -1.93 2.33 -0.58 0.20 -4.90 120.64 113.44 2wqk n GLU 171 Ca 0.03 0.01 -0.42 0.00 -0.42 0.00 0.00 57.16 56.35 2wqk n GLU 171 Cb 0.29 -1.52 -0.03 0.00 -0.57 0.00 0.00 31.44 29.61 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 -3.03 2.55 -0.03 -3.67 -1.09 -0.99 -4.90 121.20 110.05 2wqk s ILE 172 Ca 0.10 0.41 0.14 0.00 -2.23 0.00 0.00 60.65 59.07 2wqk s ILE 172 Cb 0.17 -3.26 0.01 0.00 -1.58 0.00 0.00 42.46 37.80 2wqk s ILE 172 CO 0.73 0.04 1.46 0.11 -1.23 0.00 0.00 174.94 176.05 2wqk h LYS 173 N 6.34 0.00 0.00 2.79 1.57 -1.42 -3.49 116.57 122.37 2wqk h LYS 173 Ca -0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 2wqk h LYS 173 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 2wqk h LYS 173 CO 0.88 0.59 0.00 0.41 -0.57 0.00 0.00 179.45 180.77 2wqk n GLY 174 N 1.07 -2.01 3.26 3.86 0.00 -1.26 -5.02 105.19 105.09 2wqk n GLY 174 Ca 0.01 -1.24 -0.32 0.00 0.00 0.00 0.00 46.02 44.48 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 -2.54 2.16 -0.04 -0.61 1.01 -1.26 -1.06 121.20 118.86 2wqk s ILE 175 Ca 0.00 -1.00 0.05 0.00 0.00 0.00 0.00 60.65 59.70 2wqk s ILE 175 Cb 0.00 -1.81 -0.01 0.00 0.01 0.00 0.00 42.46 40.65 2wqk s ILE 175 CO 0.00 0.56 -0.20 -0.54 0.00 0.00 0.00 174.94 174.76 2wqk s LYS 176 N 0.09 1.98 0.00 2.79 1.02 0.16 -4.94 119.74 120.84 2wqk s LYS 176 Ca -0.11 -0.73 -0.30 0.00 0.02 0.00 0.00 55.97 54.85 2wqk s LYS 176 Cb -0.16 -1.75 -0.04 0.00 -0.52 0.00 0.00 37.83 35.36 2wqk s LYS 176 CO 0.06 0.34 1.12 0.08 -0.92 0.00 0.00 175.35 176.03 2wqk s VAL 177 N -0.16 4.40 0.12 3.17 1.01 -1.26 -0.90 120.40 126.78 2wqk s VAL 177 Ca -0.01 1.72 0.03 0.00 0.00 0.00 0.00 61.98 63.72 2wqk s VAL 177 Cb -0.11 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 2wqk s VAL 177 CO 0.02 0.09 -0.09 0.42 0.00 0.00 0.00 175.10 175.55 2wqk s THR 178 N 1.37 0.96 0.34 3.92 -4.23 -0.29 -4.89 115.64 112.82 2wqk s THR 178 Ca 0.55 -1.99 0.02 0.00 -1.18 0.00 0.00 61.69 59.08 2wqk s THR 178 Cb -0.25 -1.76 -0.03 0.00 1.34 0.00 0.00 72.50 71.80 2wqk s THR 178 CO 0.26 -0.79 0.53 0.00 -0.54 0.00 0.00 174.62 174.07 2wqk s ARG 179 N -3.75 3.40 0.03 3.99 1.70 -0.58 -4.18 118.95 119.56 2wqk s ARG 179 Ca 0.14 -0.47 -0.30 0.00 -0.47 0.00 0.00 55.73 54.63 2wqk s ARG 179 Cb 0.03 -2.70 -0.08 0.00 -0.57 0.00 0.00 34.95 31.64 2wqk s ARG 179 CO -0.02 0.14 1.68 -1.14 -1.08 0.00 0.00 175.30 174.88 2wqk s GLN 180 N -4.28 4.19 0.91 3.89 0.74 -1.26 -1.08 119.66 122.76 2wqk s GLN 180 Ca 0.40 2.32 -0.13 0.00 0.05 0.00 0.00 55.36 58.00 2wqk s GLN 180 Cb -0.10 -3.75 0.18 0.00 1.10 0.00 0.00 33.01 30.44 2wqk s GLN 180 CO 0.35 -0.78 1.25 0.20 -0.55 0.00 0.00 175.29 175.76 2wqk s GLY 181 N 2.83 1.76 0.00 2.59 0.00 -1.26 -4.88 107.32 108.37 2wqk s GLY 181 Ca 0.75 -1.25 0.00 0.00 0.00 0.00 0.00 44.72 44.22 2wqk s GLY 181 CO 0.32 -0.54 0.00 0.28 0.00 0.00 0.00 173.10 173.16 2wqk n LYS 182 N -3.56 0.00 -4.49 2.90 5.02 -1.26 -3.42 118.16 113.36 2wqk n LYS 182 Ca 0.15 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 56.10 2wqk n LYS 182 Cb 0.60 0.00 -0.15 0.00 -0.02 0.00 0.00 35.03 35.45 2wqk n LYS 182 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2wqk s ARG 183 N 0.00 3.21 -0.98 1.97 0.52 -1.26 -1.95 118.95 120.46 2wqk s ARG 183 Ca 0.00 -0.75 -0.06 0.00 -0.52 0.00 0.00 55.73 54.40 2wqk s ARG 183 Cb 0.00 -2.63 -0.02 0.00 0.52 0.00 0.00 34.95 32.82 2wqk s ARG 183 CO 0.00 -0.00 2.85 0.00 0.02 0.00 0.00 175.30 178.16 2wqk n ALA 184 N 4.11 6.87 -3.56 2.13 0.00 -1.26 -4.82 120.51 123.98 2wqk n ALA 184 Ca -0.19 -3.31 -0.09 0.00 0.00 0.00 0.00 53.44 49.84 2wqk n ALA 184 Cb 0.52 -2.72 -0.02 0.00 0.00 0.00 0.00 19.45 17.23 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 -0.01 -0.39 -0.19 0.00 -0.85 -1.26 0.12 117.35 114.77 2wqk s TYR 185 Ca 0.62 0.13 -0.10 0.00 -0.52 0.00 0.00 57.07 57.20 2wqk s TYR 185 Cb 0.25 0.59 -0.05 0.00 0.38 0.00 0.00 41.96 43.13 2wqk s TYR 185 CO -0.10 -0.86 0.15 0.15 -1.52 0.00 0.00 175.55 173.38 2wqk s LYS 186 N -3.60 4.17 -0.13 -3.49 -0.14 0.31 -4.90 119.74 111.96 2wqk s LYS 186 Ca 0.05 -0.18 -0.17 0.00 -1.36 0.00 0.00 55.97 54.31 2wqk s LYS 186 Cb -0.02 -3.41 -0.04 0.00 -1.68 0.00 0.00 37.83 32.68 2wqk s LYS 186 CO -0.07 0.31 0.45 -2.00 -0.76 0.00 0.00 175.35 173.29 2wqk s GLU 187 N 0.32 4.31 -0.02 1.68 2.12 -1.26 -0.22 118.70 125.63 2wqk s GLU 187 Ca 0.09 0.39 0.02 0.00 0.36 0.00 0.00 54.97 55.83 2wqk s GLU 187 Cb -0.11 -3.45 0.01 0.00 0.26 0.00 0.00 34.13 30.83 2wqk s GLU 187 CO -0.01 0.13 -0.07 0.50 -0.54 0.00 0.00 175.26 175.27 2wqk s ARG 188 N 0.72 0.78 -0.19 4.30 3.52 -0.39 -4.99 118.95 122.70 2wqk s ARG 188 Ca 0.24 -0.22 -0.08 0.00 -0.13 0.00 0.00 55.73 55.55 2wqk s ARG 188 Cb -0.15 -0.75 -0.04 0.00 -1.56 0.00 0.00 34.95 32.45 2wqk s ARG 188 CO 0.09 0.06 0.08 0.08 -0.81 0.00 0.00 175.30 174.80 2wqk s VAL 189 N 0.31 4.85 -0.12 7.11 1.01 -1.26 0.04 120.40 132.34 2wqk s VAL 189 Ca -0.04 -0.01 -0.05 0.00 0.00 0.00 0.00 61.98 61.88 2wqk s VAL 189 Cb -0.09 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.05 2wqk s VAL 189 CO 0.00 0.44 0.06 -0.36 0.00 0.00 0.00 175.10 175.24 2wqk s PHE 190 N 0.54 3.33 -0.09 5.22 0.08 0.01 -4.94 117.98 122.13 2wqk s PHE 190 Ca 0.04 0.27 -0.03 0.00 0.12 0.00 0.00 56.93 57.33 2wqk s PHE 190 Cb -0.13 -1.92 -0.03 0.00 -0.57 0.00 0.00 43.02 40.37 2wqk s PHE 190 CO 0.01 0.47 0.02 0.21 -0.10 0.00 0.00 175.22 175.82 2wqk s LYS 191 N -0.57 3.06 0.21 0.44 2.20 -1.26 -0.72 119.74 123.10 2wqk s LYS 191 Ca 0.11 -0.38 0.04 0.00 -0.36 0.00 0.00 55.97 55.38 2wqk s LYS 191 Cb -0.12 -2.85 -0.05 0.00 -1.51 0.00 0.00 37.83 33.31 2wqk s LYS 191 CO 0.02 0.69 -0.02 0.71 -0.36 0.00 0.00 175.35 176.39 2wqk s TYR 192 N -0.85 1.49 -0.13 4.03 2.02 0.32 -5.01 117.35 119.22 2wqk s TYR 192 Ca 0.13 -0.90 0.02 0.00 -0.37 0.00 0.00 57.07 55.95 2wqk s TYR 192 Cb -0.11 -0.85 -0.00 0.00 -0.40 0.00 0.00 41.96 40.60 2wqk s TYR 192 CO 0.02 -0.03 -0.18 0.42 -1.57 0.00 0.00 175.55 174.22 2wqk s ILE 193 N -3.41 2.47 0.95 2.71 -1.09 -1.26 -1.33 121.20 120.24 2wqk s ILE 193 Ca 0.26 -0.85 -0.13 0.00 -2.23 0.00 0.00 60.65 57.69 2wqk s ILE 193 Cb 0.05 -2.01 0.16 0.00 -1.58 0.00 0.00 42.46 39.09 2wqk s ILE 193 CO 0.07 0.54 1.15 1.51 -1.23 0.00 0.00 174.94 176.98 2wqk s ASP 194 N 0.58 3.14 0.40 3.58 1.47 0.65 -4.88 116.67 121.62 2wqk s ASP 194 Ca -0.11 0.85 0.26 0.00 1.18 0.00 0.00 52.55 54.74 2wqk s ASP 194 Cb -0.16 -1.34 1.42 0.00 -0.34 0.00 0.00 42.92 42.50 2wqk s ASP 194 CO 0.03 -2.77 1.79 -0.65 0.68 0.00 0.00 175.17 174.26 2wqk h PRO 195 N -1.65 0.00 -0.47 2.11 0.11 -2.01 -1.38 132.00 128.71 2wqk h PRO 195 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 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 0.56 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.01 2wqk n TYR 196 N -2.43 0.62 -0.70 0.65 4.01 -1.26 -4.98 117.16 113.07 2wqk n TYR 196 Ca -0.02 -0.39 0.00 0.00 -0.16 0.00 0.00 57.90 57.33 2wqk n TYR 196 Cb 0.07 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 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 1.21 0.64 3.75 2.72 0.00 -0.52 -5.07 105.19 107.93 2wqk n GLY 197 Ca 0.18 -0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.38 2.96 0.46 1.61 -0.14 -1.26 -4.80 119.74 118.19 2wqk s LYS 198 Ca 0.00 -0.55 -0.21 0.00 -1.36 0.00 0.00 55.97 53.85 2wqk s LYS 198 Cb 0.00 -2.79 -0.09 0.00 -1.68 0.00 0.00 37.83 33.28 2wqk s LYS 198 CO 0.00 0.63 1.04 -1.25 -0.76 0.00 0.00 175.35 175.01 2wqk s PRO 199 N -1.76 3.92 0.13 -1.68 0.04 -1.26 -0.25 135.00 134.14 2wqk s PRO 199 Ca 0.23 1.39 -0.08 0.00 0.04 0.00 0.00 61.00 62.58 2wqk s PRO 199 Cb -0.12 -2.22 -0.01 0.00 0.04 0.00 0.00 34.50 32.19 2wqk s PRO 199 CO 0.14 -0.34 0.22 -0.59 0.04 0.00 0.00 177.00 176.47 2wqk s PHE 200 N -1.90 0.38 0.06 0.56 -0.12 -0.44 -4.86 117.98 111.65 2wqk s PHE 200 Ca 0.64 -0.77 0.03 0.00 -0.05 0.00 0.00 56.93 56.78 2wqk s PHE 200 Cb -0.18 -0.11 -0.03 0.00 -0.63 0.00 0.00 43.02 42.07 2wqk s PHE 200 CO 0.22 -0.63 -0.09 0.71 -0.05 0.00 0.00 175.22 175.38 2wqk s TYR 201 N -3.94 0.80 -0.11 3.49 2.02 -1.26 -0.52 117.35 117.83 2wqk s TYR 201 Ca 0.14 -0.57 -0.01 0.00 -0.37 0.00 0.00 57.07 56.26 2wqk s TYR 201 Cb 0.04 -0.47 0.03 0.00 -0.40 0.00 0.00 41.96 41.17 2wqk s TYR 201 CO -0.03 -0.07 -0.04 -0.46 -1.57 0.00 0.00 175.55 173.38 2wqk s TRP 202 N -1.78 1.15 -0.37 2.71 -0.11 0.10 -4.96 118.94 115.68 2wqk s TRP 202 Ca -0.05 -0.55 -0.27 0.00 1.22 0.00 0.00 56.10 56.45 2wqk s TRP 202 Cb -0.07 -1.06 0.02 0.00 -1.50 0.00 0.00 33.47 30.86 2wqk s TRP 202 CO -0.00 -0.46 1.00 0.42 -4.62 0.00 0.00 176.95 173.29 2wqk s ILE 203 N 1.82 4.50 -0.03 5.86 1.01 -1.26 -0.81 121.20 132.29 2wqk s ILE 203 Ca 0.04 1.34 -0.01 0.00 0.00 0.00 0.00 60.65 62.03 2wqk s ILE 203 Cb -0.13 -4.40 -0.04 0.00 0.01 0.00 0.00 42.46 37.90 2wqk s ILE 203 CO -0.07 -0.60 0.05 0.00 0.00 0.00 0.00 174.94 174.31 2wqk s ALA 204 N 3.69 3.46 -0.27 9.38 0.00 0.11 -4.98 121.76 133.14 2wqk s ALA 204 Ca 0.42 -0.87 -0.10 0.00 0.00 0.00 0.00 51.96 51.40 2wqk s ALA 204 Cb -0.11 -1.52 -0.05 0.00 0.00 0.00 0.00 23.12 21.45 2wqk s ALA 204 CO 0.20 0.65 0.17 0.00 0.00 0.00 0.00 175.76 176.78 2wqk s ALA 205 N -1.10 3.49 0.27 0.00 0.00 -1.26 -1.26 121.76 121.91 2wqk s ALA 205 Ca 0.20 -1.07 0.11 0.00 0.00 0.00 0.00 51.96 51.20 2wqk s ALA 205 Cb -0.12 -2.40 -0.05 0.00 0.00 0.00 0.00 23.12 20.55 2wqk s ALA 205 CO 0.10 -0.50 -0.19 -1.21 0.00 0.00 0.00 175.76 173.96 2wqk s GLU 206 N 1.65 1.65 -1.40 0.00 2.02 0.70 -4.82 118.70 118.50 2wqk s GLU 206 Ca 0.07 -1.76 -0.03 0.00 0.02 0.00 0.00 54.97 53.28 2wqk s GLU 206 Cb -0.16 -1.70 0.02 0.00 0.10 0.00 0.00 34.13 32.40 2wqk s GLU 206 CO 0.09 0.31 0.61 0.39 0.02 0.00 0.00 175.26 176.68 2wqk n GLU 207 N -0.60 -4.15 -1.68 1.61 1.02 -1.26 -0.53 120.64 115.05 2wqk n GLU 207 Ca -0.05 0.51 -0.43 0.00 -0.02 0.00 0.00 57.16 57.17 2wqk n GLU 207 Cb 0.60 -4.92 -0.03 0.00 -0.02 0.00 0.00 31.44 27.07 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 -4.38 2.56 -0.89 -0.32 7.35 -1.26 -2.47 117.46 118.04 2wqk n PHE 208 Ca -0.25 -0.23 0.00 0.00 -0.76 0.00 0.00 57.45 56.21 2wqk n PHE 208 Cb 0.66 -2.76 0.00 0.00 0.35 0.00 0.00 39.48 37.73 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 4.37 0.54 0.27 7.13 0.00 0.12 -4.89 105.19 112.73 2wqk n GLY 209 Ca 0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.33 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 -0.30 1.61 4.06 -1.73 -3.04 115.95 116.55 2wqk h TRP 210 Ca 0.00 0.00 -0.24 0.00 2.06 0.00 0.00 58.89 60.71 2wqk h TRP 210 Cb 0.12 0.00 -0.27 0.00 -1.00 0.00 0.00 29.16 28.01 2wqk h TRP 210 CO 0.08 0.07 -0.81 0.72 -3.56 0.00 0.00 178.44 174.94 2wqk n HIS 211 N -3.94 1.04 -1.83 0.49 8.25 -1.26 -5.09 115.22 112.88 2wqk n HIS 211 Ca -0.02 -1.63 -0.42 0.00 -0.26 0.00 0.00 57.72 55.38 2wqk n HIS 211 Cb 0.16 -0.25 -0.03 0.00 1.12 0.00 0.00 29.99 30.99 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 -2.82 3.84 -0.16 -1.41 0.00 -1.15 -4.98 121.76 115.08 2wqk s ALA 212 Ca 0.39 1.48 -0.20 0.00 0.00 0.00 0.00 51.96 53.64 2wqk s ALA 212 Cb 0.38 -3.66 -0.03 0.00 0.00 0.00 0.00 23.12 19.81 2wqk s ALA 212 CO -0.05 -0.86 0.57 -1.21 0.00 0.00 0.00 175.76 174.21 2wqk s GLU 213 N 0.98 4.27 0.29 0.00 8.01 -1.26 -4.92 118.70 126.06 2wqk s GLU 213 Ca 0.71 0.55 -0.30 0.00 0.01 0.00 0.00 54.97 55.94 2wqk s GLU 213 Cb -0.47 -3.52 -0.12 0.00 -4.31 0.00 0.00 34.13 25.71 2wqk s GLU 213 CO 0.33 -0.07 1.48 -1.91 0.01 0.00 0.00 175.26 175.10 2wqk n GLU 214 N 4.46 2.39 0.00 1.61 2.13 -1.26 -1.96 120.64 128.01 2wqk n GLU 214 Ca -0.04 0.85 0.00 0.00 0.66 0.00 0.00 57.16 58.63 2wqk n GLU 214 Cb 0.51 -2.55 0.00 0.00 0.27 0.00 0.00 31.44 29.66 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 1.83 3.01 3.91 8.31 0.00 -1.26 -5.09 105.19 115.90 2wqk n GLY 215 Ca 0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.64 4.83 0.18 2.61 -4.23 -0.83 -1.53 115.64 114.04 2wqk s THR 216 Ca 0.00 0.21 -0.13 0.00 -1.18 0.00 0.00 61.69 60.59 2wqk s THR 216 Cb 0.00 -3.84 0.08 0.00 1.34 0.00 0.00 72.50 70.08 2wqk s THR 216 CO 0.00 -0.84 1.76 -2.24 -0.54 0.00 0.00 174.62 172.76 2wqk h ASP 217 N 0.19 0.25 -0.22 3.99 3.04 -1.43 -2.28 116.42 119.95 2wqk h ASP 217 Ca -0.47 0.05 0.02 0.00 -3.24 0.00 0.00 57.03 53.39 2wqk h ASP 217 Cb 1.21 0.01 -0.02 0.00 -1.04 0.00 0.00 39.33 39.49 2wqk h ASP 217 CO 0.62 0.17 0.09 1.88 -2.04 0.00 0.00 179.24 179.96 2wqk h TYR 218 N 0.40 0.16 -0.79 4.15 0.05 -1.92 -2.56 116.97 116.47 2wqk h TYR 218 Ca 0.23 0.01 0.00 0.00 0.05 0.00 0.00 58.73 59.02 2wqk h TYR 218 Cb 0.21 -0.04 -0.04 0.00 1.01 0.00 0.00 36.73 37.87 2wqk h TYR 218 CO -0.14 0.08 0.51 2.35 -1.05 0.00 0.00 178.16 179.92 2wqk h TRP 219 N 0.20 1.02 0.31 4.88 7.01 -1.71 -0.92 115.95 126.73 2wqk h TRP 219 Ca 0.09 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.09 2wqk h TRP 219 Cb 0.05 -0.34 0.00 0.00 -2.10 0.00 0.00 29.16 26.77 2wqk h TRP 219 CO -0.11 0.65 -0.17 0.00 -2.79 0.00 0.00 178.44 176.03 2wqk h ALA 220 N 1.28 -0.44 -0.21 2.65 0.00 -1.09 -1.94 119.26 119.52 2wqk h ALA 220 Ca 0.29 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.97 2wqk h ALA 220 Cb -0.10 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2wqk h ALA 220 CO -0.06 -0.75 -0.44 -0.39 0.00 0.00 0.00 179.25 177.61 2wqk h VAL 221 N -0.44 1.31 0.00 0.00 -1.51 -1.28 -0.00 116.25 114.33 2wqk h VAL 221 Ca -0.04 -1.63 -0.01 0.00 -1.23 0.00 0.00 66.70 63.79 2wqk h VAL 221 Cb 0.35 1.63 -0.00 0.00 -2.13 0.00 0.00 31.29 31.14 2wqk h VAL 221 CO 0.05 0.51 -0.05 -0.07 -1.23 0.00 0.00 177.57 176.78 2wqk h LEU 222 N 0.42 0.00 -3.01 4.19 3.38 -1.00 -2.48 115.31 116.80 2wqk h LEU 222 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2wqk h LEU 222 Cb 0.94 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.69 2wqk h LEU 222 CO 0.08 0.05 0.00 0.59 0.09 0.00 0.00 178.44 179.25 2wqk n ASN 223 N -4.27 4.21 0.00 -0.43 3.02 -0.74 -4.97 115.26 112.07 2wqk n ASN 223 Ca -0.03 -2.31 0.00 0.00 -0.03 0.00 0.00 54.58 52.21 2wqk n ASN 223 Cb 0.13 -0.50 0.00 0.00 -0.61 0.00 0.00 39.78 38.80 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 1.03 0.61 3.70 7.41 0.00 -0.93 -4.90 105.19 112.10 2wqk n GLY 224 Ca 0.23 -0.56 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 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 3.01 0.26 1.61 2.02 -0.06 -1.01 117.35 121.18 2wqk s TYR 225 Ca 0.00 -0.01 -0.30 0.00 -0.37 0.00 0.00 57.07 56.39 2wqk s TYR 225 Cb 0.00 -1.55 -0.09 0.00 -0.40 0.00 0.00 41.96 39.92 2wqk s TYR 225 CO 0.00 0.48 1.26 0.08 -1.57 0.00 0.00 175.55 175.80 2wqk s VAL 226 N -1.32 3.12 -0.18 0.71 1.01 -0.22 -3.09 120.40 120.43 2wqk s VAL 226 Ca 0.26 1.03 -0.07 0.00 0.00 0.00 0.00 61.98 63.20 2wqk s VAL 226 Cb -0.12 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 2wqk s VAL 226 CO 0.19 0.20 0.06 -0.55 0.00 0.00 0.00 175.10 175.00 2wqk s SER 227 N -0.20 5.57 -0.21 3.32 0.15 -0.42 -0.67 113.70 121.24 2wqk s SER 227 Ca 0.51 0.06 0.01 0.00 0.70 0.00 0.00 55.95 57.23 2wqk s SER 227 Cb -0.36 -1.95 0.05 0.00 -1.71 0.00 0.00 66.02 62.04 2wqk s SER 227 CO 0.44 0.17 -0.08 -0.69 1.20 0.00 0.00 173.24 174.27 2wqk s VAL 228 N 0.41 1.58 -0.18 4.45 1.01 -0.08 -1.26 120.40 126.34 2wqk s VAL 228 Ca 0.03 -1.09 -0.04 0.00 0.00 0.00 0.00 61.98 60.88 2wqk s VAL 228 Cb -0.13 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.49 2wqk s VAL 228 CO 0.00 0.05 -0.03 -0.89 0.00 0.00 0.00 175.10 174.24 2wqk s THR 229 N 1.40 3.81 -0.19 3.92 2.01 -0.22 -1.14 115.64 125.24 2wqk s THR 229 Ca -0.03 -0.37 -0.27 0.00 0.31 0.00 0.00 61.69 61.33 2wqk s THR 229 Cb -0.17 -2.69 -0.01 0.00 0.01 0.00 0.00 72.50 69.64 2wqk s THR 229 CO -0.07 0.46 0.91 -2.16 -0.69 0.00 0.00 174.62 173.08 2wqk s PRO 230 N 0.71 4.28 -0.04 4.92 0.04 -1.26 -1.11 135.00 142.54 2wqk s PRO 230 Ca -0.01 1.15 -0.01 0.00 0.04 0.00 0.00 61.00 62.17 2wqk s PRO 230 Cb -0.14 -3.60 -0.04 0.00 0.04 0.00 0.00 34.50 30.76 2wqk s PRO 230 CO 0.02 -0.45 0.04 -0.51 0.04 0.00 0.00 177.00 176.15 2wqk s LEU 231 N 2.55 3.74 0.28 -3.56 1.43 -0.09 -4.95 118.68 118.07 2wqk s LEU 231 Ca 0.41 0.13 -0.29 0.00 -1.03 0.00 0.00 54.13 53.35 2wqk s LEU 231 Cb -0.16 -2.05 -0.10 0.00 0.03 0.00 0.00 46.19 43.91 2wqk s LEU 231 CO 0.11 0.32 1.38 -1.00 0.23 0.00 0.00 176.35 177.38 2wqk s HIS 232 N -1.06 3.03 -0.02 0.29 3.76 -1.26 -1.88 115.29 118.15 2wqk s HIS 232 Ca 0.18 1.19 -0.20 0.00 -0.15 0.00 0.00 55.06 56.09 2wqk s HIS 232 Cb -0.12 -3.76 -0.31 0.00 1.11 0.00 0.00 32.58 29.51 2wqk s HIS 232 CO 0.09 -2.31 0.96 1.25 -0.85 0.00 0.00 174.74 173.87 2wqk h LEU 233 N 4.36 0.58 -9.02 0.89 5.85 -1.70 -3.45 115.31 112.82 2wqk h LEU 233 Ca -0.47 -0.91 -0.60 0.00 0.84 0.00 0.00 57.88 56.74 2wqk h LEU 233 Cb 1.22 -0.19 -0.09 0.00 0.37 0.00 0.00 40.66 41.97 2wqk h LEU 233 CO 0.72 1.44 0.39 -0.62 -0.34 0.00 0.00 178.44 180.04 2wqk s ASP 234 N -7.08 6.76 0.00 1.25 -1.08 -1.26 -4.92 116.67 110.34 2wqk s ASP 234 Ca -0.12 0.93 0.28 0.00 -0.52 0.00 0.00 52.55 53.12 2wqk s ASP 234 Cb 0.02 -2.41 1.14 0.00 -1.46 0.00 0.00 42.92 40.21 2wqk s ASP 234 CO 0.86 -0.49 1.85 0.18 0.52 0.00 0.00 175.17 178.09 2wqk n LEU 235 N 5.95 0.09 -4.73 -1.34 4.77 -1.26 -4.91 117.00 115.57 2wqk n LEU 235 Ca 0.04 0.40 -0.42 0.00 -0.03 0.00 0.00 56.01 56.00 2wqk n LEU 235 Cb 0.48 -0.44 -0.03 0.00 -2.33 0.00 0.00 43.42 41.10 2wqk n LEU 235 CO 0.46 0.02 1.19 -0.89 -1.33 0.00 0.00 177.39 176.85 2wqk s THR 236 N -2.97 2.60 -1.14 -5.08 2.01 -1.26 -4.93 115.64 104.87 2wqk s THR 236 Ca 0.15 0.46 -0.16 0.00 0.31 0.00 0.00 61.69 62.44 2wqk s THR 236 Cb 0.19 -3.29 0.15 0.00 0.01 0.00 0.00 72.50 69.55 2wqk s THR 236 CO 0.55 0.05 1.39 0.21 -0.69 0.00 0.00 174.62 176.13 2wqk s ASN 237 N 0.88 6.92 0.31 3.53 3.84 -1.26 -4.87 114.94 124.29 2wqk s ASN 237 Ca 0.67 -2.65 -0.00 0.00 0.21 0.00 0.00 52.86 51.09 2wqk s ASN 237 Cb -0.43 -2.43 0.51 0.00 -0.55 0.00 0.00 41.25 38.35 2wqk s ASN 237 CO 0.36 -0.90 1.96 1.88 -2.79 0.00 0.00 177.10 177.61 2wqk h TYR 238 N 7.71 0.99 -0.98 0.43 0.05 -1.99 -2.96 116.97 120.24 2wqk h TYR 238 Ca 0.29 0.02 0.08 0.00 0.05 0.00 0.00 58.73 59.17 2wqk h TYR 238 Cb 0.92 -0.33 -0.07 0.00 1.01 0.00 0.00 36.73 38.25 2wqk h TYR 238 CO 1.16 0.59 0.63 -0.22 -1.05 0.00 0.00 178.16 179.27 2wqk h LYS 239 N 1.04 1.04 -0.20 4.88 3.64 -2.04 -2.71 116.57 122.24 2wqk h LYS 239 Ca 0.32 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 2wqk h LYS 239 Cb -0.01 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 31.57 2wqk h LYS 239 CO -0.09 0.69 0.00 1.33 -2.27 0.00 0.00 179.45 179.11 2wqk n VAL 240 N -4.53 0.25 -0.34 2.00 0.24 -1.12 -4.30 118.33 110.53 2wqk n VAL 240 Ca 0.16 -0.45 0.06 0.00 -2.04 0.00 0.00 64.34 62.07 2wqk n VAL 240 Cb 0.24 0.62 0.22 0.00 -1.47 0.00 0.00 33.84 33.46 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 2.98 0.88 -0.05 7.34 2.86 -1.55 -0.42 114.93 126.97 2wqk h MET 241 Ca 0.00 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.60 2wqk h MET 241 Cb 0.65 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 32.11 2wqk h MET 241 CO 0.00 0.58 0.04 1.57 1.06 0.00 0.00 176.91 180.17 2wqk h LYS 242 N 0.91 0.00 -0.01 1.72 2.10 -1.82 -1.90 116.57 117.58 2wqk h LYS 242 Ca 0.47 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.12 2wqk h LYS 242 Cb 0.48 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.81 2wqk h LYS 242 CO -0.27 0.00 -0.08 0.43 -2.00 0.00 0.00 179.45 177.53 2wqk n SER 243 N -4.30 0.64 -0.01 7.07 7.64 -0.17 -3.15 113.62 121.34 2wqk n SER 243 Ca -0.02 -0.86 0.01 0.00 1.01 0.00 0.00 58.87 59.02 2wqk n SER 243 Cb 0.14 -0.03 0.02 0.00 -1.01 0.00 0.00 64.21 63.33 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 -0.71 1.10 0.35 0.44 -5.35 -0.73 -4.68 119.36 109.77 2wqk n ILE 244 Ca 0.17 -1.15 0.12 0.00 -0.27 0.00 0.00 62.75 61.61 2wqk n ILE 244 Cb 0.27 0.41 0.51 0.00 -1.74 0.00 0.00 39.64 39.09 2wqk n ILE 244 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2wqk n LYS 245 N -0.62 0.19 0.31 6.28 4.76 -1.09 -1.47 118.16 126.51 2wqk n LYS 245 Ca 0.02 0.47 0.19 0.00 -2.87 0.00 0.00 58.31 56.12 2wqk n LYS 245 Cb 0.31 -1.89 1.04 0.00 -1.84 0.00 0.00 35.03 32.65 2wqk n LYS 245 CO 0.00 0.00 0.00 0.10 -1.37 0.00 0.00 177.40 176.13 2wqk h TYR 246 N 0.00 0.00 0.00 2.13 -0.00 -1.83 -1.05 116.97 116.22 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 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.02 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 -1.64 -2.66 115.31 114.49 2wqk h LEU 247 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2wqk h LEU 247 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2wqk h LEU 247 CO -0.00 0.00 -0.23 -0.62 0.09 0.00 0.00 178.44 177.68 2wqk n GLU 248 N -2.74 0.20 0.00 1.13 1.02 -0.40 -5.22 120.64 114.63 2wqk n GLU 248 Ca 0.01 0.12 0.09 0.00 -0.02 0.00 0.00 57.16 57.36 2wqk n GLU 248 Cb 0.28 -1.69 0.51 0.00 -0.02 0.00 0.00 31.44 30.52 2wqk n GLU 248 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06