#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qr5 s VAL 7 N 0.00 4.12 -1.22 -1.45 -7.23 -1.26 -4.96 120.40 108.39 2qr5 s VAL 7 Ca 0.00 1.35 -0.16 0.00 -1.81 0.00 0.00 61.98 61.36 2qr5 s VAL 7 Cb 0.00 -3.89 0.12 0.00 0.56 0.00 0.00 36.38 33.18 2qr5 s VAL 7 CO 0.00 -0.14 1.55 -1.61 -0.31 0.00 0.00 175.10 174.59 2qr5 s GLU 8 N 3.66 4.01 0.17 4.82 2.02 -1.26 -4.86 118.70 127.25 2qr5 s GLU 8 Ca 0.59 -2.24 -0.17 0.00 0.02 0.00 0.00 54.97 53.17 2qr5 s GLU 8 Cb -0.24 -5.26 0.11 0.00 0.10 0.00 0.00 34.13 28.84 2qr5 s GLU 8 CO 0.18 -1.99 1.67 0.74 0.02 0.00 0.00 175.26 175.88 2qr5 h PHE 9 N 7.52 -0.21 0.00 1.61 -1.00 -2.00 -2.13 116.94 120.72 2qr5 h PHE 9 Ca 0.36 0.04 -0.05 0.00 2.81 0.00 0.00 57.97 61.12 2qr5 h PHE 9 Cb 0.88 0.16 -0.01 0.00 3.61 0.00 0.00 35.95 40.60 2qr5 h PHE 9 CO 1.25 -0.18 -0.25 0.66 -1.61 0.00 0.00 178.31 178.18 2qr5 h SER 10 N 0.01 0.00 -0.16 2.17 4.64 -1.99 -0.38 113.55 117.83 2qr5 h SER 10 Ca 0.20 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.48 2qr5 h SER 10 Cb 0.31 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.39 2qr5 h SER 10 CO -0.43 0.25 -0.08 -0.09 -0.87 0.00 0.00 176.83 175.61 2qr5 h ARG 11 N 0.00 0.34 -0.29 4.77 2.43 -1.81 -1.87 114.38 117.94 2qr5 h ARG 11 Ca -0.00 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 59.01 2qr5 h ARG 11 Cb 0.58 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.10 2qr5 h ARG 11 CO 0.03 0.66 0.16 0.82 -1.51 0.00 0.00 179.97 180.13 2qr5 h ILE 12 N 0.01 1.13 -0.92 1.20 2.04 -1.03 -2.21 117.51 117.74 2qr5 h ILE 12 Ca 0.04 -0.36 0.05 0.00 1.00 0.00 0.00 64.86 65.59 2qr5 h ILE 12 Cb 0.56 0.84 -0.06 0.00 -0.74 0.00 0.00 36.82 37.41 2qr5 h ILE 12 CO 0.02 0.13 0.58 0.58 0.00 0.00 0.00 178.15 179.47 2qr5 h VAL 13 N 0.35 1.10 -0.56 1.67 2.07 -1.08 0.48 116.25 120.27 2qr5 h VAL 13 Ca 0.10 -0.37 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 2qr5 h VAL 13 Cb 0.08 -0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 29.73 2qr5 h VAL 13 CO -0.02 0.20 0.24 -0.09 0.02 0.00 0.00 177.57 177.92 2qr5 h ARG 14 N 1.09 0.82 -0.05 1.57 2.43 -1.10 0.15 114.38 119.29 2qr5 h ARG 14 Ca 0.39 -0.14 -0.01 0.00 -0.81 0.00 0.00 59.98 59.41 2qr5 h ARG 14 Cb 0.11 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.52 2qr5 h ARG 14 CO -0.15 0.70 -0.00 -0.44 -1.51 0.00 0.00 179.97 178.56 2qr5 h ASP 15 N 0.76 0.09 -0.47 -3.80 3.32 -1.05 -2.94 116.42 112.32 2qr5 h ASP 15 Ca 0.19 -0.33 -0.08 0.00 0.02 0.00 0.00 57.03 56.83 2qr5 h ASP 15 Cb 0.17 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 2qr5 h ASP 15 CO -0.02 0.40 -0.01 0.58 -1.72 0.00 0.00 179.24 178.47 2qr5 h VAL 16 N -0.22 1.26 0.00 -1.35 2.07 -0.70 -0.81 116.25 116.51 2qr5 h VAL 16 Ca 0.01 -1.08 -0.07 0.00 0.82 0.00 0.00 66.70 66.38 2qr5 h VAL 16 Cb 0.35 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 2qr5 h VAL 16 CO 0.00 0.37 -0.35 1.05 0.02 0.00 0.00 177.57 178.66 2qr5 h GLU 17 N 0.70 0.00 0.08 1.57 4.11 -0.77 -1.44 114.58 118.83 2qr5 h GLU 17 Ca 0.13 0.00 -0.26 0.00 0.07 0.00 0.00 59.36 59.31 2qr5 h GLU 17 Cb 0.52 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.77 2qr5 h GLU 17 CO 0.03 0.35 -1.12 0.00 0.07 0.00 0.00 179.01 178.34 2qr5 h ARG 18 N 0.00 0.34 -0.59 1.06 3.08 -1.28 -0.57 114.38 116.43 2qr5 h ARG 18 Ca -0.00 -0.48 -0.04 0.00 0.07 0.00 0.00 59.98 59.53 2qr5 h ARG 18 Cb 0.66 0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.84 2qr5 h ARG 18 CO 0.05 1.18 0.19 -0.07 -1.07 0.00 0.00 179.97 180.25 2qr5 h LEU 19 N 0.15 0.81 -0.23 3.04 3.38 -0.82 -1.14 115.31 120.50 2qr5 h LEU 19 Ca -0.12 -0.13 -0.18 0.00 0.09 0.00 0.00 57.88 57.54 2qr5 h LEU 19 Cb 1.81 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 42.35 2qr5 h LEU 19 CO 0.19 0.76 -0.57 0.40 0.09 0.00 0.00 178.44 179.32 2qr5 h ILE 20 N 0.86 1.29 -0.07 1.22 2.04 -1.24 -3.30 117.51 118.31 2qr5 h ILE 20 Ca 0.20 -1.77 -0.08 0.00 1.00 0.00 0.00 64.86 64.21 2qr5 h ILE 20 Cb 0.24 1.79 -0.01 0.00 -0.74 0.00 0.00 36.82 38.09 2qr5 h ILE 20 CO -0.01 0.57 -0.31 0.00 0.00 0.00 0.00 178.15 178.40 2qr5 h ALA 21 N 0.62 1.35 -2.04 1.87 0.00 -0.89 -3.45 119.26 116.73 2qr5 h ALA 21 Ca -0.01 -0.31 -0.62 0.00 0.00 0.00 0.00 54.91 53.97 2qr5 h ALA 21 Cb 1.18 -0.07 0.06 0.00 0.00 0.00 0.00 17.79 18.95 2qr5 h ALA 21 CO 0.12 0.46 0.67 1.55 0.00 0.00 0.00 179.25 182.05 2qr5 n VAL 22 N -4.14 0.01 -1.91 0.00 3.14 -0.45 -4.84 118.33 110.14 2qr5 n VAL 22 Ca -0.01 -0.00 -0.41 0.00 -2.96 0.00 0.00 64.34 60.96 2qr5 n VAL 22 Cb 0.38 -1.26 -0.01 0.00 -1.06 0.00 0.00 33.84 31.89 2qr5 n VAL 22 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 2qr5 s GLU 23 N 0.78 4.19 -0.04 1.45 8.01 -1.26 -4.92 118.70 126.91 2qr5 s GLU 23 Ca 0.81 2.45 0.01 0.00 0.01 0.00 0.00 54.97 58.25 2qr5 s GLU 23 Cb -0.79 -3.01 0.02 0.00 -4.31 0.00 0.00 34.13 26.04 2qr5 s GLU 23 CO 0.42 -0.42 -0.04 0.15 0.01 0.00 0.00 175.26 175.37 2qr5 s LYS 24 N -1.85 0.79 -0.02 1.61 1.02 -1.08 -3.52 119.74 116.69 2qr5 s LYS 24 Ca 0.52 -0.11 0.06 0.00 0.02 0.00 0.00 55.97 56.47 2qr5 s LYS 24 Cb -0.44 -0.80 -0.01 0.00 -0.52 0.00 0.00 37.83 36.06 2qr5 s LYS 24 CO 0.58 -0.07 -0.19 0.71 -0.92 0.00 0.00 175.35 175.46 2qr5 s TYR 25 N 0.84 1.73 0.07 3.18 1.51 -0.21 -0.64 117.35 123.84 2qr5 s TYR 25 Ca -0.11 -0.34 0.09 0.00 -1.01 0.00 0.00 57.07 55.70 2qr5 s TYR 25 Cb -0.14 -1.12 -0.03 0.00 -0.11 0.00 0.00 41.96 40.56 2qr5 s TYR 25 CO 0.00 -0.04 -0.25 -1.54 -1.11 0.00 0.00 175.55 172.61 2qr5 s SER 26 N -0.41 3.05 -0.12 2.29 1.04 0.10 -3.91 113.70 115.74 2qr5 s SER 26 Ca 0.06 -0.63 -0.23 0.00 0.48 0.00 0.00 55.95 55.64 2qr5 s SER 26 Cb -0.08 -0.24 -0.03 0.00 0.10 0.00 0.00 66.02 65.77 2qr5 s SER 26 CO -0.00 0.21 0.69 -0.22 0.98 0.00 0.00 173.24 174.89 2qr5 s LEU 27 N -1.50 4.25 -0.15 2.42 2.96 -1.26 -1.52 118.68 123.87 2qr5 s LEU 27 Ca 0.11 1.07 0.10 0.00 -0.22 0.00 0.00 54.13 55.19 2qr5 s LEU 27 Cb -0.10 -3.04 -0.16 0.00 0.50 0.00 0.00 46.19 43.40 2qr5 s LEU 27 CO 0.03 -0.20 -0.00 0.00 -1.32 0.00 0.00 176.35 174.86 2qr5 n GLN 28 N 4.34 1.42 -2.76 1.98 1.13 0.12 -4.73 117.38 118.88 2qr5 n GLN 28 Ca -0.01 0.02 0.00 0.00 -1.94 0.00 0.00 57.00 55.07 2qr5 n GLN 28 Cb 0.50 -1.36 0.00 0.00 0.11 0.00 0.00 30.24 29.50 2qr5 n GLN 28 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2qr5 n GLY 29 N 2.27 -0.49 2.97 1.08 0.00 -1.16 -4.52 105.19 105.34 2qr5 n GLY 29 Ca -0.25 -1.00 -0.23 0.00 0.00 0.00 0.00 46.02 44.54 2qr5 n GLY 29 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qr5 s VAL 30 N -3.31 0.93 0.28 1.61 1.01 -1.26 -1.02 120.40 118.65 2qr5 s VAL 30 Ca 0.00 -0.34 0.11 0.00 0.00 0.00 0.00 61.98 61.75 2qr5 s VAL 30 Cb 0.00 -0.89 -0.05 0.00 0.00 0.00 0.00 36.38 35.44 2qr5 s VAL 30 CO 0.00 0.32 -0.18 0.68 0.00 0.00 0.00 175.10 175.91 2qr5 s VAL 31 N 0.88 2.37 -0.17 2.92 -7.23 0.12 -1.14 120.40 118.16 2qr5 s VAL 31 Ca -0.11 -2.37 -0.02 0.00 -1.81 0.00 0.00 61.98 57.68 2qr5 s VAL 31 Cb -0.15 -2.31 0.02 0.00 0.56 0.00 0.00 36.38 34.49 2qr5 s VAL 31 CO 0.01 -0.40 0.04 -0.90 -0.31 0.00 0.00 175.10 173.55 2qr5 n ASP 32 N -0.62 -0.11 0.00 4.85 3.85 -0.62 -1.65 116.55 122.25 2qr5 n ASP 32 Ca -0.05 -0.11 0.00 0.00 -0.71 0.00 0.00 54.79 53.91 2qr5 n ASP 32 Cb 0.60 -0.15 0.00 0.00 -1.35 0.00 0.00 41.12 40.23 2qr5 n ASP 32 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2qr5 n GLY 33 N -0.68 0.43 1.65 6.12 0.00 -1.26 -4.34 105.19 107.11 2qr5 n GLY 33 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 2qr5 n GLY 33 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2qr5 n ASP 34 N 0.00 1.34 -4.63 1.61 3.85 -1.18 -4.69 116.55 112.85 2qr5 n ASP 34 Ca 0.00 -2.31 -0.34 0.00 -0.71 0.00 0.00 54.79 51.42 2qr5 n ASP 34 Cb 0.00 -0.36 -0.10 0.00 -1.35 0.00 0.00 41.12 39.30 2qr5 n ASP 34 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 2qr5 s LYS 35 N -1.25 2.92 0.05 0.11 1.02 -0.66 -4.85 119.74 117.08 2qr5 s LYS 35 Ca 0.34 -0.47 -0.29 0.00 0.02 0.00 0.00 55.97 55.57 2qr5 s LYS 35 Cb 0.38 -2.72 -0.05 0.00 -0.52 0.00 0.00 37.83 34.92 2qr5 s LYS 35 CO -0.13 0.67 0.93 -0.51 -0.92 0.00 0.00 175.35 175.39 2qr5 s LEU 36 N -0.80 4.43 -0.36 3.17 1.43 0.61 -0.70 118.68 126.47 2qr5 s LEU 36 Ca 0.12 1.67 -0.15 0.00 -1.03 0.00 0.00 54.13 54.74 2qr5 s LEU 36 Cb -0.11 -3.51 -0.00 0.00 0.03 0.00 0.00 46.19 42.59 2qr5 s LEU 36 CO 0.02 -0.13 0.37 -0.22 0.23 0.00 0.00 176.35 176.61 2qr5 s LEU 37 N 0.42 4.57 -0.00 1.79 2.96 -0.18 -0.96 118.68 127.27 2qr5 s LEU 37 Ca 0.47 -0.37 0.08 0.00 -0.22 0.00 0.00 54.13 54.09 2qr5 s LEU 37 Cb -0.22 -2.33 -0.02 0.00 0.50 0.00 0.00 46.19 44.12 2qr5 s LEU 37 CO 0.28 -0.39 -0.25 0.68 -1.32 0.00 0.00 176.35 175.35 2qr5 s VAL 38 N 2.01 1.96 -0.22 1.68 -7.23 0.01 -0.70 120.40 117.91 2qr5 s VAL 38 Ca 0.11 -1.13 -0.09 0.00 -1.81 0.00 0.00 61.98 59.07 2qr5 s VAL 38 Cb -0.17 -1.64 -0.04 0.00 0.56 0.00 0.00 36.38 35.09 2qr5 s VAL 38 CO 0.12 0.49 0.10 -0.69 -0.31 0.00 0.00 175.10 174.81 2qr5 s VAL 39 N -0.64 4.91 0.00 1.32 1.01 -0.58 0.35 120.40 126.77 2qr5 s VAL 39 Ca 0.10 0.02 0.03 0.00 0.00 0.00 0.00 61.98 62.13 2qr5 s VAL 39 Cb -0.09 -3.26 -0.01 0.00 0.00 0.00 0.00 36.38 33.01 2qr5 s VAL 39 CO -0.00 0.39 -0.10 -0.83 0.00 0.00 0.00 175.10 174.55 2qr5 s GLY 40 N 0.91 0.52 -0.58 4.51 0.00 0.89 -0.72 107.32 112.85 2qr5 s GLY 40 Ca 0.05 -0.50 -0.28 0.00 0.00 0.00 0.00 44.72 43.99 2qr5 s GLY 40 CO 0.03 -0.45 1.27 -0.12 0.00 0.00 0.00 173.10 173.84 2qr5 s PHE 41 N -0.40 2.48 -0.09 1.90 5.36 0.19 -0.02 117.98 127.40 2qr5 s PHE 41 Ca 0.02 0.41 -0.26 0.00 -0.96 0.00 0.00 56.93 56.14 2qr5 s PHE 41 Cb -0.05 -4.48 0.06 0.00 -0.34 0.00 0.00 43.02 38.21 2qr5 s PHE 41 CO -0.00 -1.75 0.61 0.45 -1.46 0.00 0.00 175.22 173.07 2qr5 s SER 42 N 3.49 -0.59 -1.68 6.13 0.15 -0.52 -2.64 113.70 118.04 2qr5 s SER 42 Ca 0.46 0.76 -0.02 0.00 0.70 0.00 0.00 55.95 57.85 2qr5 s SER 42 Cb -0.09 0.70 0.00 0.00 -1.71 0.00 0.00 66.02 64.92 2qr5 s SER 42 CO 0.25 -0.49 0.19 -0.62 1.20 0.00 0.00 173.24 173.77 2qr5 n GLU 43 N 1.43 -2.70 -1.00 5.44 1.02 -1.26 -2.59 120.64 120.97 2qr5 n GLU 43 Ca -0.18 0.96 -0.00 0.00 -0.02 0.00 0.00 57.16 57.92 2qr5 n GLU 43 Cb 0.56 -5.68 -0.00 0.00 -0.02 0.00 0.00 31.44 26.30 2qr5 n GLU 43 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qr5 n GLY 44 N -1.16 0.47 3.65 0.62 0.00 -1.26 -5.01 105.19 102.50 2qr5 n GLY 44 Ca -0.20 -0.18 -0.09 0.00 0.00 0.00 0.00 46.02 45.55 2qr5 n GLY 44 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qr5 s SER 45 N -2.17 -0.32 -0.22 1.61 1.04 -1.07 -0.93 113.70 111.64 2qr5 s SER 45 Ca 0.00 -0.45 -0.29 0.00 0.48 0.00 0.00 55.95 55.69 2qr5 s SER 45 Cb 0.00 0.65 -0.00 0.00 0.10 0.00 0.00 66.02 66.77 2qr5 s SER 45 CO 0.00 -1.17 1.22 -0.69 0.98 0.00 0.00 173.24 173.58 2qr5 s VAL 46 N -3.87 4.34 0.17 5.02 1.01 -0.64 -1.44 120.40 124.97 2qr5 s VAL 46 Ca 0.09 1.58 0.05 0.00 0.00 0.00 0.00 61.98 63.70 2qr5 s VAL 46 Cb -0.03 -4.13 -0.05 0.00 0.00 0.00 0.00 36.38 32.18 2qr5 s VAL 46 CO -0.00 -0.26 -0.09 0.20 0.00 0.00 0.00 175.10 174.95 2qr5 s ASN 47 N 2.02 1.88 -0.15 3.32 0.01 0.98 -1.72 114.94 121.28 2qr5 s ASN 47 Ca 0.52 -1.05 -0.04 0.00 -0.71 0.00 0.00 52.86 51.58 2qr5 s ASN 47 Cb -0.18 -0.02 -0.03 0.00 0.41 0.00 0.00 41.25 41.42 2qr5 s ASN 47 CO 0.15 -0.35 -0.01 0.00 -1.51 0.00 0.00 177.10 175.38 2qr5 s ALA 48 N -3.31 3.13 0.06 0.60 0.00 -1.26 -0.08 121.76 120.90 2qr5 s ALA 48 Ca 0.19 -0.80 0.05 0.00 0.00 0.00 0.00 51.96 51.41 2qr5 s ALA 48 Cb 0.03 -1.62 -0.03 0.00 0.00 0.00 0.00 23.12 21.50 2qr5 s ALA 48 CO 0.03 0.27 -0.15 0.71 0.00 0.00 0.00 175.76 176.61 2qr5 s TYR 49 N 0.17 1.32 0.05 0.00 1.51 0.15 -0.19 117.35 120.36 2qr5 s TYR 49 Ca 0.00 -0.41 -0.14 0.00 -1.01 0.00 0.00 57.07 55.51 2qr5 s TYR 49 Cb -0.13 -0.76 -0.06 0.00 -0.11 0.00 0.00 41.96 40.90 2qr5 s TYR 49 CO 0.02 0.07 0.44 -0.51 -1.11 0.00 0.00 175.55 174.46 2qr5 s LEU 50 N -1.48 4.44 -0.04 -1.29 1.43 0.11 -0.81 118.68 121.04 2qr5 s LEU 50 Ca 0.01 0.98 0.02 0.00 -1.03 0.00 0.00 54.13 54.11 2qr5 s LEU 50 Cb -0.09 -2.80 0.01 0.00 0.03 0.00 0.00 46.19 43.35 2qr5 s LEU 50 CO 0.02 0.26 -0.07 -0.47 0.23 0.00 0.00 176.35 176.32 2qr5 s TYR 51 N -1.20 0.91 0.00 0.29 5.04 -0.13 -0.26 117.35 121.99 2qr5 s TYR 51 Ca 0.28 -0.26 0.00 0.00 -2.44 0.00 0.00 57.07 54.65 2qr5 s TYR 51 Cb -0.16 -0.71 0.00 0.00 0.35 0.00 0.00 41.96 41.44 2qr5 s TYR 51 CO 0.16 -0.16 0.68 -0.40 -1.34 0.00 0.00 175.55 174.48 2qr5 n ASP 52 N 3.70 1.26 0.00 4.32 5.68 -1.11 -0.28 116.55 130.11 2qr5 n ASP 52 Ca -0.22 -1.44 0.00 0.00 -0.50 0.00 0.00 54.79 52.63 2qr5 n ASP 52 Cb 0.52 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 2qr5 n ASP 52 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2qr5 n GLY 53 N -0.22 0.67 0.00 6.12 0.00 -1.26 -4.85 105.19 105.65 2qr5 n GLY 53 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2qr5 n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qr5 n GLY 54 N -1.17 0.00 3.68 -0.02 0.00 -1.26 -5.12 105.19 101.30 2qr5 n GLY 54 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2qr5 n GLY 54 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qr5 s GLU 55 N -0.59 2.78 -0.20 1.61 2.12 -1.26 -5.10 118.70 118.05 2qr5 s GLU 55 Ca 0.00 -0.62 -0.00 0.00 0.36 0.00 0.00 54.97 54.71 2qr5 s GLU 55 Cb 0.00 -2.66 0.02 0.00 0.26 0.00 0.00 34.13 31.74 2qr5 s GLU 55 CO 0.00 0.62 -0.15 -0.08 -0.54 0.00 0.00 175.26 175.12 2qr5 s THR 56 N -1.09 2.44 -0.25 -1.70 -1.32 -1.26 -2.75 115.64 109.71 2qr5 s THR 56 Ca 0.20 -0.90 -0.05 0.00 -1.21 0.00 0.00 61.69 59.73 2qr5 s THR 56 Cb -0.11 -2.10 -0.00 0.00 -1.51 0.00 0.00 72.50 68.78 2qr5 s THR 56 CO 0.10 0.44 -0.00 -0.69 -2.21 0.00 0.00 174.62 172.26 2qr5 s VAL 57 N 1.32 3.53 0.02 5.08 1.01 0.64 -4.93 120.40 127.07 2qr5 s VAL 57 Ca 0.04 -0.59 -0.30 0.00 0.00 0.00 0.00 61.98 61.13 2qr5 s VAL 57 Cb -0.14 -2.69 -0.05 0.00 0.00 0.00 0.00 36.38 33.49 2qr5 s VAL 57 CO -0.09 0.30 1.33 -0.75 0.00 0.00 0.00 175.10 175.88 2qr5 s LYS 58 N 1.47 4.33 -0.11 2.72 2.20 -1.26 0.08 119.74 129.17 2qr5 s LYS 58 Ca 0.04 1.89 0.02 0.00 -0.36 0.00 0.00 55.97 57.57 2qr5 s LYS 58 Cb -0.15 -3.48 -0.24 0.00 -1.51 0.00 0.00 37.83 32.44 2qr5 s LYS 58 CO -0.01 -0.47 0.38 1.28 -0.36 0.00 0.00 175.35 176.17 2qr5 n LEU 59 N 4.87 1.94 -4.94 5.43 4.77 0.74 -4.20 117.00 125.61 2qr5 n LEU 59 Ca 0.12 0.23 -0.24 0.00 -0.03 0.00 0.00 56.01 56.08 2qr5 n LEU 59 Cb 0.44 -0.58 -0.00 0.00 -2.33 0.00 0.00 43.42 40.95 2qr5 n LEU 59 CO 0.57 0.69 0.25 0.54 -1.33 0.00 0.00 177.39 178.11 2qr5 s ASN 60 N -6.58 6.16 0.00 -1.43 4.22 -1.26 0.33 114.94 116.38 2qr5 s ASN 60 Ca -0.17 0.48 0.00 0.00 -2.14 0.00 0.00 52.86 51.03 2qr5 s ASN 60 Cb 0.07 -1.93 0.00 0.00 1.28 0.00 0.00 41.25 40.68 2qr5 s ASN 60 CO 0.77 -0.46 0.00 0.54 -2.04 0.00 0.00 177.10 175.92 2qr5 n ARG 61 N -1.95 0.00 -1.92 3.55 5.12 -1.26 -4.62 116.66 115.58 2qr5 n ARG 61 Ca -0.02 0.00 -0.30 0.00 -1.93 0.00 0.00 57.85 55.60 2qr5 n ARG 61 Cb 0.56 -0.21 0.03 0.00 -1.16 0.00 0.00 32.46 31.69 2qr5 n ARG 61 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 2qr5 s GLU 62 N 0.00 3.13 0.45 5.56 2.02 -1.26 -4.97 118.70 123.63 2qr5 s GLU 62 Ca 0.00 0.54 -0.23 0.00 0.02 0.00 0.00 54.97 55.29 2qr5 s GLU 62 Cb 0.00 -2.06 -0.10 0.00 0.10 0.00 0.00 34.13 32.07 2qr5 s GLU 62 CO 0.00 -0.84 1.03 -2.30 0.02 0.00 0.00 175.26 173.17 2qr5 n PRO 63 N -2.88 1.34 -4.38 0.39 -0.02 -1.26 -5.01 135.00 123.18 2qr5 n PRO 63 Ca 0.06 0.49 -0.28 0.00 -2.02 0.00 0.00 63.50 61.75 2qr5 n PRO 63 Cb 0.56 -2.10 -0.07 0.00 -0.02 0.00 0.00 33.50 31.87 2qr5 n PRO 63 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 2qr5 s ILE 64 N -1.31 1.74 -0.24 4.25 -4.36 -0.70 -4.89 121.20 115.68 2qr5 s ILE 64 Ca 0.65 -1.81 0.01 0.00 -0.26 0.00 0.00 60.65 59.23 2qr5 s ILE 64 Cb -0.53 -2.55 -0.18 0.00 1.25 0.00 0.00 42.46 40.45 2qr5 s ILE 64 CO 0.55 0.00 -0.15 0.59 0.24 0.00 0.00 174.94 176.17 2qr5 n ASN 65 N -1.30 2.00 -2.77 4.36 4.13 0.54 -4.59 115.26 117.62 2qr5 n ASN 65 Ca -0.08 -0.09 -0.02 0.00 1.68 0.00 0.00 54.58 56.07 2qr5 n ASN 65 Cb 0.66 -0.48 0.02 0.00 -1.54 0.00 0.00 39.78 38.44 2qr5 n ASN 65 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2qr5 n SER 66 N -3.30 -1.36 -4.24 6.41 3.41 -1.04 -5.01 113.62 108.49 2qr5 n SER 66 Ca -0.44 -1.72 -0.18 0.00 -0.26 0.00 0.00 58.87 56.26 2qr5 n SER 66 Cb 1.00 2.22 -0.11 0.00 -0.26 0.00 0.00 64.21 67.05 2qr5 n SER 66 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2qr5 s VAL 67 N -2.18 1.33 0.56 -3.33 -7.23 -1.26 0.01 120.40 108.29 2qr5 s VAL 67 Ca 0.18 -1.69 -0.17 0.00 -1.81 0.00 0.00 61.98 58.49 2qr5 s VAL 67 Cb -0.02 -1.51 -0.05 0.00 0.56 0.00 0.00 36.38 35.36 2qr5 s VAL 67 CO 0.04 -0.40 1.04 -0.76 -0.31 0.00 0.00 175.10 174.72 2qr5 s LEU 68 N -2.41 3.59 -0.08 1.32 1.43 -0.16 -4.91 118.68 117.46 2qr5 s LEU 68 Ca 0.08 1.79 -0.30 0.00 -1.03 0.00 0.00 54.13 54.68 2qr5 s LEU 68 Cb -0.05 -4.53 -0.05 0.00 0.03 0.00 0.00 46.19 41.58 2qr5 s LEU 68 CO 0.03 -0.99 1.64 -1.81 0.23 0.00 0.00 176.35 175.45 2qr5 s ASP 69 N -2.68 6.63 0.20 2.29 -0.00 0.23 -4.73 116.67 118.61 2qr5 s ASP 69 Ca 0.63 2.15 -0.25 0.00 -0.00 0.00 0.00 52.55 55.08 2qr5 s ASP 69 Cb -0.15 -2.53 -0.08 0.00 -0.00 0.00 0.00 42.92 40.15 2qr5 s ASP 69 CO 0.33 -0.97 0.81 -2.16 -0.00 0.00 0.00 175.17 173.18 2qr5 s PRO 70 N 4.11 4.56 0.48 8.23 0.04 -1.26 -0.61 135.00 150.55 2qr5 s PRO 70 Ca 0.73 1.18 -0.22 0.00 0.04 0.00 0.00 61.00 62.72 2qr5 s PRO 70 Cb -0.32 -3.17 -0.07 0.00 0.04 0.00 0.00 34.50 30.98 2qr5 s PRO 70 CO 0.29 0.51 1.15 -1.01 0.04 0.00 0.00 177.00 177.98 2qr5 s HIS 71 N -1.25 2.85 0.08 0.56 3.76 -0.72 -4.70 115.29 115.87 2qr5 s HIS 71 Ca 0.39 1.54 -0.37 0.00 -0.15 0.00 0.00 55.06 56.47 2qr5 s HIS 71 Cb -0.22 -3.35 -0.17 0.00 1.11 0.00 0.00 32.58 29.95 2qr5 s HIS 71 CO 0.26 -1.48 1.31 0.66 -0.85 0.00 0.00 174.74 174.64 2qr5 n TYR 72 N -0.65 1.44 -1.00 1.40 4.02 -1.26 -2.82 117.16 118.29 2qr5 n TYR 72 Ca 0.08 0.67 -0.00 0.00 -0.01 0.00 0.00 57.90 58.64 2qr5 n TYR 72 Cb 0.49 -2.31 -0.00 0.00 -0.02 0.00 0.00 39.34 37.49 2qr5 n TYR 72 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2qr5 n GLY 73 N 2.43 0.46 3.77 2.72 0.00 -0.29 -4.92 105.19 109.36 2qr5 n GLY 73 Ca 0.18 -0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 2qr5 n GLY 73 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qr5 s VAL 74 N -1.93 3.04 -0.16 1.61 -7.23 -1.13 -3.03 120.40 111.57 2qr5 s VAL 74 Ca 0.00 0.76 0.01 0.00 -1.81 0.00 0.00 61.98 60.94 2qr5 s VAL 74 Cb 0.00 -3.37 0.19 0.00 0.56 0.00 0.00 36.38 33.76 2qr5 s VAL 74 CO 0.00 -0.03 1.24 0.61 -0.31 0.00 0.00 175.10 176.61 2qr5 n GLY 75 N 0.42 2.67 3.64 2.32 0.00 -1.26 -1.59 105.19 111.39 2qr5 n GLY 75 Ca 0.08 -0.31 -0.09 0.00 0.00 0.00 0.00 46.02 45.71 2qr5 n GLY 75 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2qr5 s ARG 76 N -0.97 1.44 -0.02 1.61 1.70 -1.26 -2.40 118.95 119.06 2qr5 s ARG 76 Ca 0.16 -0.69 0.02 0.00 -0.47 0.00 0.00 55.73 54.76 2qr5 s ARG 76 Cb 0.14 0.57 0.00 0.00 -0.57 0.00 0.00 34.95 35.08 2qr5 s ARG 76 CO 0.03 -0.65 -0.08 0.08 -1.08 0.00 0.00 175.30 173.60 2qr5 s VAL 77 N -3.73 0.67 -0.34 4.99 1.01 -0.30 -4.90 120.40 117.80 2qr5 s VAL 77 Ca 0.06 -0.32 -0.08 0.00 0.00 0.00 0.00 61.98 61.64 2qr5 s VAL 77 Cb -0.03 -0.59 0.03 0.00 0.00 0.00 0.00 36.38 35.78 2qr5 s VAL 77 CO -0.03 0.21 0.14 -0.63 0.00 0.00 0.00 175.10 174.79 2qr5 s ILE 78 N 0.07 4.17 0.22 2.22 -1.09 -1.26 -0.83 121.20 124.71 2qr5 s ILE 78 Ca -0.01 -0.89 -0.18 0.00 -2.23 0.00 0.00 60.65 57.35 2qr5 s ILE 78 Cb -0.06 -3.29 -0.08 0.00 -1.58 0.00 0.00 42.46 37.45 2qr5 s ILE 78 CO 0.00 -0.13 0.68 -0.76 -1.23 0.00 0.00 174.94 173.51 2qr5 s LEU 79 N 1.49 4.30 -0.24 2.97 1.43 0.63 -0.99 118.68 128.27 2qr5 s LEU 79 Ca 0.01 1.31 -0.05 0.00 -1.03 0.00 0.00 54.13 54.38 2qr5 s LEU 79 Cb -0.19 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.43 2qr5 s LEU 79 CO 0.04 0.01 -0.01 -0.69 0.23 0.00 0.00 176.35 175.93 2qr5 s VAL 80 N -1.59 3.54 -0.04 -1.59 1.01 0.10 -1.18 120.40 120.66 2qr5 s VAL 80 Ca 0.44 -0.53 0.02 0.00 0.00 0.00 0.00 61.98 61.91 2qr5 s VAL 80 Cb -0.15 -2.67 0.01 0.00 0.00 0.00 0.00 36.38 33.57 2qr5 s VAL 80 CO 0.20 0.34 -0.10 -0.60 0.00 0.00 0.00 175.10 174.94 2qr5 s ARG 81 N 1.49 1.23 0.08 2.72 3.52 -0.48 -0.34 118.95 127.17 2qr5 s ARG 81 Ca 0.05 -0.31 -0.31 0.00 -0.13 0.00 0.00 55.73 55.03 2qr5 s ARG 81 Cb -0.15 -1.09 -0.09 0.00 -1.56 0.00 0.00 34.95 32.06 2qr5 s ARG 81 CO -0.02 0.05 1.71 0.34 -0.81 0.00 0.00 175.30 176.57 2qr5 s ASP 82 N 0.50 6.55 -0.18 -2.12 -1.08 -1.26 -0.93 116.67 118.15 2qr5 s ASP 82 Ca -0.09 2.56 0.17 0.00 -0.52 0.00 0.00 52.55 54.67 2qr5 s ASP 82 Cb -0.13 -2.56 0.52 0.00 -1.46 0.00 0.00 42.92 39.29 2qr5 s ASP 82 CO 0.02 -0.92 1.41 1.33 0.52 0.00 0.00 175.17 177.53 2qr5 n VAL 83 N 4.75 2.28 -1.55 1.11 0.24 -0.71 -4.62 118.33 119.84 2qr5 n VAL 83 Ca 0.16 -1.92 0.07 0.00 -2.04 0.00 0.00 64.34 60.61 2qr5 n VAL 83 Cb 0.40 -0.26 0.14 0.00 -1.47 0.00 0.00 33.84 32.65 2qr5 n VAL 83 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2qr5 n SER 84 N -0.57 1.70 -3.83 -1.34 3.41 -1.25 -5.01 113.62 106.73 2qr5 n SER 84 Ca 0.21 -3.21 -0.29 0.00 -0.26 0.00 0.00 58.87 55.32 2qr5 n SER 84 Cb 0.89 -0.44 0.04 0.00 -0.26 0.00 0.00 64.21 64.44 2qr5 n SER 84 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qr5 n LYS 85 N -0.95 -6.16 0.00 4.33 5.02 -1.26 -2.99 118.16 116.15 2qr5 n LYS 85 Ca 0.15 0.66 0.00 0.00 -2.02 0.00 0.00 58.31 57.09 2qr5 n LYS 85 Cb 0.72 -5.59 0.00 0.00 -0.02 0.00 0.00 35.03 30.14 2qr5 n LYS 85 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qr5 n GLY 86 N -1.77 2.30 0.00 0.72 0.00 -1.26 -2.92 105.19 102.26 2qr5 n GLY 86 Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.15 2qr5 n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qr5 n ALA 87 N -0.51 2.38 -3.66 4.61 0.00 -1.16 -3.78 120.51 118.38 2qr5 n ALA 87 Ca 0.00 -0.13 -0.24 0.00 0.00 0.00 0.00 53.44 53.07 2qr5 n ALA 87 Cb 0.00 -1.34 0.06 0.00 0.00 0.00 0.00 19.45 18.18 2qr5 n ALA 87 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2qr5 n GLU 88 N -0.93 -6.63 -3.32 0.00 1.02 -1.26 -4.49 120.64 105.03 2qr5 n GLU 88 Ca 0.15 0.74 -0.46 0.00 -0.02 0.00 0.00 57.16 57.58 2qr5 n GLU 88 Cb 0.07 -5.68 -0.05 0.00 -0.02 0.00 0.00 31.44 25.76 2qr5 n GLU 88 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2qr5 s GLN 89 N -6.14 2.97 0.14 3.49 -1.52 -1.26 -3.80 119.66 113.55 2qr5 s GLN 89 Ca 0.39 -1.68 -0.15 0.00 -1.95 0.00 0.00 55.36 51.97 2qr5 s GLN 89 Cb -0.18 -4.27 -0.07 0.00 -0.22 0.00 0.00 33.01 28.26 2qr5 s GLN 89 CO 0.77 -1.30 0.56 -1.01 -0.25 0.00 0.00 175.29 174.05 2qr5 s HIS 90 N 1.60 3.63 0.30 0.91 3.76 0.61 -1.73 115.29 124.36 2qr5 s HIS 90 Ca 0.03 1.09 0.07 0.00 -0.15 0.00 0.00 55.06 56.11 2qr5 s HIS 90 Cb -0.29 -2.39 -0.03 0.00 1.11 0.00 0.00 32.58 30.98 2qr5 s HIS 90 CO 0.03 0.44 0.25 0.00 -0.85 0.00 0.00 174.74 174.61 2qr5 s ALA 91 N -1.43 3.72 -0.02 -1.40 0.00 -0.11 -2.37 121.76 120.14 2qr5 s ALA 91 Ca 0.37 -1.56 0.02 0.00 0.00 0.00 0.00 51.96 50.79 2qr5 s ALA 91 Cb -0.15 -1.22 -0.03 0.00 0.00 0.00 0.00 23.12 21.72 2qr5 s ALA 91 CO 0.19 0.12 -0.04 -0.51 0.00 0.00 0.00 175.76 175.51 2qr5 s LEU 92 N -3.92 3.30 -0.09 0.00 1.43 -1.26 -1.38 118.68 116.76 2qr5 s LEU 92 Ca 0.37 -0.05 -0.01 0.00 -1.03 0.00 0.00 54.13 53.41 2qr5 s LEU 92 Cb -0.07 -1.84 0.03 0.00 0.03 0.00 0.00 46.19 44.34 2qr5 s LEU 92 CO 0.26 0.31 0.00 -0.36 0.23 0.00 0.00 176.35 176.79 2qr5 s PHE 93 N -0.97 0.76 -0.04 0.29 0.40 -0.32 -0.13 117.98 117.97 2qr5 s PHE 93 Ca 0.16 -0.29 -0.25 0.00 -0.60 0.00 0.00 56.93 55.96 2qr5 s PHE 93 Cb -0.11 -0.86 -0.04 0.00 0.51 0.00 0.00 43.02 42.52 2qr5 s PHE 93 CO 0.06 -0.38 0.78 0.21 0.70 0.00 0.00 175.22 176.60 2qr5 s LYS 94 N 1.94 4.47 -0.17 0.44 2.20 0.11 -0.27 119.74 128.47 2qr5 s LYS 94 Ca 0.04 1.03 0.01 0.00 -0.36 0.00 0.00 55.97 56.69 2qr5 s LYS 94 Cb -0.13 -3.44 0.01 0.00 -1.51 0.00 0.00 37.83 32.76 2qr5 s LYS 94 CO -0.06 0.06 -0.18 0.08 -0.36 0.00 0.00 175.35 174.89 2qr5 s VAL 95 N 0.76 2.31 0.05 4.02 1.01 -0.01 -0.65 120.40 127.89 2qr5 s VAL 95 Ca 0.41 -0.87 -0.31 0.00 0.00 0.00 0.00 61.98 61.21 2qr5 s VAL 95 Cb -0.19 -1.97 -0.06 0.00 0.00 0.00 0.00 36.38 34.17 2qr5 s VAL 95 CO 0.21 0.53 1.26 0.21 0.00 0.00 0.00 175.10 177.31 2qr5 s ASN 96 N 1.08 7.00 0.39 3.32 3.04 -1.26 -1.15 114.94 127.36 2qr5 s ASN 96 Ca -0.00 2.07 0.28 0.00 0.04 0.00 0.00 52.86 55.24 2qr5 s ASN 96 Cb -0.14 -2.58 1.34 0.00 -1.54 0.00 0.00 41.25 38.33 2qr5 s ASN 96 CO -0.06 -0.55 1.85 0.71 -3.04 0.00 0.00 177.10 176.01 2qr5 h THR 97 N 4.56 0.00 0.00 -5.21 1.35 -1.82 0.29 112.91 112.08 2qr5 h THR 97 Ca -0.40 -0.17 -0.01 0.00 -0.55 0.00 0.00 66.41 65.27 2qr5 h THR 97 Cb 1.20 0.90 -0.00 0.00 -1.73 0.00 0.00 68.15 68.53 2qr5 h THR 97 CO 0.84 0.00 -0.41 0.28 -0.25 0.00 0.00 175.52 175.98 2qr5 h SER 98 N 0.00 0.00 -2.39 5.36 0.02 -1.91 -3.37 113.55 111.26 2qr5 h SER 98 Ca 0.00 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.35 2qr5 h SER 98 Cb 0.21 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 62.34 2qr5 h SER 98 CO 0.00 0.06 -0.69 0.54 -1.14 0.00 0.00 176.83 175.60 2qr5 n ARG 99 N -2.97 1.93 -1.70 3.45 1.74 0.09 -5.11 116.66 114.09 2qr5 n ARG 99 Ca 0.02 -4.31 -0.38 0.00 -0.77 0.00 0.00 57.85 52.41 2qr5 n ARG 99 Cb 0.56 -2.07 0.06 0.00 -1.02 0.00 0.00 32.46 30.00 2qr5 n ARG 99 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2qr5 n PRO 100 N 1.33 1.18 -0.54 5.56 -0.04 -1.22 -2.62 135.00 138.65 2qr5 n PRO 100 Ca 0.26 0.45 0.00 0.00 -0.04 0.00 0.00 63.50 64.17 2qr5 n PRO 100 Cb 0.42 -2.45 0.00 0.00 -0.04 0.00 0.00 33.50 31.43 2qr5 n PRO 100 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qr5 n GLY 101 N 0.98 1.61 3.34 0.55 0.00 0.15 -4.98 105.19 106.84 2qr5 n GLY 101 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 2qr5 n GLY 101 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qr5 s GLU 102 N -0.08 2.74 0.08 1.61 2.02 -1.08 -4.68 118.70 119.33 2qr5 s GLU 102 Ca 0.00 -1.21 0.04 0.00 0.02 0.00 0.00 54.97 53.82 2qr5 s GLU 102 Cb 0.00 -3.74 -0.04 0.00 0.10 0.00 0.00 34.13 30.45 2qr5 s GLU 102 CO 0.00 -0.79 0.03 -1.21 0.02 0.00 0.00 175.26 173.32 2qr5 s GLU 103 N 1.51 2.69 -0.15 1.61 2.02 -1.26 -4.27 118.70 120.84 2qr5 s GLU 103 Ca 0.02 -0.77 -0.02 0.00 0.02 0.00 0.00 54.97 54.21 2qr5 s GLU 103 Cb -0.21 -2.62 0.05 0.00 0.10 0.00 0.00 34.13 31.45 2qr5 s GLU 103 CO 0.05 0.55 0.02 -1.14 0.02 0.00 0.00 175.26 174.77 2qr5 s GLN 104 N -2.33 0.63 0.15 1.61 0.74 0.18 -4.95 119.66 115.68 2qr5 s GLN 104 Ca 0.27 -0.22 -0.31 0.00 0.05 0.00 0.00 55.36 55.15 2qr5 s GLN 104 Cb -0.12 -1.71 -0.08 0.00 1.10 0.00 0.00 33.01 32.20 2qr5 s GLN 104 CO 0.20 -0.52 1.37 0.50 -0.55 0.00 0.00 175.29 176.28 2qr5 s ARG 105 N 1.91 4.34 -1.04 1.67 3.52 -1.26 0.06 118.95 128.15 2qr5 s ARG 105 Ca 0.01 2.08 -0.21 0.00 -0.13 0.00 0.00 55.73 57.48 2qr5 s ARG 105 Cb -0.15 -3.23 0.08 0.00 -1.56 0.00 0.00 34.95 30.09 2qr5 s ARG 105 CO -0.07 -0.38 1.41 -0.51 -0.81 0.00 0.00 175.30 174.93 2qr5 s LEU 106 N 0.67 3.95 0.11 -0.88 1.43 0.81 -4.84 118.68 119.93 2qr5 s LEU 106 Ca 0.62 -1.75 0.24 0.00 -1.03 0.00 0.00 54.13 52.21 2qr5 s LEU 106 Cb -0.37 -2.53 0.92 0.00 0.03 0.00 0.00 46.19 44.25 2qr5 s LEU 106 CO 0.33 -1.34 1.73 -0.62 0.23 0.00 0.00 176.35 176.68 2qr5 n GLU 107 N 8.18 0.11 0.30 1.70 -0.58 -1.26 -2.27 120.64 126.82 2qr5 n GLU 107 Ca 0.33 0.21 0.20 0.00 -0.42 0.00 0.00 57.16 57.47 2qr5 n GLU 107 Cb 0.50 -1.66 0.90 0.00 -0.57 0.00 0.00 31.44 30.61 2qr5 n GLU 107 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2qr5 h ALA 108 N 2.60 1.00 -2.81 0.62 0.00 -1.99 -3.40 119.26 115.27 2qr5 h ALA 108 Ca 0.00 0.00 -0.70 0.00 0.00 0.00 0.00 54.91 54.21 2qr5 h ALA 108 Cb 0.47 0.00 -0.24 0.00 0.00 0.00 0.00 17.79 18.02 2qr5 h ALA 108 CO 0.00 0.00 -0.52 0.08 0.00 0.00 0.00 179.25 178.81 2qr5 s VAL 109 N -3.86 4.62 0.62 0.00 1.01 -0.96 -4.84 120.40 116.99 2qr5 s VAL 109 Ca -0.01 -0.72 -0.18 0.00 0.00 0.00 0.00 61.98 61.07 2qr5 s VAL 109 Cb 0.10 -3.51 -0.02 0.00 0.00 0.00 0.00 36.38 32.95 2qr5 s VAL 109 CO 0.49 -0.15 1.22 -1.59 0.00 0.00 0.00 175.10 175.07 2qr5 s LYS 110 N 1.58 2.79 0.35 2.72 -2.85 -1.26 -4.81 119.74 118.26 2qr5 s LYS 110 Ca 0.03 1.85 -0.28 0.00 -1.00 0.00 0.00 55.97 56.56 2qr5 s LYS 110 Cb -0.19 -1.90 -0.12 0.00 -2.06 0.00 0.00 37.83 33.56 2qr5 s LYS 110 CO 0.07 -1.35 1.45 -2.30 0.10 0.00 0.00 175.35 173.31 2qr5 n PRO 111 N -1.81 2.49 -3.83 1.78 -0.02 -1.26 -4.92 135.00 127.43 2qr5 n PRO 111 Ca 0.14 0.88 -0.06 0.00 -2.02 0.00 0.00 63.50 62.43 2qr5 n PRO 111 Cb 0.49 -2.57 -0.02 0.00 -0.02 0.00 0.00 33.50 31.39 2qr5 n PRO 111 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qr5 s MET 112 N -1.69 1.67 -0.53 -0.52 0.23 -1.00 -4.80 119.30 112.66 2qr5 s MET 112 Ca 0.56 -0.92 -0.28 0.00 -1.03 0.00 0.00 55.69 54.02 2qr5 s MET 112 Cb -0.51 0.57 0.02 0.00 -1.53 0.00 0.00 34.83 33.38 2qr5 s MET 112 CO 0.60 -0.77 1.29 0.50 -2.03 0.00 0.00 175.02 174.62 2qr5 s ARG 113 N -3.80 3.49 -0.17 3.16 3.52 -0.58 -0.29 118.95 124.29 2qr5 s ARG 113 Ca 0.11 0.48 -0.24 0.00 -0.13 0.00 0.00 55.73 55.95 2qr5 s ARG 113 Cb -0.05 -4.03 -0.02 0.00 -1.56 0.00 0.00 34.95 29.29 2qr5 s ARG 113 CO 0.06 -1.69 0.78 0.42 -0.81 0.00 0.00 175.30 174.06 2qr5 s ILE 114 N 5.30 4.92 -0.22 4.11 -1.09 -1.26 -0.44 121.20 132.51 2qr5 s ILE 114 Ca 0.50 1.54 0.05 0.00 -2.23 0.00 0.00 60.65 60.50 2qr5 s ILE 114 Cb -0.09 -4.09 -0.17 0.00 -1.58 0.00 0.00 42.46 36.52 2qr5 s ILE 114 CO 0.28 0.06 -0.15 0.18 -1.23 0.00 0.00 174.94 174.08 2qr5 n LEU 115 N 5.08 2.31 -3.72 2.97 4.77 0.44 -4.97 117.00 123.87 2qr5 n LEU 115 Ca 0.03 -0.10 -0.07 0.00 -0.03 0.00 0.00 56.01 55.84 2qr5 n LEU 115 Cb 0.49 -0.53 -0.02 0.00 -2.33 0.00 0.00 43.42 41.03 2qr5 n LEU 115 CO 0.47 0.79 0.56 -0.94 -1.33 0.00 0.00 177.39 176.94 2qr5 s SER 116 N -6.03 -0.29 0.00 -1.43 1.04 -1.20 -4.98 113.70 100.80 2qr5 s SER 116 Ca -0.26 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 55.77 2qr5 s SER 116 Cb 0.07 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.80 2qr5 s SER 116 CO 0.59 -1.08 0.00 0.61 0.98 0.00 0.00 173.24 174.33 2qr5 n GLY 117 N -0.43 1.12 2.91 7.32 0.00 -1.26 -1.67 105.19 113.18 2qr5 n GLY 117 Ca -0.07 -0.62 -0.13 0.00 0.00 0.00 0.00 46.02 45.20 2qr5 n GLY 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qr5 s VAL 118 N -2.00 0.16 -0.21 1.61 1.01 0.14 -0.60 120.40 120.50 2qr5 s VAL 118 Ca 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 61.98 61.80 2qr5 s VAL 118 Cb 0.00 -0.15 0.01 0.00 0.00 0.00 0.00 36.38 36.23 2qr5 s VAL 118 CO 0.00 -0.01 -0.10 -0.62 0.00 0.00 0.00 175.10 174.38 2qr5 s ASP 119 N -0.18 3.92 0.01 3.32 2.15 0.22 -1.07 116.67 125.04 2qr5 s ASP 119 Ca -0.01 -0.57 0.27 0.00 0.43 0.00 0.00 52.55 52.68 2qr5 s ASP 119 Cb -0.02 -1.64 0.87 0.00 -0.30 0.00 0.00 42.92 41.83 2qr5 s ASP 119 CO -0.00 -0.03 1.67 0.35 -0.17 0.00 0.00 175.17 176.99 2qr5 n THR 120 N 4.71 0.04 0.00 1.71 -2.24 -0.19 -1.75 114.28 116.55 2qr5 n THR 120 Ca -0.19 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2qr5 n THR 120 Cb 0.50 -0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.57 2qr5 n THR 120 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qr5 n GLY 121 N 1.49 3.10 0.13 3.38 0.00 -1.26 -4.74 105.19 107.28 2qr5 n GLY 121 Ca 0.06 -0.94 -0.24 0.00 0.00 0.00 0.00 46.02 44.91 2qr5 n GLY 121 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qr5 n GLU 122 N 0.00 0.63 -4.45 1.61 1.02 -1.26 -5.02 120.64 113.17 2qr5 n GLU 122 Ca 0.00 0.32 -0.23 0.00 -0.02 0.00 0.00 57.16 57.23 2qr5 n GLU 122 Cb 0.00 -1.60 -0.13 0.00 -0.02 0.00 0.00 31.44 29.68 2qr5 n GLU 122 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2qr5 s ALA 123 N -2.48 1.51 -0.23 0.62 0.00 -1.26 -4.53 121.76 115.38 2qr5 s ALA 123 Ca -0.32 -1.00 -0.05 0.00 0.00 0.00 0.00 51.96 50.59 2qr5 s ALA 123 Cb 0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.95 2qr5 s ALA 123 CO 0.59 0.31 -0.00 0.08 0.00 0.00 0.00 175.76 176.74 2qr5 s VAL 124 N -0.90 3.73 -0.13 0.00 1.01 -0.03 -1.02 120.40 123.05 2qr5 s VAL 124 Ca 0.05 -0.37 0.02 0.00 0.00 0.00 0.00 61.98 61.68 2qr5 s VAL 124 Cb -0.09 -2.72 0.00 0.00 0.00 0.00 0.00 36.38 33.58 2qr5 s VAL 124 CO 0.02 0.39 -0.21 -0.69 0.00 0.00 0.00 175.10 174.61 2qr5 s VAL 125 N 1.52 2.22 0.06 2.92 1.01 -0.23 0.04 120.40 127.93 2qr5 s VAL 125 Ca 0.06 -0.94 -0.13 0.00 0.00 0.00 0.00 61.98 60.97 2qr5 s VAL 125 Cb -0.15 -1.89 0.02 0.00 0.00 0.00 0.00 36.38 34.36 2qr5 s VAL 125 CO -0.01 0.54 0.29 0.72 0.00 0.00 0.00 175.10 176.65 2qr5 s PHE 126 N 0.67 -0.06 0.01 5.22 -0.12 -0.79 0.27 117.98 123.18 2qr5 s PHE 126 Ca -0.10 -0.15 -0.00 0.00 -0.05 0.00 0.00 56.93 56.63 2qr5 s PHE 126 Cb -0.16 0.08 -0.04 0.00 -0.63 0.00 0.00 43.02 42.27 2qr5 s PHE 126 CO 0.01 -0.53 0.11 0.95 -0.05 0.00 0.00 175.22 175.72 2qr5 s THR 127 N -2.91 4.89 -0.08 -4.49 -4.23 -0.67 -0.50 115.64 107.65 2qr5 s THR 127 Ca -0.02 -0.39 -0.18 0.00 -1.18 0.00 0.00 61.69 59.91 2qr5 s THR 127 Cb 0.00 -3.27 0.04 0.00 1.34 0.00 0.00 72.50 70.62 2qr5 s THR 127 CO -0.06 0.31 0.43 -0.83 -0.54 0.00 0.00 174.62 173.93 2qr5 s GLY 128 N -1.89 -0.30 -0.08 3.99 0.00 -0.58 -0.42 107.32 108.04 2qr5 s GLY 128 Ca 0.25 0.87 0.04 0.00 0.00 0.00 0.00 44.72 45.88 2qr5 s GLY 128 CO 0.16 0.65 -0.21 0.00 0.00 0.00 0.00 173.10 173.70 2qr5 s ALA 129 N -0.69 2.32 0.19 3.20 0.00 0.41 -0.90 121.76 126.29 2qr5 s ALA 129 Ca -0.08 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 50.89 2qr5 s ALA 129 Cb -0.03 -0.84 0.01 0.00 0.00 0.00 0.00 23.12 22.25 2qr5 s ALA 129 CO 0.04 0.38 0.05 0.25 0.00 0.00 0.00 175.76 176.48 2qr5 n THR 130 N 3.06 0.00 -0.29 0.00 -2.24 0.39 -1.52 114.28 113.68 2qr5 n THR 130 Ca -0.18 -0.84 0.06 0.00 -2.27 0.00 0.00 64.05 60.82 2qr5 n THR 130 Cb 0.52 0.01 0.27 0.00 -2.10 0.00 0.00 70.33 69.04 2qr5 n THR 130 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 2qr5 h GLU 131 N 0.00 0.93 0.00 -0.78 9.09 -1.95 -2.59 114.58 119.28 2qr5 h GLU 131 Ca -0.14 -0.06 0.00 0.00 0.05 0.00 0.00 59.36 59.21 2qr5 h GLU 131 Cb 0.46 -0.21 0.00 0.00 -1.65 0.00 0.00 28.75 27.35 2qr5 h GLU 131 CO 0.24 0.61 -1.08 -0.40 0.05 0.00 0.00 179.01 178.43 2qr5 n ASP 132 N -4.51 1.09 -3.61 3.06 5.75 -1.26 -3.09 116.55 113.98 2qr5 n ASP 132 Ca 0.14 -0.48 -0.13 0.00 -0.01 0.00 0.00 54.79 54.31 2qr5 n ASP 132 Cb 0.25 1.28 -0.06 0.00 -1.03 0.00 0.00 41.12 41.56 2qr5 n ASP 132 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2qr5 s ARG 133 N -2.61 1.00 -0.19 0.11 1.70 -1.24 -4.90 118.95 112.81 2qr5 s ARG 133 Ca 0.01 -0.32 -0.08 0.00 -0.47 0.00 0.00 55.73 54.87 2qr5 s ARG 133 Cb 0.10 0.45 -0.04 0.00 -0.57 0.00 0.00 34.95 34.89 2qr5 s ARG 133 CO 0.59 -0.36 0.08 0.08 -1.08 0.00 0.00 175.30 174.61 2qr5 s VAL 134 N -2.56 4.95 0.03 4.99 1.01 -1.26 -0.46 120.40 127.11 2qr5 s VAL 134 Ca -0.05 0.03 -0.00 0.00 0.00 0.00 0.00 61.98 61.96 2qr5 s VAL 134 Cb -0.01 -3.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 2qr5 s VAL 134 CO -0.03 0.44 -0.03 0.00 0.00 0.00 0.00 175.10 175.49 2qr5 s ALA 135 N 0.45 0.26 -0.22 5.51 0.00 -0.08 -0.41 121.76 127.27 2qr5 s ALA 135 Ca 0.05 -0.81 -0.16 0.00 0.00 0.00 0.00 51.96 51.04 2qr5 s ALA 135 Cb -0.12 0.19 -0.04 0.00 0.00 0.00 0.00 23.12 23.15 2qr5 s ALA 135 CO 0.00 -0.24 0.40 -1.17 0.00 0.00 0.00 175.76 174.76 2qr5 s LEU 136 N -1.98 4.11 0.22 0.00 2.96 0.03 -1.52 118.68 122.50 2qr5 s LEU 136 Ca -0.08 0.46 0.11 0.00 -0.22 0.00 0.00 54.13 54.40 2qr5 s LEU 136 Cb -0.04 -2.50 -0.05 0.00 0.50 0.00 0.00 46.19 44.10 2qr5 s LEU 136 CO -0.04 -0.12 -0.20 -0.31 -1.32 0.00 0.00 176.35 174.35 2qr5 s TYR 137 N 1.60 2.14 -0.03 5.38 1.51 0.35 -0.51 117.35 127.79 2qr5 s TYR 137 Ca 0.18 -0.39 0.02 0.00 -1.01 0.00 0.00 57.07 55.87 2qr5 s TYR 137 Cb -0.15 -1.00 0.01 0.00 -0.11 0.00 0.00 41.96 40.70 2qr5 s TYR 137 CO 0.08 0.53 -0.07 0.00 -1.11 0.00 0.00 175.55 174.98 2qr5 s ALA 138 N -2.18 0.78 -0.30 3.71 0.00 0.27 -1.88 121.76 122.16 2qr5 s ALA 138 Ca 0.23 -0.24 -0.01 0.00 0.00 0.00 0.00 51.96 51.94 2qr5 s ALA 138 Cb -0.06 -0.34 0.06 0.00 0.00 0.00 0.00 23.12 22.78 2qr5 s ALA 138 CO 0.11 0.09 0.00 -1.17 0.00 0.00 0.00 175.76 174.79 2qr5 s LEU 139 N 0.39 3.98 0.00 0.00 2.96 0.11 -1.05 118.68 125.07 2qr5 s LEU 139 Ca -0.06 -1.41 0.00 0.00 -0.22 0.00 0.00 54.13 52.44 2qr5 s LEU 139 Cb -0.10 -1.69 0.00 0.00 0.50 0.00 0.00 46.19 44.90 2qr5 s LEU 139 CO 0.01 -0.28 0.00 -0.90 -1.32 0.00 0.00 176.35 173.86 2qr5 n ASP 140 N 4.57 1.76 0.27 3.68 5.68 -1.05 -0.85 116.55 130.61 2qr5 n ASP 140 Ca -0.11 -0.19 0.15 0.00 -0.50 0.00 0.00 54.79 54.14 2qr5 n ASP 140 Cb 0.43 0.00 0.77 0.00 -1.14 0.00 0.00 41.12 41.18 2qr5 n ASP 140 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 2qr5 h GLY 141 N 0.00 0.00 0.40 6.12 0.00 -1.99 -2.18 103.07 105.42 2qr5 h GLY 141 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2qr5 h GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2qr5 n GLY 142 N -0.55 -0.88 0.81 4.60 0.00 -1.26 -5.03 105.19 102.88 2qr5 n GLY 142 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2qr5 n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qr5 n GLY 143 N 0.80 -1.82 3.77 -0.02 0.00 -0.82 -4.94 105.19 102.15 2qr5 n GLY 143 Ca 0.13 -1.95 -0.38 0.00 0.00 0.00 0.00 46.02 43.82 2qr5 n GLY 143 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qr5 s LEU 144 N 0.00 4.38 -0.03 0.99 2.96 -1.26 -2.52 118.68 123.20 2qr5 s LEU 144 Ca 0.00 0.97 0.03 0.00 -0.22 0.00 0.00 54.13 54.91 2qr5 s LEU 144 Cb 0.00 -2.73 0.00 0.00 0.50 0.00 0.00 46.19 43.96 2qr5 s LEU 144 CO 0.00 0.13 -0.10 -0.13 -1.32 0.00 0.00 176.35 174.93 2qr5 s ARG 145 N -0.15 1.09 -0.58 1.98 0.52 -0.21 -5.00 118.95 116.60 2qr5 s ARG 145 Ca 0.27 -0.36 -0.23 0.00 -0.52 0.00 0.00 55.73 54.89 2qr5 s ARG 145 Cb -0.17 -1.01 0.06 0.00 0.52 0.00 0.00 34.95 34.35 2qr5 s ARG 145 CO 0.13 0.14 0.89 -2.00 0.02 0.00 0.00 175.30 174.48 2qr5 s GLU 146 N 0.15 3.21 0.21 3.54 2.12 -1.26 -0.56 118.70 126.11 2qr5 s GLU 146 Ca -0.03 -0.59 -0.05 0.00 0.36 0.00 0.00 54.97 54.65 2qr5 s GLU 146 Cb -0.09 -4.13 0.17 0.00 0.26 0.00 0.00 34.13 30.34 2qr5 s GLU 146 CO 0.01 -1.56 1.64 -0.07 -0.54 0.00 0.00 175.26 174.74 2qr5 h LEU 147 N 10.88 0.86 -7.00 2.70 3.38 -1.13 -3.47 115.31 121.53 2qr5 h LEU 147 Ca -0.27 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.40 2qr5 h LEU 147 Cb 1.08 -0.23 -0.19 0.00 0.09 0.00 0.00 40.66 41.40 2qr5 h LEU 147 CO 1.10 1.01 0.29 0.00 0.09 0.00 0.00 178.44 180.93 2qr5 s ALA 148 N -4.74 -1.80 -0.14 1.53 0.00 -1.12 -1.23 121.76 114.26 2qr5 s ALA 148 Ca -0.10 1.30 -0.17 0.00 0.00 0.00 0.00 51.96 52.99 2qr5 s ALA 148 Cb 0.13 -0.08 -0.04 0.00 0.00 0.00 0.00 23.12 23.13 2qr5 s ALA 148 CO 0.84 -0.40 0.42 0.50 0.00 0.00 0.00 175.76 177.12 2qr5 s ARG 149 N -1.46 4.30 -0.08 0.00 3.52 -1.26 -0.79 118.95 123.19 2qr5 s ARG 149 Ca -0.07 0.34 -0.11 0.00 -0.13 0.00 0.00 55.73 55.75 2qr5 s ARG 149 Cb -0.00 -3.44 -0.05 0.00 -1.56 0.00 0.00 34.95 29.90 2qr5 s ARG 149 CO 0.05 0.16 0.27 -0.51 -0.81 0.00 0.00 175.30 174.46 2qr5 s LEU 150 N 0.66 4.41 0.26 -0.88 1.43 0.46 -4.94 118.68 120.07 2qr5 s LEU 150 Ca 0.23 0.67 -0.01 0.00 -1.03 0.00 0.00 54.13 53.99 2qr5 s LEU 150 Cb -0.14 -2.32 0.55 0.00 0.03 0.00 0.00 46.19 44.31 2qr5 s LEU 150 CO 0.08 0.34 1.73 -0.65 0.23 0.00 0.00 176.35 178.08 2qr5 h PRO 151 N 5.09 0.45 0.00 1.29 0.11 -1.93 -3.37 132.00 133.63 2qr5 h PRO 151 Ca -0.52 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.56 2qr5 h PRO 151 Cb 1.22 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2qr5 h PRO 151 CO 0.62 0.30 0.00 0.41 -0.21 0.00 0.00 178.00 179.12 2qr5 n GLY 152 N -1.33 4.19 3.57 -0.55 0.00 -1.26 -4.95 105.19 104.86 2qr5 n GLY 152 Ca 0.17 -0.89 -0.47 0.00 0.00 0.00 0.00 46.02 44.83 2qr5 n GLY 152 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qr5 n PHE 153 N 0.00 1.16 -3.71 1.61 3.01 -1.25 -4.76 117.46 113.52 2qr5 n PHE 153 Ca 0.00 0.71 -0.14 0.00 1.01 0.00 0.00 57.45 59.03 2qr5 n PHE 153 Cb 0.00 -2.25 -0.08 0.00 -0.01 0.00 0.00 39.48 37.15 2qr5 n PHE 153 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2qr5 s GLY 154 N -0.25 -0.24 -0.03 1.37 0.00 -1.26 -0.59 107.32 106.32 2qr5 s GLY 154 Ca 0.68 0.49 0.01 0.00 0.00 0.00 0.00 44.72 45.90 2qr5 s GLY 154 CO 0.55 0.25 -0.04 -1.36 0.00 0.00 0.00 173.10 172.49 2qr5 s PHE 155 N -1.46 0.64 0.13 1.90 0.40 0.11 -4.70 117.98 114.99 2qr5 s PHE 155 Ca -0.12 -0.15 -0.30 0.00 -0.60 0.00 0.00 56.93 55.75 2qr5 s PHE 155 Cb -0.04 -0.56 -0.07 0.00 0.51 0.00 0.00 43.02 42.86 2qr5 s PHE 155 CO 0.04 -0.14 1.18 0.08 0.70 0.00 0.00 175.22 177.08 2qr5 s VAL 156 N 0.69 3.82 -0.20 -0.44 1.01 -1.26 -0.88 120.40 123.15 2qr5 s VAL 156 Ca -0.09 1.43 0.05 0.00 0.00 0.00 0.00 61.98 63.37 2qr5 s VAL 156 Cb -0.12 -3.92 -0.15 0.00 0.00 0.00 0.00 36.38 32.19 2qr5 s VAL 156 CO -0.00 0.18 -0.13 -1.20 0.00 0.00 0.00 175.10 173.95 2qr5 n SER 157 N 3.11 2.04 -3.60 3.32 7.64 0.20 -4.58 113.62 121.75 2qr5 n SER 157 Ca 0.06 -0.09 -0.09 0.00 1.01 0.00 0.00 58.87 59.76 2qr5 n SER 157 Cb 0.46 -0.03 -0.05 0.00 -1.01 0.00 0.00 64.21 63.57 2qr5 n SER 157 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2qr5 s ASP 158 N -5.78 -0.34 -0.01 6.43 2.15 -0.97 -4.89 116.67 113.26 2qr5 s ASP 158 Ca -0.23 0.42 0.04 0.00 0.43 0.00 0.00 52.55 53.21 2qr5 s ASP 158 Cb 0.07 0.35 -0.01 0.00 -0.30 0.00 0.00 42.92 43.03 2qr5 s ASP 158 CO 0.53 -0.27 -0.11 -0.63 -0.17 0.00 0.00 175.17 174.51 2qr5 s ILE 159 N -0.86 0.90 -0.15 4.11 1.01 -1.26 -1.00 121.20 123.95 2qr5 s ILE 159 Ca 0.00 -0.49 -0.04 0.00 0.00 0.00 0.00 60.65 60.12 2qr5 s ILE 159 Cb -0.01 -0.75 0.07 0.00 0.01 0.00 0.00 42.46 41.78 2qr5 s ILE 159 CO -0.01 0.25 0.21 -0.60 0.00 0.00 0.00 174.94 174.79 2qr5 s ARG 160 N -0.28 0.13 7.99 2.79 3.52 -0.34 -4.97 118.95 127.80 2qr5 s ARG 160 Ca 0.04 0.43 0.00 0.00 -0.13 0.00 0.00 55.73 56.07 2qr5 s ARG 160 Cb -0.04 -0.67 0.00 0.00 -1.56 0.00 0.00 34.95 32.67 2qr5 s ARG 160 CO -0.00 -0.46 0.00 0.41 -0.81 0.00 0.00 175.30 174.43 2qr5 n GLY 161 N 5.33 4.26 0.47 8.12 0.00 -1.26 -1.85 105.19 120.26 2qr5 n GLY 161 Ca -0.05 0.11 0.10 0.00 0.00 0.00 0.00 46.02 46.18 2qr5 n GLY 161 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qr5 n ASP 162 N 8.80 1.93 -4.70 1.61 9.92 -1.26 -4.92 116.55 127.93 2qr5 n ASP 162 Ca 0.00 -1.46 -0.40 0.00 -0.53 0.00 0.00 54.79 52.40 2qr5 n ASP 162 Cb 0.00 0.44 -0.05 0.00 -0.64 0.00 0.00 41.12 40.87 2qr5 n ASP 162 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 2qr5 s LEU 163 N -2.25 4.26 -0.12 0.64 2.96 -0.77 0.21 118.68 123.61 2qr5 s LEU 163 Ca 0.17 1.14 -0.03 0.00 -0.22 0.00 0.00 54.13 55.19 2qr5 s LEU 163 Cb 0.16 -3.09 -0.03 0.00 0.50 0.00 0.00 46.19 43.73 2qr5 s LEU 163 CO 0.48 -0.20 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.66 2qr5 s ILE 164 N 1.26 4.09 0.06 6.68 1.01 -0.60 -1.19 121.20 132.50 2qr5 s ILE 164 Ca 0.37 -0.31 0.08 0.00 0.00 0.00 0.00 60.65 60.79 2qr5 s ILE 164 Cb -0.17 -2.76 -0.03 0.00 0.01 0.00 0.00 42.46 39.51 2qr5 s ILE 164 CO 0.16 0.54 -0.22 0.00 0.00 0.00 0.00 174.94 175.42 2qr5 s ALA 165 N -0.20 1.86 0.35 9.38 0.00 -0.17 -1.55 121.76 131.43 2qr5 s ALA 165 Ca 0.04 -1.14 -0.12 0.00 0.00 0.00 0.00 51.96 50.75 2qr5 s ALA 165 Cb -0.13 -0.35 0.03 0.00 0.00 0.00 0.00 23.12 22.68 2qr5 s ALA 165 CO 0.02 0.41 0.66 0.20 0.00 0.00 0.00 175.76 177.05 2qr5 s GLY 166 N -1.34 0.65 -0.11 0.00 0.00 0.40 -0.63 107.32 106.30 2qr5 s GLY 166 Ca 0.08 -0.93 0.01 0.00 0.00 0.00 0.00 44.72 43.88 2qr5 s GLY 166 CO 0.02 -0.52 -0.14 1.08 0.00 0.00 0.00 173.10 173.55 2qr5 s LEU 167 N -3.09 2.71 -0.08 0.66 1.43 -0.06 -0.56 118.68 119.69 2qr5 s LEU 167 Ca 0.20 -0.29 0.04 0.00 -1.03 0.00 0.00 54.13 53.05 2qr5 s LEU 167 Cb -0.03 -1.59 0.00 0.00 0.03 0.00 0.00 46.19 44.60 2qr5 s LEU 167 CO 0.13 0.22 -0.21 -0.83 0.23 0.00 0.00 176.35 175.89 2qr5 s GLY 168 N 0.03 1.16 -1.01 -3.19 0.00 0.13 -0.72 107.32 103.73 2qr5 s GLY 168 Ca -0.04 -0.81 -0.18 0.00 0.00 0.00 0.00 44.72 43.68 2qr5 s GLY 168 CO 0.04 -0.24 1.25 -1.36 0.00 0.00 0.00 173.10 172.78 2qr5 s PHE 169 N 0.36 3.11 -1.83 1.90 0.40 0.24 0.63 117.98 122.78 2qr5 s PHE 169 Ca -0.15 -1.47 0.15 0.00 -0.60 0.00 0.00 56.93 54.86 2qr5 s PHE 169 Cb -0.17 -4.36 0.18 0.00 0.51 0.00 0.00 43.02 39.19 2qr5 s PHE 169 CO 0.07 -1.54 1.06 1.19 0.70 0.00 0.00 175.22 176.70 2qr5 n PHE 170 N 6.74 0.12 0.00 0.36 0.99 -1.24 -3.84 117.46 120.58 2qr5 n PHE 170 Ca 0.28 -0.09 0.00 0.00 -0.00 0.00 0.00 57.45 57.64 2qr5 n PHE 170 Cb 0.48 -0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.96 2qr5 n PHE 170 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2qr5 n GLY 171 N 0.88 3.23 2.34 1.37 0.00 -1.26 -4.84 105.19 106.91 2qr5 n GLY 171 Ca 0.10 -0.28 -0.16 0.00 0.00 0.00 0.00 46.02 45.69 2qr5 n GLY 171 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qr5 n GLY 172 N -0.78 0.44 3.31 -0.02 0.00 -1.26 -0.84 105.19 106.03 2qr5 n GLY 172 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2qr5 n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qr5 n GLY 173 N -0.63 0.48 3.84 -0.02 0.00 -1.26 -4.99 105.19 102.62 2qr5 n GLY 173 Ca -0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 2qr5 n GLY 173 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qr5 s ARG 174 N -0.55 3.95 -0.20 1.61 0.52 -0.02 -5.00 118.95 119.25 2qr5 s ARG 174 Ca 0.00 0.95 -0.02 0.00 -0.52 0.00 0.00 55.73 56.13 2qr5 s ARG 174 Cb 0.00 -2.14 -0.00 0.00 0.52 0.00 0.00 34.95 33.33 2qr5 s ARG 174 CO 0.00 -0.27 -0.08 0.08 0.02 0.00 0.00 175.30 175.05 2qr5 s VAL 175 N -2.63 3.09 0.10 3.52 1.01 -1.26 -3.71 120.40 120.52 2qr5 s VAL 175 Ca 0.59 -0.60 -0.01 0.00 0.00 0.00 0.00 61.98 61.96 2qr5 s VAL 175 Cb -0.10 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 2qr5 s VAL 175 CO 0.31 0.46 0.27 -0.44 0.00 0.00 0.00 175.10 175.71 2qr5 s SER 176 N 1.27 6.40 0.14 3.32 0.01 0.20 -2.15 113.70 122.88 2qr5 s SER 176 Ca 0.03 0.37 -0.26 0.00 1.31 0.00 0.00 55.95 57.40 2qr5 s SER 176 Cb -0.14 -2.00 -0.07 0.00 0.21 0.00 0.00 66.02 64.02 2qr5 s SER 176 CO -0.04 0.12 0.79 -0.22 0.41 0.00 0.00 173.24 174.30 2qr5 s LEU 177 N -2.63 4.56 0.10 2.44 2.96 -0.71 0.19 118.68 125.59 2qr5 s LEU 177 Ca 0.37 1.62 0.06 0.00 -0.22 0.00 0.00 54.13 55.95 2qr5 s LEU 177 Cb -0.13 -3.31 -0.03 0.00 0.50 0.00 0.00 46.19 43.22 2qr5 s LEU 177 CO 0.27 0.15 -0.14 0.72 -1.32 0.00 0.00 176.35 176.02 2qr5 s PHE 178 N -0.82 1.36 0.12 5.38 -0.12 0.27 0.33 117.98 124.50 2qr5 s PHE 178 Ca 0.37 -0.52 0.07 0.00 -0.05 0.00 0.00 56.93 56.80 2qr5 s PHE 178 Cb -0.23 -0.73 -0.04 0.00 -0.63 0.00 0.00 43.02 41.40 2qr5 s PHE 178 CO 0.26 0.12 -0.16 0.95 -0.05 0.00 0.00 175.22 176.33 2qr5 s THR 179 N -1.83 1.47 0.33 -4.49 -4.23 0.39 -0.45 115.64 106.82 2qr5 s THR 179 Ca 0.05 -1.69 0.04 0.00 -1.18 0.00 0.00 61.69 58.92 2qr5 s THR 179 Cb -0.07 -1.55 -0.02 0.00 1.34 0.00 0.00 72.50 72.20 2qr5 s THR 179 CO 0.03 -0.32 0.33 -0.55 -0.54 0.00 0.00 174.62 173.57 2qr5 s SER 180 N -2.33 1.38 -0.07 3.99 0.15 -0.60 -0.54 113.70 115.68 2qr5 s SER 180 Ca 0.09 -1.66 0.04 0.00 0.70 0.00 0.00 55.95 55.12 2qr5 s SER 180 Cb -0.06 0.58 -0.00 0.00 -1.71 0.00 0.00 66.02 64.82 2qr5 s SER 180 CO 0.04 -1.12 -0.22 0.20 1.20 0.00 0.00 173.24 173.34 2qr5 s ASN 181 N -3.32 2.78 0.49 5.45 0.01 -1.16 -1.55 114.94 117.63 2qr5 s ASN 181 Ca 0.38 -0.48 0.17 0.00 -0.71 0.00 0.00 52.86 52.21 2qr5 s ASN 181 Cb 0.02 -1.04 1.18 0.00 0.41 0.00 0.00 41.25 41.82 2qr5 s ASN 181 CO 0.25 0.17 2.07 0.25 -1.51 0.00 0.00 177.10 178.33 2qr5 h LEU 182 N 6.48 0.00 0.00 0.60 5.85 -0.58 0.25 115.31 127.90 2qr5 h LEU 182 Ca -0.26 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.32 2qr5 h LEU 182 Cb 1.20 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.21 2qr5 h LEU 182 CO 0.47 0.10 -0.85 0.28 -0.34 0.00 0.00 178.44 178.11 2qr5 h SER 183 N 0.00 0.00 0.29 1.25 0.02 -1.96 -3.42 113.55 109.73 2qr5 h SER 183 Ca -0.00 -0.44 -0.14 0.00 -0.84 0.00 0.00 61.79 60.37 2qr5 h SER 183 Cb 0.18 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.70 2qr5 h SER 183 CO 0.01 1.21 -1.85 -1.54 -1.14 0.00 0.00 176.83 173.52 2qr5 n SER 184 N -4.52 0.31 0.00 3.07 3.41 -1.22 -5.08 113.62 109.59 2qr5 n SER 184 Ca -0.22 0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.52 2qr5 n SER 184 Cb 0.52 1.10 0.00 0.00 -0.26 0.00 0.00 64.21 65.57 2qr5 n SER 184 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qr5 n GLY 185 N 1.41 -0.13 0.00 5.00 0.00 0.86 -4.95 105.19 107.40 2qr5 n GLY 185 Ca -0.13 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.81 2qr5 n GLY 185 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qr5 n GLY 186 N 0.00 -0.78 2.98 -0.02 0.00 -0.37 -2.98 105.19 104.02 2qr5 n GLY 186 Ca 0.00 -1.71 -0.14 0.00 0.00 0.00 0.00 46.02 44.17 2qr5 n GLY 186 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qr5 s LEU 187 N -1.79 -0.22 -0.14 0.99 2.96 -1.26 -4.37 118.68 114.84 2qr5 s LEU 187 Ca 0.00 0.54 -0.03 0.00 -0.22 0.00 0.00 54.13 54.42 2qr5 s LEU 187 Cb 0.00 0.62 -0.03 0.00 0.50 0.00 0.00 46.19 47.28 2qr5 s LEU 187 CO 0.00 -0.24 -0.03 -0.13 -1.32 0.00 0.00 176.35 174.63 2qr5 s ARG 188 N 2.33 3.54 -0.09 1.98 0.52 0.30 -4.98 118.95 122.55 2qr5 s ARG 188 Ca 0.01 -0.50 0.03 0.00 -0.52 0.00 0.00 55.73 54.75 2qr5 s ARG 188 Cb -0.12 -2.89 -0.01 0.00 0.52 0.00 0.00 34.95 32.45 2qr5 s ARG 188 CO -0.08 0.33 -0.18 0.08 0.02 0.00 0.00 175.30 175.47 2qr5 s VAL 189 N 0.13 2.65 -0.25 3.52 1.01 -1.26 -0.46 120.40 125.73 2qr5 s VAL 189 Ca -0.01 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.16 2qr5 s VAL 189 Cb -0.13 -2.05 0.06 0.00 0.00 0.00 0.00 36.38 34.26 2qr5 s VAL 189 CO 0.03 0.55 -0.06 -0.36 0.00 0.00 0.00 175.10 175.26 2qr5 s PHE 190 N 0.01 2.63 0.09 5.22 0.40 0.15 -5.00 117.98 121.49 2qr5 s PHE 190 Ca -0.06 -1.93 -0.08 0.00 -0.60 0.00 0.00 56.93 54.26 2qr5 s PHE 190 Cb -0.15 -1.71 -0.06 0.00 0.51 0.00 0.00 43.02 41.62 2qr5 s PHE 190 CO 0.05 -0.81 0.38 -0.51 0.70 0.00 0.00 175.22 175.03 2qr5 s ASP 191 N 1.31 6.58 -0.11 1.36 1.01 -1.26 -1.73 116.67 123.83 2qr5 s ASP 191 Ca -0.06 0.71 -0.03 0.00 0.71 0.00 0.00 52.55 53.88 2qr5 s ASP 191 Cb -0.19 -2.14 -0.03 0.00 1.01 0.00 0.00 42.92 41.56 2qr5 s ASP 191 CO -0.06 0.14 0.01 -0.55 0.21 0.00 0.00 175.17 174.91 2qr5 s SER 192 N -1.96 5.25 0.35 0.27 0.15 -1.26 -5.01 113.70 111.49 2qr5 s SER 192 Ca 0.35 0.11 0.14 0.00 0.70 0.00 0.00 55.95 57.24 2qr5 s SER 192 Cb -0.13 -1.60 0.64 0.00 -1.71 0.00 0.00 66.02 63.22 2qr5 s SER 192 CO 0.20 0.32 1.76 1.23 1.20 0.00 0.00 173.24 177.95 2qr5 h GLY 193 N 5.58 0.00 1.30 9.45 0.00 -2.01 -3.34 103.07 114.04 2qr5 h GLY 193 Ca -0.46 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 2qr5 h GLY 193 CO 0.58 0.00 -0.77 0.83 0.00 0.00 0.00 176.54 177.17 2qr5 h GLU 194 N 0.00 0.00 0.00 4.80 5.08 -1.96 -3.50 114.58 119.00 2qr5 h GLU 194 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2qr5 h GLU 194 Cb 0.81 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.06 2qr5 h GLU 194 CO 0.06 0.06 0.00 0.41 -1.00 0.00 0.00 179.01 178.54 2qr5 n GLY 195 N 1.19 -0.66 3.36 -3.84 0.00 -1.25 -3.76 105.19 100.22 2qr5 n GLY 195 Ca 0.00 -0.45 -0.29 0.00 0.00 0.00 0.00 46.02 45.28 2qr5 n GLY 195 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qr5 s SER 196 N -4.00 3.17 0.06 1.61 0.01 -0.20 -4.39 113.70 109.96 2qr5 s SER 196 Ca 0.00 -0.68 -0.30 0.00 1.31 0.00 0.00 55.95 56.28 2qr5 s SER 196 Cb 0.00 -0.24 -0.05 0.00 0.21 0.00 0.00 66.02 65.95 2qr5 s SER 196 CO 0.00 0.20 0.96 -0.36 0.41 0.00 0.00 173.24 174.45 2qr5 s PHE 197 N -0.97 3.75 -0.68 2.43 0.40 -0.92 0.25 117.98 122.25 2qr5 s PHE 197 Ca 0.12 1.74 0.11 0.00 -0.60 0.00 0.00 56.93 58.30 2qr5 s PHE 197 Cb -0.10 -3.07 -0.07 0.00 0.51 0.00 0.00 43.02 40.29 2qr5 s PHE 197 CO 0.04 0.12 0.52 -1.13 0.70 0.00 0.00 175.22 175.48 2qr5 n SER 198 N 3.24 0.77 -3.53 1.36 3.41 -0.07 -4.75 113.62 114.05 2qr5 n SER 198 Ca 0.04 -0.89 -0.10 0.00 -0.26 0.00 0.00 58.87 57.66 2qr5 n SER 198 Cb 0.50 0.81 -0.04 0.00 -0.26 0.00 0.00 64.21 65.22 2qr5 n SER 198 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2qr5 s SER 199 N -1.79 -0.40 -0.03 4.04 0.15 -1.26 -4.86 113.70 109.55 2qr5 s SER 199 Ca 0.06 0.23 -0.24 0.00 0.70 0.00 0.00 55.95 56.69 2qr5 s SER 199 Cb 0.08 0.37 0.05 0.00 -1.71 0.00 0.00 66.02 64.82 2qr5 s SER 199 CO 0.37 -0.52 0.53 0.00 1.20 0.00 0.00 173.24 174.83 2qr5 s ALA 200 N -2.15 -1.38 -0.21 5.45 0.00 -1.26 -1.44 121.76 120.76 2qr5 s ALA 200 Ca 0.01 0.90 -0.19 0.00 0.00 0.00 0.00 51.96 52.67 2qr5 s ALA 200 Cb -0.01 0.06 0.06 0.00 0.00 0.00 0.00 23.12 23.23 2qr5 s ALA 200 CO -0.03 -0.34 0.57 0.45 0.00 0.00 0.00 175.76 176.40 2qr5 s SER 201 N -1.31 -0.61 -0.24 0.00 0.15 0.32 -4.56 113.70 107.45 2qr5 s SER 201 Ca -0.11 1.15 -0.23 0.00 0.70 0.00 0.00 55.95 57.46 2qr5 s SER 201 Cb -0.02 1.16 -0.01 0.00 -1.71 0.00 0.00 66.02 65.44 2qr5 s SER 201 CO 0.07 -0.20 0.73 -0.63 1.20 0.00 0.00 173.24 174.41 2qr5 s ILE 202 N 0.40 4.91 0.74 6.45 1.01 -1.26 -0.48 121.20 132.97 2qr5 s ILE 202 Ca -0.01 1.36 -0.13 0.00 0.00 0.00 0.00 60.65 61.87 2qr5 s ILE 202 Cb -0.04 -4.03 0.05 0.00 0.01 0.00 0.00 42.46 38.44 2qr5 s ILE 202 CO -0.01 -0.02 1.13 -0.94 0.00 0.00 0.00 174.94 175.11 2qr5 s SER 203 N 1.39 4.42 0.52 3.58 1.04 0.36 -4.85 113.70 120.15 2qr5 s SER 203 Ca 0.31 2.06 0.36 0.00 0.48 0.00 0.00 55.95 59.16 2qr5 s SER 203 Cb -0.15 -2.55 1.52 0.00 0.10 0.00 0.00 66.02 64.93 2qr5 s SER 203 CO 0.08 -2.10 1.76 -0.65 0.98 0.00 0.00 173.24 173.31 2qr5 h PRO 204 N -0.63 0.05 -0.02 4.02 0.11 -1.96 0.14 132.00 133.72 2qr5 h PRO 204 Ca -0.46 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2qr5 h PRO 204 Cb 1.26 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2qr5 h PRO 204 CO 0.50 0.03 0.00 0.41 -0.21 0.00 0.00 178.00 178.74 2qr5 n GLY 205 N -1.74 -0.83 2.24 -0.55 0.00 -1.26 -4.91 105.19 98.13 2qr5 n GLY 205 Ca 0.29 -0.14 -0.12 0.00 0.00 0.00 0.00 46.02 46.05 2qr5 n GLY 205 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2qr5 n MET 206 N -0.61 -1.05 -4.07 1.61 2.81 0.50 -5.03 117.12 111.27 2qr5 n MET 206 Ca 0.12 0.59 -0.22 0.00 -1.81 0.00 0.00 57.70 56.38 2qr5 n MET 206 Cb 0.09 -4.76 -0.05 0.00 -0.71 0.00 0.00 33.22 27.79 2qr5 n MET 206 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2qr5 s LYS 207 N -4.63 2.70 -0.33 0.03 1.02 -1.26 -4.72 119.74 112.55 2qr5 s LYS 207 Ca 0.01 -1.24 -0.11 0.00 0.02 0.00 0.00 55.97 54.65 2qr5 s LYS 207 Cb -0.00 -2.42 -0.01 0.00 -0.52 0.00 0.00 37.83 34.87 2qr5 s LYS 207 CO 0.01 0.29 0.19 0.08 -0.92 0.00 0.00 175.35 175.00 2qr5 s VAL 208 N -2.25 4.91 -0.07 3.17 1.01 0.74 -0.49 120.40 127.43 2qr5 s VAL 208 Ca 0.35 -0.35 -0.22 0.00 0.00 0.00 0.00 61.98 61.77 2qr5 s VAL 208 Cb -0.06 -3.52 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 2qr5 s VAL 208 CO 0.24 0.02 0.63 -0.89 0.00 0.00 0.00 175.10 175.10 2qr5 s THR 209 N 1.66 5.06 0.02 3.92 2.01 0.37 0.45 115.64 129.13 2qr5 s THR 209 Ca 0.05 1.29 -0.02 0.00 0.31 0.00 0.00 61.69 63.32 2qr5 s THR 209 Cb -0.17 -3.97 -0.02 0.00 0.01 0.00 0.00 72.50 68.35 2qr5 s THR 209 CO 0.08 0.30 0.00 0.00 -0.69 0.00 0.00 174.62 174.31 2qr5 s ALA 210 N 0.59 0.06 -0.16 7.40 0.00 0.22 -0.52 121.76 129.35 2qr5 s ALA 210 Ca 0.34 -0.55 -0.19 0.00 0.00 0.00 0.00 51.96 51.56 2qr5 s ALA 210 Cb -0.17 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.07 2qr5 s ALA 210 CO 0.16 -0.19 0.52 0.20 0.00 0.00 0.00 175.76 176.45 2qr5 s GLY 211 N -1.58 2.22 -0.25 0.00 0.00 -0.52 -1.24 107.32 105.95 2qr5 s GLY 211 Ca -0.14 -0.28 -0.05 0.00 0.00 0.00 0.00 44.72 44.25 2qr5 s GLY 211 CO -0.01 0.98 0.01 -2.27 0.00 0.00 0.00 173.10 171.80 2qr5 s LEU 212 N 1.21 3.31 -0.35 0.66 2.96 0.90 -0.89 118.68 126.49 2qr5 s LEU 212 Ca 0.26 -0.56 -0.14 0.00 -0.22 0.00 0.00 54.13 53.47 2qr5 s LEU 212 Cb -0.15 -1.79 -0.01 0.00 0.50 0.00 0.00 46.19 44.73 2qr5 s LEU 212 CO 0.10 -0.10 0.28 -1.61 -1.32 0.00 0.00 176.35 173.71 2qr5 s GLU 213 N 1.47 3.48 0.00 1.98 2.02 0.14 -1.36 118.70 126.43 2qr5 s GLU 213 Ca 0.04 -0.61 0.00 0.00 0.02 0.00 0.00 54.97 54.42 2qr5 s GLU 213 Cb -0.16 -3.82 0.00 0.00 0.10 0.00 0.00 34.13 30.25 2qr5 s GLU 213 CO -0.01 -0.49 0.00 0.25 0.02 0.00 0.00 175.26 175.03 2qr5 n THR 214 N 5.15 0.00 -0.14 3.63 -2.24 -0.40 -1.03 114.28 119.25 2qr5 n THR 214 Ca -0.11 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.58 2qr5 n THR 214 Cb 0.49 -0.81 -0.03 0.00 -2.10 0.00 0.00 70.33 67.88 2qr5 n THR 214 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qr5 h ALA 215 N 0.59 -0.32 0.00 6.98 0.00 -1.94 0.61 119.26 125.18 2qr5 h ALA 215 Ca 0.00 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2qr5 h ALA 215 Cb 0.00 0.83 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2qr5 h ALA 215 CO 0.00 -0.81 -1.19 2.89 0.00 0.00 0.00 179.25 180.15 2qr5 n ARG 216 N -5.42 0.08 -3.57 0.00 -4.01 -1.26 -2.83 116.66 99.66 2qr5 n ARG 216 Ca 0.00 0.02 -0.20 0.00 -1.04 0.00 0.00 57.85 56.64 2qr5 n ARG 216 Cb 0.35 -0.92 -0.02 0.00 -3.04 0.00 0.00 32.46 28.83 2qr5 n ARG 216 CO 0.00 0.00 0.00 -2.00 -3.04 0.00 0.00 177.63 172.59 2qr5 s GLU 217 N -2.06 2.86 0.10 2.89 -6.30 -1.26 -4.43 118.70 110.49 2qr5 s GLU 217 Ca -0.05 -1.21 0.10 0.00 -2.50 0.00 0.00 54.97 51.31 2qr5 s GLU 217 Cb 0.01 -2.62 -0.04 0.00 0.00 0.00 0.00 34.13 31.48 2qr5 s GLU 217 CO 0.07 0.01 -0.25 0.00 0.02 0.00 0.00 175.26 175.10 2qr5 s ALA 218 N -2.28 2.39 0.27 6.30 0.00 0.12 -1.28 121.76 127.27 2qr5 s ALA 218 Ca 0.45 -1.39 -0.09 0.00 0.00 0.00 0.00 51.96 50.93 2qr5 s ALA 218 Cb -0.07 -0.45 -0.01 0.00 0.00 0.00 0.00 23.12 22.59 2qr5 s ALA 218 CO 0.29 0.55 0.44 -0.98 0.00 0.00 0.00 175.76 176.06 2qr5 s ARG 219 N -1.81 1.60 -0.14 0.00 1.70 -0.46 -4.59 118.95 115.24 2qr5 s ARG 219 Ca 0.14 -1.42 -0.05 0.00 -0.47 0.00 0.00 55.73 53.92 2qr5 s ARG 219 Cb -0.10 0.44 -0.04 0.00 -0.57 0.00 0.00 34.95 34.68 2qr5 s ARG 219 CO 0.05 -0.65 0.04 -0.51 -1.08 0.00 0.00 175.30 173.15 2qr5 s LEU 220 N -3.09 3.75 0.19 -1.89 1.43 -1.26 -0.07 118.68 117.74 2qr5 s LEU 220 Ca 0.26 0.12 0.06 0.00 -1.03 0.00 0.00 54.13 53.55 2qr5 s LEU 220 Cb 0.00 -1.91 -0.05 0.00 0.03 0.00 0.00 46.19 44.26 2qr5 s LEU 220 CO 0.12 0.26 -0.11 0.68 0.23 0.00 0.00 176.35 177.52 2qr5 s VAL 221 N -0.15 1.48 -0.14 -1.59 -7.23 -0.37 -1.54 120.40 110.86 2qr5 s VAL 221 Ca 0.06 -2.14 -0.01 0.00 -1.81 0.00 0.00 61.98 58.08 2qr5 s VAL 221 Cb -0.12 -2.02 -0.02 0.00 0.56 0.00 0.00 36.38 34.78 2qr5 s VAL 221 CO 0.01 -0.61 -0.10 -0.89 -0.31 0.00 0.00 175.10 173.20 2qr5 s THR 222 N -3.13 3.30 -0.17 5.32 2.01 0.71 -0.61 115.64 123.06 2qr5 s THR 222 Ca 0.21 -0.57 -0.01 0.00 0.31 0.00 0.00 61.69 61.64 2qr5 s THR 222 Cb 0.01 -2.41 0.00 0.00 0.01 0.00 0.00 72.50 70.11 2qr5 s THR 222 CO 0.05 0.51 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.67 2qr5 s VAL 223 N 0.39 2.73 -0.43 3.82 1.01 0.17 -1.41 120.40 126.68 2qr5 s VAL 223 Ca -0.08 -0.73 -0.22 0.00 0.00 0.00 0.00 61.98 60.94 2qr5 s VAL 223 Cb -0.15 -2.17 0.02 0.00 0.00 0.00 0.00 36.38 34.07 2qr5 s VAL 223 CO 0.05 0.50 0.72 -0.62 0.00 0.00 0.00 175.10 175.74 2qr5 s ASP 224 N 1.05 6.40 0.21 3.32 -1.08 -0.73 -0.19 116.67 125.64 2qr5 s ASP 224 Ca -0.01 -0.11 0.19 0.00 -0.52 0.00 0.00 52.55 52.10 2qr5 s ASP 224 Cb -0.15 -2.36 0.87 0.00 -1.46 0.00 0.00 42.92 39.82 2qr5 s ASP 224 CO -0.03 -0.81 1.57 -0.81 0.52 0.00 0.00 175.17 175.61 2qr5 n PRO 225 N 6.46 0.12 0.10 4.34 -0.04 -1.26 -0.67 135.00 144.05 2qr5 n PRO 225 Ca 0.01 0.47 -0.15 0.00 -0.04 0.00 0.00 63.50 63.79 2qr5 n PRO 225 Cb 0.48 -1.80 -0.14 0.00 -0.04 0.00 0.00 33.50 32.01 2qr5 n PRO 225 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qr5 h ARG 226 N 0.00 0.23 0.00 0.54 3.08 -1.94 -3.38 114.38 112.91 2qr5 h ARG 226 Ca 0.00 -0.39 0.00 0.00 0.07 0.00 0.00 59.98 59.66 2qr5 h ARG 226 Cb 0.19 0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.39 2qr5 h ARG 226 CO 0.00 1.18 0.00 -0.40 -1.07 0.00 0.00 179.97 179.68 2qr5 n ASP 227 N -3.50 0.46 -0.34 7.04 3.85 -1.17 -5.02 116.55 117.86 2qr5 n ASP 227 Ca -0.07 -0.88 -0.04 0.00 -0.71 0.00 0.00 54.79 53.08 2qr5 n ASP 227 Cb 1.01 0.09 -0.02 0.00 -1.35 0.00 0.00 41.12 40.85 2qr5 n ASP 227 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2qr5 n GLY 228 N 0.09 0.69 3.76 6.12 0.00 0.16 -5.00 105.19 111.01 2qr5 n GLY 228 Ca 0.00 -0.37 -0.41 0.00 0.00 0.00 0.00 46.02 45.24 2qr5 n GLY 228 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qr5 s SER 229 N -2.50 6.83 -0.19 1.61 1.04 -1.23 -4.83 113.70 114.43 2qr5 s SER 229 Ca 0.00 2.57 0.01 0.00 0.48 0.00 0.00 55.95 59.02 2qr5 s SER 229 Cb 0.00 -2.63 0.03 0.00 0.10 0.00 0.00 66.02 63.52 2qr5 s SER 229 CO 0.00 -0.52 -0.15 -0.69 0.98 0.00 0.00 173.24 172.85 2qr5 s VAL 230 N -0.64 1.88 0.13 5.02 1.01 -1.26 -1.78 120.40 124.75 2qr5 s VAL 230 Ca 0.52 -0.98 0.08 0.00 0.00 0.00 0.00 61.98 61.60 2qr5 s VAL 230 Cb -0.39 -1.80 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 2qr5 s VAL 230 CO 0.47 0.37 -0.20 -1.83 0.00 0.00 0.00 175.10 173.90 2qr5 s GLU 231 N 1.33 1.20 0.34 2.72 -1.05 -0.50 -4.97 118.70 117.77 2qr5 s GLU 231 Ca 0.02 -1.27 -0.29 0.00 -0.15 0.00 0.00 54.97 53.29 2qr5 s GLU 231 Cb -0.15 -1.40 -0.11 0.00 -0.44 0.00 0.00 34.13 32.04 2qr5 s GLU 231 CO -0.10 0.31 1.40 -0.51 0.95 0.00 0.00 175.26 177.31 2qr5 s ASP 232 N -2.21 6.56 -0.33 0.83 1.11 -1.26 -0.21 116.67 121.17 2qr5 s ASP 232 Ca 0.10 2.86 -0.14 0.00 0.18 0.00 0.00 52.55 55.55 2qr5 s ASP 232 Cb -0.08 -2.66 -0.02 0.00 1.07 0.00 0.00 42.92 41.23 2qr5 s ASP 232 CO 0.05 -0.71 0.30 -0.22 1.18 0.00 0.00 175.17 175.78 2qr5 s LEU 233 N -1.78 4.38 -0.11 1.23 2.96 -0.59 -4.70 118.68 120.08 2qr5 s LEU 233 Ca 0.52 -0.22 -0.09 0.00 -0.22 0.00 0.00 54.13 54.12 2qr5 s LEU 233 Cb -0.43 -2.25 -0.04 0.00 0.50 0.00 0.00 46.19 43.96 2qr5 s LEU 233 CO 0.57 -0.25 0.19 -1.61 -1.32 0.00 0.00 176.35 173.93 2qr5 s GLU 234 N 1.89 3.61 0.14 1.98 0.41 -1.26 -4.72 118.70 120.75 2qr5 s GLU 234 Ca 0.10 -0.03 0.06 0.00 -0.41 0.00 0.00 54.97 54.69 2qr5 s GLU 234 Cb -0.17 -3.22 -0.04 0.00 -1.78 0.00 0.00 34.13 28.92 2qr5 s GLU 234 CO 0.11 0.71 -0.00 -0.51 -0.49 0.00 0.00 175.26 175.08 2qr5 s LEU 235 N -0.89 3.36 0.60 1.80 1.43 -1.26 -5.01 118.68 118.71 2qr5 s LEU 235 Ca 0.16 -0.32 0.34 0.00 -1.03 0.00 0.00 54.13 53.29 2qr5 s LEU 235 Cb -0.13 -2.05 1.92 0.00 0.03 0.00 0.00 46.19 45.96 2qr5 s LEU 235 CO 0.05 0.12 2.24 1.55 0.23 0.00 0.00 176.35 180.54 2qr5 h PRO 236 N 2.97 0.00 -6.53 1.29 0.13 -1.98 -3.42 132.00 124.47 2qr5 h PRO 236 Ca -0.47 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 63.98 2qr5 h PRO 236 Cb 1.19 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.13 2qr5 h PRO 236 CO 0.58 0.03 -0.76 0.45 -0.23 0.00 0.00 178.00 178.06 2qr5 s SER 237 N -5.80 4.15 0.00 1.44 0.15 -1.11 -5.05 113.70 107.48 2qr5 s SER 237 Ca -0.04 -0.37 0.20 0.00 0.70 0.00 0.00 55.95 56.44 2qr5 s SER 237 Cb 0.14 -0.76 0.29 0.00 -1.71 0.00 0.00 66.02 63.97 2qr5 s SER 237 CO 0.51 0.23 1.25 0.29 1.20 0.00 0.00 173.24 176.72 2qr5 n LYS 238 N 1.20 2.14 -0.26 5.44 4.01 -1.26 -4.45 118.16 124.97 2qr5 n LYS 238 Ca -0.15 -1.97 0.04 0.00 -0.51 0.00 0.00 58.31 55.71 2qr5 n LYS 238 Cb 0.52 -1.43 0.17 0.00 -0.51 0.00 0.00 35.03 33.79 2qr5 n LYS 238 CO 0.00 0.00 0.00 -0.44 -1.11 0.00 0.00 177.40 175.85 2qr5 h ASP 239 N 3.95 0.46 -0.36 4.39 5.19 -1.92 -0.33 116.42 127.79 2qr5 h ASP 239 Ca 0.00 0.08 -0.01 0.00 -0.62 0.00 0.00 57.03 56.48 2qr5 h ASP 239 Cb 0.88 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.38 2qr5 h ASP 239 CO 0.00 0.23 0.19 0.15 -3.12 0.00 0.00 179.24 176.69 2qr5 h PHE 240 N 0.59 0.50 -0.38 4.55 3.57 -1.59 -0.16 116.94 124.01 2qr5 h PHE 240 Ca 0.39 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.78 2qr5 h PHE 240 Cb 0.49 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 2qr5 h PHE 240 CO -0.11 0.40 -0.16 0.66 -2.23 0.00 0.00 178.31 176.86 2qr5 h SER 241 N 0.45 0.69 0.47 0.41 4.64 -1.76 -2.61 113.55 115.85 2qr5 h SER 241 Ca 0.13 -0.22 -0.04 0.00 -0.47 0.00 0.00 61.79 61.19 2qr5 h SER 241 Cb 0.07 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 61.96 2qr5 h SER 241 CO -0.02 0.87 -0.17 0.28 -0.87 0.00 0.00 176.83 176.92 2qr5 h SER 242 N 0.63 0.00 0.66 4.97 0.02 -0.73 -2.83 113.55 116.28 2qr5 h SER 242 Ca 0.10 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.98 2qr5 h SER 242 Cb 0.63 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.16 2qr5 h SER 242 CO 0.04 0.17 -0.32 0.22 -1.14 0.00 0.00 176.83 175.80 2qr5 h TYR 243 N 0.00 0.00 -5.69 3.45 3.20 -0.62 -3.48 116.97 113.83 2qr5 h TYR 243 Ca -0.00 0.00 -0.32 0.00 3.14 0.00 0.00 58.73 61.55 2qr5 h TYR 243 Cb 0.45 0.00 0.16 0.00 1.54 0.00 0.00 36.73 38.88 2qr5 h TYR 243 CO 0.00 0.32 -0.85 0.54 -1.64 0.00 0.00 178.16 176.53 2qr5 n ARG 244 N -3.66 -3.33 -2.52 1.82 5.12 -1.07 -4.93 116.66 108.10 2qr5 n ARG 244 Ca -0.01 0.77 -0.34 0.00 -1.93 0.00 0.00 57.85 56.34 2qr5 n ARG 244 Cb 0.44 -5.50 -0.03 0.00 -1.16 0.00 0.00 32.46 26.20 2qr5 n ARG 244 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2qr5 s PRO 245 N -5.03 3.79 -0.00 5.56 0.04 -1.26 -4.89 135.00 133.20 2qr5 s PRO 245 Ca 0.31 1.34 0.16 0.00 0.04 0.00 0.00 61.00 62.85 2qr5 s PRO 245 Cb -0.06 -2.09 -0.19 0.00 0.04 0.00 0.00 34.50 32.20 2qr5 s PRO 245 CO 0.77 -0.44 0.63 2.41 0.04 0.00 0.00 177.00 180.40 2qr5 n THR 246 N -1.04 0.00 -3.66 1.26 -1.04 -0.13 -0.70 114.28 108.97 2qr5 n THR 246 Ca 0.09 -0.17 -0.13 0.00 -2.04 0.00 0.00 64.05 61.81 2qr5 n THR 246 Cb 0.53 0.84 -0.06 0.00 -1.82 0.00 0.00 70.33 69.81 2qr5 n THR 246 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2qr5 s ALA 247 N -2.64 -1.03 -0.18 2.41 0.00 -1.04 -3.84 121.76 115.43 2qr5 s ALA 247 Ca 0.04 0.33 -0.04 0.00 0.00 0.00 0.00 51.96 52.29 2qr5 s ALA 247 Cb 0.12 0.35 -0.02 0.00 0.00 0.00 0.00 23.12 23.56 2qr5 s ALA 247 CO 0.67 -0.46 -0.03 0.42 0.00 0.00 0.00 175.76 176.37 2qr5 s ILE 248 N -2.46 3.84 -0.04 0.00 1.09 -1.26 -0.72 121.20 121.65 2qr5 s ILE 248 Ca -0.05 -0.36 -0.23 0.00 -1.10 0.00 0.00 60.65 58.91 2qr5 s ILE 248 Cb -0.01 -2.71 -0.26 0.00 -1.06 0.00 0.00 42.46 38.43 2qr5 s ILE 248 CO -0.02 0.46 1.00 0.74 -0.10 0.00 0.00 174.94 177.02 2qr5 h THR 249 N 5.31 1.52 -1.60 2.92 2.02 -0.33 -3.45 112.91 119.29 2qr5 h THR 249 Ca -0.34 -2.17 0.07 0.00 0.77 0.00 0.00 66.41 64.75 2qr5 h THR 249 Cb 1.18 2.87 -0.23 0.00 -1.74 0.00 0.00 68.15 70.23 2qr5 h THR 249 CO 0.61 0.61 0.52 0.86 0.37 0.00 0.00 175.52 178.49 2qr5 s TRP 250 N -2.91 -0.39 0.03 3.16 -0.00 -1.16 -4.90 118.94 112.77 2qr5 s TRP 250 Ca -0.15 0.66 -0.10 0.00 -0.00 0.00 0.00 56.10 56.51 2qr5 s TRP 250 Cb 0.01 0.45 0.01 0.00 -0.00 0.00 0.00 33.47 33.94 2qr5 s TRP 250 CO 0.79 -0.36 0.22 -0.48 -0.00 0.00 0.00 176.95 177.11 2qr5 s LEU 251 N -1.13 1.26 -0.09 5.86 0.05 -1.26 -0.54 118.68 122.83 2qr5 s LEU 251 Ca -0.02 -0.28 -0.30 0.00 0.05 0.00 0.00 54.13 53.58 2qr5 s LEU 251 Cb -0.00 1.02 0.10 0.00 -2.05 0.00 0.00 46.19 45.26 2qr5 s LEU 251 CO 0.02 -0.54 0.86 -0.83 -0.55 0.00 0.00 176.35 175.31 2qr5 s GLY 252 N -1.94 -0.41 -0.15 -3.48 0.00 -0.17 -4.64 107.32 96.52 2qr5 s GLY 252 Ca -0.07 1.58 -0.21 0.00 0.00 0.00 0.00 44.72 46.02 2qr5 s GLY 252 CO -0.02 0.86 0.61 -0.19 0.00 0.00 0.00 173.10 174.35 2qr5 s TYR 253 N -1.57 3.45 0.73 1.90 1.51 -1.26 -0.79 117.35 121.31 2qr5 s TYR 253 Ca -0.03 0.98 -0.11 0.00 -1.01 0.00 0.00 57.07 56.90 2qr5 s TYR 253 Cb -0.00 -2.74 0.03 0.00 -0.11 0.00 0.00 41.96 39.13 2qr5 s TYR 253 CO 0.02 -0.03 1.08 -0.51 -1.11 0.00 0.00 175.55 175.00 2qr5 s LEU 254 N 1.35 2.89 0.63 -1.29 1.43 0.27 -4.92 118.68 119.04 2qr5 s LEU 254 Ca 0.30 1.34 0.34 0.00 -1.03 0.00 0.00 54.13 55.08 2qr5 s LEU 254 Cb -0.16 -4.12 1.88 0.00 0.03 0.00 0.00 46.19 43.82 2qr5 s LEU 254 CO 0.12 -1.53 2.14 -0.65 0.23 0.00 0.00 176.35 176.66 2qr5 h PRO 255 N -0.78 0.00 -0.31 1.29 0.11 -1.95 0.43 132.00 130.79 2qr5 h PRO 255 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2qr5 h PRO 255 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2qr5 h PRO 255 CO 0.60 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.99 2qr5 n ASP 256 N -3.35 2.15 0.00 -2.05 5.68 -1.26 -4.92 116.55 112.80 2qr5 n ASP 256 Ca -0.01 -1.87 0.00 0.00 -0.50 0.00 0.00 54.79 52.41 2qr5 n ASP 256 Cb 0.26 -0.20 0.00 0.00 -1.14 0.00 0.00 41.12 40.04 2qr5 n ASP 256 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2qr5 n GLY 257 N 1.20 1.06 3.76 6.12 0.00 0.14 -5.04 105.19 112.43 2qr5 n GLY 257 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 2qr5 n GLY 257 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qr5 s ARG 258 N -0.51 4.52 -0.39 1.61 0.52 -1.26 -4.76 118.95 118.69 2qr5 s ARG 258 Ca 0.00 1.78 -0.20 0.00 -0.52 0.00 0.00 55.73 56.79 2qr5 s ARG 258 Cb 0.00 -3.05 0.01 0.00 0.52 0.00 0.00 34.95 32.43 2qr5 s ARG 258 CO 0.00 0.11 0.61 -1.17 0.02 0.00 0.00 175.30 174.87 2qr5 s LEU 259 N -1.71 4.37 -0.08 2.53 2.96 -1.26 -0.56 118.68 124.92 2qr5 s LEU 259 Ca 0.47 -0.07 -0.21 0.00 -0.22 0.00 0.00 54.13 54.10 2qr5 s LEU 259 Cb -0.31 -2.72 -0.04 0.00 0.50 0.00 0.00 46.19 43.62 2qr5 s LEU 259 CO 0.39 -0.64 0.61 0.00 -1.32 0.00 0.00 176.35 175.40 2qr5 s ALA 260 N 2.68 3.39 -0.04 5.97 0.00 0.03 -0.68 121.76 133.11 2qr5 s ALA 260 Ca 0.22 0.01 0.02 0.00 0.00 0.00 0.00 51.96 52.22 2qr5 s ALA 260 Cb -0.15 -2.84 0.01 0.00 0.00 0.00 0.00 23.12 20.15 2qr5 s ALA 260 CO 0.16 -0.06 -0.10 0.08 0.00 0.00 0.00 175.76 175.84 2qr5 s VAL 261 N 0.72 0.91 -0.26 0.00 1.01 0.37 -1.00 120.40 122.15 2qr5 s VAL 261 Ca 0.33 -0.39 -0.07 0.00 0.00 0.00 0.00 61.98 61.86 2qr5 s VAL 261 Cb -0.17 -0.84 -0.01 0.00 0.00 0.00 0.00 36.38 35.36 2qr5 s VAL 261 CO 0.15 0.29 0.05 -0.69 0.00 0.00 0.00 175.10 174.91 2qr5 s VAL 262 N 0.49 4.05 0.10 2.92 1.01 0.30 -0.95 120.40 128.31 2qr5 s VAL 262 Ca -0.09 -0.39 0.07 0.00 0.00 0.00 0.00 61.98 61.57 2qr5 s VAL 262 Cb -0.13 -2.95 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 2qr5 s VAL 262 CO 0.02 0.27 -0.18 0.00 0.00 0.00 0.00 175.10 175.21 2qr5 s ALA 263 N 1.56 1.59 0.21 5.51 0.00 -0.69 0.45 121.76 130.38 2qr5 s ALA 263 Ca 0.05 -1.20 0.02 0.00 0.00 0.00 0.00 51.96 50.84 2qr5 s ALA 263 Cb -0.16 -0.17 -0.05 0.00 0.00 0.00 0.00 23.12 22.74 2qr5 s ALA 263 CO 0.02 0.25 0.01 -0.98 0.00 0.00 0.00 175.76 175.07 2qr5 s ARG 264 N -2.04 1.25 -0.24 0.00 1.70 0.10 -0.86 118.95 118.87 2qr5 s ARG 264 Ca 0.05 -1.63 -0.21 0.00 -0.47 0.00 0.00 55.73 53.47 2qr5 s ARG 264 Cb -0.09 -0.41 0.06 0.00 -0.57 0.00 0.00 34.95 33.94 2qr5 s ARG 264 CO 0.04 -0.14 0.62 -0.98 -1.08 0.00 0.00 175.30 173.76 2qr5 s ARG 265 N -3.91 0.72 -1.57 3.89 1.70 -0.28 -0.95 118.95 118.54 2qr5 s ARG 265 Ca 0.28 0.89 -0.04 0.00 -0.47 0.00 0.00 55.73 56.39 2qr5 s ARG 265 Cb 0.06 0.34 0.01 0.00 -0.57 0.00 0.00 34.95 34.79 2qr5 s ARG 265 CO 0.08 -0.09 0.44 0.39 -1.08 0.00 0.00 175.30 175.03 2qr5 n GLU 266 N 2.86 -3.95 -1.05 3.89 1.02 -1.26 -2.34 120.64 119.81 2qr5 n GLU 266 Ca -0.14 0.89 -0.02 0.00 -0.02 0.00 0.00 57.16 57.87 2qr5 n GLU 266 Cb 0.56 -5.69 -0.01 0.00 -0.02 0.00 0.00 31.44 26.28 2qr5 n GLU 266 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qr5 n GLY 267 N -1.35 0.53 3.02 0.62 0.00 -1.26 -4.81 105.19 101.94 2qr5 n GLY 267 Ca -0.14 -0.47 -0.18 0.00 0.00 0.00 0.00 46.02 45.22 2qr5 n GLY 267 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qr5 s ARG 268 N -1.33 0.72 0.35 1.61 0.52 -0.99 -0.86 118.95 118.99 2qr5 s ARG 268 Ca 0.00 -0.33 0.08 0.00 -0.52 0.00 0.00 55.73 54.95 2qr5 s ARG 268 Cb 0.00 -0.70 -0.03 0.00 0.52 0.00 0.00 34.95 34.75 2qr5 s ARG 268 CO 0.00 0.19 0.31 -1.54 0.02 0.00 0.00 175.30 174.28 2qr5 s SER 269 N -0.25 5.22 0.15 0.23 1.04 -0.37 -1.13 113.70 118.60 2qr5 s SER 269 Ca 0.03 -0.56 0.04 0.00 0.48 0.00 0.00 55.95 55.95 2qr5 s SER 269 Cb -0.04 -0.87 -0.04 0.00 0.10 0.00 0.00 66.02 65.17 2qr5 s SER 269 CO -0.00 -0.42 -0.09 0.00 0.98 0.00 0.00 173.24 173.71 2qr5 s ALA 270 N -2.35 1.46 -0.06 5.32 0.00 -0.04 -4.72 121.76 121.36 2qr5 s ALA 270 Ca 0.43 -1.51 0.04 0.00 0.00 0.00 0.00 51.96 50.91 2qr5 s ALA 270 Cb -0.05 0.11 -0.02 0.00 0.00 0.00 0.00 23.12 23.16 2qr5 s ALA 270 CO 0.27 -0.13 -0.18 0.08 0.00 0.00 0.00 175.76 175.81 2qr5 s VAL 271 N -3.36 2.74 -0.04 0.00 1.01 -1.26 -1.71 120.40 117.78 2qr5 s VAL 271 Ca 0.18 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.36 2qr5 s VAL 271 Cb 0.03 -2.06 0.01 0.00 0.00 0.00 0.00 36.38 34.35 2qr5 s VAL 271 CO 0.01 0.57 -0.10 -0.36 0.00 0.00 0.00 175.10 175.23 2qr5 s PHE 272 N -0.39 1.08 -0.24 5.22 0.40 -0.12 -0.78 117.98 123.15 2qr5 s PHE 272 Ca 0.04 -0.31 -0.03 0.00 -0.60 0.00 0.00 56.93 56.03 2qr5 s PHE 272 Cb -0.12 -0.79 0.02 0.00 0.51 0.00 0.00 43.02 42.63 2qr5 s PHE 272 CO 0.02 -0.16 -0.05 0.42 0.70 0.00 0.00 175.22 176.16 2qr5 s ILE 273 N 0.40 3.08 -1.51 0.64 -1.09 0.01 -0.48 121.20 122.26 2qr5 s ILE 273 Ca -0.07 -0.85 -0.12 0.00 -2.23 0.00 0.00 60.65 57.38 2qr5 s ILE 273 Cb -0.11 -2.52 0.08 0.00 -1.58 0.00 0.00 42.46 38.33 2qr5 s ILE 273 CO 0.01 0.26 0.92 0.47 -1.23 0.00 0.00 174.94 175.37 2qr5 n ASP 274 N 4.72 -4.14 0.00 3.58 8.00 0.15 -0.77 116.55 128.09 2qr5 n ASP 274 Ca -0.17 -0.80 0.00 0.00 0.71 0.00 0.00 54.79 54.53 2qr5 n ASP 274 Cb 0.48 -3.82 0.00 0.00 -0.02 0.00 0.00 41.12 37.76 2qr5 n ASP 274 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qr5 n GLY 275 N -1.67 2.67 3.65 0.44 0.00 -1.26 -2.76 105.19 106.25 2qr5 n GLY 275 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2qr5 n GLY 275 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qr5 s GLU 276 N -0.00 4.20 0.27 1.61 2.12 0.05 -1.87 118.70 125.07 2qr5 s GLU 276 Ca 0.00 0.91 -0.30 0.00 0.36 0.00 0.00 54.97 55.94 2qr5 s GLU 276 Cb 0.00 -3.63 -0.12 0.00 0.26 0.00 0.00 34.13 30.63 2qr5 s GLU 276 CO 0.00 -0.47 1.49 -2.13 -0.54 0.00 0.00 175.26 173.61 2qr5 n ARG 277 N 5.83 2.35 -5.05 4.30 3.00 -1.26 -0.81 116.66 125.03 2qr5 n ARG 277 Ca 0.05 0.84 -0.32 0.00 -0.00 0.00 0.00 57.85 58.41 2qr5 n ARG 277 Cb 0.48 -2.55 -0.15 0.00 0.00 0.00 0.00 32.46 30.24 2qr5 n ARG 277 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2qr5 s VAL 278 N -0.08 2.54 0.17 5.15 1.01 0.04 -4.87 120.40 124.36 2qr5 s VAL 278 Ca 0.66 -0.88 -0.32 0.00 0.00 0.00 0.00 61.98 61.44 2qr5 s VAL 278 Cb -0.57 -1.99 -0.11 0.00 0.00 0.00 0.00 36.38 33.71 2qr5 s VAL 278 CO 0.50 0.56 1.75 -1.61 0.00 0.00 0.00 175.10 176.30 2qr5 s GLU 279 N -0.08 4.14 -0.01 2.72 0.41 -1.26 -4.27 118.70 120.36 2qr5 s GLU 279 Ca -0.04 2.57 -0.04 0.00 -0.41 0.00 0.00 54.97 57.04 2qr5 s GLU 279 Cb -0.14 -3.30 -0.00 0.00 -1.78 0.00 0.00 34.13 28.90 2qr5 s GLU 279 CO 0.04 -0.77 0.09 0.00 -0.49 0.00 0.00 175.26 174.13 2qr5 s ALA 280 N 1.83 -0.20 0.41 5.21 0.00 -1.26 -4.33 121.76 123.43 2qr5 s ALA 280 Ca 0.77 -0.12 -0.26 0.00 0.00 0.00 0.00 51.96 52.34 2qr5 s ALA 280 Cb -0.47 0.04 -0.10 0.00 0.00 0.00 0.00 23.12 22.59 2qr5 s ALA 280 CO 0.34 -0.15 1.34 -2.30 0.00 0.00 0.00 175.76 174.99 2qr5 n PRO 281 N 1.94 2.13 -2.01 0.00 -0.02 -1.26 -4.90 135.00 130.87 2qr5 n PRO 281 Ca -0.20 0.76 -0.41 0.00 -2.02 0.00 0.00 63.50 61.63 2qr5 n PRO 281 Cb 0.56 -2.48 -0.01 0.00 -0.02 0.00 0.00 33.50 31.56 2qr5 n PRO 281 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 2qr5 s GLN 282 N -2.21 4.24 0.00 -0.52 0.74 -1.26 -4.72 119.66 115.93 2qr5 s GLN 282 Ca 0.59 2.32 0.00 0.00 0.05 0.00 0.00 55.36 58.33 2qr5 s GLN 282 Cb -0.50 -3.01 0.00 0.00 1.10 0.00 0.00 33.01 30.60 2qr5 s GLN 282 CO 0.59 -0.33 0.00 0.41 -0.55 0.00 0.00 175.29 175.42 2qr5 n GLY 283 N 0.68 0.55 3.45 2.59 0.00 -1.26 -4.76 105.19 106.43 2qr5 n GLY 283 Ca 0.01 -1.61 -0.30 0.00 0.00 0.00 0.00 46.02 44.12 2qr5 n GLY 283 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qr5 s ASN 284 N -4.00 3.70 0.30 1.61 0.01 0.86 -1.24 114.94 116.18 2qr5 s ASN 284 Ca 0.00 -0.56 0.11 0.00 -0.71 0.00 0.00 52.86 51.70 2qr5 s ASN 284 Cb 0.00 -0.48 -0.05 0.00 0.41 0.00 0.00 41.25 41.13 2qr5 s ASN 284 CO 0.00 0.20 -0.17 -1.00 -1.51 0.00 0.00 177.10 174.63 2qr5 s HIS 285 N -1.04 2.33 0.00 2.20 3.76 -1.26 -1.53 115.29 119.74 2qr5 s HIS 285 Ca 0.16 -0.37 0.00 0.00 -0.15 0.00 0.00 55.06 54.70 2qr5 s HIS 285 Cb -0.10 -1.10 0.00 0.00 1.11 0.00 0.00 32.58 32.49 2qr5 s HIS 285 CO 0.07 0.68 0.00 0.41 -0.85 0.00 0.00 174.74 175.06 2qr5 n GLY 286 N -0.67 4.16 3.63 -2.22 0.00 -1.12 -4.97 105.19 103.99 2qr5 n GLY 286 Ca -0.05 -1.91 -0.34 0.00 0.00 0.00 0.00 46.02 43.73 2qr5 n GLY 286 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2qr5 n ARG 287 N 0.00 0.09 -4.73 1.61 1.85 -1.26 -4.69 116.66 109.53 2qr5 n ARG 287 Ca 0.00 0.10 -0.33 0.00 -1.00 0.00 0.00 57.85 56.62 2qr5 n ARG 287 Cb 0.00 -2.29 -0.15 0.00 -1.05 0.00 0.00 32.46 28.97 2qr5 n ARG 287 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2qr5 s VAL 288 N -2.16 2.69 0.21 8.89 1.01 -1.26 -4.02 120.40 125.75 2qr5 s VAL 288 Ca 0.70 -0.78 0.10 0.00 0.00 0.00 0.00 61.98 62.00 2qr5 s VAL 288 Cb -0.29 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 2qr5 s VAL 288 CO 0.54 0.53 -0.14 0.68 0.00 0.00 0.00 175.10 176.71 2qr5 s VAL 289 N 0.57 2.90 -0.24 2.92 -7.23 -0.19 -4.96 120.40 114.17 2qr5 s VAL 289 Ca -0.10 -1.89 -0.15 0.00 -1.81 0.00 0.00 61.98 58.04 2qr5 s VAL 289 Cb -0.16 -2.45 -0.04 0.00 0.56 0.00 0.00 36.38 34.29 2qr5 s VAL 289 CO 0.03 -0.18 0.36 -0.22 -0.31 0.00 0.00 175.10 174.78 2qr5 s LEU 290 N -2.97 4.09 -0.11 1.32 2.96 -1.26 -0.50 118.68 122.21 2qr5 s LEU 290 Ca 0.25 0.34 -0.03 0.00 -0.22 0.00 0.00 54.13 54.47 2qr5 s LEU 290 Cb -0.08 -2.42 0.04 0.00 0.50 0.00 0.00 46.19 44.24 2qr5 s LEU 290 CO 0.14 -0.12 0.06 0.86 -1.32 0.00 0.00 176.35 175.98 2qr5 s TRP 291 N 1.70 0.25 -1.34 5.38 -0.00 0.10 -4.84 118.94 120.19 2qr5 s TRP 291 Ca 0.15 -0.10 -0.02 0.00 -0.00 0.00 0.00 56.10 56.13 2qr5 s TRP 291 Cb -0.15 -0.64 -0.00 0.00 -0.00 0.00 0.00 33.47 32.68 2qr5 s TRP 291 CO 0.09 -0.37 0.55 0.54 -0.00 0.00 0.00 176.95 177.76 2qr5 n ARG 292 N 5.26 -3.58 -1.08 5.86 1.74 -1.26 -0.55 116.66 123.06 2qr5 n ARG 292 Ca -0.05 0.48 -0.03 0.00 -0.77 0.00 0.00 57.85 57.48 2qr5 n ARG 292 Cb 0.49 -4.70 -0.01 0.00 -1.02 0.00 0.00 32.46 27.22 2qr5 n ARG 292 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qr5 n GLY 293 N -1.81 0.38 3.51 -0.13 0.00 -1.26 -4.99 105.19 100.89 2qr5 n GLY 293 Ca -0.28 -0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.36 2qr5 n GLY 293 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qr5 s LYS 294 N -1.80 2.49 -0.04 1.61 1.02 0.29 -5.10 119.74 118.21 2qr5 s LYS 294 Ca 0.00 -0.72 -0.30 0.00 0.02 0.00 0.00 55.97 54.98 2qr5 s LYS 294 Cb 0.00 -2.40 -0.03 0.00 -0.52 0.00 0.00 37.83 34.88 2qr5 s LYS 294 CO 0.00 0.62 1.10 -0.51 -0.92 0.00 0.00 175.35 175.64 2qr5 s LEU 295 N -0.94 4.30 -0.07 3.17 1.43 -1.26 0.02 118.68 125.33 2qr5 s LEU 295 Ca 0.13 1.74 0.03 0.00 -1.03 0.00 0.00 54.13 55.00 2qr5 s LEU 295 Cb -0.11 -3.56 0.01 0.00 0.03 0.00 0.00 46.19 42.56 2qr5 s LEU 295 CO 0.02 -0.46 -0.17 -0.69 0.23 0.00 0.00 176.35 175.28 2qr5 s VAL 296 N 1.72 1.46 0.31 -1.59 1.01 0.34 -0.39 120.40 123.26 2qr5 s VAL 296 Ca 0.53 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.86 2qr5 s VAL 296 Cb -0.23 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.82 2qr5 s VAL 296 CO 0.23 0.42 0.14 0.28 0.00 0.00 0.00 175.10 176.18 2qr5 s THR 297 N 0.42 0.43 0.25 3.92 -1.32 -0.22 -1.02 115.64 118.10 2qr5 s THR 297 Ca -0.13 -2.00 -0.04 0.00 -1.21 0.00 0.00 61.69 58.31 2qr5 s THR 297 Cb -0.15 -2.53 -0.05 0.00 -1.51 0.00 0.00 72.50 68.26 2qr5 s THR 297 CO 0.05 0.00 0.49 -0.94 -2.21 0.00 0.00 174.62 172.01 2qr5 s SER 298 N -3.39 6.43 -0.05 8.08 1.04 -1.26 -0.50 113.70 124.06 2qr5 s SER 298 Ca 0.35 0.60 -0.05 0.00 0.48 0.00 0.00 55.95 57.33 2qr5 s SER 298 Cb 0.05 -2.10 0.01 0.00 0.10 0.00 0.00 66.02 64.09 2qr5 s SER 298 CO 0.17 -0.13 0.13 -2.28 0.98 0.00 0.00 173.24 172.11 2qr5 s HIS 299 N -1.98 -0.13 0.08 5.02 5.04 0.17 -2.79 115.29 120.71 2qr5 s HIS 299 Ca 0.42 0.31 -0.13 0.00 -1.54 0.00 0.00 55.06 54.11 2qr5 s HIS 299 Cb -0.11 0.04 0.02 0.00 0.04 0.00 0.00 32.58 32.57 2qr5 s HIS 299 CO 0.29 -0.09 0.30 -0.08 -2.34 0.00 0.00 174.74 172.83 2qr5 s THR 300 N -0.06 0.10 0.31 0.89 -1.32 -0.58 -0.47 115.64 114.50 2qr5 s THR 300 Ca -0.01 -0.79 -0.09 0.00 -1.21 0.00 0.00 61.69 59.59 2qr5 s THR 300 Cb -0.02 -1.13 0.01 0.00 -1.51 0.00 0.00 72.50 69.86 2qr5 s THR 300 CO 0.00 -0.43 0.54 -0.94 -2.21 0.00 0.00 174.62 171.58 2qr5 s SER 301 N -2.52 0.32 0.26 8.08 1.04 -0.89 -0.10 113.70 119.89 2qr5 s SER 301 Ca 0.00 -1.18 0.17 0.00 0.48 0.00 0.00 55.95 55.42 2qr5 s SER 301 Cb 0.02 0.67 0.90 0.00 0.10 0.00 0.00 66.02 67.71 2qr5 s SER 301 CO -0.08 -1.31 1.50 0.18 0.98 0.00 0.00 173.24 174.51 2qr5 n LEU 302 N -0.48 0.43 0.00 2.42 4.77 -1.25 -0.88 117.00 122.01 2qr5 n LEU 302 Ca -0.02 0.69 0.00 0.00 -0.03 0.00 0.00 56.01 56.65 2qr5 n LEU 302 Cb 0.61 -0.74 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 2qr5 n LEU 302 CO 0.26 -0.84 0.30 -1.54 -1.33 0.00 0.00 177.39 174.24 2qr5 n SER 303 N -2.09 1.21 -3.96 -1.43 3.41 -1.26 -4.72 113.62 104.79 2qr5 n SER 303 Ca -0.01 -1.22 -0.31 0.00 -0.26 0.00 0.00 58.87 57.07 2qr5 n SER 303 Cb 0.05 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 63.85 2qr5 n SER 303 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2qr5 s THR 304 N -0.22 1.80 0.49 6.66 2.01 -0.52 -5.00 115.64 120.86 2qr5 s THR 304 Ca 0.00 -1.70 -0.23 0.00 0.31 0.00 0.00 61.69 60.07 2qr5 s THR 304 Cb 0.00 -2.16 -0.07 0.00 0.01 0.00 0.00 72.50 70.28 2qr5 s THR 304 CO 0.00 -0.34 1.26 -2.65 -0.69 0.00 0.00 174.62 172.20 2qr5 n PRO 305 N 4.51 1.70 -1.62 4.92 -0.02 -1.26 -2.09 135.00 141.15 2qr5 n PRO 305 Ca -0.06 0.62 -0.54 0.00 -2.02 0.00 0.00 63.50 61.50 2qr5 n PRO 305 Cb 0.43 -2.42 -0.06 0.00 -0.02 0.00 0.00 33.50 31.42 2qr5 n PRO 305 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2qr5 n PRO 306 N -0.49 1.09 -4.18 0.52 -0.02 -1.26 -4.77 135.00 125.89 2qr5 n PRO 306 Ca 0.09 0.40 -0.11 0.00 -2.02 0.00 0.00 63.50 61.85 2qr5 n PRO 306 Cb 0.42 -2.04 -0.10 0.00 -0.02 0.00 0.00 33.50 31.76 2qr5 n PRO 306 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 2qr5 s ARG 307 N 1.17 1.07 -0.25 -0.52 1.70 0.38 -1.04 118.95 121.46 2qr5 s ARG 307 Ca 0.88 -1.53 -0.10 0.00 -0.47 0.00 0.00 55.73 54.51 2qr5 s ARG 307 Cb -1.00 0.19 -0.04 0.00 -0.57 0.00 0.00 34.95 33.53 2qr5 s ARG 307 CO 0.52 -0.30 0.15 0.42 -1.08 0.00 0.00 175.30 175.00 2qr5 s ILE 308 N -4.05 5.08 0.17 4.99 -1.09 -0.10 0.44 121.20 126.64 2qr5 s ILE 308 Ca 0.30 0.09 0.09 0.00 -2.23 0.00 0.00 60.65 58.90 2qr5 s ILE 308 Cb 0.07 -3.39 -0.04 0.00 -1.58 0.00 0.00 42.46 37.52 2qr5 s ILE 308 CO 0.06 0.31 -0.19 0.68 -1.23 0.00 0.00 174.94 174.58 2qr5 s VAL 309 N 1.42 1.89 0.02 2.92 -7.23 0.35 0.04 120.40 119.80 2qr5 s VAL 309 Ca 0.07 -1.95 -0.12 0.00 -1.81 0.00 0.00 61.98 58.17 2qr5 s VAL 309 Cb -0.15 -1.89 -0.06 0.00 0.56 0.00 0.00 36.38 34.85 2qr5 s VAL 309 CO 0.07 -0.30 0.37 -0.55 -0.31 0.00 0.00 175.10 174.38 2qr5 s SER 310 N -2.70 6.69 0.14 4.85 0.15 0.42 -1.06 113.70 122.18 2qr5 s SER 310 Ca 0.17 0.83 0.08 0.00 0.70 0.00 0.00 55.95 57.72 2qr5 s SER 310 Cb -0.06 -2.20 -0.04 0.00 -1.71 0.00 0.00 66.02 62.02 2qr5 s SER 310 CO 0.07 0.26 -0.08 -0.76 1.20 0.00 0.00 173.24 173.94 2qr5 s LEU 311 N -1.46 3.08 0.00 3.45 1.43 0.47 -0.78 118.68 124.87 2qr5 s LEU 311 Ca 0.27 -0.44 0.27 0.00 -1.03 0.00 0.00 54.13 53.21 2qr5 s LEU 311 Cb -0.15 -1.82 1.17 0.00 0.03 0.00 0.00 46.19 45.43 2qr5 s LEU 311 CO 0.15 0.14 1.81 -0.81 0.23 0.00 0.00 176.35 177.87 2qr5 n PRO 312 N 0.35 1.52 0.27 1.29 -0.04 -1.26 -4.09 135.00 133.04 2qr5 n PRO 312 Ca -0.12 -0.77 0.13 0.00 -0.04 0.00 0.00 63.50 62.70 2qr5 n PRO 312 Cb 0.54 -1.47 0.75 0.00 -0.04 0.00 0.00 33.50 33.28 2qr5 n PRO 312 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2qr5 h SER 313 N 1.81 0.00 -0.08 3.54 4.64 -1.82 -3.41 113.55 118.23 2qr5 h SER 313 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2qr5 h SER 313 Cb 0.39 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 2qr5 h SER 313 CO 0.00 0.10 -0.03 0.61 -0.87 0.00 0.00 176.83 176.64 2qr5 n GLY 314 N -0.79 0.53 3.67 -0.77 0.00 0.04 -4.99 105.19 102.87 2qr5 n GLY 314 Ca -0.02 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.19 2qr5 n GLY 314 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qr5 s GLU 315 N -1.22 4.22 0.18 1.61 2.12 -1.16 -4.73 118.70 119.71 2qr5 s GLU 315 Ca 0.00 2.02 -0.30 0.00 0.36 0.00 0.00 54.97 57.05 2qr5 s GLU 315 Cb 0.00 -3.83 -0.08 0.00 0.26 0.00 0.00 34.13 30.48 2qr5 s GLU 315 CO 0.00 -0.75 1.22 -1.25 -0.54 0.00 0.00 175.26 173.94 2qr5 s PRO 316 N 3.51 4.47 -0.25 4.30 0.04 -1.26 -0.44 135.00 145.37 2qr5 s PRO 316 Ca 0.67 1.91 0.03 0.00 0.04 0.00 0.00 61.00 63.64 2qr5 s PRO 316 Cb -0.30 -3.23 -0.18 0.00 0.04 0.00 0.00 34.50 30.83 2qr5 s PRO 316 CO 0.25 -0.13 -0.20 1.28 0.04 0.00 0.00 177.00 178.24 2qr5 n LEU 317 N 2.58 2.81 -3.50 -3.56 4.77 0.11 -4.92 117.00 115.29 2qr5 n LEU 317 Ca 0.05 -0.13 -0.16 0.00 -0.03 0.00 0.00 56.01 55.74 2qr5 n LEU 317 Cb 0.44 -0.84 -0.12 0.00 -2.33 0.00 0.00 43.42 40.57 2qr5 n LEU 317 CO 0.56 0.91 -0.17 -0.22 -1.33 0.00 0.00 177.39 177.14 2qr5 s LEU 318 N -6.47 -0.21 -0.03 2.23 2.96 -1.13 -5.01 118.68 111.02 2qr5 s LEU 318 Ca -0.33 -0.04 -0.08 0.00 -0.22 0.00 0.00 54.13 53.45 2qr5 s LEU 318 Cb 0.09 0.52 0.01 0.00 0.50 0.00 0.00 46.19 47.31 2qr5 s LEU 318 CO 0.62 -0.31 0.19 -1.83 -1.32 0.00 0.00 176.35 173.69 2qr5 s GLU 319 N 2.37 0.41 -0.07 1.98 -1.05 -1.26 -0.92 118.70 120.15 2qr5 s GLU 319 Ca 0.07 -0.10 -0.16 0.00 -0.15 0.00 0.00 54.97 54.63 2qr5 s GLU 319 Cb -0.15 0.18 -0.05 0.00 -0.44 0.00 0.00 34.13 33.67 2qr5 s GLU 319 CO -0.12 -0.09 0.41 0.20 0.95 0.00 0.00 175.26 176.61 2qr5 s GLY 320 N -0.79 2.40 -0.15 -3.83 0.00 -1.23 -4.98 107.32 98.74 2qr5 s GLY 320 Ca -0.09 -0.25 -0.13 0.00 0.00 0.00 0.00 44.72 44.25 2qr5 s GLY 320 CO 0.01 0.42 0.28 -0.32 0.00 0.00 0.00 173.10 173.49 2qr5 s GLY 321 N -0.18 2.21 0.29 0.20 0.00 -1.26 -4.79 107.32 103.79 2qr5 s GLY 321 Ca 0.23 -0.47 -0.29 0.00 0.00 0.00 0.00 44.72 44.19 2qr5 s GLY 321 CO 0.10 0.35 1.18 1.08 0.00 0.00 0.00 173.10 175.81 2qr5 s LEU 322 N 0.29 4.50 0.59 0.66 1.43 -1.26 -4.97 118.68 119.92 2qr5 s LEU 322 Ca 0.16 2.42 -0.20 0.00 -1.03 0.00 0.00 54.13 55.48 2qr5 s LEU 322 Cb -0.13 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.42 2qr5 s LEU 322 CO 0.04 -0.29 1.31 -2.84 0.23 0.00 0.00 176.35 174.79 2qr5 s PRO 323 N -1.52 2.90 0.17 1.29 0.02 -1.26 -4.82 135.00 131.78 2qr5 s PRO 323 Ca 0.46 2.09 -0.17 0.00 0.02 0.00 0.00 61.00 63.40 2qr5 s PRO 323 Cb -0.35 -2.05 0.11 0.00 0.02 0.00 0.00 34.50 32.23 2qr5 s PRO 323 CO 0.45 -1.33 1.65 1.49 -0.33 0.00 0.00 177.00 178.93 2qr5 h GLU 324 N 1.03 -0.05 -0.66 5.54 4.22 -1.99 -1.12 114.58 121.56 2qr5 h GLU 324 Ca -0.51 0.00 0.11 0.00 0.08 0.00 0.00 59.36 59.05 2qr5 h GLU 324 Cb 1.31 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.53 2qr5 h GLU 324 CO 0.55 -0.03 0.44 0.38 -2.18 0.00 0.00 179.01 178.17 2qr5 h ASP 325 N -0.05 0.39 0.39 1.04 -0.00 -2.00 -1.45 116.42 114.75 2qr5 h ASP 325 Ca 0.20 0.01 -0.32 0.00 -0.00 0.00 0.00 57.03 56.93 2qr5 h ASP 325 Cb 0.36 -0.07 0.02 0.00 -0.00 0.00 0.00 39.33 39.63 2qr5 h ASP 325 CO -0.45 0.23 -1.46 -0.07 -0.00 0.00 0.00 179.24 177.48 2qr5 h LEU 326 N 0.43 0.61 -0.79 0.15 3.38 -1.61 -3.14 115.31 114.34 2qr5 h LEU 326 Ca 0.31 -0.72 0.05 0.00 0.09 0.00 0.00 57.88 57.62 2qr5 h LEU 326 Cb 0.63 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.13 2qr5 h LEU 326 CO -0.09 1.57 0.49 -0.09 0.09 0.00 0.00 178.44 180.41 2qr5 h ARG 327 N 0.11 0.88 0.00 1.13 9.65 -0.69 -2.07 114.38 123.39 2qr5 h ARG 327 Ca -0.23 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.60 2qr5 h ARG 327 Cb 2.08 -0.20 0.00 0.00 -1.39 0.00 0.00 29.97 30.46 2qr5 h ARG 327 CO 0.22 0.58 0.00 -0.09 2.80 0.00 0.00 179.97 183.48 2qr5 h ARG 328 N 0.91 0.00 0.00 0.20 9.65 -1.27 -2.78 114.38 121.09 2qr5 h ARG 328 Ca 0.34 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 59.21 2qr5 h ARG 328 Cb 0.13 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.71 2qr5 h ARG 328 CO -0.16 0.00 -0.05 0.66 2.80 0.00 0.00 179.97 183.22 2qr5 h SER 329 N 0.00 0.00 -2.70 -3.80 4.64 -1.33 -3.37 113.55 106.99 2qr5 h SER 329 Ca 0.00 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 60.67 2qr5 h SER 329 Cb 0.45 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 62.39 2qr5 h SER 329 CO 0.00 0.05 0.46 -0.63 -0.87 0.00 0.00 176.83 175.84 2qr5 s ILE 330 N -3.41 4.44 0.12 0.95 1.01 -1.05 0.22 121.20 123.49 2qr5 s ILE 330 Ca 0.04 -0.53 -0.14 0.00 0.00 0.00 0.00 60.65 60.02 2qr5 s ILE 330 Cb 0.07 -4.65 -0.04 0.00 0.01 0.00 0.00 42.46 37.86 2qr5 s ILE 330 CO 0.62 -1.39 1.51 0.00 0.00 0.00 0.00 174.94 175.68 2qr5 h ALA 331 N 9.47 0.54 0.00 9.38 0.00 -0.97 -3.44 119.26 134.23 2qr5 h ALA 331 Ca -0.28 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.29 2qr5 h ALA 331 Cb 1.07 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2qr5 h ALA 331 CO 1.16 0.45 0.00 0.41 0.00 0.00 0.00 179.25 181.27 2qr5 n GLY 332 N -0.11 -0.29 3.13 0.00 0.00 -1.16 -4.98 105.19 101.78 2qr5 n GLY 332 Ca -0.02 -0.97 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 2qr5 n GLY 332 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qr5 s SER 333 N 0.00 1.05 0.11 1.61 1.04 -1.26 -0.48 113.70 115.77 2qr5 s SER 333 Ca 0.00 -0.81 -0.12 0.00 0.48 0.00 0.00 55.95 55.50 2qr5 s SER 333 Cb 0.00 0.06 0.02 0.00 0.10 0.00 0.00 66.02 66.20 2qr5 s SER 333 CO 0.00 -0.34 0.30 0.00 0.98 0.00 0.00 173.24 174.18 2qr5 s ARG 334 N -2.83 0.97 -0.21 4.02 1.70 -0.67 -4.99 118.95 116.94 2qr5 s ARG 334 Ca 0.02 -0.84 -0.09 0.00 -0.47 0.00 0.00 55.73 54.36 2qr5 s ARG 334 Cb -0.02 0.41 -0.04 0.00 -0.57 0.00 0.00 34.95 34.73 2qr5 s ARG 334 CO -0.02 -0.35 0.10 -1.17 -1.08 0.00 0.00 175.30 172.78 2qr5 s LEU 335 N -2.84 3.96 0.22 -1.89 2.96 -1.26 -0.55 118.68 119.29 2qr5 s LEU 335 Ca 0.04 0.10 0.11 0.00 -0.22 0.00 0.00 54.13 54.16 2qr5 s LEU 335 Cb 0.03 -2.03 -0.05 0.00 0.50 0.00 0.00 46.19 44.65 2qr5 s LEU 335 CO -0.11 0.13 -0.20 0.68 -1.32 0.00 0.00 176.35 175.53 2qr5 s VAL 336 N 0.64 2.21 -0.29 1.68 -7.23 -0.05 -4.97 120.40 112.40 2qr5 s VAL 336 Ca 0.06 -2.18 -0.03 0.00 -1.81 0.00 0.00 61.98 58.02 2qr5 s VAL 336 Cb -0.13 -2.12 0.03 0.00 0.56 0.00 0.00 36.38 34.72 2qr5 s VAL 336 CO 0.01 -0.33 0.01 0.26 -0.31 0.00 0.00 175.10 174.75 2qr5 s TRP 337 N -2.24 3.17 -0.21 2.82 0.52 -1.26 -0.47 118.94 121.27 2qr5 s TRP 337 Ca 0.23 -1.52 -0.11 0.00 0.02 0.00 0.00 56.10 54.72 2qr5 s TRP 337 Cb -0.05 -2.15 -0.05 0.00 -1.15 0.00 0.00 33.47 30.07 2qr5 s TRP 337 CO 0.11 -0.72 0.18 0.08 0.02 0.00 0.00 176.95 176.62 2qr5 s VAL 338 N 1.35 5.36 -0.03 4.03 1.01 -0.58 -4.83 120.40 126.71 2qr5 s VAL 338 Ca -0.01 0.27 -0.30 0.00 0.00 0.00 0.00 61.98 61.94 2qr5 s VAL 338 Cb -0.18 -3.52 -0.06 0.00 0.00 0.00 0.00 36.38 32.61 2qr5 s VAL 338 CO -0.01 0.38 1.67 -0.70 0.00 0.00 0.00 175.10 176.44 2qr5 s GLU 339 N 0.76 4.18 0.18 2.72 2.12 -1.26 0.15 118.70 127.56 2qr5 s GLU 339 Ca 0.10 2.23 -0.00 0.00 0.36 0.00 0.00 54.97 57.66 2qr5 s GLU 339 Cb -0.13 -3.94 0.04 0.00 0.26 0.00 0.00 34.13 30.36 2qr5 s GLU 339 CO 0.02 -0.83 0.24 0.45 -0.54 0.00 0.00 175.26 174.60 2qr5 n SER 340 N 6.93 0.29 0.20 -1.70 2.88 0.13 -4.89 113.62 117.46 2qr5 n SER 340 Ca 0.17 -1.26 0.04 0.00 -1.33 0.00 0.00 58.87 56.49 2qr5 n SER 340 Cb 0.42 -0.16 0.41 0.00 -0.75 0.00 0.00 64.21 64.13 2qr5 n SER 340 CO 0.00 0.00 0.00 2.19 -1.23 0.00 0.00 175.04 176.00 2qr5 h PHE 341 N -0.49 0.00 -0.34 0.66 -5.15 -1.85 -2.54 116.94 107.23 2qr5 h PHE 341 Ca -0.08 0.00 -0.02 0.00 -0.20 0.00 0.00 57.97 57.67 2qr5 h PHE 341 Cb 0.29 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.44 2qr5 h PHE 341 CO 0.00 0.33 0.01 -0.40 -2.00 0.00 0.00 178.31 176.25 2qr5 n ASP 342 N -4.05 4.15 0.00 -0.68 5.68 -1.26 -4.95 116.55 115.45 2qr5 n ASP 342 Ca -0.02 -3.07 0.00 0.00 -0.50 0.00 0.00 54.79 51.20 2qr5 n ASP 342 Cb 0.38 -0.59 0.00 0.00 -1.14 0.00 0.00 41.12 39.77 2qr5 n ASP 342 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2qr5 n GLY 343 N -0.35 2.34 3.65 6.12 0.00 -0.96 -5.02 105.19 110.96 2qr5 n GLY 343 Ca 0.24 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.87 2qr5 n GLY 343 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2qr5 n SER 344 N 0.00 1.53 -4.66 1.61 7.64 -1.26 -4.66 113.62 113.81 2qr5 n SER 344 Ca 0.00 0.97 -0.36 0.00 1.01 0.00 0.00 58.87 60.49 2qr5 n SER 344 Cb 0.00 -1.42 -0.09 0.00 -1.01 0.00 0.00 64.21 61.69 2qr5 n SER 344 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2qr5 s ARG 345 N -2.39 4.07 -0.32 1.43 1.81 -1.26 0.19 118.95 122.49 2qr5 s ARG 345 Ca 0.68 -0.27 -0.14 0.00 -1.72 0.00 0.00 55.73 54.27 2qr5 s ARG 345 Cb -0.48 -3.47 -0.02 0.00 -0.45 0.00 0.00 34.95 30.53 2qr5 s ARG 345 CO 0.53 0.13 0.31 0.08 -0.68 0.00 0.00 175.30 175.67 2qr5 s VAL 346 N 0.84 5.22 -0.30 3.52 1.01 0.12 -4.85 120.40 125.96 2qr5 s VAL 346 Ca 0.07 0.10 -0.29 0.00 0.00 0.00 0.00 61.98 61.86 2qr5 s VAL 346 Cb -0.13 -3.73 0.01 0.00 0.00 0.00 0.00 36.38 32.53 2qr5 s VAL 346 CO 0.02 0.02 1.21 -2.16 0.00 0.00 0.00 175.10 174.19 2qr5 s PRO 347 N 1.92 3.99 -0.13 2.72 0.05 -1.26 -1.53 135.00 140.76 2qr5 s PRO 347 Ca 0.10 1.19 0.03 0.00 0.05 0.00 0.00 61.00 62.38 2qr5 s PRO 347 Cb -0.16 -3.82 0.01 0.00 0.05 0.00 0.00 34.50 30.58 2qr5 s PRO 347 CO 0.11 -1.01 -0.22 0.99 0.05 0.00 0.00 177.00 176.92 2qr5 s THR 348 N 4.03 2.00 0.04 1.26 2.01 0.38 -1.60 115.64 123.76 2qr5 s THR 348 Ca 0.52 -0.95 -0.23 0.00 0.31 0.00 0.00 61.69 61.33 2qr5 s THR 348 Cb -0.15 -1.77 -0.06 0.00 0.01 0.00 0.00 72.50 70.53 2qr5 s THR 348 CO 0.20 0.54 0.69 -0.31 -0.69 0.00 0.00 174.62 175.04 2qr5 s TYR 349 N 0.75 3.74 -0.15 4.92 1.51 -0.65 -0.87 117.35 126.60 2qr5 s TYR 349 Ca -0.09 1.37 -0.01 0.00 -1.01 0.00 0.00 57.07 57.33 2qr5 s TYR 349 Cb -0.16 -2.71 -0.01 0.00 -0.11 0.00 0.00 41.96 38.97 2qr5 s TYR 349 CO -0.00 0.35 -0.11 0.08 -1.11 0.00 0.00 175.55 174.76 2qr5 s VAL 350 N -0.28 3.11 -0.33 0.71 1.01 0.29 -0.00 120.40 124.90 2qr5 s VAL 350 Ca 0.35 -0.63 -0.04 0.00 0.00 0.00 0.00 61.98 61.66 2qr5 s VAL 350 Cb -0.20 -2.33 0.05 0.00 0.00 0.00 0.00 36.38 33.90 2qr5 s VAL 350 CO 0.21 0.51 0.06 -0.22 0.00 0.00 0.00 175.10 175.66 2qr5 s LEU 351 N 0.58 4.20 0.03 3.92 2.96 0.11 -1.67 118.68 128.82 2qr5 s LEU 351 Ca -0.07 -1.27 -0.29 0.00 -0.22 0.00 0.00 54.13 52.27 2qr5 s LEU 351 Cb -0.15 -1.79 -0.04 0.00 0.50 0.00 0.00 46.19 44.70 2qr5 s LEU 351 CO 0.03 -0.31 0.94 -1.61 -1.32 0.00 0.00 176.35 174.07 2qr5 s GLU 352 N 1.31 4.59 0.13 1.98 2.02 0.37 -1.04 118.70 128.06 2qr5 s GLU 352 Ca -0.03 1.36 -0.24 0.00 0.02 0.00 0.00 54.97 56.08 2qr5 s GLU 352 Cb -0.20 -3.42 -0.07 0.00 0.10 0.00 0.00 34.13 30.53 2qr5 s GLU 352 CO 0.00 0.07 0.74 0.45 0.02 0.00 0.00 175.26 176.54 2qr5 s SER 353 N 0.59 7.31 0.05 -0.19 0.15 -1.26 -0.53 113.70 119.81 2qr5 s SER 353 Ca 0.48 1.55 0.21 0.00 0.70 0.00 0.00 55.95 58.90 2qr5 s SER 353 Cb -0.21 -2.47 0.88 0.00 -1.71 0.00 0.00 66.02 62.51 2qr5 s SER 353 CO 0.27 0.19 1.67 0.61 1.20 0.00 0.00 173.24 177.19 2qr5 n GLY 354 N 1.74 -1.26 0.78 9.45 0.00 0.60 -3.50 105.19 113.00 2qr5 n GLY 354 Ca -0.06 -0.05 0.07 0.00 0.00 0.00 0.00 46.02 45.98 2qr5 n GLY 354 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qr5 n ARG 355 N -1.66 2.93 -4.34 1.61 1.74 -1.26 -4.96 116.66 110.73 2qr5 n ARG 355 Ca 0.05 -2.28 -0.26 0.00 -0.77 0.00 0.00 57.85 54.58 2qr5 n ARG 355 Cb 0.25 -1.43 -0.13 0.00 -1.02 0.00 0.00 32.46 30.14 2qr5 n ARG 355 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qr5 s ALA 356 N -1.39 2.08 1.09 7.54 0.00 -1.23 -4.59 121.76 125.27 2qr5 s ALA 356 Ca 0.30 -1.35 -0.18 0.00 0.00 0.00 0.00 51.96 50.72 2qr5 s ALA 356 Cb 0.18 -0.31 0.25 0.00 0.00 0.00 0.00 23.12 23.25 2qr5 s ALA 356 CO 0.16 0.45 1.26 -1.25 0.00 0.00 0.00 175.76 176.38 2qr5 s PRO 357 N -1.98 -0.36 -0.12 0.00 0.04 -1.26 -4.90 135.00 126.41 2qr5 s PRO 357 Ca 0.10 -0.38 -0.02 0.00 0.04 0.00 0.00 61.00 60.74 2qr5 s PRO 357 Cb -0.10 -1.73 0.04 0.00 0.04 0.00 0.00 34.50 32.75 2qr5 s PRO 357 CO 0.05 -3.09 0.01 0.99 0.04 0.00 0.00 177.00 175.00 2qr5 s THR 358 N -3.59 0.48 0.65 1.26 2.01 -1.26 -2.64 115.64 112.55 2qr5 s THR 358 Ca 0.75 -0.18 -0.16 0.00 0.31 0.00 0.00 61.69 62.41 2qr5 s THR 358 Cb -0.04 -0.77 -0.00 0.00 0.01 0.00 0.00 72.50 71.70 2qr5 s THR 358 CO 0.54 0.08 1.16 -2.16 -0.69 0.00 0.00 174.62 173.56 2qr5 s PRO 359 N 1.91 2.69 0.22 4.92 0.04 -1.23 -5.06 135.00 138.49 2qr5 s PRO 359 Ca 0.03 1.63 -0.09 0.00 0.04 0.00 0.00 61.00 62.61 2qr5 s PRO 359 Cb -0.14 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.47 2qr5 s PRO 359 CO -0.07 -1.38 0.35 0.20 0.04 0.00 0.00 177.00 176.15 2qr5 s GLY 360 N -2.10 0.81 0.10 0.56 0.00 -0.03 -4.59 107.32 102.08 2qr5 s GLY 360 Ca 0.72 -1.14 -0.31 0.00 0.00 0.00 0.00 44.72 44.00 2qr5 s GLY 360 CO 0.39 -0.89 1.45 -4.14 0.00 0.00 0.00 173.10 169.91 2qr5 s PRO 361 N -4.06 4.28 -0.06 2.90 0.02 -1.26 -0.61 135.00 136.21 2qr5 s PRO 361 Ca 0.27 2.14 0.03 0.00 0.02 0.00 0.00 61.00 63.46 2qr5 s PRO 361 Cb 0.02 -3.33 0.01 0.00 0.02 0.00 0.00 34.50 31.22 2qr5 s PRO 361 CO 0.09 -0.52 -0.14 0.99 -0.33 0.00 0.00 177.00 177.08 2qr5 s THR 362 N 1.50 1.25 -0.20 0.99 2.01 -0.27 -1.45 115.64 119.47 2qr5 s THR 362 Ca 0.66 -0.58 -0.07 0.00 0.31 0.00 0.00 61.69 62.02 2qr5 s THR 362 Cb -0.37 -1.11 -0.04 0.00 0.01 0.00 0.00 72.50 70.99 2qr5 s THR 362 CO 0.30 0.38 0.06 -0.69 -0.69 0.00 0.00 174.62 173.97 2qr5 s VAL 363 N 0.39 4.55 -0.35 3.82 1.01 0.61 -0.94 120.40 129.48 2qr5 s VAL 363 Ca -0.10 -0.11 -0.24 0.00 0.00 0.00 0.00 61.98 61.53 2qr5 s VAL 363 Cb -0.14 -3.07 0.01 0.00 0.00 0.00 0.00 36.38 33.18 2qr5 s VAL 363 CO 0.03 0.42 0.83 -0.69 0.00 0.00 0.00 175.10 175.70 2qr5 s VAL 364 N 0.77 4.70 -0.30 2.92 1.01 0.11 -1.00 120.40 128.61 2qr5 s VAL 364 Ca 0.03 1.05 -0.08 0.00 0.00 0.00 0.00 61.98 62.98 2qr5 s VAL 364 Cb -0.14 -4.24 -0.00 0.00 0.00 0.00 0.00 36.38 32.01 2qr5 s VAL 364 CO 0.02 -0.43 0.12 -0.22 0.00 0.00 0.00 175.10 174.60 2qr5 s LEU 365 N 3.19 4.00 -0.51 3.92 2.96 0.29 -1.78 118.68 130.75 2qr5 s LEU 365 Ca 0.34 -0.60 -0.01 0.00 -0.22 0.00 0.00 54.13 53.64 2qr5 s LEU 365 Cb -0.13 -1.95 0.13 0.00 0.50 0.00 0.00 46.19 44.74 2qr5 s LEU 365 CO 0.16 -0.19 0.29 0.68 -1.32 0.00 0.00 176.35 175.97 2qr5 s VAL 366 N 1.57 3.21 -0.11 1.68 -7.23 -0.09 -4.39 120.40 115.03 2qr5 s VAL 366 Ca 0.04 -2.68 0.00 0.00 -1.81 0.00 0.00 61.98 57.53 2qr5 s VAL 366 Cb -0.17 -3.17 -0.02 0.00 0.56 0.00 0.00 36.38 33.58 2qr5 s VAL 366 CO 0.05 -0.77 -0.12 0.00 -0.31 0.00 0.00 175.10 173.94 2qr5 s ALA 367 N 0.37 2.68 0.00 1.32 0.00 -1.26 -1.96 121.76 122.91 2qr5 s ALA 367 Ca 0.14 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 51.19 2qr5 s ALA 367 Cb -0.22 -1.18 0.00 0.00 0.00 0.00 0.00 23.12 21.72 2qr5 s ALA 367 CO -0.04 0.33 0.00 0.41 0.00 0.00 0.00 175.76 176.47 2qr5 n GLY 368 N 3.18 -1.70 0.00 0.00 0.00 0.05 -4.85 105.19 101.86 2qr5 n GLY 368 Ca -0.18 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.15 2qr5 n GLY 368 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qr5 n GLY 369 N 0.00 0.11 3.34 -0.02 0.00 -1.26 -2.50 105.19 104.86 2qr5 n GLY 369 Ca 0.00 -1.84 -0.28 0.00 0.00 0.00 0.00 46.02 43.90 2qr5 n GLY 369 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qr5 n PRO 370 N 0.26 -2.43 -1.30 1.61 -0.04 -1.26 -4.14 135.00 127.70 2qr5 n PRO 370 Ca 0.00 -1.71 -0.10 0.00 -0.04 0.00 0.00 63.50 61.65 2qr5 n PRO 370 Cb 0.00 -1.44 -0.04 0.00 -0.04 0.00 0.00 33.50 31.98 2qr5 n PRO 370 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2qr5 n PHE 371 N -4.38 0.00 -3.21 0.54 0.99 0.16 -5.00 117.46 106.57 2qr5 n PHE 371 Ca 0.14 0.00 -0.20 0.00 -0.00 0.00 0.00 57.45 57.39 2qr5 n PHE 371 Cb 0.54 -2.33 0.05 0.00 -1.00 0.00 0.00 39.48 36.74 2qr5 n PHE 371 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2qr5 n ALA 372 N 1.19 1.14 -3.17 4.37 0.00 -1.26 -4.28 120.51 118.50 2qr5 n ALA 372 Ca -0.10 -2.08 -0.13 0.00 0.00 0.00 0.00 53.44 51.13 2qr5 n ALA 372 Cb 0.47 0.63 -0.12 0.00 0.00 0.00 0.00 19.45 20.42 2qr5 n ALA 372 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2qr5 s GLU 373 N -4.50 0.20 -0.48 0.00 2.12 -1.26 -0.72 118.70 114.06 2qr5 s GLU 373 Ca 0.54 0.28 -0.21 0.00 0.36 0.00 0.00 54.97 55.94 2qr5 s GLU 373 Cb -0.04 0.06 0.04 0.00 0.26 0.00 0.00 34.13 34.45 2qr5 s GLU 373 CO 0.34 -0.05 0.70 -0.51 -0.54 0.00 0.00 175.26 175.20 2qr5 s ASP 374 N 0.28 6.30 0.39 -1.70 1.01 -1.26 -5.01 116.67 116.67 2qr5 s ASP 374 Ca -0.01 -0.52 0.01 0.00 0.71 0.00 0.00 52.55 52.73 2qr5 s ASP 374 Cb -0.03 -2.33 -0.00 0.00 1.01 0.00 0.00 42.92 41.57 2qr5 s ASP 374 CO -0.01 -0.90 0.03 -1.54 0.21 0.00 0.00 175.17 172.95 2qr5 n SER 375 N 6.46 2.71 -4.21 0.27 3.41 -1.26 -4.69 113.62 116.31 2qr5 n SER 375 Ca -0.02 -2.79 -0.42 0.00 -0.26 0.00 0.00 58.87 55.38 2qr5 n SER 375 Cb 0.47 0.41 -0.01 0.00 -0.26 0.00 0.00 64.21 64.82 2qr5 n SER 375 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2qr5 n ASP 376 N -1.33 4.28 -3.87 4.04 2.03 -0.04 -4.80 116.55 116.87 2qr5 n ASP 376 Ca -0.14 -2.86 -0.11 0.00 0.52 0.00 0.00 54.79 52.19 2qr5 n ASP 376 Cb 0.51 -1.68 -0.11 0.00 -0.72 0.00 0.00 41.12 39.12 2qr5 n ASP 376 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2qr5 s SER 377 N 4.05 0.00 0.25 1.67 0.01 -1.26 -3.08 113.70 115.34 2qr5 s SER 377 Ca 0.53 -0.08 -0.31 0.00 1.31 0.00 0.00 55.95 57.40 2qr5 s SER 377 Cb 0.08 0.20 -0.13 0.00 0.21 0.00 0.00 66.02 66.38 2qr5 s SER 377 CO 0.02 -0.22 1.42 1.87 0.41 0.00 0.00 173.24 176.74 2qr5 n TRP 378 N 2.12 2.24 -3.73 2.43 -0.00 -0.06 -3.96 117.44 116.48 2qr5 n TRP 378 Ca -0.19 0.42 -0.22 0.00 -0.00 0.00 0.00 57.50 57.51 2qr5 n TRP 378 Cb 0.57 -2.47 -0.18 0.00 -0.00 0.00 0.00 31.31 29.23 2qr5 n TRP 378 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 2qr5 s ASP 379 N 0.27 1.55 0.28 5.87 -1.08 -1.26 -4.98 116.67 117.31 2qr5 s ASP 379 Ca 0.67 -0.09 0.05 0.00 -0.52 0.00 0.00 52.55 52.66 2qr5 s ASP 379 Cb -0.63 -0.35 0.40 0.00 -1.46 0.00 0.00 42.92 40.88 2qr5 s ASP 379 CO 0.50 -0.22 1.67 0.74 0.52 0.00 0.00 175.17 178.38 2qr5 h THR 380 N 6.37 1.32 -0.14 1.71 2.02 -1.94 -1.30 112.91 120.95 2qr5 h THR 380 Ca -0.17 -1.57 -0.01 0.00 0.77 0.00 0.00 66.41 65.43 2qr5 h THR 380 Cb 1.12 1.70 -0.01 0.00 -1.74 0.00 0.00 68.15 69.22 2qr5 h THR 380 CO 0.23 0.47 0.06 -0.26 0.37 0.00 0.00 175.52 176.40 2qr5 h PHE 381 N 0.24 0.20 0.10 3.16 -1.00 -1.98 -1.68 116.94 115.97 2qr5 h PHE 381 Ca 0.02 -0.01 -0.00 0.00 2.81 0.00 0.00 57.97 60.78 2qr5 h PHE 381 Cb 0.86 -0.06 0.00 0.00 3.61 0.00 0.00 35.95 40.36 2qr5 h PHE 381 CO 0.02 0.25 -0.05 0.00 -1.61 0.00 0.00 178.31 176.92 2qr5 h ALA 382 N 0.93 -0.13 -0.83 2.45 0.00 -1.94 -0.19 119.26 119.53 2qr5 h ALA 382 Ca 0.05 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2qr5 h ALA 382 Cb 0.13 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2qr5 h ALA 382 CO -0.01 -0.56 0.55 0.00 0.00 0.00 0.00 179.25 179.24 2qr5 h ALA 383 N 0.73 1.06 0.00 0.00 0.00 -1.22 -0.55 119.26 119.28 2qr5 h ALA 383 Ca -0.01 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 2qr5 h ALA 383 Cb 0.13 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2qr5 h ALA 383 CO 0.02 0.45 -0.54 0.66 0.00 0.00 0.00 179.25 179.84 2qr5 h SER 384 N 1.12 0.00 -0.22 0.00 4.64 -1.01 -0.29 113.55 117.79 2qr5 h SER 384 Ca 0.31 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.52 2qr5 h SER 384 Cb -0.11 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 61.97 2qr5 h SER 384 CO -0.07 0.54 -0.29 -0.07 -0.87 0.00 0.00 176.83 176.08 2qr5 h LEU 385 N 0.00 0.63 -0.98 5.97 3.38 -0.20 -2.55 115.31 121.56 2qr5 h LEU 385 Ca -0.01 -0.51 0.08 0.00 0.09 0.00 0.00 57.88 57.54 2qr5 h LEU 385 Cb 1.13 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.63 2qr5 h LEU 385 CO 0.07 1.01 0.62 0.00 0.09 0.00 0.00 178.44 180.23 2qr5 h ALA 386 N 0.64 1.38 0.00 1.53 0.00 -0.82 0.10 119.26 122.09 2qr5 h ALA 386 Ca 0.03 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2qr5 h ALA 386 Cb 0.86 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2qr5 h ALA 386 CO 0.07 0.37 -0.40 0.00 0.00 0.00 0.00 179.25 179.29 2qr5 h ALA 387 N 1.46 1.15 -0.25 0.00 0.00 -1.00 -2.65 119.26 117.97 2qr5 h ALA 387 Ca 0.44 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2qr5 h ALA 387 Cb 0.23 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2qr5 h ALA 387 CO -0.19 0.49 0.00 0.00 0.00 0.00 0.00 179.25 179.55 2qr5 n ALA 388 N -2.37 2.49 -0.73 0.00 0.00 -0.84 -4.91 120.51 114.14 2qr5 n ALA 388 Ca -0.01 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.82 2qr5 n ALA 388 Cb 0.47 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.88 2qr5 n ALA 388 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qr5 n GLY 389 N 1.16 1.14 3.38 0.00 0.00 -0.91 -5.00 105.19 104.95 2qr5 n GLY 389 Ca 0.15 -0.41 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 2qr5 n GLY 389 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qr5 s PHE 390 N -2.00 2.69 0.47 1.61 0.40 0.30 -4.48 117.98 116.97 2qr5 s PHE 390 Ca 0.00 -0.50 -0.23 0.00 -0.60 0.00 0.00 56.93 55.60 2qr5 s PHE 390 Cb 0.00 -1.71 -0.07 0.00 0.51 0.00 0.00 43.02 41.75 2qr5 s PHE 390 CO 0.00 -0.08 1.18 -1.01 0.70 0.00 0.00 175.22 176.02 2qr5 s HIS 391 N -0.14 2.81 -0.07 0.36 3.76 -0.53 -2.64 115.29 118.84 2qr5 s HIS 391 Ca -0.02 1.52 0.05 0.00 -0.15 0.00 0.00 55.06 56.46 2qr5 s HIS 391 Cb -0.14 -3.42 -0.00 0.00 1.11 0.00 0.00 32.58 30.13 2qr5 s HIS 391 CO 0.04 -1.65 -0.22 0.08 -0.85 0.00 0.00 174.74 172.14 2qr5 s VAL 392 N -1.53 1.82 -0.13 -0.90 1.01 -0.21 -0.28 120.40 120.18 2qr5 s VAL 392 Ca 0.65 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.73 2qr5 s VAL 392 Cb -0.30 -1.57 0.02 0.00 0.00 0.00 0.00 36.38 34.53 2qr5 s VAL 392 CO 0.36 0.51 -0.16 -0.69 0.00 0.00 0.00 175.10 175.11 2qr5 s VAL 393 N 0.15 1.64 -0.51 2.92 1.01 -0.17 -0.71 120.40 124.73 2qr5 s VAL 393 Ca -0.10 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 61.20 2qr5 s VAL 393 Cb -0.15 -1.50 0.15 0.00 0.00 0.00 0.00 36.38 34.88 2qr5 s VAL 393 CO 0.05 0.47 0.31 -0.04 0.00 0.00 0.00 175.10 175.90 2qr5 s MET 394 N 1.11 1.65 -0.03 2.72 -1.94 0.99 -0.54 119.30 123.26 2qr5 s MET 394 Ca -0.03 -2.45 -0.22 0.00 -1.71 0.00 0.00 55.69 51.28 2qr5 s MET 394 Cb -0.14 -2.67 -0.05 0.00 2.01 0.00 0.00 34.83 33.98 2qr5 s MET 394 CO -0.05 -1.21 0.66 -1.25 -0.01 0.00 0.00 175.02 173.16 2qr5 s PRO 395 N -0.22 4.40 -1.34 2.03 0.04 -1.26 -1.63 135.00 137.01 2qr5 s PRO 395 Ca 0.21 0.83 -0.16 0.00 0.04 0.00 0.00 61.00 61.92 2qr5 s PRO 395 Cb -0.17 -3.39 0.03 0.00 0.04 0.00 0.00 34.50 31.01 2qr5 s PRO 395 CO -0.06 0.22 2.05 0.09 0.04 0.00 0.00 177.00 179.35 2qr5 n ASN 396 N 3.20 4.02 -4.61 6.66 3.02 -0.63 -4.87 115.26 122.05 2qr5 n ASN 396 Ca -0.04 -2.84 -0.34 0.00 -0.03 0.00 0.00 54.58 51.33 2qr5 n ASN 396 Cb 0.51 -1.64 0.12 0.00 -0.61 0.00 0.00 39.78 38.15 2qr5 n ASN 396 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qr5 n TYR 397 N 7.19 0.51 -1.63 3.10 0.18 -1.26 -4.33 117.16 120.92 2qr5 n TYR 397 Ca 0.51 0.37 -0.47 0.00 1.88 0.00 0.00 57.90 60.19 2qr5 n TYR 397 Cb 0.41 -2.03 -0.03 0.00 -0.38 0.00 0.00 39.34 37.31 2qr5 n TYR 397 CO 0.00 0.00 0.00 2.89 -2.08 0.00 0.00 176.86 177.67 2qr5 n ARG 398 N -2.55 1.65 0.00 -3.48 1.85 -1.26 -0.84 116.66 112.02 2qr5 n ARG 398 Ca 0.12 0.59 0.00 0.00 -1.00 0.00 0.00 57.85 57.56 2qr5 n ARG 398 Cb 0.51 -2.17 0.00 0.00 -1.05 0.00 0.00 32.46 29.74 2qr5 n ARG 398 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2qr5 n GLY 399 N 2.10 2.02 3.84 2.89 0.00 -0.49 -4.52 105.19 111.03 2qr5 n GLY 399 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 2qr5 n GLY 399 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qr5 s SER 400 N -1.64 5.60 0.52 1.61 0.01 -0.02 0.39 113.70 120.18 2qr5 s SER 400 Ca 0.00 1.48 0.08 0.00 1.31 0.00 0.00 55.95 58.82 2qr5 s SER 400 Cb 0.00 -2.40 0.06 0.00 0.21 0.00 0.00 66.02 63.89 2qr5 s SER 400 CO 0.00 -1.28 0.71 0.28 0.41 0.00 0.00 173.24 173.36 2qr5 s THR 401 N -3.13 2.51 0.00 1.44 -1.32 0.10 -3.58 115.64 111.66 2qr5 s THR 401 Ca 0.57 -0.97 0.00 0.00 -1.21 0.00 0.00 61.69 60.09 2qr5 s THR 401 Cb -0.13 -2.54 0.00 0.00 -1.51 0.00 0.00 72.50 68.32 2qr5 s THR 401 CO 0.54 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.56 2qr5 n GLY 402 N -2.12 0.41 0.16 6.08 0.00 -1.26 -4.61 105.19 103.84 2qr5 n GLY 402 Ca 0.12 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.18 2qr5 n GLY 402 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2qr5 n TYR 403 N -1.79 0.00 0.00 1.61 4.02 -1.26 -4.49 117.16 115.25 2qr5 n TYR 403 Ca 0.00 -0.45 0.00 0.00 -0.01 0.00 0.00 57.90 57.44 2qr5 n TYR 403 Cb 0.00 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 39.24 2qr5 n TYR 403 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2qr5 n GLY 404 N -0.61 2.34 0.34 2.72 0.00 -1.25 -4.64 105.19 104.10 2qr5 n GLY 404 Ca 0.06 -2.00 -0.04 0.00 0.00 0.00 0.00 46.02 44.03 2qr5 n GLY 404 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2qr5 h GLU 405 N 0.00 1.19 0.24 1.61 4.57 -0.71 -2.69 114.58 118.79 2qr5 h GLU 405 Ca 0.00 -0.13 -0.01 0.00 -1.18 0.00 0.00 59.36 58.03 2qr5 h GLU 405 Cb 0.00 -0.23 0.00 0.00 -0.16 0.00 0.00 28.75 28.36 2qr5 h GLU 405 CO 0.00 0.87 -0.11 1.49 -1.18 0.00 0.00 179.01 180.07 2qr5 h GLU 406 N 1.19 -0.31 -0.64 1.92 4.81 -1.75 -0.70 114.58 119.11 2qr5 h GLU 406 Ca 0.30 0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.57 2qr5 h GLU 406 Cb 0.02 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.43 2qr5 h GLU 406 CO -0.05 -0.13 0.41 2.35 -0.73 0.00 0.00 179.01 180.86 2qr5 h TRP 407 N -0.41 0.77 -0.35 0.92 -0.00 -1.79 -2.39 115.95 112.70 2qr5 h TRP 407 Ca -0.03 0.02 -0.01 0.00 -0.00 0.00 0.00 58.89 58.87 2qr5 h TRP 407 Cb 0.32 -0.26 -0.02 0.00 -0.00 0.00 0.00 29.16 29.20 2qr5 h TRP 407 CO -0.03 0.47 0.17 -0.09 -0.00 0.00 0.00 178.44 178.96 2qr5 h ARG 408 N 0.82 0.47 -0.01 2.65 2.43 -1.21 -1.26 114.38 118.28 2qr5 h ARG 408 Ca 0.24 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.37 2qr5 h ARG 408 Cb -0.05 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.41 2qr5 h ARG 408 CO -0.07 0.36 -0.35 1.28 -1.51 0.00 0.00 179.97 179.68 2qr5 n LEU 409 N -4.43 1.30 0.29 3.80 4.77 -0.29 -3.68 117.00 118.76 2qr5 n LEU 409 Ca 0.02 -0.40 0.17 0.00 -0.03 0.00 0.00 56.01 55.77 2qr5 n LEU 409 Cb 0.11 -0.09 0.90 0.00 -2.33 0.00 0.00 43.42 42.01 2qr5 n LEU 409 CO 0.36 0.25 1.06 0.11 -1.33 0.00 0.00 177.39 177.84 2qr5 h LYS 410 N 1.50 0.00 0.00 3.23 1.57 -1.37 -2.12 116.57 119.38 2qr5 h LYS 410 Ca 0.00 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 2qr5 h LYS 410 Cb 0.58 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.88 2qr5 h LYS 410 CO 0.00 0.04 -0.42 0.97 -0.57 0.00 0.00 179.45 179.47 2qr5 h ILE 411 N 0.00 0.92 -2.17 1.86 2.10 -1.79 -3.43 117.51 114.99 2qr5 h ILE 411 Ca -0.00 -1.71 -0.57 0.00 1.08 0.00 0.00 64.86 63.67 2qr5 h ILE 411 Cb 0.25 2.04 0.02 0.00 -1.09 0.00 0.00 36.82 38.03 2qr5 h ILE 411 CO 0.01 0.41 1.25 -0.38 -1.08 0.00 0.00 178.15 178.35 2qr5 n ILE 412 N -3.48 0.64 -0.70 2.19 2.08 -0.80 -0.36 119.36 118.94 2qr5 n ILE 412 Ca 0.00 -0.18 0.00 0.00 0.56 0.00 0.00 62.75 63.13 2qr5 n ILE 412 Cb 0.56 -2.22 0.00 0.00 -0.75 0.00 0.00 39.64 37.23 2qr5 n ILE 412 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2qr5 n GLY 413 N 4.76 0.77 2.54 7.39 0.00 0.11 -4.93 105.19 115.83 2qr5 n GLY 413 Ca 0.23 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.14 2qr5 n GLY 413 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2qr5 n ASP 414 N 0.00 0.69 -4.78 1.61 2.03 0.51 -4.85 116.55 111.76 2qr5 n ASP 414 Ca 0.00 -2.82 -0.36 0.00 0.52 0.00 0.00 54.79 52.13 2qr5 n ASP 414 Cb 0.00 -0.25 -0.03 0.00 -0.72 0.00 0.00 41.12 40.12 2qr5 n ASP 414 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2qr5 s PRO 415 N -2.38 4.00 -1.20 -0.67 0.04 -1.25 -3.01 135.00 130.54 2qr5 s PRO 415 Ca 0.30 1.55 -0.07 0.00 0.04 0.00 0.00 61.00 62.81 2qr5 s PRO 415 Cb 0.41 -2.43 -0.02 0.00 0.04 0.00 0.00 34.50 32.51 2qr5 s PRO 415 CO -0.01 -0.29 0.79 0.00 0.04 0.00 0.00 177.00 177.52 2qr5 n GLY 417 N -1.51 3.41 0.32 0.00 0.00 -1.16 -4.91 105.19 101.35 2qr5 n GLY 417 Ca -0.19 -0.43 -0.02 0.00 0.00 0.00 0.00 46.02 45.38 2qr5 n GLY 417 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2qr5 h GLY 418 N 0.00 1.23 1.69 -0.02 0.00 -1.93 -2.29 103.07 101.75 2qr5 h GLY 418 Ca 0.00 -0.42 -0.04 0.00 0.00 0.00 0.00 47.33 46.87 2qr5 h GLY 418 CO 0.00 0.36 -0.01 1.05 0.00 0.00 0.00 176.54 177.94 2qr5 h GLU 419 N 1.07 0.39 -0.19 4.80 9.09 -1.82 -0.01 114.58 127.92 2qr5 h GLU 419 Ca 0.34 -0.07 -0.14 0.00 0.05 0.00 0.00 59.36 59.53 2qr5 h GLU 419 Cb -0.01 -0.06 -0.01 0.00 -1.65 0.00 0.00 28.75 27.02 2qr5 h GLU 419 CO -0.11 0.43 -0.48 1.25 0.05 0.00 0.00 179.01 180.15 2qr5 h LEU 420 N 0.38 0.53 -1.28 3.06 5.85 -1.78 -0.90 115.31 121.17 2qr5 h LEU 420 Ca 0.09 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 58.52 2qr5 h LEU 420 Cb 0.28 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 2qr5 h LEU 420 CO 0.01 0.93 0.19 -0.33 -0.34 0.00 0.00 178.44 178.90 2qr5 h GLU 421 N 0.39 0.69 -0.41 1.25 4.39 -0.80 -0.06 114.58 120.02 2qr5 h GLU 421 Ca 0.02 -0.10 -0.11 0.00 0.34 0.00 0.00 59.36 59.52 2qr5 h GLU 421 Cb 0.99 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.50 2qr5 h GLU 421 CO 0.09 0.57 -0.16 -0.44 -1.16 0.00 0.00 179.01 177.90 2qr5 h ASP 422 N 0.69 0.86 -0.32 1.42 3.32 -0.20 0.32 116.42 122.50 2qr5 h ASP 422 Ca 0.17 -0.39 -0.07 0.00 0.02 0.00 0.00 57.03 56.76 2qr5 h ASP 422 Cb 0.14 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 2qr5 h ASP 422 CO -0.02 1.06 -0.06 0.58 -1.72 0.00 0.00 179.24 179.08 2qr5 h VAL 423 N 0.66 1.27 -0.71 -1.35 2.07 -0.96 -2.12 116.25 115.10 2qr5 h VAL 423 Ca 0.10 -1.09 -0.07 0.00 0.82 0.00 0.00 66.70 66.46 2qr5 h VAL 423 Cb 0.71 1.32 -0.03 0.00 -1.52 0.00 0.00 31.29 31.78 2qr5 h VAL 423 CO 0.05 0.35 0.19 0.28 0.02 0.00 0.00 177.57 178.47 2qr5 h SER 424 N 0.39 1.07 -0.99 0.57 0.02 -0.92 -2.09 113.55 111.60 2qr5 h SER 424 Ca 0.08 -0.22 0.03 0.00 -0.84 0.00 0.00 61.79 60.85 2qr5 h SER 424 Cb 0.54 -0.28 -0.06 0.00 0.14 0.00 0.00 62.40 62.74 2qr5 h SER 424 CO 0.03 1.01 0.65 0.00 -1.14 0.00 0.00 176.83 177.37 2qr5 h ALA 425 N 1.12 1.30 -0.51 3.77 0.00 -0.74 0.60 119.26 124.81 2qr5 h ALA 425 Ca 0.23 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 2qr5 h ALA 425 Cb 0.35 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2qr5 h ALA 425 CO -0.00 0.54 -0.09 0.00 0.00 0.00 0.00 179.25 179.71 2qr5 h ALA 426 N 1.40 0.88 -0.13 0.00 0.00 -1.11 -1.00 119.26 119.31 2qr5 h ALA 426 Ca 0.39 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2qr5 h ALA 426 Cb -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2qr5 h ALA 426 CO -0.12 0.64 0.04 0.00 0.00 0.00 0.00 179.25 179.81 2qr5 h ALA 427 N 1.06 0.17 -0.46 0.00 0.00 -0.75 -2.00 119.26 117.28 2qr5 h ALA 427 Ca 0.14 -0.12 0.08 0.00 0.00 0.00 0.00 54.91 55.01 2qr5 h ALA 427 Cb 0.61 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.29 2qr5 h ALA 427 CO 0.04 -0.22 0.05 0.00 0.00 0.00 0.00 179.25 179.12 2qr5 h ARG 428 N 0.03 0.16 -0.65 0.00 -0.00 -0.75 -2.39 114.38 110.78 2qr5 h ARG 428 Ca 0.04 -0.01 -0.03 0.00 -0.50 0.00 0.00 59.98 59.48 2qr5 h ARG 428 Cb 0.22 -0.04 -0.03 0.00 0.00 0.00 0.00 29.97 30.12 2qr5 h ARG 428 CO -0.00 0.11 0.29 2.35 0.00 0.00 0.00 179.97 182.72 2qr5 h TRP 429 N 0.17 0.92 -0.86 3.04 7.01 -1.10 0.13 115.95 125.26 2qr5 h TRP 429 Ca 0.23 -0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.19 2qr5 h TRP 429 Cb 0.32 -0.29 -0.04 0.00 -2.10 0.00 0.00 29.16 27.05 2qr5 h TRP 429 CO -0.25 0.69 0.55 0.00 -2.79 0.00 0.00 178.44 176.63 2qr5 h ALA 430 N 1.40 1.35 0.09 2.65 0.00 -0.86 -0.09 119.26 123.81 2qr5 h ALA 430 Ca 0.22 -0.07 -0.21 0.00 0.00 0.00 0.00 54.91 54.85 2qr5 h ALA 430 Cb 0.12 -0.35 0.02 0.00 0.00 0.00 0.00 17.79 17.59 2qr5 h ALA 430 CO -0.03 0.58 -0.88 -0.09 0.00 0.00 0.00 179.25 178.84 2qr5 h ARG 431 N 1.17 0.43 -0.44 0.00 2.43 -1.07 0.13 114.38 117.04 2qr5 h ARG 431 Ca 0.31 -0.59 -0.12 0.00 -0.81 0.00 0.00 59.98 58.77 2qr5 h ARG 431 Cb -0.10 0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 2qr5 h ARG 431 CO -0.06 1.24 -0.19 0.93 -1.51 0.00 0.00 179.97 180.38 2qr5 h GLU 432 N -0.09 0.90 0.00 0.20 3.07 -0.45 -3.08 114.58 115.12 2qr5 h GLU 432 Ca -0.14 -0.38 0.00 0.00 -0.50 0.00 0.00 59.36 58.34 2qr5 h GLU 432 Cb 1.62 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 29.50 2qr5 h GLU 432 CO 0.17 1.03 0.00 -1.13 -1.40 0.00 0.00 179.01 177.68 2qr5 n SER 433 N -4.20 0.00 0.00 1.42 3.41 -0.07 -4.89 113.62 109.29 2qr5 n SER 433 Ca -0.01 0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.83 2qr5 n SER 433 Cb 0.43 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 2qr5 n SER 433 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qr5 n GLY 434 N 0.59 0.82 0.12 5.00 0.00 -1.17 -4.99 105.19 105.56 2qr5 n GLY 434 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 2qr5 n GLY 434 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2qr5 h LEU 435 N 0.00 0.52 -9.02 0.99 5.85 -1.41 -3.26 115.31 108.98 2qr5 h LEU 435 Ca 0.00 -0.94 -0.62 0.00 0.84 0.00 0.00 57.88 57.15 2qr5 h LEU 435 Cb 0.00 -0.17 -0.18 0.00 0.37 0.00 0.00 40.66 40.68 2qr5 h LEU 435 CO 0.00 1.46 -0.60 0.00 -0.34 0.00 0.00 178.44 178.96 2qr5 s ALA 436 N -2.46 3.27 -0.14 1.25 0.00 0.33 -0.85 121.76 123.16 2qr5 s ALA 436 Ca -0.13 -0.77 0.21 0.00 0.00 0.00 0.00 51.96 51.27 2qr5 s ALA 436 Cb 0.02 -1.78 -0.16 0.00 0.00 0.00 0.00 23.12 21.20 2qr5 s ALA 436 CO 0.84 0.21 0.75 -1.13 0.00 0.00 0.00 175.76 176.43 2qr5 n SER 437 N 3.48 0.50 -3.62 0.00 3.41 0.22 -4.51 113.62 113.10 2qr5 n SER 437 Ca -0.17 0.20 -0.16 0.00 -0.26 0.00 0.00 58.87 58.48 2qr5 n SER 437 Cb 0.52 0.98 -0.07 0.00 -0.26 0.00 0.00 64.21 65.38 2qr5 n SER 437 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2qr5 s GLU 438 N -3.29 0.87 -0.00 4.33 -1.05 -1.25 -4.98 118.70 113.32 2qr5 s GLU 438 Ca -0.04 0.27 0.07 0.00 -0.15 0.00 0.00 54.97 55.12 2qr5 s GLU 438 Cb 0.11 0.41 -0.03 0.00 -0.44 0.00 0.00 34.13 34.18 2qr5 s GLU 438 CO 0.84 -0.23 -0.21 -0.51 0.95 0.00 0.00 175.26 176.09 2qr5 s LEU 439 N -0.87 2.38 0.17 1.83 1.43 -1.26 -1.11 118.68 121.25 2qr5 s LEU 439 Ca -0.09 -0.41 0.03 0.00 -1.03 0.00 0.00 54.13 52.63 2qr5 s LEU 439 Cb -0.02 -1.43 -0.05 0.00 0.03 0.00 0.00 46.19 44.72 2qr5 s LEU 439 CO 0.06 0.30 -0.04 -0.31 0.23 0.00 0.00 176.35 176.60 2qr5 s TYR 440 N -0.75 1.25 -0.04 0.29 1.51 -0.12 0.28 117.35 119.77 2qr5 s TYR 440 Ca 0.12 -0.92 0.03 0.00 -1.01 0.00 0.00 57.07 55.30 2qr5 s TYR 440 Cb -0.10 -0.70 0.00 0.00 -0.11 0.00 0.00 41.96 41.05 2qr5 s TYR 440 CO 0.01 -0.09 -0.14 -1.50 -1.11 0.00 0.00 175.55 172.72 2qr5 s ILE 441 N -3.52 1.19 -0.03 2.71 2.07 -1.08 0.09 121.20 122.63 2qr5 s ILE 441 Ca 0.21 -0.57 0.02 0.00 -1.41 0.00 0.00 60.65 58.90 2qr5 s ILE 441 Cb 0.05 -1.04 0.01 0.00 0.13 0.00 0.00 42.46 41.61 2qr5 s ILE 441 CO 0.03 0.35 -0.07 -0.32 -1.91 0.00 0.00 174.94 173.02 2qr5 s MET 442 N 0.19 0.89 -0.00 3.50 -2.45 -0.74 -1.36 119.30 119.33 2qr5 s MET 442 Ca -0.05 -0.21 -0.08 0.00 -1.25 0.00 0.00 55.69 54.10 2qr5 s MET 442 Cb -0.11 -0.85 0.00 0.00 1.25 0.00 0.00 34.83 35.12 2qr5 s MET 442 CO 0.02 0.02 0.15 0.20 1.05 0.00 0.00 175.02 176.46 2qr5 s GLY 443 N 0.51 0.02 0.02 2.11 0.00 -0.26 -0.92 107.32 108.80 2qr5 s GLY 443 Ca -0.07 -0.06 0.06 0.00 0.00 0.00 0.00 44.72 44.65 2qr5 s GLY 443 CO 0.01 -0.20 -0.18 -0.47 0.00 0.00 0.00 173.10 172.26 2qr5 s TYR 444 N -1.28 1.56 0.00 1.90 5.04 -0.83 -0.18 117.35 123.56 2qr5 s TYR 444 Ca -0.14 -0.33 0.00 0.00 -2.44 0.00 0.00 57.07 54.16 2qr5 s TYR 444 Cb -0.07 -0.96 0.00 0.00 0.35 0.00 0.00 41.96 41.28 2qr5 s TYR 444 CO 0.02 0.03 0.00 0.45 -1.34 0.00 0.00 175.55 174.70 2qr5 n SER 445 N 2.23 0.00 0.07 4.32 2.88 -0.20 -0.28 113.62 122.65 2qr5 n SER 445 Ca -0.16 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.42 2qr5 n SER 445 Cb 0.54 0.00 0.45 0.00 -0.75 0.00 0.00 64.21 64.45 2qr5 n SER 445 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 2qr5 h TYR 446 N 0.00 0.37 -0.90 0.66 3.20 -1.69 0.57 116.97 119.18 2qr5 h TYR 446 Ca 0.00 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 61.92 2qr5 h TYR 446 Cb 0.00 -0.12 -0.06 0.00 1.54 0.00 0.00 36.73 38.10 2qr5 h TYR 446 CO 0.00 0.28 0.58 0.78 -1.64 0.00 0.00 178.16 178.17 2qr5 h GLY 447 N 0.50 1.29 0.91 1.82 0.00 -0.33 -0.58 103.07 106.68 2qr5 h GLY 447 Ca 0.10 -0.42 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 2qr5 h GLY 447 CO -0.01 0.33 0.10 -1.33 0.00 0.00 0.00 176.54 175.63 2qr5 h GLY 448 N 1.06 0.42 -0.21 4.60 0.00 -0.83 -0.09 103.07 108.02 2qr5 h GLY 448 Ca 0.37 -0.23 0.11 0.00 0.00 0.00 0.00 47.33 47.59 2qr5 h GLY 448 CO -0.13 0.22 -0.18 -1.82 0.00 0.00 0.00 176.54 174.63 2qr5 h TYR 449 N 0.27 -0.42 -0.68 5.60 3.20 -0.96 -2.17 116.97 121.82 2qr5 h TYR 449 Ca 0.09 0.06 0.01 0.00 3.14 0.00 0.00 58.73 62.02 2qr5 h TYR 449 Cb 0.18 0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.69 2qr5 h TYR 449 CO -0.01 -0.28 0.45 0.52 -1.64 0.00 0.00 178.16 177.20 2qr5 h MET 450 N -0.04 0.88 -0.16 1.82 2.86 -0.36 0.11 114.93 120.03 2qr5 h MET 450 Ca 0.27 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.86 2qr5 h MET 450 Cb 0.46 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 2qr5 h MET 450 CO -0.61 0.58 0.10 1.15 1.06 0.00 0.00 176.91 179.19 2qr5 h THR 451 N 0.90 1.05 -0.53 2.22 2.02 -0.46 -0.01 112.91 118.11 2qr5 h THR 451 Ca 0.25 -0.10 -0.08 0.00 0.77 0.00 0.00 66.41 67.26 2qr5 h THR 451 Cb -0.08 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 2qr5 h THR 451 CO -0.06 0.05 0.03 -0.07 0.37 0.00 0.00 175.52 175.83 2qr5 h LEU 452 N 0.20 0.84 -0.62 2.58 3.38 -0.79 -1.50 115.31 119.41 2qr5 h LEU 452 Ca 0.06 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.74 2qr5 h LEU 452 Cb -0.01 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2qr5 h LEU 452 CO -0.01 0.89 0.07 0.00 0.09 0.00 0.00 178.44 179.48 2qr5 h ALA 454 N 1.01 0.52 -0.37 0.00 0.00 -0.61 0.28 119.26 120.09 2qr5 h ALA 454 Ca 0.18 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.67 2qr5 h ALA 454 Cb 0.47 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2qr5 h ALA 454 CO 0.02 0.36 -0.27 -0.07 0.00 0.00 0.00 179.25 179.29 2qr5 h LEU 455 N 0.53 0.79 0.05 0.00 3.38 -1.28 0.48 115.31 119.26 2qr5 h LEU 455 Ca 0.10 -0.31 -0.24 0.00 0.09 0.00 0.00 57.88 57.52 2qr5 h LEU 455 Cb 0.58 -0.22 0.02 0.00 0.09 0.00 0.00 40.66 41.13 2qr5 h LEU 455 CO 0.03 1.02 -0.98 0.71 0.09 0.00 0.00 178.44 179.31 2qr5 h THR 456 N 0.66 1.33 0.00 0.22 1.35 -1.31 -3.31 112.91 111.85 2qr5 h THR 456 Ca 0.08 -2.29 -0.17 0.00 -0.55 0.00 0.00 66.41 63.49 2qr5 h THR 456 Cb 0.79 2.59 -0.03 0.00 -1.73 0.00 0.00 68.15 69.76 2qr5 h THR 456 CO 0.07 0.69 -1.64 0.23 -0.25 0.00 0.00 175.52 174.62 2qr5 n MET 457 N -3.94 0.64 -3.02 4.72 2.81 0.96 -4.45 117.12 114.83 2qr5 n MET 457 Ca -0.12 0.12 -0.22 0.00 -1.81 0.00 0.00 57.70 55.67 2qr5 n MET 457 Cb 0.86 -1.72 -0.03 0.00 -0.71 0.00 0.00 33.22 31.62 2qr5 n MET 457 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2qr5 n LYS 458 N -2.77 2.16 -1.76 0.03 4.01 0.17 -5.04 118.16 114.96 2qr5 n LYS 458 Ca -0.12 -4.13 -0.39 0.00 -0.51 0.00 0.00 58.31 53.15 2qr5 n LYS 458 Cb 0.84 -1.97 0.03 0.00 -0.51 0.00 0.00 35.03 33.42 2qr5 n LYS 458 CO 0.00 0.00 0.00 -0.35 -1.11 0.00 0.00 177.40 175.94 2qr5 n PRO 459 N -0.02 2.04 0.00 1.97 -0.04 -1.24 -2.07 135.00 135.64 2qr5 n PRO 459 Ca 0.28 0.74 0.00 0.00 -0.04 0.00 0.00 63.50 64.47 2qr5 n PRO 459 Cb 0.54 -2.62 0.00 0.00 -0.04 0.00 0.00 33.50 31.37 2qr5 n PRO 459 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qr5 n GLY 460 N 0.64 1.98 0.06 0.55 0.00 -1.26 -4.92 105.19 102.24 2qr5 n GLY 460 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 2qr5 n GLY 460 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2qr5 h LEU 461 N 0.00 0.02-10.11 0.99 5.85 -1.77 -3.45 115.31 106.83 2qr5 h LEU 461 Ca 0.00 -0.64 -0.48 0.00 0.84 0.00 0.00 57.88 57.60 2qr5 h LEU 461 Cb 0.00 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 2qr5 h LEU 461 CO 0.00 0.65 -0.45 -0.36 -0.34 0.00 0.00 178.44 177.94 2qr5 s PHE 462 N -3.67 3.39 0.09 1.25 0.40 -1.26 -4.74 117.98 113.45 2qr5 s PHE 462 Ca -0.17 -0.01 0.05 0.00 -0.60 0.00 0.00 56.93 56.20 2qr5 s PHE 462 Cb 0.00 -1.56 -0.23 0.00 0.51 0.00 0.00 43.02 41.75 2qr5 s PHE 462 CO 0.68 0.47 1.18 -0.22 0.70 0.00 0.00 175.22 178.03 2qr5 h LYS 463 N 1.41 0.07 -2.39 0.44 3.64 -0.50 -3.48 116.57 115.75 2qr5 h LYS 463 Ca -0.51 -0.12 0.10 0.00 -1.27 0.00 0.00 60.65 58.86 2qr5 h LYS 463 Cb 1.22 0.04 -0.14 0.00 -0.41 0.00 0.00 32.23 32.95 2qr5 h LYS 463 CO 0.62 1.01 0.45 0.00 -2.27 0.00 0.00 179.45 179.26 2qr5 s ALA 464 N -2.68 -1.76 0.07 5.00 0.00 -1.26 -4.26 121.76 116.87 2qr5 s ALA 464 Ca -0.01 0.79 0.01 0.00 0.00 0.00 0.00 51.96 52.75 2qr5 s ALA 464 Cb 0.09 0.52 -0.04 0.00 0.00 0.00 0.00 23.12 23.69 2qr5 s ALA 464 CO 0.84 -0.76 -0.06 0.20 0.00 0.00 0.00 175.76 175.98 2qr5 s GLY 465 N -2.59 0.63 -0.16 0.00 0.00 -0.88 -2.65 107.32 101.67 2qr5 s GLY 465 Ca 0.06 -1.14 0.00 0.00 0.00 0.00 0.00 44.72 43.64 2qr5 s GLY 465 CO -0.08 -1.23 -0.12 0.14 0.00 0.00 0.00 173.10 171.82 2qr5 s VAL 466 N -2.98 1.49 -0.27 1.40 1.01 -0.47 -0.97 120.40 119.61 2qr5 s VAL 466 Ca 0.04 -0.67 -0.02 0.00 0.00 0.00 0.00 61.98 61.33 2qr5 s VAL 466 Cb 0.01 -1.46 0.03 0.00 0.00 0.00 0.00 36.38 34.96 2qr5 s VAL 466 CO -0.04 0.36 -0.02 0.00 0.00 0.00 0.00 175.10 175.40 2qr5 s ALA 467 N 1.51 2.78 -0.15 5.51 0.00 0.65 -1.10 121.76 130.96 2qr5 s ALA 467 Ca 0.03 -1.58 -0.05 0.00 0.00 0.00 0.00 51.96 50.36 2qr5 s ALA 467 Cb -0.14 -1.84 -0.03 0.00 0.00 0.00 0.00 23.12 21.11 2qr5 s ALA 467 CO -0.10 -1.02 0.01 0.20 0.00 0.00 0.00 175.76 174.86 2qr5 s GLY 468 N 1.31 1.82 -1.24 0.00 0.00 0.74 -1.23 107.32 108.73 2qr5 s GLY 468 Ca -0.02 -0.79 -0.15 0.00 0.00 0.00 0.00 44.72 43.77 2qr5 s GLY 468 CO -0.02 -0.14 0.65 0.00 0.00 0.00 0.00 173.10 173.59 2qr5 n ALA 469 N 3.20 -2.36 -2.54 3.20 0.00 0.10 -1.03 120.51 121.08 2qr5 n ALA 469 Ca -0.17 -0.28 -0.21 0.00 0.00 0.00 0.00 53.44 52.77 2qr5 n ALA 469 Cb 0.53 -3.05 -0.00 0.00 0.00 0.00 0.00 19.45 16.92 2qr5 n ALA 469 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2qr5 s SER 470 N -3.81 6.04 -0.07 0.00 1.04 -1.26 -2.64 113.70 113.00 2qr5 s SER 470 Ca 0.30 0.11 -0.18 0.00 0.48 0.00 0.00 55.95 56.67 2qr5 s SER 470 Cb -0.12 -1.56 -0.05 0.00 0.10 0.00 0.00 66.02 64.39 2qr5 s SER 470 CO 0.88 -0.43 0.48 -0.69 0.98 0.00 0.00 173.24 174.46 2qr5 s VAL 471 N -2.28 5.10 0.00 5.02 1.01 -1.26 -4.80 120.40 123.19 2qr5 s VAL 471 Ca 0.43 0.97 0.00 0.00 0.00 0.00 0.00 61.98 63.39 2qr5 s VAL 471 Cb -0.10 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.47 2qr5 s VAL 471 CO 0.34 0.40 0.00 1.33 0.00 0.00 0.00 175.10 177.17 2qr5 n VAL 472 N 3.09 0.00 -3.64 2.92 0.24 -1.26 -4.28 118.33 115.40 2qr5 n VAL 472 Ca -0.09 0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 61.94 2qr5 n VAL 472 Cb 0.52 -0.83 -0.16 0.00 -1.47 0.00 0.00 33.84 31.90 2qr5 n VAL 472 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2qr5 s ASP 473 N -3.18 2.86 0.36 -1.34 2.15 -1.26 -2.20 116.67 114.06 2qr5 s ASP 473 Ca 0.00 -0.88 0.05 0.00 0.43 0.00 0.00 52.55 52.15 2qr5 s ASP 473 Cb 0.00 -0.41 0.73 0.00 -0.30 0.00 0.00 42.92 42.94 2qr5 s ASP 473 CO 0.00 -0.36 1.98 -0.50 -0.17 0.00 0.00 175.17 176.12 2qr5 h TRP 474 N 8.34 0.75 0.34 -5.34 4.06 -1.92 -2.02 115.95 120.16 2qr5 h TRP 474 Ca -0.16 0.02 -0.02 0.00 2.06 0.00 0.00 58.89 60.79 2qr5 h TRP 474 Cb 1.10 -0.25 0.00 0.00 -1.00 0.00 0.00 29.16 29.02 2qr5 h TRP 474 CO 0.23 0.42 -0.16 0.93 -3.56 0.00 0.00 178.44 176.30 2qr5 h GLU 475 N 0.76 -0.44 -0.51 0.49 5.08 -1.96 -0.52 114.58 117.49 2qr5 h GLU 475 Ca 0.29 0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.60 2qr5 h GLU 475 Cb 0.17 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 2qr5 h GLU 475 CO -0.09 -0.14 0.01 1.49 -1.00 0.00 0.00 179.01 179.29 2qr5 h GLU 476 N -0.76 0.89 -0.56 2.33 4.81 -1.97 -2.01 114.58 117.32 2qr5 h GLU 476 Ca -0.05 -0.28 0.10 0.00 -0.13 0.00 0.00 59.36 59.00 2qr5 h GLU 476 Cb 0.51 -0.08 -0.08 0.00 0.63 0.00 0.00 28.75 29.73 2qr5 h GLU 476 CO 0.08 0.91 0.14 1.98 -0.73 0.00 0.00 179.01 181.39 2qr5 h MET 477 N 0.75 0.28 -0.73 1.92 4.05 -1.41 -2.10 114.93 117.69 2qr5 h MET 477 Ca 0.15 -0.02 0.04 0.00 -0.28 0.00 0.00 59.70 59.59 2qr5 h MET 477 Cb 0.50 -0.06 -0.05 0.00 -0.80 0.00 0.00 31.60 31.19 2qr5 h MET 477 CO 0.02 0.18 0.45 -0.92 0.23 0.00 0.00 176.91 176.88 2qr5 h TYR 478 N 0.28 0.84 0.00 1.39 3.20 -0.65 -0.63 116.97 121.40 2qr5 h TYR 478 Ca 0.29 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.17 2qr5 h TYR 478 Cb 0.39 -0.27 -0.00 0.00 1.54 0.00 0.00 36.73 38.39 2qr5 h TYR 478 CO -0.22 0.46 -0.03 0.93 -1.64 0.00 0.00 178.16 177.66 2qr5 h GLU 479 N 0.86 0.00 -0.15 1.82 3.07 -0.71 -2.73 114.58 116.74 2qr5 h GLU 479 Ca 0.31 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.17 2qr5 h GLU 479 Cb 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 2qr5 h GLU 479 CO -0.14 0.03 0.00 1.28 -1.40 0.00 0.00 179.01 178.79 2qr5 n LEU 480 N -3.61 2.82 -4.90 1.33 4.32 -0.35 -5.00 117.00 111.61 2qr5 n LEU 480 Ca -0.03 -1.21 -0.28 0.00 -0.02 0.00 0.00 56.01 54.47 2qr5 n LEU 480 Cb 0.13 -0.08 -0.02 0.00 -1.62 0.00 0.00 43.42 41.82 2qr5 n LEU 480 CO 0.27 0.55 0.34 -0.44 -1.22 0.00 0.00 177.39 176.89 2qr5 s SER 481 N -1.49 6.41 0.89 -1.43 0.01 -0.57 -5.05 113.70 112.47 2qr5 s SER 481 Ca 0.26 0.88 -0.12 0.00 1.31 0.00 0.00 55.95 58.29 2qr5 s SER 481 Cb 0.17 -2.22 0.18 0.00 0.21 0.00 0.00 66.02 64.36 2qr5 s SER 481 CO 0.25 -0.38 1.23 1.51 0.41 0.00 0.00 173.24 176.27 2qr5 s ASP 482 N -3.50 3.47 0.40 2.44 1.47 -1.26 -4.71 116.67 114.98 2qr5 s ASP 482 Ca 0.47 0.11 0.08 0.00 1.18 0.00 0.00 52.55 54.39 2qr5 s ASP 482 Cb -0.10 -0.25 0.83 0.00 -0.34 0.00 0.00 42.92 43.05 2qr5 s ASP 482 CO 0.35 -2.48 2.00 0.00 0.68 0.00 0.00 175.17 175.71 2qr5 h ALA 483 N -1.33 1.62 0.12 2.11 0.00 -1.39 0.11 119.26 120.49 2qr5 h ALA 483 Ca -0.42 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 2qr5 h ALA 483 Cb 1.24 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2qr5 h ALA 483 CO 0.39 0.30 -0.06 0.00 0.00 0.00 0.00 179.25 179.88 2qr5 h ALA 484 N 1.69 -0.16 -0.45 0.00 0.00 -1.86 -2.79 119.26 115.69 2qr5 h ALA 484 Ca 0.10 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 2qr5 h ALA 484 Cb 0.12 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2qr5 h ALA 484 CO -0.01 -0.35 0.05 0.74 0.00 0.00 0.00 179.25 179.69 2qr5 h PHE 485 N -0.65 0.73 -0.35 0.00 -1.00 -1.86 -0.42 116.94 113.39 2qr5 h PHE 485 Ca -0.02 -0.08 0.02 0.00 2.81 0.00 0.00 57.97 60.71 2qr5 h PHE 485 Cb 0.50 -0.21 -0.03 0.00 3.61 0.00 0.00 35.95 39.82 2qr5 h PHE 485 CO 0.07 0.66 0.18 0.00 -1.61 0.00 0.00 178.31 177.62 2qr5 h ARG 486 N 0.67 0.36 -0.56 1.51 3.08 -0.85 0.20 114.38 118.79 2qr5 h ARG 486 Ca 0.14 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 60.09 2qr5 h ARG 486 Cb 0.34 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 2qr5 h ARG 486 CO 0.01 0.24 0.04 -0.97 -1.07 0.00 0.00 179.97 178.22 2qr5 h ASN 487 N 0.37 0.94 -0.63 7.04 -0.73 -1.20 -0.97 115.58 120.41 2qr5 h ASN 487 Ca 0.15 -0.29 -0.03 0.00 1.87 0.00 0.00 56.30 58.00 2qr5 h ASN 487 Cb 0.05 -0.25 -0.03 0.00 0.27 0.00 0.00 38.32 38.36 2qr5 h ASN 487 CO -0.09 0.99 0.28 0.15 -0.37 0.00 0.00 177.43 178.38 2qr5 h PHE 488 N 0.85 0.93 -0.61 0.67 3.57 -0.63 -0.12 116.94 121.61 2qr5 h PHE 488 Ca 0.16 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 2qr5 h PHE 488 Cb 0.49 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 38.92 2qr5 h PHE 488 CO 0.04 0.72 0.35 0.82 -2.23 0.00 0.00 178.31 178.01 2qr5 h ILE 489 N 0.87 1.19 -0.56 1.41 2.04 -0.30 -0.71 117.51 121.45 2qr5 h ILE 489 Ca 0.21 -0.44 0.07 0.00 1.00 0.00 0.00 64.86 65.70 2qr5 h ILE 489 Cb 0.17 0.37 -0.06 0.00 -0.74 0.00 0.00 36.82 36.56 2qr5 h ILE 489 CO -0.02 0.20 0.23 -0.33 0.00 0.00 0.00 178.15 178.23 2qr5 h GLU 490 N 0.83 0.43 -0.62 2.37 5.08 -0.73 -0.36 114.58 121.57 2qr5 h GLU 490 Ca 0.22 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.48 2qr5 h GLU 490 Cb 0.01 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 2qr5 h GLU 490 CO -0.04 0.28 0.12 1.96 -1.00 0.00 0.00 179.01 180.33 2qr5 h GLN 491 N 0.44 1.02 -0.13 2.33 4.20 -0.67 0.70 115.11 122.99 2qr5 h GLN 491 Ca 0.27 -0.26 -0.18 0.00 0.06 0.00 0.00 58.65 58.53 2qr5 h GLN 491 Cb 0.27 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 27.92 2qr5 h GLN 491 CO -0.24 0.94 -0.67 1.25 -0.67 0.00 0.00 178.83 179.44 2qr5 h LEU 492 N 0.93 0.61 -0.84 1.46 5.85 -0.70 -3.10 115.31 119.51 2qr5 h LEU 492 Ca 0.19 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.54 2qr5 h LEU 492 Cb 0.40 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.26 2qr5 h LEU 492 CO 0.01 1.11 -0.26 0.35 -0.34 0.00 0.00 178.44 179.31 2qr5 n THR 493 N -3.90 0.00 -1.48 1.05 -2.24 -0.18 0.08 114.28 107.61 2qr5 n THR 493 Ca -0.04 -0.22 -0.10 0.00 -2.27 0.00 0.00 64.05 61.42 2qr5 n THR 493 Cb 0.67 0.75 -0.04 0.00 -2.10 0.00 0.00 70.33 69.62 2qr5 n THR 493 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qr5 n GLY 494 N 1.34 0.94 2.35 3.38 0.00 -0.32 -2.96 105.19 109.91 2qr5 n GLY 494 Ca 0.13 -0.54 -0.09 0.00 0.00 0.00 0.00 46.02 45.52 2qr5 n GLY 494 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qr5 n GLY 495 N -1.57 1.07 3.60 -0.02 0.00 0.23 -4.98 105.19 103.51 2qr5 n GLY 495 Ca -0.11 -0.44 -0.37 0.00 0.00 0.00 0.00 46.02 45.10 2qr5 n GLY 495 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2qr5 s SER 496 N -2.74 5.97 0.47 1.61 0.15 -1.15 -4.95 113.70 113.05 2qr5 s SER 496 Ca 0.00 0.02 0.24 0.00 0.70 0.00 0.00 55.95 56.91 2qr5 s SER 496 Cb 0.00 -2.09 1.18 0.00 -1.71 0.00 0.00 66.02 63.40 2qr5 s SER 496 CO 0.00 -0.00 1.96 0.03 1.20 0.00 0.00 173.24 176.43 2qr5 h ARG 497 N 8.01 0.00 -0.14 5.44 2.47 -1.94 -2.39 114.38 125.84 2qr5 h ARG 497 Ca -0.36 0.00 -0.17 0.00 -1.26 0.00 0.00 59.98 58.18 2qr5 h ARG 497 Cb 1.18 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.50 2qr5 h ARG 497 CO 0.59 0.19 -0.64 1.49 0.56 0.00 0.00 179.97 182.17 2qr5 h GLU 498 N 0.00 0.50 -0.16 0.04 4.57 -1.96 -2.50 114.58 115.07 2qr5 h GLU 498 Ca -0.00 -0.36 -0.05 0.00 -1.18 0.00 0.00 59.36 57.77 2qr5 h GLU 498 Cb 0.52 0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 29.16 2qr5 h GLU 498 CO 0.02 0.98 -0.11 0.82 -1.18 0.00 0.00 179.01 179.54 2qr5 h ILE 499 N 0.37 1.33 -0.79 2.32 1.08 -1.81 -0.11 117.51 119.89 2qr5 h ILE 499 Ca -0.01 -1.22 0.18 0.00 -0.39 0.00 0.00 64.86 63.42 2qr5 h ILE 499 Cb 1.20 1.80 -0.12 0.00 -3.07 0.00 0.00 36.82 36.62 2qr5 h ILE 499 CO 0.12 0.36 0.19 0.24 -0.69 0.00 0.00 178.15 178.36 2qr5 h MET 500 N 0.00 0.24 0.02 2.37 2.86 -1.41 -1.66 114.93 117.35 2qr5 h MET 500 Ca 0.03 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2qr5 h MET 500 Cb 0.62 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.23 2qr5 h MET 500 CO 0.03 0.16 -0.01 -0.09 1.06 0.00 0.00 176.91 178.06 2qr5 h ARG 501 N 0.25 -0.02 0.00 1.72 1.12 -1.31 -3.27 114.38 112.86 2qr5 h ARG 501 Ca 0.46 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.33 2qr5 h ARG 501 Cb 0.84 0.01 0.00 0.00 -0.01 0.00 0.00 29.97 30.80 2qr5 h ARG 501 CO -0.57 0.71 0.00 -1.13 -3.11 0.00 0.00 179.97 175.87 2qr5 n SER 502 N -4.73 0.04 -0.80 -3.80 3.41 -0.07 -2.57 113.62 105.11 2qr5 n SER 502 Ca -0.09 0.50 0.07 0.00 -0.26 0.00 0.00 58.87 59.10 2qr5 n SER 502 Cb 0.37 -0.52 0.19 0.00 -0.26 0.00 0.00 64.21 63.99 2qr5 n SER 502 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2qr5 n ARG 503 N -1.54 2.78 -3.21 4.33 5.12 -0.65 -4.89 116.66 118.61 2qr5 n ARG 503 Ca 0.06 -2.17 -0.40 0.00 -1.93 0.00 0.00 57.85 53.41 2qr5 n ARG 503 Cb 0.32 -1.34 -0.07 0.00 -1.16 0.00 0.00 32.46 30.21 2qr5 n ARG 503 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 2qr5 s SER 504 N -1.01 6.43 0.58 0.55 0.01 -1.06 -4.84 113.70 114.37 2qr5 s SER 504 Ca 0.29 0.45 0.32 0.00 1.31 0.00 0.00 55.95 58.32 2qr5 s SER 504 Cb 0.15 -2.29 1.80 0.00 0.21 0.00 0.00 66.02 65.89 2qr5 s SER 504 CO 0.20 -0.34 2.21 1.55 0.41 0.00 0.00 173.24 177.27 2qr5 h PRO 505 N 8.09 0.00 -0.45 12.44 0.13 -1.84 -2.06 132.00 148.31 2qr5 h PRO 505 Ca -0.28 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 64.98 2qr5 h PRO 505 Cb 1.13 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.25 2qr5 h PRO 505 CO 0.74 0.04 0.52 0.97 -0.23 0.00 0.00 178.00 180.03 2qr5 h ILE 506 N 0.00 0.31 -0.01 -3.56 6.09 -1.81 0.79 117.51 119.32 2qr5 h ILE 506 Ca -0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 2qr5 h ILE 506 Cb 0.12 0.58 0.00 0.00 0.47 0.00 0.00 36.82 37.99 2qr5 h ILE 506 CO 0.00 0.00 -0.07 0.59 -3.07 0.00 0.00 178.15 175.60 2qr5 n ASN 507 N -3.62 1.28 -0.14 2.19 3.02 -0.77 -3.91 115.26 113.31 2qr5 n ASN 507 Ca 0.08 -1.29 0.05 0.00 -0.03 0.00 0.00 54.58 53.40 2qr5 n ASN 507 Cb 0.70 0.03 0.07 0.00 -0.61 0.00 0.00 39.78 39.97 2qr5 n ASN 507 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2qr5 n HIS 508 N -0.12 0.00 -0.25 3.10 8.25 0.26 -4.85 115.22 121.61 2qr5 n HIS 508 Ca 0.17 -0.62 0.02 0.00 -0.26 0.00 0.00 57.72 57.04 2qr5 n HIS 508 Cb 0.34 -0.10 0.25 0.00 1.12 0.00 0.00 29.99 31.60 2qr5 n HIS 508 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2qr5 h VAL 509 N 1.73 1.13 -1.55 1.59 2.07 -1.66 -0.77 116.25 118.79 2qr5 h VAL 509 Ca 0.00 -0.35 0.46 0.00 0.82 0.00 0.00 66.70 67.63 2qr5 h VAL 509 Cb 0.99 0.03 -0.08 0.00 -1.52 0.00 0.00 31.29 30.71 2qr5 h VAL 509 CO 0.00 0.19 1.09 -2.24 0.02 0.00 0.00 177.57 176.63 2qr5 h ASP 510 N 1.02 0.07 1.58 0.57 2.03 -1.91 -1.37 116.42 118.41 2qr5 h ASP 510 Ca 0.33 0.03 0.00 0.00 -0.73 0.00 0.00 57.03 56.66 2qr5 h ASP 510 Cb 0.03 0.03 0.00 0.00 -0.83 0.00 0.00 39.33 38.56 2qr5 h ASP 510 CO -0.10 -0.03 -0.18 0.03 -1.03 0.00 0.00 179.24 177.93 2qr5 h ARG 511 N 0.04 0.00 -6.53 4.15 3.08 -1.44 -3.46 114.38 110.22 2qr5 h ARG 511 Ca 0.78 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 60.31 2qr5 h ARG 511 Cb 2.96 0.00 0.04 0.00 0.08 0.00 0.00 29.97 33.04 2qr5 h ARG 511 CO -0.11 0.00 1.01 0.42 -1.07 0.00 0.00 179.97 180.22 2qr5 s ILE 512 N -3.19 2.68 -0.07 2.04 1.01 -0.52 -4.77 121.20 118.39 2qr5 s ILE 512 Ca 0.07 0.30 0.02 0.00 0.00 0.00 0.00 60.65 61.04 2qr5 s ILE 512 Cb 0.09 -3.19 -0.03 0.00 0.01 0.00 0.00 42.46 39.34 2qr5 s ILE 512 CO 0.66 0.01 0.08 0.29 0.00 0.00 0.00 174.94 175.98 2qr5 n LYS 513 N 5.08 3.93 -3.99 2.79 4.76 -1.26 -5.04 118.16 124.43 2qr5 n LYS 513 Ca 0.16 -0.01 -0.32 0.00 -2.87 0.00 0.00 58.31 55.28 2qr5 n LYS 513 Cb 0.39 -0.78 -0.05 0.00 -1.84 0.00 0.00 35.03 32.75 2qr5 n LYS 513 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2qr5 s GLU 514 N -1.57 3.20 0.54 1.97 8.01 -1.26 -5.01 118.70 124.57 2qr5 s GLU 514 Ca 0.00 -0.51 -0.22 0.00 0.01 0.00 0.00 54.97 54.26 2qr5 s GLU 514 Cb 0.02 -2.92 -0.05 0.00 -4.31 0.00 0.00 34.13 26.87 2qr5 s GLU 514 CO 0.10 0.61 1.34 -2.14 0.01 0.00 0.00 175.26 175.18 2qr5 s PRO 515 N -2.25 3.16 -0.01 0.39 0.02 -1.26 -4.86 135.00 130.20 2qr5 s PRO 515 Ca 0.30 2.20 0.00 0.00 0.02 0.00 0.00 61.00 63.52 2qr5 s PRO 515 Cb -0.13 -2.25 0.01 0.00 0.02 0.00 0.00 34.50 32.15 2qr5 s PRO 515 CO 0.22 -1.16 0.01 -1.17 -0.33 0.00 0.00 177.00 174.57 2qr5 s LEU 516 N -3.52 1.71 -0.12 -5.54 2.96 -1.18 -2.07 118.68 110.92 2qr5 s LEU 516 Ca 0.71 0.01 0.00 0.00 -0.22 0.00 0.00 54.13 54.64 2qr5 s LEU 516 Cb -0.40 -0.03 -0.02 0.00 0.50 0.00 0.00 46.19 46.25 2qr5 s LEU 516 CO 0.47 -0.04 -0.13 0.00 -1.32 0.00 0.00 176.35 175.33 2qr5 s ALA 517 N 0.34 2.64 -0.13 5.97 0.00 -0.14 -0.73 121.76 129.71 2qr5 s ALA 517 Ca -0.03 -0.90 -0.03 0.00 0.00 0.00 0.00 51.96 51.01 2qr5 s ALA 517 Cb -0.04 -1.19 -0.03 0.00 0.00 0.00 0.00 23.12 21.86 2qr5 s ALA 517 CO -0.01 0.30 -0.03 -0.51 0.00 0.00 0.00 175.76 175.50 2qr5 s LEU 518 N 0.18 3.31 -0.09 0.00 1.43 0.12 -0.26 118.68 123.38 2qr5 s LEU 518 Ca -0.07 -0.05 0.01 0.00 -1.03 0.00 0.00 54.13 52.98 2qr5 s LEU 518 Cb -0.15 -1.78 0.02 0.00 0.03 0.00 0.00 46.19 44.31 2qr5 s LEU 518 CO 0.05 0.24 -0.10 -0.63 0.23 0.00 0.00 176.35 176.14 2qr5 s ILE 519 N -0.08 1.09 -0.09 -0.59 1.01 -0.36 -0.15 121.20 122.03 2qr5 s ILE 519 Ca 0.02 -0.40 -0.05 0.00 0.00 0.00 0.00 60.65 60.23 2qr5 s ILE 519 Cb -0.13 -1.04 0.04 0.00 0.01 0.00 0.00 42.46 41.34 2qr5 s ILE 519 CO 0.02 0.36 0.20 -2.28 0.00 0.00 0.00 174.94 173.25 2qr5 s HIS 520 N 1.10 -0.25 0.22 3.97 2.46 0.02 0.01 115.29 122.83 2qr5 s HIS 520 Ca -0.06 0.63 -0.30 0.00 0.47 0.00 0.00 55.06 55.80 2qr5 s HIS 520 Cb -0.14 0.00 -0.09 0.00 -0.13 0.00 0.00 32.58 32.23 2qr5 s HIS 520 CO -0.02 -0.19 1.01 -2.14 -2.47 0.00 0.00 174.74 170.94 2qr5 s PRO 521 N 1.04 4.73 0.32 2.88 0.02 -1.26 -1.38 135.00 141.35 2qr5 s PRO 521 Ca -0.08 1.61 0.13 0.00 0.02 0.00 0.00 61.00 62.69 2qr5 s PRO 521 Cb -0.09 -3.27 0.51 0.00 0.02 0.00 0.00 34.50 31.67 2qr5 s PRO 521 CO -0.06 0.32 1.68 -0.56 -0.33 0.00 0.00 177.00 178.05 2qr5 h GLN 522 N 4.40 0.00 -0.50 5.54 3.07 -0.79 -3.04 115.11 123.80 2qr5 h GLN 522 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.29 2qr5 h GLN 522 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.77 2qr5 h GLN 522 CO 0.69 0.51 0.00 0.09 0.09 0.00 0.00 178.83 180.21 2qr5 n ASN 523 N -3.76 4.96 -4.64 0.06 3.02 -0.34 -4.56 115.26 110.00 2qr5 n ASN 523 Ca -0.01 -2.83 -0.54 0.00 -0.03 0.00 0.00 54.58 51.17 2qr5 n ASN 523 Cb 0.55 -0.61 -0.07 0.00 -0.61 0.00 0.00 39.78 39.05 2qr5 n ASN 523 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2qr5 n ASP 524 N 0.40 2.56 -0.87 6.41 -0.08 -1.15 -3.07 116.55 120.75 2qr5 n ASP 524 Ca 0.25 0.91 0.10 0.00 -1.51 0.00 0.00 54.79 54.54 2qr5 n ASP 524 Cb 1.03 -1.21 0.11 0.00 2.34 0.00 0.00 41.12 43.39 2qr5 n ASP 524 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2qr5 n SER 525 N 6.66 2.84 -0.10 1.67 3.41 -1.26 -3.75 113.62 123.10 2qr5 n SER 525 Ca 0.29 -1.88 -0.16 0.00 -0.26 0.00 0.00 58.87 56.87 2qr5 n SER 525 Cb 0.18 -0.06 -0.07 0.00 -0.26 0.00 0.00 64.21 64.01 2qr5 n SER 525 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2qr5 n ARG 526 N 1.19 0.53 -3.86 4.33 1.74 -1.26 -4.76 116.66 114.56 2qr5 n ARG 526 Ca 0.13 0.48 -0.33 0.00 -0.77 0.00 0.00 57.85 57.36 2qr5 n ARG 526 Cb 0.52 -1.66 -0.12 0.00 -1.02 0.00 0.00 32.46 30.18 2qr5 n ARG 526 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2qr5 s THR 527 N -2.40 2.99 0.70 0.55 -4.23 -1.26 -5.01 115.64 106.97 2qr5 s THR 527 Ca -0.26 -2.85 -0.15 0.00 -1.18 0.00 0.00 61.69 57.26 2qr5 s THR 527 Cb 0.06 -3.04 0.02 0.00 1.34 0.00 0.00 72.50 70.87 2qr5 s THR 527 CO 0.44 -0.77 1.17 -2.16 -0.54 0.00 0.00 174.62 172.76 2qr5 s PRO 528 N 0.21 2.43 0.26 3.99 0.04 -1.25 -4.70 135.00 135.98 2qr5 s PRO 528 Ca 0.15 1.63 0.07 0.00 0.04 0.00 0.00 61.00 62.88 2qr5 s PRO 528 Cb -0.22 -1.88 0.34 0.00 0.04 0.00 0.00 34.50 32.77 2qr5 s PRO 528 CO -0.03 -1.58 1.61 1.25 0.04 0.00 0.00 177.00 178.29 2qr5 h LEU 529 N -0.11 0.15 -0.24 -3.56 5.85 -1.80 -3.38 115.31 112.23 2qr5 h LEU 529 Ca -0.47 -0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.19 2qr5 h LEU 529 Cb 1.28 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.23 2qr5 h LEU 529 CO 0.52 0.69 0.06 0.50 -0.34 0.00 0.00 178.44 179.86 2qr5 h LYS 530 N 0.10 0.15 -0.27 1.25 3.64 -1.92 0.37 116.57 119.90 2qr5 h LYS 530 Ca -0.00 -0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.44 2qr5 h LYS 530 Cb 1.04 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.82 2qr5 h LYS 530 CO 0.08 0.10 0.21 -1.35 -2.27 0.00 0.00 179.45 176.22 2qr5 h PRO 531 N 0.15 0.00 -0.59 1.90 0.11 -1.97 -1.80 132.00 129.80 2qr5 h PRO 531 Ca 0.11 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.13 2qr5 h PRO 531 Cb 0.10 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.18 2qr5 h PRO 531 CO -0.13 0.00 0.01 1.25 -0.21 0.00 0.00 178.00 178.92 2qr5 h LEU 532 N 0.00 1.00 -1.35 2.35 6.46 -0.47 -2.14 115.31 121.16 2qr5 h LEU 532 Ca 0.13 -0.27 0.03 0.00 -0.12 0.00 0.00 57.88 57.64 2qr5 h LEU 532 Cb 0.54 -0.27 -0.04 0.00 -0.73 0.00 0.00 40.66 40.16 2qr5 h LEU 532 CO -0.00 1.04 0.46 -0.07 -0.62 0.00 0.00 178.44 179.25 2qr5 h LEU 533 N 0.94 0.74 -0.28 2.25 3.38 -0.79 -0.75 115.31 120.80 2qr5 h LEU 533 Ca 0.17 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.96 2qr5 h LEU 533 Cb 0.53 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 2qr5 h LEU 533 CO 0.03 0.52 -0.48 -0.09 0.09 0.00 0.00 178.44 178.51 2qr5 h ARG 534 N 0.86 0.82 -0.36 1.13 2.43 -1.46 -2.05 114.38 115.76 2qr5 h ARG 534 Ca 0.27 -0.51 0.06 0.00 -0.81 0.00 0.00 59.98 59.00 2qr5 h ARG 534 Cb 0.01 0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.56 2qr5 h ARG 534 CO -0.07 1.14 0.01 1.25 -1.51 0.00 0.00 179.97 180.79 2qr5 h LEU 535 N 0.59 -0.12 -0.64 3.80 5.85 -0.93 -1.80 115.31 122.07 2qr5 h LEU 535 Ca 0.02 0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.86 2qr5 h LEU 535 Cb 1.08 0.13 -0.05 0.00 0.37 0.00 0.00 40.66 42.20 2qr5 h LEU 535 CO 0.11 -0.02 0.37 0.24 -0.34 0.00 0.00 178.44 178.80 2qr5 h MET 536 N 0.12 0.70 -1.00 1.25 2.86 -0.98 0.93 114.93 118.81 2qr5 h MET 536 Ca 0.17 -0.04 0.12 0.00 -2.06 0.00 0.00 59.70 57.89 2qr5 h MET 536 Cb 0.24 -0.16 -0.08 0.00 0.06 0.00 0.00 31.60 31.66 2qr5 h MET 536 CO -0.28 0.46 0.63 0.78 1.06 0.00 0.00 176.91 179.56 2qr5 h GLY 537 N 0.72 1.61 1.41 8.32 0.00 -1.16 0.10 103.07 114.07 2qr5 h GLY 537 Ca 0.27 -0.42 -0.24 0.00 0.00 0.00 0.00 47.33 46.94 2qr5 h GLY 537 CO -0.14 0.16 -0.95 0.83 0.00 0.00 0.00 176.54 176.45 2qr5 h GLU 538 N 0.98 0.53 -0.45 4.80 4.39 -0.26 -1.14 114.58 123.42 2qr5 h GLU 538 Ca 0.49 -0.55 -0.05 0.00 0.34 0.00 0.00 59.36 59.59 2qr5 h GLU 538 Cb 0.50 0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.28 2qr5 h GLU 538 CO -0.26 1.18 0.07 -0.07 -1.16 0.00 0.00 179.01 178.77 2qr5 h LEU 539 N 0.31 0.72 -0.04 1.33 3.38 -0.55 -2.54 115.31 117.92 2qr5 h LEU 539 Ca -0.09 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 2qr5 h LEU 539 Cb 1.58 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 42.14 2qr5 h LEU 539 CO 0.17 0.80 0.02 0.25 0.09 0.00 0.00 178.44 179.78 2qr5 h LEU 540 N 0.62 0.05 -2.03 1.67 5.85 -0.70 -0.83 115.31 119.93 2qr5 h LEU 540 Ca 0.14 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 2qr5 h LEU 540 Cb 0.39 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.40 2qr5 h LEU 540 CO 0.01 0.07 -0.09 0.00 -0.34 0.00 0.00 178.44 178.09 2qr5 h ALA 541 N 0.98 1.37 -0.47 1.25 0.00 -1.15 -2.13 119.26 119.11 2qr5 h ALA 541 Ca 0.01 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2qr5 h ALA 541 Cb 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2qr5 h ALA 541 CO -0.00 0.12 0.00 0.54 0.00 0.00 0.00 179.25 179.90 2qr5 n ARG 542 N -3.74 2.55 -1.32 0.00 1.74 -0.96 -4.95 116.66 109.98 2qr5 n ARG 542 Ca -0.02 -2.36 -0.05 0.00 -0.77 0.00 0.00 57.85 54.65 2qr5 n ARG 542 Cb 0.20 -1.53 -0.02 0.00 -1.02 0.00 0.00 32.46 30.09 2qr5 n ARG 542 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qr5 n GLY 543 N 1.55 0.63 3.80 -0.13 0.00 -0.80 -5.02 105.19 105.21 2qr5 n GLY 543 Ca 0.21 -0.83 -0.35 0.00 0.00 0.00 0.00 46.02 45.05 2qr5 n GLY 543 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qr5 s LYS 544 N -2.75 4.40 -0.22 1.61 -0.14 -0.33 -5.00 119.74 117.30 2qr5 s LYS 544 Ca 0.00 1.16 -0.29 0.00 -1.36 0.00 0.00 55.97 55.48 2qr5 s LYS 544 Cb 0.00 -2.62 0.01 0.00 -1.68 0.00 0.00 37.83 33.54 2qr5 s LYS 544 CO 0.00 0.20 1.02 0.99 -0.76 0.00 0.00 175.35 176.81 2qr5 s THR 545 N -1.78 4.70 0.00 2.17 2.01 -1.26 -4.69 115.64 116.79 2qr5 s THR 545 Ca 0.53 1.99 -0.11 0.00 0.31 0.00 0.00 61.69 64.41 2qr5 s THR 545 Cb -0.15 -4.29 0.01 0.00 0.01 0.00 0.00 72.50 68.08 2qr5 s THR 545 CO 0.20 -0.16 0.22 0.72 -0.69 0.00 0.00 174.62 174.91 2qr5 s PHE 546 N 3.11 -0.05 0.06 4.92 -0.12 -1.26 -3.12 117.98 121.51 2qr5 s PHE 546 Ca 0.43 0.01 0.09 0.00 -0.05 0.00 0.00 56.93 57.41 2qr5 s PHE 546 Cb -0.15 0.02 -0.03 0.00 -0.63 0.00 0.00 43.02 42.23 2qr5 s PHE 546 CO 0.07 -0.36 -0.24 -2.00 -0.05 0.00 0.00 175.22 172.64 2qr5 s GLU 547 N -1.60 1.83 -0.03 1.99 2.12 0.09 -4.98 118.70 118.12 2qr5 s GLU 547 Ca -0.12 -1.10 -0.04 0.00 0.36 0.00 0.00 54.97 54.06 2qr5 s GLU 547 Cb -0.05 -2.04 0.01 0.00 0.26 0.00 0.00 34.13 32.31 2qr5 s GLU 547 CO 0.02 0.51 0.10 0.00 -0.54 0.00 0.00 175.26 175.35 2qr5 s ALA 548 N -0.88 -0.26 -0.06 6.30 0.00 -1.26 0.16 121.76 125.77 2qr5 s ALA 548 Ca 0.13 0.23 -0.00 0.00 0.00 0.00 0.00 51.96 52.32 2qr5 s ALA 548 Cb -0.10 -0.14 0.02 0.00 0.00 0.00 0.00 23.12 22.90 2qr5 s ALA 548 CO 0.04 -0.07 -0.02 -1.01 0.00 0.00 0.00 175.76 174.70 2qr5 s HIS 549 N -0.11 0.71 -0.13 0.00 3.76 0.78 -4.95 115.29 115.35 2qr5 s HIS 549 Ca -0.02 -0.20 0.01 0.00 -0.15 0.00 0.00 55.06 54.71 2qr5 s HIS 549 Cb -0.02 -0.73 -0.01 0.00 1.11 0.00 0.00 32.58 32.94 2qr5 s HIS 549 CO 0.00 -0.26 -0.16 0.42 -0.85 0.00 0.00 174.74 173.89 2qr5 s ILE 550 N 1.43 2.75 -0.20 0.60 1.01 -1.26 -0.80 121.20 124.73 2qr5 s ILE 550 Ca -0.03 -0.76 -0.07 0.00 0.00 0.00 0.00 60.65 59.79 2qr5 s ILE 550 Cb -0.13 -2.14 -0.04 0.00 0.01 0.00 0.00 42.46 40.16 2qr5 s ILE 550 CO -0.03 0.53 0.06 -0.63 0.00 0.00 0.00 174.94 174.87 2qr5 s ILE 551 N 0.46 4.59 0.46 2.92 -1.09 -0.48 -4.92 121.20 123.14 2qr5 s ILE 551 Ca -0.11 -0.10 -0.16 0.00 -2.23 0.00 0.00 60.65 58.05 2qr5 s ILE 551 Cb -0.16 -3.08 -0.08 0.00 -1.58 0.00 0.00 42.46 37.55 2qr5 s ILE 551 CO 0.05 0.43 0.92 -2.16 -1.23 0.00 0.00 174.94 172.95 2qr5 s PRO 552 N 0.66 3.99 -1.44 2.79 0.04 -1.26 -0.65 135.00 139.14 2qr5 s PRO 552 Ca 0.03 0.89 -0.10 0.00 0.04 0.00 0.00 61.00 61.85 2qr5 s PRO 552 Cb -0.13 -2.22 0.06 0.00 0.04 0.00 0.00 34.50 32.25 2qr5 s PRO 552 CO 0.02 -0.14 0.70 -0.25 0.04 0.00 0.00 177.00 177.37 2qr5 n ASP 553 N -1.21 -4.72 -3.92 6.66 8.00 -1.26 -4.86 116.55 115.23 2qr5 n ASP 553 Ca 0.06 -0.50 -0.09 0.00 0.71 0.00 0.00 54.79 54.96 2qr5 n ASP 553 Cb 0.54 -3.83 -0.09 0.00 -0.02 0.00 0.00 41.12 37.72 2qr5 n ASP 553 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qr5 s ALA 554 N -3.12 -0.09 0.00 2.24 0.00 -1.15 -4.50 121.76 115.14 2qr5 s ALA 554 Ca 0.47 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.92 2qr5 s ALA 554 Cb -0.24 0.24 0.00 0.00 0.00 0.00 0.00 23.12 23.13 2qr5 s ALA 554 CO 0.58 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 176.44 2qr5 n GLY 555 N 0.81 5.84 0.19 0.00 0.00 -1.25 -1.20 105.19 109.59 2qr5 n GLY 555 Ca -0.19 -1.55 0.04 0.00 0.00 0.00 0.00 46.02 44.31 2qr5 n GLY 555 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2qr5 h HIS 556 N 0.00 0.00 -3.63 1.61 2.76 -1.86 -3.40 115.15 110.63 2qr5 h HIS 556 Ca 0.00 0.00 -0.70 0.00 -2.20 0.00 0.00 60.37 57.47 2qr5 h HIS 556 Cb 0.00 0.00 -0.27 0.00 1.55 0.00 0.00 27.41 28.69 2qr5 h HIS 556 CO 0.00 0.36 -0.56 0.00 -1.30 0.00 0.00 177.93 176.42 2qr5 s ALA 557 N -4.12 3.15 -0.14 5.26 0.00 -1.26 -5.05 121.76 119.59 2qr5 s ALA 557 Ca -0.02 -1.77 -0.27 0.00 0.00 0.00 0.00 51.96 49.90 2qr5 s ALA 557 Cb 0.14 -2.42 -0.01 0.00 0.00 0.00 0.00 23.12 20.83 2qr5 s ALA 557 CO 0.71 -1.38 0.90 0.42 0.00 0.00 0.00 175.76 176.41 2qr5 s ILE 558 N 1.46 4.84 -0.00 0.00 -1.09 -1.26 -4.92 121.20 120.23 2qr5 s ILE 558 Ca -0.00 1.79 0.00 0.00 -2.23 0.00 0.00 60.65 60.21 2qr5 s ILE 558 Cb -0.20 -4.20 0.01 0.00 -1.58 0.00 0.00 42.46 36.48 2qr5 s ILE 558 CO 0.04 0.02 0.85 -0.46 -1.23 0.00 0.00 174.94 174.17 2qr5 n ASN 559 N 5.12 1.39 -4.30 3.58 6.94 -1.26 -4.99 115.26 121.74 2qr5 n ASN 559 Ca 0.06 -1.72 -0.18 0.00 -0.02 0.00 0.00 54.58 52.72 2qr5 n ASN 559 Cb 0.49 -0.01 -0.10 0.00 -2.36 0.00 0.00 39.78 37.79 2qr5 n ASN 559 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 2qr5 s THR 560 N -0.73 1.54 0.18 5.53 -4.23 -1.26 -1.62 115.64 115.05 2qr5 s THR 560 Ca 0.01 -2.03 -0.11 0.00 -1.18 0.00 0.00 61.69 58.38 2qr5 s THR 560 Cb 0.00 -1.86 0.08 0.00 1.34 0.00 0.00 72.50 72.06 2qr5 s THR 560 CO 0.00 -0.55 1.69 -0.03 -0.54 0.00 0.00 174.62 175.20 2qr5 h MET 561 N 2.92 0.97 -0.07 3.99 1.85 -1.43 -1.98 114.93 121.18 2qr5 h MET 561 Ca -0.39 -0.22 0.04 0.00 -0.61 0.00 0.00 59.70 58.52 2qr5 h MET 561 Cb 1.21 -0.13 -0.06 0.00 0.43 0.00 0.00 31.60 33.05 2qr5 h MET 561 CO 0.58 0.88 -0.31 0.93 -0.40 0.00 0.00 176.91 178.59 2qr5 h GLU 562 N 0.89 -0.40 -0.71 0.39 3.07 -1.97 0.12 114.58 115.97 2qr5 h GLU 562 Ca 0.19 0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 59.05 2qr5 h GLU 562 Cb 0.33 0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.30 2qr5 h GLU 562 CO -0.00 -0.27 0.32 -0.44 -1.40 0.00 0.00 179.01 177.22 2qr5 h ASP 563 N -0.42 0.95 -0.79 1.42 3.32 -1.96 -1.00 116.42 117.94 2qr5 h ASP 563 Ca 0.08 -0.15 -0.05 0.00 0.02 0.00 0.00 57.03 56.93 2qr5 h ASP 563 Cb 0.54 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.81 2qr5 h ASP 563 CO -0.30 0.83 0.29 0.00 -1.72 0.00 0.00 179.24 178.34 2qr5 h ALA 564 N 1.15 1.02 -0.16 3.45 0.00 -0.75 -0.70 119.26 123.27 2qr5 h ALA 564 Ca 0.24 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2qr5 h ALA 564 Cb 0.15 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2qr5 h ALA 564 CO -0.03 0.67 0.08 0.28 0.00 0.00 0.00 179.25 180.25 2qr5 h VAL 565 N 1.15 1.11 -0.35 0.00 2.07 -0.48 0.10 116.25 119.86 2qr5 h VAL 565 Ca 0.26 -0.30 0.08 0.00 0.82 0.00 0.00 66.70 67.56 2qr5 h VAL 565 Cb 0.24 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 2qr5 h VAL 565 CO -0.02 0.10 0.24 0.11 0.02 0.00 0.00 177.57 178.02 2qr5 h LYS 566 N 0.15 0.12 0.09 1.57 1.57 -0.74 0.24 116.57 119.56 2qr5 h LYS 566 Ca 0.06 -0.01 -0.33 0.00 -1.87 0.00 0.00 60.65 58.50 2qr5 h LYS 566 Cb 0.09 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 2qr5 h LYS 566 CO -0.01 0.08 -1.82 -0.84 -0.57 0.00 0.00 179.45 176.28 2qr5 h ILE 567 N 0.12 0.79 0.11 1.86 -2.65 -0.92 -3.41 117.51 113.41 2qr5 h ILE 567 Ca 0.16 -2.53 -0.34 0.00 1.03 0.00 0.00 64.86 63.18 2qr5 h ILE 567 Cb 0.48 2.53 -0.02 0.00 -2.05 0.00 0.00 36.82 37.77 2qr5 h ILE 567 CO -0.02 0.76 -1.80 0.25 0.03 0.00 0.00 178.15 177.37 2qr5 h LEU 568 N 0.05 0.37 0.18 0.16 5.85 -0.26 -3.36 115.31 118.31 2qr5 h LEU 568 Ca -0.35 -0.70 -0.01 0.00 0.84 0.00 0.00 57.88 57.66 2qr5 h LEU 568 Cb 2.03 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.94 2qr5 h LEU 568 CO 0.10 1.61 -0.09 0.25 -0.34 0.00 0.00 178.44 179.97 2qr5 h LEU 569 N 0.07 -0.21 -1.56 2.25 5.85 -0.75 -2.27 115.31 118.69 2qr5 h LEU 569 Ca -0.35 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.46 2qr5 h LEU 569 Cb 2.04 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 43.09 2qr5 h LEU 569 CO 0.12 -0.14 0.41 -0.65 -0.34 0.00 0.00 178.44 177.84 2qr5 h PRO 570 N -0.26 0.50 -0.04 5.25 0.10 -1.77 0.35 132.00 136.13 2qr5 h PRO 570 Ca -0.03 -0.03 -0.00 0.00 0.10 0.00 0.00 66.00 66.04 2qr5 h PRO 570 Cb 0.20 -0.11 -0.00 0.00 0.10 0.00 0.00 31.00 31.18 2qr5 h PRO 570 CO 0.04 0.33 0.01 0.00 0.10 0.00 0.00 178.00 178.49 2qr5 h ALA 571 N 1.68 0.05 -0.17 -0.75 0.00 -1.64 -0.02 119.26 118.41 2qr5 h ALA 571 Ca 0.28 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2qr5 h ALA 571 Cb 0.42 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2qr5 h ALA 571 CO -0.08 -0.36 0.03 0.28 0.00 0.00 0.00 179.25 179.11 2qr5 h VAL 572 N -0.11 1.22 -0.57 0.00 2.07 -1.08 -1.99 116.25 115.79 2qr5 h VAL 572 Ca 0.01 -0.73 0.09 0.00 0.82 0.00 0.00 66.70 66.89 2qr5 h VAL 572 Cb 0.18 1.38 -0.07 0.00 -1.52 0.00 0.00 31.29 31.26 2qr5 h VAL 572 CO -0.00 0.22 0.19 -0.26 0.02 0.00 0.00 177.57 177.74 2qr5 h PHE 573 N 0.07 0.33 -0.01 1.57 0.04 -0.92 0.12 116.94 118.13 2qr5 h PHE 573 Ca 0.05 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.87 2qr5 h PHE 573 Cb 0.31 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.38 2qr5 h PHE 573 CO 0.02 0.07 -0.09 0.35 -0.60 0.00 0.00 178.31 178.06 2qr5 h PHE 574 N 0.36 -0.23 -0.64 -0.55 3.57 -0.93 -0.50 116.94 118.02 2qr5 h PHE 574 Ca 0.29 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.72 2qr5 h PHE 574 Cb 0.36 0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.18 2qr5 h PHE 574 CO -0.18 -0.14 0.11 -0.07 -2.23 0.00 0.00 178.31 175.80 2qr5 h LEU 575 N -0.15 1.00 -0.99 0.59 3.38 -0.68 -1.24 115.31 117.22 2qr5 h LEU 575 Ca 0.04 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 2qr5 h LEU 575 Cb 0.21 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 2qr5 h LEU 575 CO -0.10 1.00 0.33 0.00 0.09 0.00 0.00 178.44 179.76 2qr5 h ALA 576 N 1.04 1.21 -0.27 1.53 0.00 -0.56 -0.98 119.26 121.22 2qr5 h ALA 576 Ca 0.19 -0.16 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 2qr5 h ALA 576 Cb 0.42 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2qr5 h ALA 576 CO 0.01 0.59 -0.47 1.15 0.00 0.00 0.00 179.25 180.54 2qr5 h THR 577 N 1.04 1.29 0.00 0.00 2.02 -0.87 -3.01 112.91 113.39 2qr5 h THR 577 Ca 0.25 -1.67 -0.06 0.00 0.77 0.00 0.00 66.41 65.71 2qr5 h THR 577 Cb 0.13 1.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.12 2qr5 h THR 577 CO -0.03 0.54 -0.28 1.56 0.37 0.00 0.00 175.52 177.68 2qr5 h GLN 578 N 0.58 0.00 -0.33 6.66 1.08 -0.70 -3.04 115.11 119.35 2qr5 h GLN 578 Ca 0.03 0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.09 2qr5 h GLN 578 Cb 1.03 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.45 2qr5 h GLN 578 CO 0.10 0.28 -0.36 -0.09 -0.95 0.00 0.00 178.83 177.81 2qr5 h ARG 579 N 0.00 0.77 0.00 1.46 2.43 -1.06 -1.21 114.38 116.77 2qr5 h ARG 579 Ca -0.00 -0.38 0.00 0.00 -0.81 0.00 0.00 59.98 58.79 2qr5 h ARG 579 Cb 0.59 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 2qr5 h ARG 579 CO 0.04 1.00 0.00 0.39 -1.51 0.00 0.00 179.97 179.89 2qr5 n GLU 580 N -4.06 0.09 -0.63 0.20 1.02 -1.15 -5.11 120.64 111.00 2qr5 n GLU 580 Ca -0.01 0.32 0.00 0.00 -0.02 0.00 0.00 57.16 57.44 2qr5 n GLU 580 Cb 0.51 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 30.27 2qr5 n GLU 580 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85