#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qs2 s THR 5 N 0.00 4.15 0.14 5.15 2.01 -1.26 -4.50 115.64 121.33 2qs2 s THR 5 Ca 0.00 1.36 -0.30 0.00 0.31 0.00 0.00 61.69 63.06 2qs2 s THR 5 Cb 0.00 -3.97 -0.07 0.00 0.01 0.00 0.00 72.50 68.47 2qs2 s THR 5 CO 0.00 -0.23 1.13 -0.76 -0.69 0.00 0.00 174.62 174.07 2qs2 s LEU 6 N 3.89 4.45 -0.16 4.42 1.43 0.04 -4.85 118.68 127.90 2qs2 s LEU 6 Ca 0.58 2.07 -0.22 0.00 -1.03 0.00 0.00 54.13 55.53 2qs2 s LEU 6 Cb -0.22 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.38 2qs2 s LEU 6 CO 0.19 -0.30 0.67 -0.63 0.23 0.00 0.00 176.35 176.50 2qs2 s ILE 7 N 0.15 5.01 -0.27 -0.59 -1.09 -1.26 -0.65 121.20 122.50 2qs2 s ILE 7 Ca 0.52 1.29 -0.04 0.00 -2.23 0.00 0.00 60.65 60.19 2qs2 s ILE 7 Cb -0.29 -3.98 0.02 0.00 -1.58 0.00 0.00 42.46 36.62 2qs2 s ILE 7 CO 0.33 0.14 0.02 -0.69 -1.23 0.00 0.00 174.94 173.51 2qs2 s VAL 8 N 1.67 3.47 0.21 2.92 1.01 -0.11 0.22 120.40 129.79 2qs2 s VAL 8 Ca 0.32 -0.85 -0.25 0.00 0.00 0.00 0.00 61.98 61.20 2qs2 s VAL 8 Cb -0.16 -2.78 -0.08 0.00 0.00 0.00 0.00 36.38 33.35 2qs2 s VAL 8 CO 0.12 0.13 0.82 0.28 0.00 0.00 0.00 175.10 176.45 2qs2 s THR 9 N 1.42 4.34 0.14 3.92 -1.32 0.31 -0.63 115.64 123.82 2qs2 s THR 9 Ca 0.01 1.70 -0.03 0.00 -1.21 0.00 0.00 61.69 62.16 2qs2 s THR 9 Cb -0.17 -4.09 0.01 0.00 -1.51 0.00 0.00 72.50 66.74 2qs2 s THR 9 CO -0.01 0.40 0.24 1.07 -2.21 0.00 0.00 174.62 174.11 2qs2 n THR 10 N 1.25 0.00 -3.78 5.08 5.66 -0.96 -2.03 114.28 119.50 2qs2 n THR 10 Ca -0.03 -0.53 -0.13 0.00 -3.05 0.00 0.00 64.05 60.31 2qs2 n THR 10 Cb 0.49 0.40 -0.11 0.00 -1.55 0.00 0.00 70.33 69.55 2qs2 n THR 10 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 2qs2 s ILE 11 N -2.62 0.00 0.02 1.09 2.07 -1.26 -0.94 121.20 119.56 2qs2 s ILE 11 Ca 0.09 -0.03 -0.30 0.00 -1.41 0.00 0.00 60.65 58.99 2qs2 s ILE 11 Cb -0.01 -0.40 -0.07 0.00 0.13 0.00 0.00 42.46 42.11 2qs2 s ILE 11 CO 0.06 -0.02 1.70 -0.76 -1.91 0.00 0.00 174.94 174.01 2qs2 s LEU 12 N 0.05 4.36 -0.30 8.50 1.43 -1.26 -4.51 118.68 126.95 2qs2 s LEU 12 Ca -0.01 2.42 -0.06 0.00 -1.03 0.00 0.00 54.13 55.45 2qs2 s LEU 12 Cb -0.02 -3.55 0.19 0.00 0.03 0.00 0.00 46.19 42.84 2qs2 s LEU 12 CO 0.01 -0.93 0.79 -0.70 0.23 0.00 0.00 176.35 175.75 2qs2 s GLU 13 N 3.44 0.41 0.24 1.70 2.56 -0.18 -4.97 118.70 121.90 2qs2 s GLU 13 Ca 0.76 0.68 -0.30 0.00 0.00 0.00 0.00 54.97 56.11 2qs2 s GLU 13 Cb -0.38 0.37 -0.10 0.00 2.00 0.00 0.00 34.13 36.03 2qs2 s GLU 13 CO 0.33 -0.48 1.40 -2.00 -0.56 0.00 0.00 175.26 173.95 2qs2 s GLU 14 N 2.90 4.30 -0.22 4.30 2.12 -1.26 0.41 118.70 131.25 2qs2 s GLU 14 Ca 0.12 2.23 0.12 0.00 0.36 0.00 0.00 54.97 57.80 2qs2 s GLU 14 Cb -0.12 -3.13 0.72 0.00 0.26 0.00 0.00 34.13 31.86 2qs2 s GLU 14 CO -0.18 -0.36 1.62 -0.35 -0.54 0.00 0.00 175.26 175.45 2qs2 n PRO 15 N 2.31 4.34 -0.02 4.30 -0.04 -1.26 -4.93 135.00 139.69 2qs2 n PRO 15 Ca 0.06 -2.78 -0.16 0.00 -0.04 0.00 0.00 63.50 60.58 2qs2 n PRO 15 Cb 0.41 -2.18 -0.10 0.00 -0.04 0.00 0.00 33.50 31.59 2qs2 n PRO 15 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2qs2 h TYR 16 N 3.39 0.47 -2.80 0.54 -1.99 -0.38 -1.00 116.97 115.19 2qs2 h TYR 16 Ca 0.03 -0.23 -0.20 0.00 2.00 0.00 0.00 58.73 60.33 2qs2 h TYR 16 Cb 1.86 -0.07 -0.32 0.00 2.00 0.00 0.00 36.73 40.21 2qs2 h TYR 16 CO 1.00 1.00 -0.51 0.08 -0.00 0.00 0.00 178.16 179.72 2qs2 s VAL 17 N -3.45 -0.45 -0.01 -2.88 1.01 -0.38 -1.11 120.40 113.14 2qs2 s VAL 17 Ca -0.14 0.26 -0.09 0.00 0.00 0.00 0.00 61.98 62.01 2qs2 s VAL 17 Cb 0.03 -0.48 0.01 0.00 0.00 0.00 0.00 36.38 35.94 2qs2 s VAL 17 CO 0.78 0.11 0.18 -0.04 0.00 0.00 0.00 175.10 176.13 2qs2 s MET 18 N 2.45 0.52 0.30 2.72 -1.94 0.06 -1.01 119.30 122.39 2qs2 s MET 18 Ca 0.01 -0.31 -0.29 0.00 -1.71 0.00 0.00 55.69 53.39 2qs2 s MET 18 Cb -0.12 0.22 -0.10 0.00 2.01 0.00 0.00 34.83 36.84 2qs2 s MET 18 CO -0.09 -0.13 1.27 0.71 -0.01 0.00 0.00 175.02 176.77 2qs2 s TYR 19 N -1.30 3.18 0.37 -0.03 1.51 -1.26 -0.39 117.35 119.43 2qs2 s TYR 19 Ca -0.14 1.44 -0.27 0.00 -1.01 0.00 0.00 57.07 57.09 2qs2 s TYR 19 Cb -0.07 -3.60 -0.09 0.00 -0.11 0.00 0.00 41.96 38.09 2qs2 s TYR 19 CO 0.02 -1.63 1.25 1.03 -1.11 0.00 0.00 175.55 175.11 2qs2 s ARG 20 N -1.48 4.14 -1.34 -0.62 0.52 -0.39 -4.78 118.95 114.99 2qs2 s ARG 20 Ca 0.49 2.06 -0.16 0.00 -0.52 0.00 0.00 55.73 57.60 2qs2 s ARG 20 Cb -0.38 -2.85 0.07 0.00 0.52 0.00 0.00 34.95 32.32 2qs2 s ARG 20 CO 0.49 -0.31 1.88 1.17 0.02 0.00 0.00 175.30 178.54 2qs2 n LYS 21 N 0.37 3.13 -3.65 3.54 4.81 -1.26 -4.86 118.16 120.23 2qs2 n LYS 21 Ca 0.02 -3.12 -0.15 0.00 -0.87 0.00 0.00 58.31 54.19 2qs2 n LYS 21 Cb 0.44 -3.36 -0.08 0.00 0.02 0.00 0.00 35.03 32.05 2qs2 n LYS 21 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2qs2 s SER 22 N 3.60 -0.57 -0.04 3.14 0.15 -1.26 -5.01 113.70 113.71 2qs2 s SER 22 Ca 0.50 0.93 0.17 0.00 0.70 0.00 0.00 55.95 58.25 2qs2 s SER 22 Cb 0.07 0.93 0.55 0.00 -1.71 0.00 0.00 66.02 65.86 2qs2 s SER 22 CO 0.01 -0.33 1.46 0.47 1.20 0.00 0.00 173.24 176.06 2qs2 n ASP 23 N 2.15 3.83 -4.73 5.45 8.00 -1.26 -5.00 116.55 124.98 2qs2 n ASP 23 Ca -0.16 -2.20 -0.31 0.00 0.71 0.00 0.00 54.79 52.83 2qs2 n ASP 23 Cb 0.56 -0.43 0.12 0.00 -0.02 0.00 0.00 41.12 41.34 2qs2 n ASP 23 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2qs2 s LYS 24 N -1.37 1.83 -0.94 -1.24 1.02 -1.26 -4.87 119.74 112.92 2qs2 s LYS 24 Ca 0.41 1.34 -0.24 0.00 0.02 0.00 0.00 55.97 57.50 2qs2 s LYS 24 Cb 0.24 -1.84 -0.01 0.00 -0.52 0.00 0.00 37.83 35.70 2qs2 s LYS 24 CO 0.23 -1.99 1.76 -1.25 -0.92 0.00 0.00 175.35 173.19 2qs2 s PRO 25 N -4.73 2.93 -0.14 -1.68 0.04 -1.26 -4.92 135.00 125.24 2qs2 s PRO 25 Ca 0.64 -0.57 -0.01 0.00 0.04 0.00 0.00 61.00 61.10 2qs2 s PRO 25 Cb -0.20 -5.15 -0.02 0.00 0.04 0.00 0.00 34.50 29.17 2qs2 s PRO 25 CO 0.56 -2.95 -0.10 -0.51 0.04 0.00 0.00 177.00 174.04 2qs2 s LEU 26 N 8.23 2.85 0.19 -3.56 1.43 -1.26 -5.11 118.68 121.46 2qs2 s LEU 26 Ca 0.61 -0.28 0.08 0.00 -1.03 0.00 0.00 54.13 53.51 2qs2 s LEU 26 Cb -0.04 -1.66 -0.05 0.00 0.03 0.00 0.00 46.19 44.47 2qs2 s LEU 26 CO -0.04 0.15 -0.16 -0.31 0.23 0.00 0.00 176.35 176.23 2qs2 s TYR 27 N 0.43 1.76 0.00 0.29 1.51 -1.26 -4.63 117.35 115.45 2qs2 s TYR 27 Ca -0.08 -0.53 0.00 0.00 -1.01 0.00 0.00 57.07 55.45 2qs2 s TYR 27 Cb -0.15 -0.83 0.00 0.00 -0.11 0.00 0.00 41.96 40.86 2qs2 s TYR 27 CO 0.04 0.37 0.00 0.41 -1.11 0.00 0.00 175.55 175.26 2qs2 n GLY 28 N -0.17 3.37 0.28 0.71 0.00 -1.26 -1.61 105.19 106.51 2qs2 n GLY 28 Ca -0.10 -0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.00 2qs2 n GLY 28 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2qs2 h ASN 29 N 0.00 0.00 0.63 1.61 2.35 -1.91 -2.81 115.58 115.46 2qs2 h ASN 29 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2qs2 h ASN 29 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 2qs2 h ASN 29 CO 0.00 0.04 0.00 0.47 -1.65 0.00 0.00 177.43 176.29 2qs2 n ASP 30 N -3.95 0.21 0.22 5.81 10.43 -0.64 -2.28 116.55 126.36 2qs2 n ASP 30 Ca -0.03 0.55 0.15 0.00 2.57 0.00 0.00 54.79 58.03 2qs2 n ASP 30 Cb 0.12 -0.60 0.55 0.00 1.84 0.00 0.00 41.12 43.04 2qs2 n ASP 30 CO 0.00 0.00 0.00 0.03 -1.07 0.00 0.00 177.20 176.16 2qs2 h ARG 31 N 0.00 0.00 -6.39 -1.24 3.08 -1.61 -3.44 114.38 104.78 2qs2 h ARG 31 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 2qs2 h ARG 31 Cb 0.32 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.24 2qs2 h ARG 31 CO 0.00 0.00 -0.70 -0.06 -1.07 0.00 0.00 179.97 178.14 2qs2 s PHE 32 N -3.48 2.68 0.16 3.04 0.40 -0.97 -1.26 117.98 118.56 2qs2 s PHE 32 Ca 0.03 -0.21 -0.07 0.00 -0.60 0.00 0.00 56.93 56.09 2qs2 s PHE 32 Cb 0.09 -1.29 -0.02 0.00 0.51 0.00 0.00 43.02 42.31 2qs2 s PHE 32 CO 0.52 0.53 0.24 -1.83 0.70 0.00 0.00 175.22 175.38 2qs2 s GLU 33 N -2.97 1.13 0.00 0.44 -1.05 0.48 -4.75 118.70 111.98 2qs2 s GLU 33 Ca 0.26 -1.26 0.00 0.00 -0.15 0.00 0.00 54.97 53.82 2qs2 s GLU 33 Cb -0.08 0.35 0.00 0.00 -0.44 0.00 0.00 34.13 33.95 2qs2 s GLU 33 CO 0.16 -0.40 0.00 0.41 0.95 0.00 0.00 175.26 176.38 2qs2 n GLY 34 N -0.20 2.70 0.26 -3.83 0.00 -1.26 -0.76 105.19 102.10 2qs2 n GLY 34 Ca -0.06 -1.85 0.04 0.00 0.00 0.00 0.00 46.02 44.14 2qs2 n GLY 34 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2qs2 h TYR 35 N 0.00 0.42 0.00 1.61 3.20 -0.92 -0.96 116.97 120.31 2qs2 h TYR 35 Ca 0.00 0.04 -0.10 0.00 3.14 0.00 0.00 58.73 61.80 2qs2 h TYR 35 Cb 0.00 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.18 2qs2 h TYR 35 CO 0.00 0.03 -0.49 0.00 -1.64 0.00 0.00 178.16 176.07 2qs2 h LEU 37 N 0.00 0.92 -0.45 0.00 -0.00 -1.37 -0.37 115.31 114.03 2qs2 h LEU 37 Ca -0.00 -0.50 -0.05 0.00 -0.00 0.00 0.00 57.88 57.33 2qs2 h LEU 37 Cb 1.01 -0.26 -0.02 0.00 -0.00 0.00 0.00 40.66 41.38 2qs2 h LEU 37 CO 0.06 1.29 0.10 0.44 -0.00 0.00 0.00 178.44 180.33 2qs2 h ASP 38 N 0.62 0.69 -0.23 -0.43 3.32 -0.90 -0.94 116.42 118.55 2qs2 h ASP 38 Ca 0.01 -0.24 0.01 0.00 0.02 0.00 0.00 57.03 56.83 2qs2 h ASP 38 Cb 1.17 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.52 2qs2 h ASP 38 CO 0.12 0.75 0.14 0.25 -1.72 0.00 0.00 179.24 178.78 2qs2 h LEU 39 N 0.60 0.24 -0.70 1.55 5.85 -0.82 -1.80 115.31 120.23 2qs2 h LEU 39 Ca 0.14 -0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.88 2qs2 h LEU 39 Cb 0.33 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.27 2qs2 h LEU 39 CO 0.00 0.17 0.45 0.25 -0.34 0.00 0.00 178.44 178.98 2qs2 h LEU 40 N 0.29 0.76 -0.52 2.25 5.85 -0.96 0.67 115.31 123.66 2qs2 h LEU 40 Ca 0.09 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.82 2qs2 h LEU 40 Cb -0.02 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.80 2qs2 h LEU 40 CO -0.03 0.54 0.31 0.50 -0.34 0.00 0.00 178.44 179.41 2qs2 h LYS 41 N 0.90 0.60 -0.54 1.25 1.63 -0.91 0.16 116.57 119.67 2qs2 h LYS 41 Ca 0.27 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 60.02 2qs2 h LYS 41 Cb -0.04 -0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 31.43 2qs2 h LYS 41 CO -0.08 0.40 0.29 0.93 -3.45 0.00 0.00 179.45 177.54 2qs2 h GLU 42 N 0.62 0.75 -0.72 1.90 4.39 -0.64 -1.90 114.58 118.99 2qs2 h GLU 42 Ca 0.21 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.82 2qs2 h GLU 42 Cb 0.01 -0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 28.48 2qs2 h GLU 42 CO -0.09 0.58 0.46 -0.07 -1.16 0.00 0.00 179.01 178.73 2qs2 h LEU 43 N 0.72 0.84 -1.30 1.33 3.38 -0.56 -1.48 115.31 118.24 2qs2 h LEU 43 Ca 0.19 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 2qs2 h LEU 43 Cb 0.05 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 2qs2 h LEU 43 CO -0.03 0.63 0.06 -1.28 0.09 0.00 0.00 178.44 177.91 2qs2 h SER 44 N 0.98 0.49 1.03 -0.43 0.87 -0.67 -0.33 113.55 115.49 2qs2 h SER 44 Ca 0.26 -0.07 -0.20 0.00 -1.23 0.00 0.00 61.79 60.55 2qs2 h SER 44 Cb -0.08 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 61.73 2qs2 h SER 44 CO -0.05 0.52 -0.94 0.78 -0.53 0.00 0.00 176.83 176.60 2qs2 h ASN 45 N 0.52 0.00 0.01 6.23 2.35 -1.04 -0.39 115.58 123.26 2qs2 h ASN 45 Ca 0.12 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.80 2qs2 h ASN 45 Cb 0.25 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.62 2qs2 h ASN 45 CO 0.00 0.94 -0.25 0.40 -1.65 0.00 0.00 177.43 176.87 2qs2 h ILE 46 N 0.00 1.58 0.00 2.81 2.04 -1.04 -3.36 117.51 119.54 2qs2 h ILE 46 Ca -0.01 -2.03 -0.19 0.00 1.00 0.00 0.00 64.86 63.63 2qs2 h ILE 46 Cb 1.72 2.88 -0.03 0.00 -0.74 0.00 0.00 36.82 40.64 2qs2 h ILE 46 CO 0.12 0.55 -0.99 -0.07 0.00 0.00 0.00 178.15 177.76 2qs2 h LEU 47 N -0.56 0.00 -2.51 1.44 4.07 -1.18 -3.49 115.31 113.08 2qs2 h LEU 47 Ca -0.03 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.90 2qs2 h LEU 47 Cb 1.04 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.80 2qs2 h LEU 47 CO 0.05 0.84 -0.07 0.61 -1.08 0.00 0.00 178.44 178.79 2qs2 n GLY 48 N 1.35 0.58 3.37 0.83 0.00 -0.20 -5.07 105.19 106.05 2qs2 n GLY 48 Ca -0.02 -0.31 -0.26 0.00 0.00 0.00 0.00 46.02 45.43 2qs2 n GLY 48 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2qs2 s PHE 49 N -3.03 2.10 0.22 1.61 -0.12 -0.91 -5.05 117.98 112.80 2qs2 s PHE 49 Ca 0.02 -0.40 -0.08 0.00 -0.05 0.00 0.00 56.93 56.42 2qs2 s PHE 49 Cb -0.00 -1.08 -0.07 0.00 -0.63 0.00 0.00 43.02 41.24 2qs2 s PHE 49 CO 0.06 0.38 0.52 -0.51 -0.05 0.00 0.00 175.22 175.62 2qs2 s LEU 50 N -2.44 4.18 0.11 -1.99 1.43 -1.26 -4.78 118.68 113.93 2qs2 s LEU 50 Ca 0.16 0.85 -0.10 0.00 -1.03 0.00 0.00 54.13 54.01 2qs2 s LEU 50 Cb -0.08 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.53 2qs2 s LEU 50 CO 0.07 -0.06 0.24 -0.72 0.23 0.00 0.00 176.35 176.11 2qs2 s TYR 51 N -1.81 0.16 -0.13 0.29 -0.85 -1.26 -0.78 117.35 112.97 2qs2 s TYR 51 Ca 0.46 -0.56 -0.03 0.00 -0.52 0.00 0.00 57.07 56.42 2qs2 s TYR 51 Cb -0.11 -0.02 0.05 0.00 0.38 0.00 0.00 41.96 42.26 2qs2 s TYR 51 CO 0.22 -0.61 0.04 0.34 -1.52 0.00 0.00 175.55 174.03 2qs2 s ASP 52 N -2.88 2.17 -0.12 -0.18 -1.08 0.18 -4.89 116.67 109.87 2qs2 s ASP 52 Ca 0.07 -0.45 -0.25 0.00 -0.52 0.00 0.00 52.55 51.41 2qs2 s ASP 52 Cb 0.04 -0.41 -0.02 0.00 -1.46 0.00 0.00 42.92 41.07 2qs2 s ASP 52 CO -0.09 -0.28 0.81 -0.69 0.52 0.00 0.00 175.17 175.44 2qs2 s VAL 53 N 2.00 4.93 -0.12 1.11 1.01 -1.26 -0.93 120.40 127.14 2qs2 s VAL 53 Ca 0.02 1.62 0.01 0.00 0.00 0.00 0.00 61.98 63.63 2qs2 s VAL 53 Cb -0.15 -4.13 0.02 0.00 0.00 0.00 0.00 36.38 32.12 2qs2 s VAL 53 CO -0.07 0.11 -0.15 -0.54 0.00 0.00 0.00 175.10 174.45 2qs2 s LYS 54 N 1.64 2.20 0.23 2.72 1.02 0.20 -4.84 119.74 122.92 2qs2 s LYS 54 Ca 0.39 -0.54 -0.30 0.00 0.02 0.00 0.00 55.97 55.54 2qs2 s LYS 54 Cb -0.17 -1.93 -0.09 0.00 -0.52 0.00 0.00 37.83 35.12 2qs2 s LYS 54 CO 0.16 -0.12 1.36 -0.51 -0.92 0.00 0.00 175.35 175.32 2qs2 s LEU 55 N 1.15 4.41 0.07 3.17 1.43 -1.26 -2.25 118.68 125.39 2qs2 s LEU 55 Ca -0.03 2.54 -0.30 0.00 -1.03 0.00 0.00 54.13 55.30 2qs2 s LEU 55 Cb -0.14 -3.62 -0.09 0.00 0.03 0.00 0.00 46.19 42.37 2qs2 s LEU 55 CO -0.04 -0.60 1.86 0.54 0.23 0.00 0.00 176.35 178.35 2qs2 s VAL 56 N -0.07 2.85 0.28 -1.59 0.11 -0.11 -4.86 120.40 117.00 2qs2 s VAL 56 Ca 0.57 0.12 0.02 0.00 -2.93 0.00 0.00 61.98 59.75 2qs2 s VAL 56 Cb -0.39 -3.07 0.27 0.00 -1.53 0.00 0.00 36.38 31.65 2qs2 s VAL 56 CO 0.42 -0.01 1.77 -0.65 -3.33 0.00 0.00 175.10 173.30 2qs2 h PRO 57 N 9.51 0.67 -0.01 1.54 0.11 -1.91 -1.53 132.00 140.38 2qs2 h PRO 57 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2qs2 h PRO 57 Cb 1.22 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2qs2 h PRO 57 CO 0.94 0.44 -0.09 -0.40 -0.21 0.00 0.00 178.00 178.68 2qs2 n ASP 58 N -4.83 0.94 -1.72 -2.05 5.68 -1.26 -4.94 116.55 108.38 2qs2 n ASP 58 Ca 0.20 -1.06 -0.16 0.00 -0.50 0.00 0.00 54.79 53.27 2qs2 n ASP 58 Cb 0.49 0.01 -0.02 0.00 -1.14 0.00 0.00 41.12 40.46 2qs2 n ASP 58 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2qs2 n GLY 59 N 1.22 0.18 3.56 6.12 0.00 -0.58 -4.99 105.19 110.70 2qs2 n GLY 59 Ca 0.17 -0.21 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 2qs2 n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qs2 s LYS 60 N -4.46 2.04 -0.04 1.61 -0.14 -1.26 -5.03 119.74 112.46 2qs2 s LYS 60 Ca 0.00 -1.14 -0.24 0.00 -1.36 0.00 0.00 55.97 53.23 2qs2 s LYS 60 Cb 0.00 -2.22 -0.19 0.00 -1.68 0.00 0.00 37.83 33.74 2qs2 s LYS 60 CO 0.00 0.48 1.07 1.88 -0.76 0.00 0.00 175.35 178.02 2qs2 h TYR 61 N 3.38 -0.12 0.00 3.18 -1.99 -1.93 -2.46 116.97 117.03 2qs2 h TYR 61 Ca -0.48 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.24 2qs2 h TYR 61 Cb 1.18 0.04 0.00 0.00 2.00 0.00 0.00 36.73 39.95 2qs2 h TYR 61 CO 0.62 0.37 0.00 0.41 -0.00 0.00 0.00 178.16 179.56 2qs2 n GLY 62 N 0.42 3.11 3.17 3.88 0.00 -1.26 -1.60 105.19 112.91 2qs2 n GLY 62 Ca -0.08 -0.27 -0.10 0.00 0.00 0.00 0.00 46.02 45.56 2qs2 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qs2 s ALA 63 N 0.00 0.97 -0.00 4.61 0.00 -1.26 -4.91 121.76 121.17 2qs2 s ALA 63 Ca 0.00 -1.50 0.02 0.00 0.00 0.00 0.00 51.96 50.47 2qs2 s ALA 63 Cb 0.00 0.82 -0.04 0.00 0.00 0.00 0.00 23.12 23.91 2qs2 s ALA 63 CO 0.00 -0.46 -0.01 -1.14 0.00 0.00 0.00 175.76 174.15 2qs2 s GLN 64 N -4.03 2.75 0.53 0.00 0.74 -1.26 -2.12 119.66 116.28 2qs2 s GLN 64 Ca 0.24 -0.63 0.06 0.00 0.05 0.00 0.00 55.36 55.08 2qs2 s GLN 64 Cb 0.07 -2.65 0.10 0.00 1.10 0.00 0.00 33.01 31.63 2qs2 s GLN 64 CO 0.02 0.62 0.74 0.27 -0.55 0.00 0.00 175.29 176.39 2qs2 n ASN 65 N 1.41 1.61 0.17 6.67 0.23 -0.02 -4.95 115.26 120.38 2qs2 n ASN 65 Ca -0.15 -2.21 0.10 0.00 -0.53 0.00 0.00 54.58 51.80 2qs2 n ASN 65 Cb 0.53 -0.42 0.63 0.00 -2.08 0.00 0.00 39.78 38.43 2qs2 n ASN 65 CO 0.00 0.00 0.00 -2.24 -0.93 0.00 0.00 177.26 174.09 2qs2 h ASP 66 N -0.10 0.06 -0.10 0.53 2.03 -2.01 -1.54 116.42 115.30 2qs2 h ASP 66 Ca -0.25 -0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.05 2qs2 h ASP 66 Cb 1.06 -0.01 0.00 0.00 -0.83 0.00 0.00 39.33 39.55 2qs2 h ASP 66 CO 0.32 0.04 0.00 0.29 -1.03 0.00 0.00 179.24 178.86 2qs2 n LYS 67 N -4.50 1.62 -0.87 4.15 5.02 -1.26 -4.89 118.16 117.44 2qs2 n LYS 67 Ca 0.01 -0.92 0.00 0.00 -2.02 0.00 0.00 58.31 55.38 2qs2 n LYS 67 Cb 0.20 -1.42 0.00 0.00 -0.02 0.00 0.00 35.03 33.80 2qs2 n LYS 67 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qs2 n GLY 68 N 1.11 0.51 3.72 0.72 0.00 -0.58 -5.03 105.19 105.64 2qs2 n GLY 68 Ca 0.17 -0.51 -0.39 0.00 0.00 0.00 0.00 46.02 45.29 2qs2 n GLY 68 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qs2 s GLU 69 N -0.98 4.41 0.27 1.61 2.02 -1.26 -4.82 118.70 119.96 2qs2 s GLU 69 Ca 0.00 0.78 0.04 0.00 0.02 0.00 0.00 54.97 55.81 2qs2 s GLU 69 Cb 0.00 -3.44 -0.03 0.00 0.10 0.00 0.00 34.13 30.76 2qs2 s GLU 69 CO 0.00 0.10 0.41 -1.58 0.02 0.00 0.00 175.26 174.21 2qs2 s TRP 70 N 0.70 3.42 0.04 1.61 0.52 -1.26 -0.84 118.94 123.12 2qs2 s TRP 70 Ca 0.35 0.02 0.00 0.00 0.02 0.00 0.00 56.10 56.49 2qs2 s TRP 70 Cb -0.17 -1.69 -0.00 0.00 -1.15 0.00 0.00 33.47 30.46 2qs2 s TRP 70 CO 0.16 0.32 0.01 0.27 0.02 0.00 0.00 176.95 177.73 2qs2 n ASN 71 N -1.51 1.26 0.00 2.95 0.23 -0.90 -4.73 115.26 112.56 2qs2 n ASN 71 Ca -0.07 -1.19 0.00 0.00 -0.53 0.00 0.00 54.58 52.79 2qs2 n ASN 71 Cb 0.57 0.07 0.00 0.00 -2.08 0.00 0.00 39.78 38.34 2qs2 n ASN 71 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2qs2 n GLY 72 N 2.69 0.98 0.33 4.83 0.00 -1.26 -1.69 105.19 111.08 2qs2 n GLY 72 Ca -0.01 -0.73 0.01 0.00 0.00 0.00 0.00 46.02 45.29 2qs2 n GLY 72 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2qs2 h MET 73 N 0.00 0.83 -0.50 1.61 2.86 -0.79 -2.17 114.93 116.77 2qs2 h MET 73 Ca 0.00 -0.06 0.02 0.00 -2.06 0.00 0.00 59.70 57.60 2qs2 h MET 73 Cb 0.00 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 31.45 2qs2 h MET 73 CO 0.00 0.57 0.30 0.28 1.06 0.00 0.00 176.91 179.12 2qs2 h VAL 74 N 0.85 1.06 -0.90 -2.22 2.07 -1.58 -2.04 116.25 113.50 2qs2 h VAL 74 Ca 0.23 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 2qs2 h VAL 74 Cb -0.06 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 30.07 2qs2 h VAL 74 CO -0.05 0.11 0.52 0.50 0.02 0.00 0.00 177.57 178.68 2qs2 h LYS 75 N 0.60 1.24 -0.94 1.57 1.63 -0.70 -1.24 116.57 118.73 2qs2 h LYS 75 Ca 0.20 -0.13 0.02 0.00 -0.85 0.00 0.00 60.65 59.89 2qs2 h LYS 75 Cb 0.01 -0.25 -0.05 0.00 -0.60 0.00 0.00 32.23 31.33 2qs2 h LYS 75 CO -0.08 0.88 0.62 0.93 -3.45 0.00 0.00 179.45 178.35 2qs2 h GLU 76 N 1.25 1.21 -0.12 1.90 4.39 -1.01 -0.21 114.58 121.99 2qs2 h GLU 76 Ca 0.32 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.93 2qs2 h GLU 76 Cb -0.02 -0.27 -0.00 0.00 -0.10 0.00 0.00 28.75 28.36 2qs2 h GLU 76 CO -0.06 0.80 -0.01 -0.07 -1.16 0.00 0.00 179.01 178.51 2qs2 h LEU 77 N 1.24 0.21 -0.92 1.33 3.38 -0.87 0.43 115.31 120.11 2qs2 h LEU 77 Ca 0.36 -0.33 0.05 0.00 0.09 0.00 0.00 57.88 58.05 2qs2 h LEU 77 Cb -0.09 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 40.54 2qs2 h LEU 77 CO -0.09 0.49 0.59 0.40 0.09 0.00 0.00 178.44 179.91 2qs2 h ILE 78 N -0.07 1.09 -0.00 1.22 2.04 -0.87 -1.67 117.51 119.25 2qs2 h ILE 78 Ca 0.03 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.52 2qs2 h ILE 78 Cb 0.39 -0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.37 2qs2 h ILE 78 CO 0.01 0.20 -0.00 0.47 0.00 0.00 0.00 178.15 178.83 2qs2 n ASP 79 N -4.55 0.06 -2.72 1.72 8.00 -0.12 -4.90 116.55 114.03 2qs2 n ASP 79 Ca 0.13 -0.95 -0.21 0.00 0.71 0.00 0.00 54.79 54.46 2qs2 n ASP 79 Cb 0.15 -0.02 0.01 0.00 -0.02 0.00 0.00 41.12 41.24 2qs2 n ASP 79 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2qs2 n HIS 80 N -0.98 -1.50 1.10 1.24 8.25 -0.63 -4.88 115.22 117.83 2qs2 n HIS 80 Ca 0.23 0.26 0.12 0.00 -0.26 0.00 0.00 57.72 58.07 2qs2 n HIS 80 Cb 0.13 -4.15 0.18 0.00 1.12 0.00 0.00 29.99 27.27 2qs2 n HIS 80 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2qs2 n ARG 81 N -3.51 2.06 -3.86 -0.41 1.74 0.11 -4.88 116.66 107.91 2qs2 n ARG 81 Ca -0.17 -1.62 -0.11 0.00 -0.77 0.00 0.00 57.85 55.17 2qs2 n ARG 81 Cb 0.65 -1.47 -0.10 0.00 -1.02 0.00 0.00 32.46 30.52 2qs2 n ARG 81 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qs2 s ALA 82 N -2.06 -0.35 -0.09 7.54 0.00 -1.01 -4.93 121.76 120.86 2qs2 s ALA 82 Ca 0.29 -0.01 0.02 0.00 0.00 0.00 0.00 51.96 52.26 2qs2 s ALA 82 Cb 0.20 0.03 -0.25 0.00 0.00 0.00 0.00 23.12 23.11 2qs2 s ALA 82 CO 0.34 -0.18 0.47 -0.25 0.00 0.00 0.00 175.76 176.13 2qs2 n ASP 83 N 1.75 1.57 -4.05 0.00 8.00 0.13 -4.48 116.55 119.47 2qs2 n ASP 83 Ca -0.21 0.28 -0.13 0.00 0.71 0.00 0.00 54.79 55.45 2qs2 n ASP 83 Cb 0.56 -0.49 -0.12 0.00 -0.02 0.00 0.00 41.12 41.06 2qs2 n ASP 83 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2qs2 s LEU 84 N -6.61 2.24 -0.26 0.64 1.43 -0.99 -4.26 118.68 110.88 2qs2 s LEU 84 Ca -0.15 -0.53 -0.03 0.00 -1.03 0.00 0.00 54.13 52.40 2qs2 s LEU 84 Cb 0.07 -0.15 0.02 0.00 0.03 0.00 0.00 46.19 46.16 2qs2 s LEU 84 CO 0.79 -0.20 -0.03 0.00 0.23 0.00 0.00 176.35 177.14 2qs2 s ALA 85 N -1.33 2.78 -0.33 4.21 0.00 0.29 -0.53 121.76 126.85 2qs2 s ALA 85 Ca -0.10 -1.47 0.01 0.00 0.00 0.00 0.00 51.96 50.40 2qs2 s ALA 85 Cb -0.10 -1.79 0.08 0.00 0.00 0.00 0.00 23.12 21.31 2qs2 s ALA 85 CO 0.00 -0.86 0.03 0.08 0.00 0.00 0.00 175.76 175.02 2qs2 s VAL 86 N 1.36 2.58 0.17 0.00 1.01 -0.86 -1.37 120.40 123.29 2qs2 s VAL 86 Ca 0.00 -1.94 -0.24 0.00 0.00 0.00 0.00 61.98 59.81 2qs2 s VAL 86 Cb -0.17 -2.70 0.06 0.00 0.00 0.00 0.00 36.38 33.56 2qs2 s VAL 86 CO -0.03 -0.38 0.89 0.00 0.00 0.00 0.00 175.10 175.58 2qs2 s ALA 87 N 1.06 -1.56 -0.91 5.51 0.00 -1.26 -4.60 121.76 120.00 2qs2 s ALA 87 Ca 0.02 0.08 -0.21 0.00 0.00 0.00 0.00 51.96 51.85 2qs2 s ALA 87 Cb -0.20 0.68 -0.12 0.00 0.00 0.00 0.00 23.12 23.48 2qs2 s ALA 87 CO -0.05 -1.02 1.94 -0.35 0.00 0.00 0.00 175.76 176.28 2qs2 n PRO 88 N -0.46 1.67 -3.86 0.00 -0.04 -1.26 -4.71 135.00 126.34 2qs2 n PRO 88 Ca -0.06 -2.07 -0.36 0.00 -0.04 0.00 0.00 63.50 60.98 2qs2 n PRO 88 Cb 0.60 -3.12 -0.14 0.00 -0.04 0.00 0.00 33.50 30.81 2qs2 n PRO 88 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2qs2 s LEU 89 N 3.24 3.17 0.12 1.53 2.96 -1.26 -5.05 118.68 123.40 2qs2 s LEU 89 Ca 0.59 -0.48 -0.30 0.00 -0.22 0.00 0.00 54.13 53.72 2qs2 s LEU 89 Cb 0.11 -1.78 -0.07 0.00 0.50 0.00 0.00 46.19 44.95 2qs2 s LEU 89 CO 0.11 -0.07 1.16 -0.89 -1.32 0.00 0.00 176.35 175.34 2qs2 s THR 90 N 1.48 3.93 -0.30 3.68 2.01 -1.26 -2.32 115.64 122.86 2qs2 s THR 90 Ca 0.05 1.51 -0.29 0.00 0.31 0.00 0.00 61.69 63.27 2qs2 s THR 90 Cb -0.15 -3.97 -0.00 0.00 0.01 0.00 0.00 72.50 68.39 2qs2 s THR 90 CO -0.01 0.19 1.36 -0.63 -0.69 0.00 0.00 174.62 174.83 2qs2 s ILE 91 N 0.41 4.05 0.10 1.82 1.01 0.18 -4.90 121.20 123.87 2qs2 s ILE 91 Ca 0.54 1.18 0.04 0.00 0.00 0.00 0.00 60.65 62.42 2qs2 s ILE 91 Cb -0.30 -4.09 -0.04 0.00 0.01 0.00 0.00 42.46 38.05 2qs2 s ILE 91 CO 0.32 -0.47 -0.12 0.42 0.00 0.00 0.00 174.94 175.10 2qs2 s THR 92 N 4.59 1.07 0.17 2.92 -4.23 -1.26 -4.64 115.64 114.26 2qs2 s THR 92 Ca 0.59 -1.62 -0.18 0.00 -1.18 0.00 0.00 61.69 59.30 2qs2 s THR 92 Cb -0.18 -1.37 0.10 0.00 1.34 0.00 0.00 72.50 72.40 2qs2 s THR 92 CO 0.25 -0.48 1.64 0.22 -0.54 0.00 0.00 174.62 175.71 2qs2 h TYR 93 N 3.64 -0.45 -0.69 3.99 3.20 -1.99 -1.29 116.97 123.37 2qs2 h TYR 93 Ca -0.38 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.52 2qs2 h TYR 93 Cb 1.19 0.26 -0.03 0.00 1.54 0.00 0.00 36.73 39.69 2qs2 h TYR 93 CO 0.64 -0.26 0.40 -0.24 -1.64 0.00 0.00 178.16 177.05 2qs2 h VAL 94 N -0.10 1.21 -0.20 1.81 3.04 -2.00 -2.79 116.25 117.22 2qs2 h VAL 94 Ca 0.20 -0.50 -0.12 0.00 -1.01 0.00 0.00 66.70 65.27 2qs2 h VAL 94 Cb 0.41 0.28 -0.01 0.00 -2.01 0.00 0.00 31.29 29.96 2qs2 h VAL 94 CO -0.48 0.22 -0.41 0.03 -1.01 0.00 0.00 177.57 175.93 2qs2 h ARG 95 N 0.95 0.45 0.00 4.17 3.08 -1.86 -2.50 114.38 118.67 2qs2 h ARG 95 Ca 0.25 -0.23 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2qs2 h ARG 95 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 2qs2 h ARG 95 CO -0.04 0.78 0.00 0.93 -1.07 0.00 0.00 179.97 180.57 2qs2 h GLU 96 N 0.38 0.00 0.00 0.04 4.39 -0.97 0.08 114.58 118.50 2qs2 h GLU 96 Ca 0.03 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 2qs2 h GLU 96 Cb 0.87 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.52 2qs2 h GLU 96 CO 0.07 0.00 -0.12 0.87 -1.16 0.00 0.00 179.01 178.67 2qs2 h LYS 97 N 0.00 0.00 0.00 2.33 1.57 -1.33 -3.38 116.57 115.76 2qs2 h LYS 97 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2qs2 h LYS 97 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.55 2qs2 h LYS 97 CO 0.00 0.12 -0.51 1.33 -0.57 0.00 0.00 179.45 179.82 2qs2 n VAL 98 N -3.38 0.00 -4.18 0.50 0.24 -0.25 -5.08 118.33 106.18 2qs2 n VAL 98 Ca -0.01 -0.05 -0.11 0.00 -2.04 0.00 0.00 64.34 62.13 2qs2 n VAL 98 Cb 0.31 0.43 -0.10 0.00 -1.47 0.00 0.00 33.84 33.01 2qs2 n VAL 98 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 2qs2 s ILE 99 N -1.13 0.18 0.29 1.34 -4.36 -0.15 -4.39 121.20 112.99 2qs2 s ILE 99 Ca 0.00 -1.95 0.07 0.00 -0.26 0.00 0.00 60.65 58.51 2qs2 s ILE 99 Cb 0.00 -2.20 -0.03 0.00 1.25 0.00 0.00 42.46 41.49 2qs2 s ILE 99 CO 0.00 -0.33 0.33 -1.81 0.24 0.00 0.00 174.94 173.37 2qs2 s ASP 100 N -3.11 5.73 0.00 4.36 1.01 0.24 -4.13 116.67 120.77 2qs2 s ASP 100 Ca 0.28 -0.24 0.01 0.00 0.71 0.00 0.00 52.55 53.32 2qs2 s ASP 100 Cb 0.07 -1.33 -0.01 0.00 1.01 0.00 0.00 42.92 42.67 2qs2 s ASP 100 CO 0.05 -0.23 -0.04 -0.36 0.21 0.00 0.00 175.17 174.79 2qs2 s PHE 101 N -2.16 0.38 1.01 4.23 0.40 -1.26 -0.91 117.98 119.67 2qs2 s PHE 101 Ca 0.38 -0.14 -0.11 0.00 -0.60 0.00 0.00 56.93 56.46 2qs2 s PHE 101 Cb -0.08 -0.24 0.20 0.00 0.51 0.00 0.00 43.02 43.40 2qs2 s PHE 101 CO 0.28 -0.02 1.09 -1.54 0.70 0.00 0.00 175.22 175.72 2qs2 s SER 102 N -0.33 2.26 0.86 1.36 1.04 0.17 -4.93 113.70 114.13 2qs2 s SER 102 Ca -0.01 1.82 -0.12 0.00 0.48 0.00 0.00 55.95 58.12 2qs2 s SER 102 Cb -0.03 -2.41 0.12 0.00 0.10 0.00 0.00 66.02 63.80 2qs2 s SER 102 CO -0.00 -3.45 1.18 -0.54 0.98 0.00 0.00 173.24 171.41 2qs2 s LYS 103 N -4.62 1.30 0.31 4.02 1.02 -1.26 -4.37 119.74 116.14 2qs2 s LYS 103 Ca 0.67 1.67 -0.29 0.00 0.02 0.00 0.00 55.97 58.04 2qs2 s LYS 103 Cb -0.23 -1.75 -0.10 0.00 -0.52 0.00 0.00 37.83 35.24 2qs2 s LYS 103 CO 0.60 -2.45 1.16 -1.25 -0.92 0.00 0.00 175.35 172.50 2qs2 s PRO 104 N -4.39 4.48 0.03 -1.68 0.04 -1.26 -4.57 135.00 127.66 2qs2 s PRO 104 Ca 0.70 1.91 0.23 0.00 0.04 0.00 0.00 61.00 63.88 2qs2 s PRO 104 Cb -0.26 -3.07 0.16 0.00 0.04 0.00 0.00 34.50 31.37 2qs2 s PRO 104 CO 0.54 0.03 1.15 1.97 0.04 0.00 0.00 177.00 180.73 2qs2 n PHE 105 N 0.91 0.16 -3.79 0.56 1.16 -0.20 -4.89 117.46 111.36 2qs2 n PHE 105 Ca -0.00 0.05 -0.13 0.00 -1.87 0.00 0.00 57.45 55.50 2qs2 n PHE 105 Cb 0.44 -0.32 -0.13 0.00 -1.61 0.00 0.00 39.48 37.86 2qs2 n PHE 105 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 2qs2 s MET 106 N -3.10 0.16 -0.08 3.97 0.00 -1.23 -5.02 119.30 114.00 2qs2 s MET 106 Ca 0.07 0.28 0.04 0.00 0.00 0.00 0.00 55.69 56.08 2qs2 s MET 106 Cb 0.16 0.01 -0.00 0.00 0.00 0.00 0.00 34.83 35.00 2qs2 s MET 106 CO 0.78 -0.07 -0.21 0.99 0.00 0.00 0.00 175.02 176.51 2qs2 s THR 107 N 0.42 1.82 0.07 10.11 2.01 -1.26 -1.21 115.64 127.59 2qs2 s THR 107 Ca -0.03 -0.90 -0.06 0.00 0.31 0.00 0.00 61.69 61.01 2qs2 s THR 107 Cb -0.04 -1.57 -0.01 0.00 0.01 0.00 0.00 72.50 70.89 2qs2 s THR 107 CO -0.02 0.51 0.12 -1.48 -0.69 0.00 0.00 174.62 173.06 2qs2 s LEU 108 N 0.24 1.74 0.02 4.42 2.34 -0.12 -4.97 118.68 122.35 2qs2 s LEU 108 Ca -0.13 -0.70 -0.15 0.00 0.06 0.00 0.00 54.13 53.21 2qs2 s LEU 108 Cb -0.16 0.76 0.02 0.00 -0.56 0.00 0.00 46.19 46.25 2qs2 s LEU 108 CO 0.06 -0.65 0.33 -0.83 -1.06 0.00 0.00 176.35 174.20 2qs2 s GLY 109 N -2.71 -0.17 0.28 -3.48 0.00 -1.26 -1.16 107.32 98.82 2qs2 s GLY 109 Ca 0.03 0.22 -0.30 0.00 0.00 0.00 0.00 44.72 44.67 2qs2 s GLY 109 CO -0.09 -0.00 1.47 1.39 0.00 0.00 0.00 173.10 175.86 2qs2 n ILE 110 N 0.87 1.18 -3.64 0.90 5.41 -1.26 -0.01 119.36 122.81 2qs2 n ILE 110 Ca -0.20 -0.29 0.00 0.00 1.00 0.00 0.00 62.75 63.26 2qs2 n ILE 110 Cb 0.58 -1.70 0.00 0.00 -0.71 0.00 0.00 39.64 37.80 2qs2 n ILE 110 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 2qs2 n SER 111 N 1.88 0.00 -4.30 4.38 2.88 0.11 0.91 113.62 119.49 2qs2 n SER 111 Ca 0.09 -0.85 -0.32 0.00 -1.33 0.00 0.00 58.87 56.45 2qs2 n SER 111 Cb 0.34 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.65 2qs2 n SER 111 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2qs2 s ILE 112 N -2.10 2.56 -0.23 2.46 1.01 -1.24 -1.41 121.20 122.25 2qs2 s ILE 112 Ca 0.00 -0.84 -0.08 0.00 0.00 0.00 0.00 60.65 59.73 2qs2 s ILE 112 Cb 0.00 -2.03 -0.04 0.00 0.01 0.00 0.00 42.46 40.40 2qs2 s ILE 112 CO 0.00 0.54 0.10 -0.22 0.00 0.00 0.00 174.94 175.36 2qs2 s LEU 113 N 0.35 3.72 0.37 2.97 2.96 0.13 -0.35 118.68 128.83 2qs2 s LEU 113 Ca -0.15 -0.06 -0.07 0.00 -0.22 0.00 0.00 54.13 53.64 2qs2 s LEU 113 Cb -0.17 -1.99 0.02 0.00 0.50 0.00 0.00 46.19 44.56 2qs2 s LEU 113 CO 0.07 0.03 0.60 -0.47 -1.32 0.00 0.00 176.35 175.26 2qs2 s TYR 114 N 1.23 0.74 0.57 5.38 5.04 -0.51 -0.86 117.35 128.93 2qs2 s TYR 114 Ca 0.05 -1.14 -0.13 0.00 -2.44 0.00 0.00 57.07 53.42 2qs2 s TYR 114 Cb -0.14 0.26 -0.06 0.00 0.35 0.00 0.00 41.96 42.37 2qs2 s TYR 114 CO 0.04 -1.32 1.00 1.03 -1.34 0.00 0.00 175.55 174.97 2qs2 s ARG 115 N -2.70 3.75 0.44 4.97 3.00 -1.26 -0.14 118.95 127.01 2qs2 s ARG 115 Ca 0.25 0.83 -0.22 0.00 0.00 0.00 0.00 55.73 56.59 2qs2 s ARG 115 Cb -0.02 -2.11 -0.10 0.00 0.00 0.00 0.00 34.95 32.72 2qs2 s ARG 115 CO 0.18 -0.43 1.00 0.15 0.00 0.00 0.00 175.30 176.20 2qs2 s LYS 116 N -4.68 4.08 0.00 3.54 1.02 -0.98 -4.39 119.74 118.33 2qs2 s LYS 116 Ca 0.57 1.31 0.00 0.00 0.02 0.00 0.00 55.97 57.87 2qs2 s LYS 116 Cb -0.11 -2.27 0.00 0.00 -0.52 0.00 0.00 37.83 34.93 2qs2 s LYS 116 CO 0.44 -0.18 0.00 0.41 -0.92 0.00 0.00 175.35 175.09 2qs2 n GLY 117 N -0.19 0.82 3.86 -3.33 0.00 -1.26 -5.07 105.19 100.02 2qs2 n GLY 117 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 2qs2 n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qs2 s THR 118 N -2.01 4.87 -1.19 2.61 -4.23 -1.26 -5.01 115.64 109.42 2qs2 s THR 118 Ca 0.00 -0.83 0.09 0.00 -1.18 0.00 0.00 61.69 59.77 2qs2 s THR 118 Cb 0.00 -3.46 0.11 0.00 1.34 0.00 0.00 72.50 70.49 2qs2 s THR 118 CO 0.00 -0.04 1.24 -0.81 -0.54 0.00 0.00 174.62 174.46 2qs2 n PRO 119 N -0.22 0.06 -2.04 3.99 -0.04 -1.26 -4.78 135.00 130.70 2qs2 n PRO 119 Ca -0.08 0.28 -0.42 0.00 -0.04 0.00 0.00 63.50 63.25 2qs2 n PRO 119 Cb 0.54 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.47 2qs2 n PRO 119 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2qs2 s ILE 120 N -2.81 3.07 0.00 0.52 -1.09 -1.26 -4.89 121.20 114.74 2qs2 s ILE 120 Ca 0.06 0.69 0.00 0.00 -2.23 0.00 0.00 60.65 59.18 2qs2 s ILE 120 Cb 0.06 -3.44 0.00 0.00 -1.58 0.00 0.00 42.46 37.50 2qs2 s ILE 120 CO 0.15 0.03 0.02 -0.67 -1.23 0.00 0.00 174.94 173.25 2qs2 n ASP 121 N 4.52 0.04 -3.28 3.58 2.03 -1.26 -4.91 116.55 117.27 2qs2 n ASP 121 Ca 0.13 -0.27 -0.08 0.00 0.52 0.00 0.00 54.79 55.10 2qs2 n ASP 121 Cb 0.41 0.24 0.01 0.00 -0.72 0.00 0.00 41.12 41.05 2qs2 n ASP 121 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2qs2 s SER 122 N -0.24 -0.09 0.30 1.67 1.04 -1.26 -2.82 113.70 112.30 2qs2 s SER 122 Ca 0.00 -0.95 0.08 0.00 0.48 0.00 0.00 55.95 55.56 2qs2 s SER 122 Cb 0.00 0.81 0.47 0.00 0.10 0.00 0.00 66.02 67.40 2qs2 s SER 122 CO 0.00 -1.56 1.70 0.00 0.98 0.00 0.00 173.24 174.36 2qs2 h ALA 123 N 2.00 1.12 -0.46 5.32 0.00 -1.97 -2.81 119.26 122.47 2qs2 h ALA 123 Ca -0.27 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.19 2qs2 h ALA 123 Cb 1.25 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 2qs2 h ALA 123 CO 0.34 0.60 0.21 -0.44 0.00 0.00 0.00 179.25 179.96 2qs2 h ASP 124 N 0.14 0.57 -0.33 0.00 3.45 -1.96 -0.32 116.42 117.96 2qs2 h ASP 124 Ca 0.01 -0.05 -0.09 0.00 0.43 0.00 0.00 57.03 57.33 2qs2 h ASP 124 Cb 0.85 -0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 39.46 2qs2 h ASP 124 CO 0.07 0.50 -0.11 0.44 -1.57 0.00 0.00 179.24 178.56 2qs2 h ASP 125 N 0.64 0.76 -0.06 6.45 3.32 -1.90 -3.01 116.42 122.62 2qs2 h ASP 125 Ca 0.16 -0.22 -0.20 0.00 0.02 0.00 0.00 57.03 56.78 2qs2 h ASP 125 Cb 0.08 -0.20 0.01 0.00 0.22 0.00 0.00 39.33 39.44 2qs2 h ASP 125 CO -0.02 0.89 -0.75 -0.07 -1.72 0.00 0.00 179.24 177.57 2qs2 h LEU 126 N 0.69 0.77 -1.13 1.55 3.38 -1.42 -3.36 115.31 115.79 2qs2 h LEU 126 Ca 0.12 -0.69 0.05 0.00 0.09 0.00 0.00 57.88 57.44 2qs2 h LEU 126 Cb 0.58 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.05 2qs2 h LEU 126 CO 0.04 1.35 0.59 0.00 0.09 0.00 0.00 178.44 180.51 2qs2 h ALA 127 N 0.43 1.46 -0.34 1.53 0.00 -1.00 -2.80 119.26 118.55 2qs2 h ALA 127 Ca -0.08 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2qs2 h ALA 127 Cb 1.41 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2qs2 h ALA 127 CO 0.15 0.42 0.00 0.36 0.00 0.00 0.00 179.25 180.18 2qs2 n LYS 128 N -4.47 2.48 -4.11 0.00 2.85 -1.14 -4.87 118.16 108.91 2qs2 n LYS 128 Ca 0.13 -1.51 -0.10 0.00 -1.05 0.00 0.00 58.31 55.78 2qs2 n LYS 128 Cb 0.15 -1.61 -0.09 0.00 -0.65 0.00 0.00 35.03 32.83 2qs2 n LYS 128 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 177.40 178.49 2qs2 s GLN 129 N -1.71 1.19 0.00 -1.58 1.03 -1.06 -5.08 119.66 112.46 2qs2 s GLN 129 Ca 0.27 -1.43 0.00 0.00 0.04 0.00 0.00 55.36 54.24 2qs2 s GLN 129 Cb 0.18 0.32 0.00 0.00 0.03 0.00 0.00 33.01 33.54 2qs2 s GLN 129 CO 0.13 -0.41 0.00 2.41 -2.54 0.00 0.00 175.29 174.87 2qs2 n THR 130 N -0.24 0.00 0.06 3.63 -1.04 -1.26 -4.81 114.28 110.62 2qs2 n THR 130 Ca -0.02 -0.13 -0.12 0.00 -2.04 0.00 0.00 64.05 61.73 2qs2 n THR 130 Cb 0.64 0.63 -0.07 0.00 -1.82 0.00 0.00 70.33 69.71 2qs2 n THR 130 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 2qs2 h LYS 131 N 0.00 -0.07 -5.72 -2.82 1.79 -1.98 -3.39 116.57 104.38 2qs2 h LYS 131 Ca 0.00 0.00 -0.59 0.00 -2.18 0.00 0.00 60.65 57.88 2qs2 h LYS 131 Cb 0.00 0.02 -0.09 0.00 -1.58 0.00 0.00 32.23 30.58 2qs2 h LYS 131 CO 0.00 -0.05 0.22 0.42 -1.08 0.00 0.00 179.45 178.97 2qs2 s ILE 132 N -6.18 4.96 0.23 1.86 1.01 -1.26 -5.01 121.20 116.81 2qs2 s ILE 132 Ca -0.13 1.32 -0.12 0.00 0.00 0.00 0.00 60.65 61.72 2qs2 s ILE 132 Cb 0.06 -4.01 -0.08 0.00 0.01 0.00 0.00 42.46 38.45 2qs2 s ILE 132 CO 0.66 0.06 0.59 -0.70 0.00 0.00 0.00 174.94 175.55 2qs2 s GLU 133 N 2.14 3.89 -0.01 2.79 2.12 -1.04 -4.94 118.70 123.65 2qs2 s GLU 133 Ca 0.31 0.41 -0.09 0.00 0.36 0.00 0.00 54.97 55.97 2qs2 s GLU 133 Cb -0.16 -2.67 0.01 0.00 0.26 0.00 0.00 34.13 31.57 2qs2 s GLU 133 CO 0.10 0.32 0.18 1.52 -0.54 0.00 0.00 175.26 176.84 2qs2 s TYR 134 N -1.77 -0.05 0.00 5.30 -0.85 -1.26 -0.50 117.35 118.22 2qs2 s TYR 134 Ca 0.47 0.06 0.00 0.00 -0.52 0.00 0.00 57.07 57.07 2qs2 s TYR 134 Cb -0.12 0.00 0.00 0.00 0.38 0.00 0.00 41.96 42.22 2qs2 s TYR 134 CO 0.20 -0.28 0.00 0.41 -1.52 0.00 0.00 175.55 174.36 2qs2 n GLY 135 N 1.66 1.61 3.24 5.49 0.00 -1.05 -4.65 105.19 111.49 2qs2 n GLY 135 Ca -0.21 -0.84 -0.14 0.00 0.00 0.00 0.00 46.02 44.83 2qs2 n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qs2 s ALA 136 N -1.00 1.39 0.21 4.61 0.00 -1.25 -0.53 121.76 125.19 2qs2 s ALA 136 Ca 0.00 -1.76 -0.31 0.00 0.00 0.00 0.00 51.96 49.89 2qs2 s ALA 136 Cb 0.00 1.30 -0.10 0.00 0.00 0.00 0.00 23.12 24.32 2qs2 s ALA 136 CO 0.00 -0.56 1.53 0.08 0.00 0.00 0.00 175.76 176.82 2qs2 s VAL 137 N -3.99 2.55 0.16 0.00 1.01 -1.26 -2.00 120.40 116.88 2qs2 s VAL 137 Ca 0.39 0.42 -0.32 0.00 0.00 0.00 0.00 61.98 62.47 2qs2 s VAL 137 Cb 0.07 -3.27 -0.11 0.00 0.00 0.00 0.00 36.38 33.07 2qs2 s VAL 137 CO 0.14 0.05 1.71 -0.60 0.00 0.00 0.00 175.10 176.40 2qs2 s ARG 138 N 0.47 4.15 -1.15 2.72 3.52 0.57 -2.84 118.95 126.39 2qs2 s ARG 138 Ca 0.66 2.53 0.00 0.00 -0.13 0.00 0.00 55.73 58.79 2qs2 s ARG 138 Cb -0.44 -3.28 0.00 0.00 -1.56 0.00 0.00 34.95 29.68 2qs2 s ARG 138 CO 0.37 -0.75 0.00 -0.25 -0.81 0.00 0.00 175.30 173.86 2qs2 n ASP 139 N 4.58 -4.66 -4.67 -2.12 8.00 -1.26 -4.99 116.55 111.42 2qs2 n ASP 139 Ca 0.16 0.27 -0.24 0.00 0.71 0.00 0.00 54.79 55.69 2qs2 n ASP 139 Cb 0.37 -3.11 0.11 0.00 -0.02 0.00 0.00 41.12 38.47 2qs2 n ASP 139 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2qs2 s GLY 140 N -2.70 1.76 0.26 0.44 0.00 -1.13 -4.92 107.32 101.03 2qs2 s GLY 140 Ca 0.00 -1.78 -0.05 0.00 0.00 0.00 0.00 44.72 42.89 2qs2 s GLY 140 CO 0.00 -1.20 1.91 1.48 0.00 0.00 0.00 173.10 175.29 2qs2 h SER 141 N -0.53 1.05 -0.38 1.64 4.64 -1.95 -1.85 113.55 116.18 2qs2 h SER 141 Ca -0.36 -0.06 -0.06 0.00 -0.47 0.00 0.00 61.79 60.84 2qs2 h SER 141 Cb 1.27 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 63.08 2qs2 h SER 141 CO 0.39 0.81 -0.01 0.74 -0.87 0.00 0.00 176.83 177.89 2qs2 h THR 142 N 1.21 1.26 -0.47 2.95 2.02 -1.93 -0.24 112.91 117.72 2qs2 h THR 142 Ca 0.31 -1.02 -0.01 0.00 0.77 0.00 0.00 66.41 66.47 2qs2 h THR 142 Cb -0.05 1.18 -0.02 0.00 -1.74 0.00 0.00 68.15 67.52 2qs2 h THR 142 CO -0.06 0.34 0.25 -0.03 0.37 0.00 0.00 175.52 176.39 2qs2 h MET 143 N 0.49 0.65 -0.89 6.66 -1.53 -1.71 -2.94 114.93 115.66 2qs2 h MET 143 Ca 0.10 -0.08 -0.01 0.00 -3.44 0.00 0.00 59.70 56.27 2qs2 h MET 143 Cb 0.49 -0.13 -0.04 0.00 -0.55 0.00 0.00 31.60 31.37 2qs2 h MET 143 CO 0.02 0.53 0.51 1.15 0.14 0.00 0.00 176.91 179.25 2qs2 h THR 144 N 0.61 1.25 0.05 -0.77 2.02 -1.14 -1.10 112.91 113.83 2qs2 h THR 144 Ca 0.16 -0.61 0.03 0.00 0.77 0.00 0.00 66.41 66.76 2qs2 h THR 144 Cb 0.07 0.03 -0.05 0.00 -1.74 0.00 0.00 68.15 66.45 2qs2 h THR 144 CO -0.02 0.28 -0.41 0.15 0.37 0.00 0.00 175.52 175.89 2qs2 h PHE 145 N 1.25 -1.15 -0.35 3.16 3.57 -0.89 -0.57 116.94 121.95 2qs2 h PHE 145 Ca 0.32 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.86 2qs2 h PHE 145 Cb 0.00 0.50 -0.02 0.00 2.79 0.00 0.00 35.95 39.22 2qs2 h PHE 145 CO 0.01 -0.50 0.23 0.74 -2.23 0.00 0.00 178.31 176.56 2qs2 h PHE 146 N -0.59 0.42 -0.19 0.41 -1.00 -1.30 -0.50 116.94 114.18 2qs2 h PHE 146 Ca 0.04 0.01 -0.12 0.00 2.81 0.00 0.00 57.97 60.71 2qs2 h PHE 146 Cb 0.65 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 40.06 2qs2 h PHE 146 CO -0.39 0.26 -0.38 -0.22 -1.61 0.00 0.00 178.31 175.97 2qs2 h LYS 147 N 0.45 0.43 0.00 1.51 3.11 -0.64 -3.21 116.57 118.23 2qs2 h LYS 147 Ca 0.13 -0.20 0.00 0.00 -2.81 0.00 0.00 60.65 57.77 2qs2 h LYS 147 Cb -0.03 -0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.20 2qs2 h LYS 147 CO -0.03 0.75 -0.90 1.63 -2.81 0.00 0.00 179.45 178.09 2qs2 n LYS 148 N -4.04 0.20 -2.14 1.90 5.02 -0.28 -4.98 118.16 113.84 2qs2 n LYS 148 Ca -0.01 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.87 2qs2 n LYS 148 Cb 0.48 -1.57 -0.02 0.00 -0.02 0.00 0.00 35.03 33.90 2qs2 n LYS 148 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2qs2 s SER 149 N -3.64 6.78 0.00 4.39 0.15 -0.26 -4.93 113.70 116.18 2qs2 s SER 149 Ca 0.06 2.65 0.15 0.00 0.70 0.00 0.00 55.95 59.51 2qs2 s SER 149 Cb 0.15 -2.65 0.01 0.00 -1.71 0.00 0.00 66.02 61.83 2qs2 s SER 149 CO 0.79 -0.53 0.84 0.29 1.20 0.00 0.00 173.24 175.83 2qs2 n LYS 150 N 0.77 1.67 -2.09 5.44 5.02 -1.26 -4.64 118.16 123.07 2qs2 n LYS 150 Ca 0.00 -0.87 -0.42 0.00 -2.02 0.00 0.00 58.31 55.00 2qs2 n LYS 150 Cb 0.42 -1.25 -0.03 0.00 -0.02 0.00 0.00 35.03 34.15 2qs2 n LYS 150 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2qs2 s ILE 151 N -1.74 3.32 0.19 -0.18 1.01 -1.26 -4.91 121.20 117.63 2qs2 s ILE 151 Ca 0.13 0.80 -0.11 0.00 0.00 0.00 0.00 60.65 61.48 2qs2 s ILE 151 Cb 0.12 -3.52 0.11 0.00 0.01 0.00 0.00 42.46 39.19 2qs2 s ILE 151 CO 0.35 0.01 1.77 0.77 0.00 0.00 0.00 174.94 177.85 2qs2 h SER 152 N 7.73 0.35 0.30 3.58 4.64 -1.99 0.15 113.55 128.32 2qs2 h SER 152 Ca -0.41 0.05 -0.05 0.00 -0.47 0.00 0.00 61.79 60.90 2qs2 h SER 152 Cb 1.19 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 2qs2 h SER 152 CO 0.91 0.23 -0.26 0.00 -0.87 0.00 0.00 176.83 176.83 2qs2 h THR 153 N 0.50 1.11 0.00 2.95 1.03 -2.00 -1.33 112.91 115.17 2qs2 h THR 153 Ca 0.26 -0.92 -0.06 0.00 -0.01 0.00 0.00 66.41 65.69 2qs2 h THR 153 Cb 0.22 1.51 -0.01 0.00 -1.07 0.00 0.00 68.15 68.80 2qs2 h THR 153 CO -0.21 0.26 -0.86 1.88 -0.01 0.00 0.00 175.52 176.57 2qs2 h TYR 154 N 0.00 0.00 -0.44 0.00 0.99 -1.75 -2.63 116.97 113.14 2qs2 h TYR 154 Ca -0.00 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.60 2qs2 h TYR 154 Cb 0.48 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 38.20 2qs2 h TYR 154 CO 0.00 0.22 -0.23 0.93 -0.00 0.00 0.00 178.16 179.08 2qs2 h GLU 155 N 0.00 0.93 -0.37 4.88 5.08 -0.56 0.14 114.58 124.68 2qs2 h GLU 155 Ca -0.04 -0.41 -0.12 0.00 -1.00 0.00 0.00 59.36 57.78 2qs2 h GLU 155 Cb 1.20 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 2qs2 h GLU 155 CO 0.02 1.08 -0.25 -0.22 -1.00 0.00 0.00 179.01 178.63 2qs2 h LYS 156 N 0.77 0.75 -0.55 2.33 3.64 -1.32 -0.35 116.57 121.84 2qs2 h LYS 156 Ca 0.10 -0.32 -0.11 0.00 -1.27 0.00 0.00 60.65 59.05 2qs2 h LYS 156 Cb 0.80 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.58 2qs2 h LYS 156 CO 0.07 0.93 -0.10 0.52 -2.27 0.00 0.00 179.45 178.60 2qs2 h MET 157 N 0.65 1.04 -0.58 1.90 2.86 -1.40 -2.35 114.93 117.05 2qs2 h MET 157 Ca 0.08 -0.38 -0.10 0.00 -2.06 0.00 0.00 59.70 57.24 2qs2 h MET 157 Cb 0.77 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.34 2qs2 h MET 157 CO 0.06 1.08 -0.02 2.35 1.06 0.00 0.00 176.91 181.43 2qs2 h TRP 158 N 0.92 1.14 -0.57 -0.22 -0.00 -0.83 -1.73 115.95 114.65 2qs2 h TRP 158 Ca 0.14 -0.20 0.07 0.00 -0.00 0.00 0.00 58.89 58.90 2qs2 h TRP 158 Cb 0.67 -0.29 -0.06 0.00 -0.00 0.00 0.00 29.16 29.48 2qs2 h TRP 158 CO 0.05 1.01 0.25 0.00 -0.00 0.00 0.00 178.44 179.75 2qs2 h ALA 159 N 1.01 0.74 -0.48 2.65 0.00 -0.92 0.21 119.26 122.48 2qs2 h ALA 159 Ca 0.16 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.05 2qs2 h ALA 159 Cb 0.58 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2qs2 h ALA 159 CO 0.03 -0.13 -0.01 0.35 0.00 0.00 0.00 179.25 179.49 2qs2 h PHE 160 N 0.46 0.92 -0.60 0.00 3.57 -1.30 -1.65 116.94 118.35 2qs2 h PHE 160 Ca 0.27 -0.16 -0.10 0.00 3.53 0.00 0.00 57.97 61.51 2qs2 h PHE 160 Cb 0.27 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 38.74 2qs2 h PHE 160 CO -0.13 0.88 -0.01 0.52 -2.23 0.00 0.00 178.31 177.34 2qs2 h MET 161 N 0.70 1.07 0.04 1.11 2.86 -0.85 -2.45 114.93 117.41 2qs2 h MET 161 Ca 0.13 -0.34 -0.25 0.00 -2.06 0.00 0.00 59.70 57.18 2qs2 h MET 161 Cb 0.52 -0.10 0.01 0.00 0.06 0.00 0.00 31.60 32.09 2qs2 h MET 161 CO 0.03 1.04 -1.05 0.66 1.06 0.00 0.00 176.91 178.65 2qs2 h SER 162 N 0.97 0.68 0.50 1.22 4.64 -0.56 -3.00 113.55 117.99 2qs2 h SER 162 Ca 0.17 -0.57 -0.15 0.00 -0.47 0.00 0.00 61.79 60.76 2qs2 h SER 162 Cb 0.57 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.43 2qs2 h SER 162 CO 0.03 1.38 -0.67 0.77 -0.87 0.00 0.00 176.83 177.47 2qs2 h SER 163 N 0.26 0.18 -1.00 4.97 4.64 -1.34 -2.85 113.55 118.42 2qs2 h SER 163 Ca -0.12 -0.12 -0.63 0.00 -0.47 0.00 0.00 61.79 60.46 2qs2 h SER 163 Cb 1.71 -0.05 -0.30 0.00 -0.31 0.00 0.00 62.40 63.45 2qs2 h SER 163 CO 0.19 0.80 0.80 -1.14 -0.87 0.00 0.00 176.83 176.61 2qs2 n ARG 164 N -3.80 2.56 -0.22 4.77 3.00 -0.92 -4.83 116.66 117.22 2qs2 n ARG 164 Ca -0.02 -3.21 -0.03 0.00 -0.00 0.00 0.00 57.85 54.59 2qs2 n ARG 164 Cb 0.66 -2.25 0.03 0.00 0.00 0.00 0.00 32.46 30.90 2qs2 n ARG 164 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.63 178.00 2qs2 h GLN 165 N 1.69 -0.10 -0.04 -0.14 -0.00 -1.35 0.20 115.11 115.37 2qs2 h GLN 165 Ca 0.62 0.01 -0.06 0.00 -0.00 0.00 0.00 58.65 59.21 2qs2 h GLN 165 Cb 1.46 0.02 -0.01 0.00 0.00 0.00 0.00 27.48 28.95 2qs2 h GLN 165 CO 1.44 -0.07 -0.27 -0.56 0.00 0.00 0.00 178.83 179.37 2qs2 h GLN 166 N -0.10 0.07 0.00 1.69 -0.00 -1.88 -3.09 115.11 111.80 2qs2 h GLN 166 Ca 0.27 -0.02 -0.35 0.00 -0.00 0.00 0.00 58.65 58.56 2qs2 h GLN 166 Cb 0.54 -0.01 -0.06 0.00 -0.00 0.00 0.00 27.48 27.96 2qs2 h GLN 166 CO -0.71 0.33 -2.21 -1.13 -0.00 0.00 0.00 178.83 175.11 2qs2 n SER 167 N -4.20 1.94 -0.19 0.06 3.41 -0.92 -4.66 113.62 109.05 2qs2 n SER 167 Ca -0.02 0.10 -0.01 0.00 -0.26 0.00 0.00 58.87 58.68 2qs2 n SER 167 Cb 0.33 -0.51 0.21 0.00 -0.26 0.00 0.00 64.21 63.99 2qs2 n SER 167 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qs2 h ALA 168 N -0.44 1.34 -2.91 7.33 0.00 -0.73 -3.41 119.26 120.44 2qs2 h ALA 168 Ca -0.52 -0.12 -0.60 0.00 0.00 0.00 0.00 54.91 53.68 2qs2 h ALA 168 Cb 1.59 -0.28 -0.08 0.00 0.00 0.00 0.00 17.79 19.03 2qs2 h ALA 168 CO -0.22 0.53 -0.25 -0.51 0.00 0.00 0.00 179.25 178.80 2qs2 s LEU 169 N -9.66 4.32 0.35 0.00 1.43 -1.17 -3.80 118.68 110.16 2qs2 s LEU 169 Ca -0.11 0.71 0.07 0.00 -1.03 0.00 0.00 54.13 53.77 2qs2 s LEU 169 Cb 0.17 -2.50 -0.02 0.00 0.03 0.00 0.00 46.19 43.87 2qs2 s LEU 169 CO 0.79 0.15 0.39 0.68 0.23 0.00 0.00 176.35 178.59 2qs2 s VAL 170 N 0.02 3.58 0.05 -1.59 -7.23 -0.85 -4.84 120.40 109.56 2qs2 s VAL 170 Ca 0.21 -1.20 -0.17 0.00 -1.81 0.00 0.00 61.98 59.01 2qs2 s VAL 170 Cb -0.14 -3.23 -0.18 0.00 0.56 0.00 0.00 36.38 33.39 2qs2 s VAL 170 CO 0.08 -0.13 1.24 0.50 -0.31 0.00 0.00 175.10 176.47 2qs2 h LYS 171 N 1.04 0.57 -3.71 4.82 3.64 -1.94 0.16 116.57 121.16 2qs2 h LYS 171 Ca -0.44 -0.47 -0.11 0.00 -1.27 0.00 0.00 60.65 58.36 2qs2 h LYS 171 Cb 1.26 0.10 -0.08 0.00 -0.41 0.00 0.00 32.23 33.10 2qs2 h LYS 171 CO 0.55 1.10 -0.10 0.54 -2.27 0.00 0.00 179.45 179.27 2qs2 s ASN 172 N -6.77 0.17 0.23 4.20 2.20 -1.26 -4.51 114.94 109.21 2qs2 s ASN 172 Ca -0.12 -1.09 -0.08 0.00 -0.94 0.00 0.00 52.86 50.63 2qs2 s ASN 172 Cb 0.06 0.63 0.24 0.00 -2.00 0.00 0.00 41.25 40.18 2qs2 s ASN 172 CO 0.84 -1.24 1.89 0.28 -2.94 0.00 0.00 177.10 175.93 2qs2 h SER 173 N 2.19 0.95 -0.77 3.54 0.02 -1.99 -0.96 113.55 116.53 2qs2 h SER 173 Ca -0.27 -0.01 0.03 0.00 -0.84 0.00 0.00 61.79 60.69 2qs2 h SER 173 Cb 1.25 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 63.52 2qs2 h SER 173 CO 0.37 0.66 0.49 0.44 -1.14 0.00 0.00 176.83 177.65 2qs2 h ASP 174 N 1.11 0.82 -0.46 3.07 3.32 -1.99 0.37 116.42 122.66 2qs2 h ASP 174 Ca 0.33 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.33 2qs2 h ASP 174 Cb -0.05 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 2qs2 h ASP 174 CO -0.10 0.57 0.12 -0.08 -1.72 0.00 0.00 179.24 178.03 2qs2 h GLU 175 N 0.96 0.73 -0.79 3.56 4.81 -1.87 -2.47 114.58 119.51 2qs2 h GLU 175 Ca 0.31 -0.17 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 2qs2 h GLU 175 Cb -0.00 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.25 2qs2 h GLU 175 CO -0.11 0.72 0.35 0.78 -0.73 0.00 0.00 179.01 180.03 2qs2 h GLY 176 N 0.61 1.23 0.97 1.92 0.00 -0.57 -0.35 103.07 106.89 2qs2 h GLY 176 Ca 0.14 -0.63 -0.03 0.00 0.00 0.00 0.00 47.33 46.81 2qs2 h GLY 176 CO 0.00 0.60 0.19 -2.22 0.00 0.00 0.00 176.54 175.11 2qs2 h ILE 177 N 1.12 1.22 -0.62 2.60 2.04 -0.93 -1.83 117.51 121.11 2qs2 h ILE 177 Ca 0.27 -0.71 -0.03 0.00 1.00 0.00 0.00 64.86 65.39 2qs2 h ILE 177 Cb 0.16 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 2qs2 h ILE 177 CO -0.03 0.27 0.25 -0.61 0.00 0.00 0.00 178.15 178.02 2qs2 h GLN 178 N 0.70 0.90 -0.42 2.37 5.75 -1.06 -0.73 115.11 122.62 2qs2 h GLN 178 Ca 0.17 -0.14 -0.08 0.00 -0.15 0.00 0.00 58.65 58.45 2qs2 h GLN 178 Cb 0.22 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.60 2qs2 h GLN 178 CO -0.01 0.73 -0.08 0.00 -2.65 0.00 0.00 178.83 176.82 2qs2 h ARG 179 N 0.88 0.73 -0.38 1.69 2.47 -0.88 -1.05 114.38 117.85 2qs2 h ARG 179 Ca 0.21 -0.23 -0.04 0.00 -1.26 0.00 0.00 59.98 58.66 2qs2 h ARG 179 Cb 0.17 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 28.40 2qs2 h ARG 179 CO -0.02 0.80 0.08 0.28 0.56 0.00 0.00 179.97 181.67 2qs2 h VAL 180 N 0.67 1.23 0.00 2.04 2.07 -0.83 -1.84 116.25 119.60 2qs2 h VAL 180 Ca 0.12 -0.80 -0.08 0.00 0.82 0.00 0.00 66.70 66.76 2qs2 h VAL 180 Cb 0.53 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 2qs2 h VAL 180 CO 0.03 0.27 -0.38 -0.07 0.02 0.00 0.00 177.57 177.45 2qs2 h LEU 181 N 0.47 0.00 0.00 2.57 3.38 -0.83 -3.37 115.31 117.53 2qs2 h LEU 181 Ca 0.12 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.85 2qs2 h LEU 181 Cb 0.33 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.03 2qs2 h LEU 181 CO 0.00 0.38 -1.88 0.35 0.09 0.00 0.00 178.44 177.38 2qs2 n THR 182 N -3.55 0.89 -4.64 0.22 -2.24 -0.42 -5.05 114.28 99.49 2qs2 n THR 182 Ca -0.00 -0.47 -0.29 0.00 -2.27 0.00 0.00 64.05 61.02 2qs2 n THR 182 Cb 0.51 -0.81 -0.09 0.00 -2.10 0.00 0.00 70.33 67.84 2qs2 n THR 182 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2qs2 s THR 183 N -2.31 1.40 -1.20 4.28 -4.23 -0.69 -5.06 115.64 107.82 2qs2 s THR 183 Ca -0.12 -2.00 -0.20 0.00 -1.18 0.00 0.00 61.69 58.19 2qs2 s THR 183 Cb 0.04 -2.57 0.05 0.00 1.34 0.00 0.00 72.50 71.36 2qs2 s THR 183 CO 0.47 0.00 1.68 -0.62 -0.54 0.00 0.00 174.62 175.61 2qs2 s ASP 184 N -3.73 6.55 -0.04 3.99 2.15 -1.26 -4.55 116.67 119.78 2qs2 s ASP 184 Ca 0.23 -2.06 -0.04 0.00 0.43 0.00 0.00 52.55 51.11 2qs2 s ASP 184 Cb 0.06 -2.58 0.01 0.00 -0.30 0.00 0.00 42.92 40.11 2qs2 s ASP 184 CO 0.12 -1.46 0.12 -0.47 -0.17 0.00 0.00 175.17 173.30 2qs2 s TYR 185 N 5.16 -0.12 -0.12 -5.34 5.04 -1.26 -2.49 117.35 118.21 2qs2 s TYR 185 Ca 0.53 0.30 0.02 0.00 -2.44 0.00 0.00 57.07 55.48 2qs2 s TYR 185 Cb 0.02 0.04 -0.01 0.00 0.35 0.00 0.00 41.96 42.37 2qs2 s TYR 185 CO 0.03 -0.07 -0.18 0.00 -1.34 0.00 0.00 175.55 174.00 2qs2 s ALA 186 N 0.03 2.41 -0.19 3.97 0.00 0.34 -4.45 121.76 123.88 2qs2 s ALA 186 Ca -0.00 -0.93 -0.10 0.00 0.00 0.00 0.00 51.96 50.93 2qs2 s ALA 186 Cb -0.01 -1.04 -0.05 0.00 0.00 0.00 0.00 23.12 22.03 2qs2 s ALA 186 CO 0.00 0.25 0.13 -1.17 0.00 0.00 0.00 175.76 174.97 2qs2 s LEU 187 N 0.38 4.23 -0.27 0.00 2.96 -0.04 -2.54 118.68 123.41 2qs2 s LEU 187 Ca -0.14 0.27 -0.20 0.00 -0.22 0.00 0.00 54.13 53.83 2qs2 s LEU 187 Cb -0.17 -2.09 -0.02 0.00 0.50 0.00 0.00 46.19 44.41 2qs2 s LEU 187 CO 0.07 0.21 0.62 -0.76 -1.32 0.00 0.00 176.35 175.16 2qs2 s LEU 188 N 0.18 4.08 0.22 -0.68 2.01 0.32 0.21 118.68 125.01 2qs2 s LEU 188 Ca 0.09 0.63 -0.16 0.00 0.01 0.00 0.00 54.13 54.70 2qs2 s LEU 188 Cb -0.11 -2.82 0.02 0.00 0.01 0.00 0.00 46.19 43.28 2qs2 s LEU 188 CO -0.01 -0.38 0.53 0.00 1.01 0.00 0.00 176.35 177.50 2qs2 s MET 189 N 2.50 1.49 0.35 1.70 0.23 -0.50 -4.53 119.30 120.54 2qs2 s MET 189 Ca 0.25 -1.01 -0.28 0.00 -1.03 0.00 0.00 55.69 53.62 2qs2 s MET 189 Cb -0.15 0.51 -0.11 0.00 -1.53 0.00 0.00 34.83 33.55 2qs2 s MET 189 CO 0.09 -0.63 1.38 -1.21 -2.03 0.00 0.00 175.02 172.61 2qs2 s GLU 190 N -3.93 4.26 0.32 3.16 0.41 -1.26 0.10 118.70 121.76 2qs2 s GLU 190 Ca 0.14 2.35 0.06 0.00 -0.41 0.00 0.00 54.97 57.11 2qs2 s GLU 190 Cb -0.02 -3.03 0.71 0.00 -1.78 0.00 0.00 34.13 30.02 2qs2 s GLU 190 CO 0.02 -0.32 1.83 0.66 -0.49 0.00 0.00 175.26 176.96 2qs2 h SER 191 N 3.24 0.78 -0.35 -0.19 4.64 -0.74 -0.80 113.55 120.12 2qs2 h SER 191 Ca -0.50 0.06 0.05 0.00 -0.47 0.00 0.00 61.79 60.93 2qs2 h SER 191 Cb 1.23 -0.09 -0.04 0.00 -0.31 0.00 0.00 62.40 63.19 2qs2 h SER 191 CO 0.65 0.36 0.10 0.71 -0.87 0.00 0.00 176.83 177.78 2qs2 h THR 192 N 0.81 0.86 -0.58 2.95 1.35 -1.91 -0.95 112.91 115.44 2qs2 h THR 192 Ca 0.51 -0.08 -0.08 0.00 -0.55 0.00 0.00 66.41 66.22 2qs2 h THR 192 Cb 0.73 0.61 -0.02 0.00 -1.73 0.00 0.00 68.15 67.73 2qs2 h THR 192 CO -0.28 0.04 0.06 0.28 -0.25 0.00 0.00 175.52 175.37 2qs2 h SER 193 N 0.23 0.95 -0.39 5.36 0.02 -1.55 -1.77 113.55 116.40 2qs2 h SER 193 Ca 0.16 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2qs2 h SER 193 Cb 0.16 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 2qs2 h SER 193 CO -0.19 0.99 0.25 0.40 -1.14 0.00 0.00 176.83 177.14 2qs2 h ILE 194 N 0.87 1.11 -0.56 3.27 2.04 -1.14 -0.75 117.51 122.36 2qs2 h ILE 194 Ca 0.17 -0.23 0.04 0.00 1.00 0.00 0.00 64.86 65.85 2qs2 h ILE 194 Cb 0.46 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 37.06 2qs2 h ILE 194 CO 0.02 0.11 0.31 -0.33 0.00 0.00 0.00 178.15 178.25 2qs2 h GLU 195 N 0.53 0.57 -0.56 2.37 5.08 -1.00 0.12 114.58 121.69 2qs2 h GLU 195 Ca 0.14 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 2qs2 h GLU 195 Cb -0.04 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.06 2qs2 h GLU 195 CO -0.03 0.38 0.27 -0.92 -1.00 0.00 0.00 179.01 177.71 2qs2 h TYR 196 N 0.59 0.81 -0.15 4.33 3.20 -0.99 -2.54 116.97 122.22 2qs2 h TYR 196 Ca 0.24 -0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.98 2qs2 h TYR 196 Cb 0.11 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.13 2qs2 h TYR 196 CO -0.08 0.62 -0.25 0.28 -1.64 0.00 0.00 178.16 177.09 2qs2 h VAL 197 N 0.76 1.36 0.00 1.81 2.07 -0.76 -3.24 116.25 118.26 2qs2 h VAL 197 Ca 0.19 -1.49 -0.05 0.00 0.82 0.00 0.00 66.70 66.18 2qs2 h VAL 197 Cb 0.11 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.84 2qs2 h VAL 197 CO -0.03 0.44 -0.23 0.71 0.02 0.00 0.00 177.57 178.48 2qs2 h THR 198 N 0.05 0.97 0.00 2.57 1.35 -0.76 0.21 112.91 117.31 2qs2 h THR 198 Ca 0.01 -0.85 -0.03 0.00 -0.55 0.00 0.00 66.41 64.99 2qs2 h THR 198 Cb 0.83 1.49 -0.00 0.00 -1.73 0.00 0.00 68.15 68.73 2qs2 h THR 198 CO 0.06 0.23 -0.12 1.56 -0.25 0.00 0.00 175.52 176.99 2qs2 h GLN 199 N 0.00 0.00 0.00 4.72 1.08 -1.49 -3.20 115.11 116.22 2qs2 h GLN 199 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2qs2 h GLN 199 Cb 0.47 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.90 2qs2 h GLN 199 CO 0.03 0.12 -0.80 0.54 -0.95 0.00 0.00 178.83 177.77 2qs2 n ARG 200 N -3.45 2.25 -3.83 1.46 1.74 -0.04 -4.11 116.66 110.68 2qs2 n ARG 200 Ca -0.01 -0.02 -0.30 0.00 -0.77 0.00 0.00 57.85 56.75 2qs2 n ARG 200 Cb 0.28 -1.16 -0.15 0.00 -1.02 0.00 0.00 32.46 30.41 2qs2 n ARG 200 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2qs2 s ASN 201 N -2.48 3.83 0.27 0.55 0.01 0.55 -5.01 114.94 112.66 2qs2 s ASN 201 Ca 0.03 -1.38 0.25 0.00 -0.71 0.00 0.00 52.86 51.05 2qs2 s ASN 201 Cb 0.10 -1.00 0.95 0.00 0.41 0.00 0.00 41.25 41.71 2qs2 s ASN 201 CO 0.55 -0.33 1.74 0.00 -1.51 0.00 0.00 177.10 177.55 2qs2 n ASN 203 N -2.32 0.50 -4.79 0.00 3.02 -1.26 -4.89 115.26 105.52 2qs2 n ASN 203 Ca 0.03 0.27 -0.31 0.00 -0.03 0.00 0.00 54.58 54.54 2qs2 n ASN 203 Cb 0.29 -0.26 -0.06 0.00 -0.61 0.00 0.00 39.78 39.14 2qs2 n ASN 203 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2qs2 s LEU 204 N -3.72 3.88 0.09 3.41 1.02 -0.93 -2.31 118.68 120.13 2qs2 s LEU 204 Ca 0.11 0.05 -0.08 0.00 0.02 0.00 0.00 54.13 54.22 2qs2 s LEU 204 Cb 0.15 -2.52 -0.00 0.00 0.02 0.00 0.00 46.19 43.84 2qs2 s LEU 204 CO 0.63 0.18 0.19 0.28 0.02 0.00 0.00 176.35 177.65 2qs2 s THR 205 N -1.38 0.14 0.24 5.49 -1.32 0.80 -4.79 115.64 114.82 2qs2 s THR 205 Ca 0.29 -1.22 -0.29 0.00 -1.21 0.00 0.00 61.69 59.27 2qs2 s THR 205 Cb -0.12 -1.38 -0.09 0.00 -1.51 0.00 0.00 72.50 69.40 2qs2 s THR 205 CO 0.22 -0.64 0.91 -1.58 -2.21 0.00 0.00 174.62 171.32 2qs2 s GLN 206 N -3.87 4.78 -0.21 7.08 0.74 -1.26 -1.43 119.66 125.49 2qs2 s GLN 206 Ca 0.06 1.41 -0.02 0.00 0.05 0.00 0.00 55.36 56.86 2qs2 s GLN 206 Cb 0.05 -3.21 0.00 0.00 1.10 0.00 0.00 33.01 30.95 2qs2 s GLN 206 CO -0.10 0.50 -0.10 0.42 -0.55 0.00 0.00 175.29 175.45 2qs2 s ILE 207 N -1.24 2.84 0.00 -2.34 -1.09 0.52 -4.93 121.20 114.97 2qs2 s ILE 207 Ca 0.41 -0.69 0.00 0.00 -2.23 0.00 0.00 60.65 58.14 2qs2 s ILE 207 Cb -0.25 -2.27 0.00 0.00 -1.58 0.00 0.00 42.46 38.36 2qs2 s ILE 207 CO 0.30 0.45 0.00 0.61 -1.23 0.00 0.00 174.94 175.07 2qs2 n GLY 208 N 4.72 -1.33 0.00 6.18 0.00 -1.13 -3.58 105.19 110.05 2qs2 n GLY 208 Ca -0.19 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.58 2qs2 n GLY 208 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qs2 n GLY 209 N 0.00 2.70 3.72 -0.02 0.00 -1.26 -4.88 105.19 105.45 2qs2 n GLY 209 Ca 0.00 -1.95 -0.41 0.00 0.00 0.00 0.00 46.02 43.65 2qs2 n GLY 209 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qs2 s LEU 210 N 0.00 4.43 0.01 0.99 1.43 -1.26 -4.56 118.68 119.71 2qs2 s LEU 210 Ca 0.00 1.64 0.04 0.00 -1.03 0.00 0.00 54.13 54.78 2qs2 s LEU 210 Cb 0.00 -3.49 -0.25 0.00 0.03 0.00 0.00 46.19 42.49 2qs2 s LEU 210 CO 0.00 -0.13 0.86 0.40 0.23 0.00 0.00 176.35 177.71 2qs2 h ILE 211 N 4.40 1.15 -2.17 -0.59 2.04 0.24 -3.48 117.51 119.10 2qs2 h ILE 211 Ca -0.42 -2.88 0.00 0.00 1.00 0.00 0.00 64.86 62.56 2qs2 h ILE 211 Cb 1.21 2.66 0.00 0.00 -0.74 0.00 0.00 36.82 39.95 2qs2 h ILE 211 CO 0.73 0.76 0.00 -0.90 0.00 0.00 0.00 178.15 178.74 2qs2 n ASP 212 N -3.31 0.42 -3.75 1.72 5.75 -1.26 -4.92 116.55 111.21 2qs2 n ASP 212 Ca -0.14 -0.75 -0.13 0.00 -0.01 0.00 0.00 54.79 53.77 2qs2 n ASP 212 Cb 1.02 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 41.00 2qs2 n ASP 212 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2qs2 s SER 213 N -0.50 -0.35 0.23 -1.12 0.15 -1.26 -4.22 113.70 106.63 2qs2 s SER 213 Ca 0.00 0.66 -0.19 0.00 0.70 0.00 0.00 55.95 57.12 2qs2 s SER 213 Cb 0.00 0.64 0.03 0.00 -1.71 0.00 0.00 66.02 64.98 2qs2 s SER 213 CO 0.00 -0.13 0.61 -1.59 1.20 0.00 0.00 173.24 173.33 2qs2 s LYS 214 N 0.45 1.54 0.11 5.44 -2.85 -0.31 -5.00 119.74 119.12 2qs2 s LYS 214 Ca -0.02 -0.90 0.07 0.00 -1.00 0.00 0.00 55.97 54.12 2qs2 s LYS 214 Cb -0.04 0.56 -0.04 0.00 -2.06 0.00 0.00 37.83 36.25 2qs2 s LYS 214 CO -0.02 -0.68 -0.18 0.20 0.10 0.00 0.00 175.35 174.77 2qs2 s GLY 215 N -2.89 1.16 -0.10 0.59 0.00 -1.26 -0.95 107.32 103.87 2qs2 s GLY 215 Ca 0.10 -1.24 -0.17 0.00 0.00 0.00 0.00 44.72 43.42 2qs2 s GLY 215 CO 0.01 -1.26 0.44 -0.19 0.00 0.00 0.00 173.10 172.10 2qs2 s TYR 216 N -1.44 3.54 0.17 1.90 4.12 -0.35 -0.65 117.35 124.64 2qs2 s TYR 216 Ca 0.06 0.86 0.03 0.00 0.02 0.00 0.00 57.07 58.04 2qs2 s TYR 216 Cb -0.09 -2.48 -0.05 0.00 -1.52 0.00 0.00 41.96 37.83 2qs2 s TYR 216 CO 0.04 0.26 -0.03 0.20 0.02 0.00 0.00 175.55 176.04 2qs2 s GLY 217 N 0.32 1.21 -0.08 0.71 0.00 -0.98 -1.04 107.32 107.46 2qs2 s GLY 217 Ca 0.24 -1.58 -0.30 0.00 0.00 0.00 0.00 44.72 43.08 2qs2 s GLY 217 CO 0.10 -1.56 1.00 0.14 0.00 0.00 0.00 173.10 172.78 2qs2 s VAL 218 N -3.54 4.80 0.24 1.40 1.01 -1.26 -4.61 120.40 118.43 2qs2 s VAL 218 Ca 0.22 2.05 -0.19 0.00 0.00 0.00 0.00 61.98 64.06 2qs2 s VAL 218 Cb 0.05 -4.32 -0.08 0.00 0.00 0.00 0.00 36.38 32.03 2qs2 s VAL 218 CO 0.03 0.04 0.73 -0.83 0.00 0.00 0.00 175.10 175.07 2qs2 s GLY 219 N 1.08 2.57 0.10 4.51 0.00 -0.47 -0.66 107.32 114.45 2qs2 s GLY 219 Ca 0.49 0.15 -0.03 0.00 0.00 0.00 0.00 44.72 45.33 2qs2 s GLY 219 CO 0.20 0.48 0.06 -0.51 0.00 0.00 0.00 173.10 173.34 2qs2 s THR 220 N -1.59 0.15 0.75 0.90 -4.23 -0.09 -0.55 115.64 110.98 2qs2 s THR 220 Ca 0.45 -1.72 -0.14 0.00 -1.18 0.00 0.00 61.69 59.10 2qs2 s THR 220 Cb -0.16 -1.72 0.05 0.00 1.34 0.00 0.00 72.50 72.01 2qs2 s THR 220 CO 0.20 -0.68 1.17 -2.84 -0.54 0.00 0.00 174.62 171.93 2qs2 s PRO 221 N -3.96 2.11 0.17 3.99 0.02 -1.26 -0.60 135.00 135.48 2qs2 s PRO 221 Ca 0.14 1.61 -0.33 0.00 0.02 0.00 0.00 61.00 62.44 2qs2 s PRO 221 Cb 0.07 -1.85 -0.13 0.00 0.02 0.00 0.00 34.50 32.61 2qs2 s PRO 221 CO -0.05 -1.82 1.61 -0.89 -0.33 0.00 0.00 177.00 175.52 2qs2 n ILE 222 N -2.94 0.03 -0.44 2.83 5.41 -1.26 -1.89 119.36 121.10 2qs2 n ILE 222 Ca 0.12 -0.01 0.00 0.00 1.00 0.00 0.00 62.75 63.87 2qs2 n ILE 222 Cb 0.51 -1.64 0.00 0.00 -0.71 0.00 0.00 39.64 37.80 2qs2 n ILE 222 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2qs2 n GLY 223 N 3.50 1.01 3.67 7.39 0.00 -1.26 -4.98 105.19 114.53 2qs2 n GLY 223 Ca 0.17 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.73 2qs2 n GLY 223 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2qs2 n SER 224 N 0.00 3.06 0.00 1.61 2.88 -0.79 -4.86 113.62 115.52 2qs2 n SER 224 Ca 0.00 1.10 0.12 0.00 -1.33 0.00 0.00 58.87 58.76 2qs2 n SER 224 Cb 0.00 -1.43 0.69 0.00 -0.75 0.00 0.00 64.21 62.72 2qs2 n SER 224 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2qs2 n PRO 225 N 3.10 0.69 0.11 -1.46 -0.04 -1.26 -2.91 135.00 133.23 2qs2 n PRO 225 Ca 0.16 0.01 0.12 0.00 -0.04 0.00 0.00 63.50 63.74 2qs2 n PRO 225 Cb 0.30 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.29 2qs2 n PRO 225 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2qs2 h TYR 226 N 0.00 0.00 0.45 0.54 -1.99 -1.97 -3.40 116.97 110.60 2qs2 h TYR 226 Ca 0.00 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 2qs2 h TYR 226 Cb 0.03 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.77 2qs2 h TYR 226 CO 0.00 0.00 -0.22 -0.09 -0.00 0.00 0.00 178.16 177.85 2qs2 h ARG 227 N 0.00 -0.59 -0.22 4.88 1.12 -1.92 0.00 114.38 117.66 2qs2 h ARG 227 Ca 0.00 0.04 -0.09 0.00 -1.11 0.00 0.00 59.98 58.82 2qs2 h ARG 227 Cb 0.98 0.13 -0.01 0.00 -0.01 0.00 0.00 29.97 31.06 2qs2 h ARG 227 CO 0.00 -0.39 -0.26 -0.44 -3.11 0.00 0.00 179.97 175.78 2qs2 h ASP 228 N -0.61 0.41 -0.81 -3.80 3.32 -1.81 -1.42 116.42 111.70 2qs2 h ASP 228 Ca -0.06 -0.14 -0.02 0.00 0.02 0.00 0.00 57.03 56.83 2qs2 h ASP 228 Cb 0.47 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.87 2qs2 h ASP 228 CO 0.10 0.67 0.41 0.11 -1.72 0.00 0.00 179.24 178.81 2qs2 h LYS 229 N 0.37 1.15 -0.44 3.56 1.57 -1.71 -1.64 116.57 119.44 2qs2 h LYS 229 Ca 0.05 -0.16 -0.13 0.00 -1.87 0.00 0.00 60.65 58.55 2qs2 h LYS 229 Cb 0.65 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 2qs2 h LYS 229 CO 0.05 0.88 -0.23 0.82 -0.57 0.00 0.00 179.45 180.40 2qs2 h ILE 230 N 1.14 1.27 -0.27 1.86 2.04 -0.59 -1.32 117.51 121.65 2qs2 h ILE 230 Ca 0.28 -1.37 0.05 0.00 1.00 0.00 0.00 64.86 64.82 2qs2 h ILE 230 Cb 0.09 1.17 -0.05 0.00 -0.74 0.00 0.00 36.82 37.29 2qs2 h ILE 230 CO -0.04 0.47 -0.08 0.74 0.00 0.00 0.00 178.15 179.24 2qs2 h THR 231 N 0.77 0.71 -0.41 -0.27 2.02 -0.99 0.86 112.91 115.60 2qs2 h THR 231 Ca 0.10 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.32 2qs2 h THR 231 Cb 0.78 0.71 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 2qs2 h THR 231 CO 0.06 0.00 0.18 0.40 0.37 0.00 0.00 175.52 176.53 2qs2 h ILE 232 N -0.02 0.92 -0.58 3.11 1.08 -0.97 -0.06 117.51 121.00 2qs2 h ILE 232 Ca 0.13 -0.12 -0.01 0.00 -0.39 0.00 0.00 64.86 64.46 2qs2 h ILE 232 Cb 0.21 0.53 -0.03 0.00 -3.07 0.00 0.00 36.82 34.47 2qs2 h ILE 232 CO -0.28 0.07 0.30 0.00 -0.69 0.00 0.00 178.15 177.55 2qs2 h ALA 233 N 1.24 0.74 -0.51 1.87 0.00 -0.91 -1.15 119.26 120.55 2qs2 h ALA 233 Ca 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2qs2 h ALA 233 Cb 0.13 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2qs2 h ALA 233 CO -0.16 0.27 0.33 0.82 0.00 0.00 0.00 179.25 180.51 2qs2 h ILE 234 N 0.78 1.14 -0.68 0.00 2.04 -0.31 -0.73 117.51 119.74 2qs2 h ILE 234 Ca 0.20 -0.26 0.01 0.00 1.00 0.00 0.00 64.86 65.81 2qs2 h ILE 234 Cb 0.07 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.52 2qs2 h ILE 234 CO -0.03 0.13 0.45 -0.07 0.00 0.00 0.00 178.15 178.63 2qs2 h LEU 235 N 0.68 0.78 0.04 1.44 3.38 -0.70 0.89 115.31 121.83 2qs2 h LEU 235 Ca 0.18 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.16 2qs2 h LEU 235 Cb -0.06 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.44 2qs2 h LEU 235 CO -0.04 0.57 -0.37 1.56 0.09 0.00 0.00 178.44 180.25 2qs2 h GLN 236 N 0.92 -0.53 -1.00 1.13 4.20 -0.87 0.05 115.11 119.01 2qs2 h GLN 236 Ca 0.25 0.04 0.02 0.00 0.06 0.00 0.00 58.65 59.01 2qs2 h GLN 236 Cb -0.10 0.12 -0.05 0.00 0.30 0.00 0.00 27.48 27.75 2qs2 h GLN 236 CO -0.05 -0.36 0.66 -0.07 -0.67 0.00 0.00 178.83 178.34 2qs2 h LEU 237 N -0.56 1.14 0.38 1.46 3.38 -0.77 0.46 115.31 120.80 2qs2 h LEU 237 Ca 0.05 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2qs2 h LEU 237 Cb 0.62 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2qs2 h LEU 237 CO -0.27 0.81 -0.18 -0.61 0.09 0.00 0.00 178.44 178.28 2qs2 h GLN 238 N 1.34 -0.49 -0.12 1.13 4.15 -0.62 0.11 115.11 120.60 2qs2 h GLN 238 Ca 0.37 0.03 -0.11 0.00 0.77 0.00 0.00 58.65 59.71 2qs2 h GLN 238 Cb -0.13 0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.66 2qs2 h GLN 238 CO -0.09 -0.33 -0.42 0.93 -1.93 0.00 0.00 178.83 176.99 2qs2 h GLU 239 N -0.51 0.28 0.00 1.69 5.08 -0.39 -2.57 114.58 118.16 2qs2 h GLU 239 Ca -0.05 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 2qs2 h GLU 239 Cb 0.39 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2qs2 h GLU 239 CO 0.08 0.65 0.00 0.39 -1.00 0.00 0.00 179.01 179.14 2qs2 n GLU 240 N -4.02 0.11 -0.63 2.33 1.02 0.10 -4.90 120.64 114.65 2qs2 n GLU 240 Ca -0.02 0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 2qs2 n GLU 240 Cb 0.49 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.41 2qs2 n GLU 240 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qs2 n GLY 241 N 1.29 0.69 0.12 0.62 0.00 -0.97 -4.97 105.19 101.97 2qs2 n GLY 241 Ca 0.09 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.98 2qs2 n GLY 241 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qs2 h LYS 242 N 2.11 0.24 -0.46 1.61 1.57 -1.01 -2.00 116.57 118.63 2qs2 h LYS 242 Ca 0.00 -0.33 -0.08 0.00 -1.87 0.00 0.00 60.65 58.37 2qs2 h LYS 242 Cb 0.00 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 2qs2 h LYS 242 CO 0.00 1.09 -0.04 -0.07 -0.57 0.00 0.00 179.45 179.85 2qs2 h LEU 243 N 0.11 0.76 -0.14 2.94 3.38 -1.75 -0.28 115.31 120.33 2qs2 h LEU 243 Ca -0.08 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.69 2qs2 h LEU 243 Cb 1.72 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 42.26 2qs2 h LEU 243 CO 0.17 0.85 0.08 -0.74 0.09 0.00 0.00 178.44 178.89 2qs2 h HIS 244 N 0.72 0.18 -0.62 1.13 2.76 -1.83 -0.65 115.15 116.85 2qs2 h HIS 244 Ca 0.13 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.31 2qs2 h HIS 244 Cb 0.51 -0.06 -0.03 0.00 1.55 0.00 0.00 27.41 29.37 2qs2 h HIS 244 CO 0.03 0.15 0.40 0.52 -1.30 0.00 0.00 177.93 177.73 2qs2 h MET 245 N 0.15 0.79 -0.33 5.26 2.86 -1.03 0.22 114.93 122.84 2qs2 h MET 245 Ca 0.05 -0.05 -0.11 0.00 -2.06 0.00 0.00 59.70 57.53 2qs2 h MET 245 Cb 0.03 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.49 2qs2 h MET 245 CO -0.01 0.52 -0.24 0.52 1.06 0.00 0.00 176.91 178.77 2qs2 h MET 246 N 0.82 0.66 -0.19 1.72 2.07 -0.94 -0.65 114.93 118.41 2qs2 h MET 246 Ca 0.23 -0.26 -0.03 0.00 -2.07 0.00 0.00 59.70 57.57 2qs2 h MET 246 Cb -0.07 -0.03 -0.01 0.00 -1.87 0.00 0.00 31.60 29.62 2qs2 h MET 246 CO -0.06 0.84 0.00 -0.22 1.07 0.00 0.00 176.91 178.54 2qs2 h LYS 247 N 0.57 0.33 -0.50 1.72 3.64 -0.76 -3.06 116.57 118.51 2qs2 h LYS 247 Ca 0.08 -0.10 0.06 0.00 -1.27 0.00 0.00 60.65 59.42 2qs2 h LYS 247 Cb 0.72 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.45 2qs2 h LYS 247 CO 0.06 0.53 0.20 1.49 -2.27 0.00 0.00 179.45 179.45 2qs2 h GLU 248 N 0.08 0.38 -0.69 1.90 4.57 -0.81 0.74 114.58 120.75 2qs2 h GLU 248 Ca 0.05 -0.02 0.13 0.00 -1.18 0.00 0.00 59.36 58.34 2qs2 h GLU 248 Cb 0.38 -0.08 -0.09 0.00 -0.16 0.00 0.00 28.75 28.79 2qs2 h GLU 248 CO 0.01 0.25 0.22 -0.22 -1.18 0.00 0.00 179.01 178.09 2qs2 h LYS 249 N 0.39 0.34 0.00 1.92 3.64 -1.07 -2.06 116.57 119.72 2qs2 h LYS 249 Ca 0.24 -0.02 -0.28 0.00 -1.27 0.00 0.00 60.65 59.32 2qs2 h LYS 249 Cb 0.23 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 31.92 2qs2 h LYS 249 CO -0.22 0.22 -1.87 0.91 -2.27 0.00 0.00 179.45 176.22 2qs2 n TRP 250 N -5.07 0.66 0.03 1.91 7.02 -1.01 -4.51 117.44 116.47 2qs2 n TRP 250 Ca 0.12 0.23 -0.21 0.00 -1.02 0.00 0.00 57.50 56.63 2qs2 n TRP 250 Cb 0.39 -1.09 -0.14 0.00 -2.42 0.00 0.00 31.31 28.05 2qs2 n TRP 250 CO 0.00 0.00 0.00 -1.49 -2.02 0.00 0.00 177.69 174.18 2qs2 h TRP 251 N 0.00 0.52 -2.75 -5.99 6.55 -0.80 -3.48 115.95 110.00 2qs2 h TRP 251 Ca -0.33 -0.38 -0.52 0.00 0.95 0.00 0.00 58.89 58.61 2qs2 h TRP 251 Cb 1.97 -0.02 0.04 0.00 -0.86 0.00 0.00 29.16 30.29 2qs2 h TRP 251 CO 0.00 1.68 0.94 0.50 -1.05 0.00 0.00 178.44 180.51 2qs2 s ARG 252 N -2.57 4.19 0.00 0.49 3.52 -0.78 -4.80 118.95 118.99 2qs2 s ARG 252 Ca -0.19 2.44 0.00 0.00 -0.13 0.00 0.00 55.73 57.85 2qs2 s ARG 252 Cb 0.06 -3.20 0.00 0.00 -1.56 0.00 0.00 34.95 30.25 2qs2 s ARG 252 CO 0.80 -0.67 0.00 0.41 -0.81 0.00 0.00 175.30 175.03 2qs2 n GLY 253 N 3.86 1.18 0.00 8.12 0.00 -1.26 -5.00 105.19 112.09 2qs2 n GLY 253 Ca 0.15 -1.96 0.03 0.00 0.00 0.00 0.00 46.02 44.23 2qs2 n GLY 253 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02