#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r53 n SER 2 N 0.00 4.64 -4.68 7.83 7.64 -1.26 -4.87 113.62 122.92 1r53 n SER 2 Ca 0.00 -3.06 -0.35 0.00 1.01 0.00 0.00 58.87 56.47 1r53 n SER 2 Cb 0.00 -0.63 -0.09 0.00 -1.01 0.00 0.00 64.21 62.48 1r53 n SER 2 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1r53 s THR 3 N -2.86 4.53 -0.04 0.44 2.01 -1.26 -1.70 115.64 116.76 1r53 s THR 3 Ca 0.49 -0.15 0.03 0.00 0.31 0.00 0.00 61.69 62.37 1r53 s THR 3 Cb 0.39 -2.95 0.00 0.00 0.01 0.00 0.00 72.50 69.95 1r53 s THR 3 CO 0.12 0.57 -0.14 0.12 -0.69 0.00 0.00 174.62 174.60 1r53 s PHE 4 N -0.54 1.44 0.00 4.92 5.36 -0.08 -4.99 117.98 124.09 1r53 s PHE 4 Ca 0.10 -0.43 0.00 0.00 -0.96 0.00 0.00 56.93 55.64 1r53 s PHE 4 Cb -0.12 -1.00 0.00 0.00 -0.34 0.00 0.00 43.02 41.56 1r53 s PHE 4 CO 0.02 -0.17 0.00 0.41 -1.46 0.00 0.00 175.22 174.02 1r53 n GLY 5 N 3.35 1.96 0.40 13.12 0.00 -1.26 -1.21 105.19 121.55 1r53 n GLY 5 Ca -0.19 -1.91 -0.13 0.00 0.00 0.00 0.00 46.02 43.79 1r53 n GLY 5 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1r53 n LYS 6 N 1.91 0.38 -0.07 1.61 4.81 -1.26 -4.76 118.16 120.78 1r53 n LYS 6 Ca 0.00 0.16 -0.09 0.00 -0.87 0.00 0.00 58.31 57.51 1r53 n LYS 6 Cb 0.00 -1.15 -0.08 0.00 0.02 0.00 0.00 35.03 33.82 1r53 n LYS 6 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1r53 n LEU 7 N -4.01 1.94 -4.33 3.14 4.77 -1.26 -4.80 117.00 112.44 1r53 n LEU 7 Ca -0.23 -0.05 -0.43 0.00 -0.03 0.00 0.00 56.01 55.27 1r53 n LEU 7 Cb 0.55 -0.24 -0.08 0.00 -2.33 0.00 0.00 43.42 41.31 1r53 n LEU 7 CO 0.09 0.59 -0.01 0.12 -1.33 0.00 0.00 177.39 176.85 1r53 s PHE 8 N -2.30 3.28 -0.05 -1.77 5.36 -1.26 -4.20 117.98 117.04 1r53 s PHE 8 Ca -0.15 -1.20 0.05 0.00 -0.96 0.00 0.00 56.93 54.67 1r53 s PHE 8 Cb 0.05 -3.17 -0.02 0.00 -0.34 0.00 0.00 43.02 39.54 1r53 s PHE 8 CO 0.40 -0.84 -0.19 1.03 -1.46 0.00 0.00 175.22 174.16 1r53 s ARG 9 N 1.55 2.49 -0.05 10.12 0.52 0.22 -4.35 118.95 129.45 1r53 s ARG 9 Ca 0.04 -0.79 0.03 0.00 -0.52 0.00 0.00 55.73 54.49 1r53 s ARG 9 Cb -0.24 -2.28 0.00 0.00 0.52 0.00 0.00 34.95 32.95 1r53 s ARG 9 CO 0.04 0.53 -0.14 0.54 0.02 0.00 0.00 175.30 176.30 1r53 s VAL 10 N -0.51 1.18 -0.15 3.52 0.11 -0.35 -0.82 120.40 123.38 1r53 s VAL 10 Ca 0.07 -0.55 -0.01 0.00 -2.93 0.00 0.00 61.98 58.56 1r53 s VAL 10 Cb -0.11 -1.04 -0.01 0.00 -1.53 0.00 0.00 36.38 33.69 1r53 s VAL 10 CO 0.01 0.35 -0.12 -0.89 -3.33 0.00 0.00 175.10 171.12 1r53 s THR 11 N 0.30 3.00 0.37 5.04 2.01 -0.31 -0.90 115.64 125.15 1r53 s THR 11 Ca -0.08 -0.66 0.08 0.00 0.31 0.00 0.00 61.69 61.34 1r53 s THR 11 Cb -0.12 -2.28 -0.04 0.00 0.01 0.00 0.00 72.50 70.07 1r53 s THR 11 CO 0.02 0.51 0.22 0.42 -0.69 0.00 0.00 174.62 175.10 1r53 s THR 12 N 0.67 2.92 0.10 -0.82 -4.23 -0.69 -0.27 115.64 113.32 1r53 s THR 12 Ca -0.06 -1.56 -0.19 0.00 -1.18 0.00 0.00 61.69 58.69 1r53 s THR 12 Cb -0.15 -3.02 0.04 0.00 1.34 0.00 0.00 72.50 70.71 1r53 s THR 12 CO 0.02 -0.11 0.46 -0.72 -0.54 0.00 0.00 174.62 173.73 1r53 s TYR 13 N -2.44 -0.31 0.00 3.99 -0.85 -0.55 -4.91 117.35 112.27 1r53 s TYR 13 Ca 0.41 0.15 0.00 0.00 -0.52 0.00 0.00 57.07 57.11 1r53 s TYR 13 Cb -0.02 0.31 0.00 0.00 0.38 0.00 0.00 41.96 42.63 1r53 s TYR 13 CO 0.24 -0.68 0.00 0.41 -1.52 0.00 0.00 175.55 174.00 1r53 n GLY 14 N 0.03 3.89 3.91 5.49 0.00 -1.26 -2.10 105.19 115.15 1r53 n GLY 14 Ca -0.17 -1.09 -0.26 0.00 0.00 0.00 0.00 46.02 44.50 1r53 n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r53 s GLU 15 N -5.21 2.25 0.11 1.61 8.01 -1.26 -3.08 118.70 121.13 1r53 s GLU 15 Ca 0.00 -2.01 -0.22 0.00 0.01 0.00 0.00 54.97 52.76 1r53 s GLU 15 Cb 0.00 -2.13 -0.08 0.00 -4.31 0.00 0.00 34.13 27.62 1r53 s GLU 15 CO 0.00 -0.65 1.71 0.66 0.01 0.00 0.00 175.26 177.00 1r53 h SER 16 N 0.70 -0.15 -1.68 -0.19 4.64 -1.94 -3.34 113.55 111.60 1r53 h SER 16 Ca -0.36 0.04 -0.66 0.00 -0.47 0.00 0.00 61.79 60.33 1r53 h SER 16 Cb 1.30 0.09 -0.36 0.00 -0.31 0.00 0.00 62.40 63.12 1r53 h SER 16 CO 0.56 -0.06 0.02 1.41 -0.87 0.00 0.00 176.83 177.89 1r53 n HIS 17 N -5.17 3.22 -4.57 4.77 8.25 -1.26 -5.01 115.22 115.45 1r53 n HIS 17 Ca -0.04 -2.77 -0.26 0.00 -0.26 0.00 0.00 57.72 54.38 1r53 n HIS 17 Cb 0.10 -0.56 -0.10 0.00 1.12 0.00 0.00 29.99 30.55 1r53 n HIS 17 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1r53 h LYS 19 N 1.85 0.80 -3.03 0.00 1.57 -1.93 -3.39 116.57 112.43 1r53 h LYS 19 Ca -0.42 -0.10 0.05 0.00 -1.87 0.00 0.00 60.65 58.31 1r53 h LYS 19 Cb 1.25 -0.16 -0.06 0.00 0.08 0.00 0.00 32.23 33.34 1r53 h LYS 19 CO 0.74 0.62 0.21 -1.54 -0.57 0.00 0.00 179.45 178.91 1r53 s SER 20 N -6.54 -0.30 0.12 0.86 1.04 -1.26 -2.12 113.70 105.50 1r53 s SER 20 Ca -0.10 -0.52 0.06 0.00 0.48 0.00 0.00 55.95 55.87 1r53 s SER 20 Cb 0.17 0.70 -0.04 0.00 0.10 0.00 0.00 66.02 66.95 1r53 s SER 20 CO 0.78 -1.27 -0.13 0.68 0.98 0.00 0.00 173.24 174.27 1r53 s VAL 21 N -3.89 1.29 -0.45 5.02 -7.23 -0.70 -4.49 120.40 109.94 1r53 s VAL 21 Ca 0.10 -1.73 0.00 0.00 -1.81 0.00 0.00 61.98 58.54 1r53 s VAL 21 Cb -0.05 -1.53 0.00 0.00 0.56 0.00 0.00 36.38 35.36 1r53 s VAL 21 CO 0.04 -0.45 0.00 0.61 -0.31 0.00 0.00 175.10 174.99 1r53 n GLY 22 N 0.50 -0.59 3.66 2.32 0.00 -0.89 -0.55 105.19 109.63 1r53 n GLY 22 Ca -0.15 -0.58 -0.06 0.00 0.00 0.00 0.00 46.02 45.22 1r53 n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r53 s ILE 24 N -3.37 1.76 -0.21 0.00 1.01 0.63 -1.33 121.20 119.68 1r53 s ILE 24 Ca 0.09 -0.78 -0.06 0.00 0.00 0.00 0.00 60.65 59.89 1r53 s ILE 24 Cb -0.02 -1.59 -0.03 0.00 0.01 0.00 0.00 42.46 40.83 1r53 s ILE 24 CO -0.02 0.49 0.03 -0.69 0.00 0.00 0.00 174.94 174.75 1r53 s VAL 25 N 1.04 4.24 -0.02 2.92 1.01 -0.04 -1.16 120.40 128.40 1r53 s VAL 25 Ca -0.04 -0.21 0.06 0.00 0.00 0.00 0.00 61.98 61.79 1r53 s VAL 25 Cb -0.15 -2.93 -0.01 0.00 0.00 0.00 0.00 36.38 33.29 1r53 s VAL 25 CO -0.04 0.41 -0.19 -0.62 0.00 0.00 0.00 175.10 174.66 1r53 s ASP 26 N 1.01 2.24 0.00 3.32 2.15 0.00 -1.09 116.67 124.30 1r53 s ASP 26 Ca 0.03 -0.35 0.00 0.00 0.43 0.00 0.00 52.55 52.66 1r53 s ASP 26 Cb -0.14 -0.32 0.00 0.00 -0.30 0.00 0.00 42.92 42.16 1r53 s ASP 26 CO 0.02 0.22 0.00 0.61 -0.17 0.00 0.00 175.17 175.85 1r53 n GLY 27 N 2.71 0.75 3.71 2.66 0.00 -1.26 -0.61 105.19 113.15 1r53 n GLY 27 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 1r53 n GLY 27 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r53 s VAL 28 N -2.09 3.20 0.51 1.61 1.01 -1.26 -4.77 120.40 118.61 1r53 s VAL 28 Ca 0.00 0.81 -0.22 0.00 0.00 0.00 0.00 61.98 62.57 1r53 s VAL 28 Cb 0.00 -3.52 -0.07 0.00 0.00 0.00 0.00 36.38 32.79 1r53 s VAL 28 CO 0.00 0.04 1.20 -0.81 0.00 0.00 0.00 175.10 175.53 1r53 n PRO 29 N 4.39 1.51 -1.57 2.72 -0.04 -1.26 -4.19 135.00 136.56 1r53 n PRO 29 Ca 0.13 0.55 -0.33 0.00 -0.04 0.00 0.00 63.50 63.81 1r53 n PRO 29 Cb 0.42 -2.36 0.07 0.00 -0.04 0.00 0.00 33.50 31.58 1r53 n PRO 29 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1r53 s PRO 30 N -2.58 2.52 0.00 0.54 0.04 -1.26 -4.26 135.00 130.00 1r53 s PRO 30 Ca 0.69 1.40 0.00 0.00 0.04 0.00 0.00 61.00 63.13 1r53 s PRO 30 Cb -0.46 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.17 1r53 s PRO 30 CO 0.52 -1.47 0.00 0.41 0.04 0.00 0.00 177.00 176.50 1r53 n GLY 31 N -0.50 0.80 3.81 0.56 0.00 0.50 -4.93 105.19 105.43 1r53 n GLY 31 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 1r53 n GLY 31 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1r53 s MET 32 N -0.66 3.52 0.16 1.61 0.00 -1.26 -4.76 119.30 117.90 1r53 s MET 32 Ca 0.00 -0.20 -0.31 0.00 0.00 0.00 0.00 55.69 55.17 1r53 s MET 32 Cb 0.00 -3.16 -0.10 0.00 0.00 0.00 0.00 34.83 31.57 1r53 s MET 32 CO 0.00 0.66 1.52 -1.12 0.00 0.00 0.00 175.02 176.08 1r53 s SER 33 N -0.71 6.64 -0.29 1.11 0.01 -1.26 -0.44 113.70 118.76 1r53 s SER 33 Ca 0.13 2.55 -0.12 0.00 1.31 0.00 0.00 55.95 59.82 1r53 s SER 33 Cb -0.12 -2.59 0.12 0.00 0.21 0.00 0.00 66.02 63.64 1r53 s SER 33 CO 0.03 -0.78 0.69 -0.22 0.41 0.00 0.00 173.24 173.37 1r53 s LEU 34 N 1.06 -1.04 0.00 2.44 2.96 -0.18 -4.92 118.68 119.00 1r53 s LEU 34 Ca 0.68 1.49 0.07 0.00 -0.22 0.00 0.00 54.13 56.16 1r53 s LEU 34 Cb -0.42 2.28 -0.03 0.00 0.50 0.00 0.00 46.19 48.52 1r53 s LEU 34 CO 0.32 -0.22 0.25 0.35 -1.32 0.00 0.00 176.35 175.73 1r53 n THR 35 N 5.05 0.00 0.29 3.68 -2.24 -1.26 -4.35 114.28 115.45 1r53 n THR 35 Ca -0.14 -2.20 0.17 0.00 -2.27 0.00 0.00 64.05 59.61 1r53 n THR 35 Cb 0.52 1.09 0.97 0.00 -2.10 0.00 0.00 70.33 70.81 1r53 n THR 35 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1r53 h GLU 36 N 0.00 0.00 0.00 -0.78 3.07 -2.00 -1.41 114.58 113.45 1r53 h GLU 36 Ca -0.21 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.60 1r53 h GLU 36 Cb 1.08 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.99 1r53 h GLU 36 CO 0.31 0.00 -0.24 0.00 -1.40 0.00 0.00 179.01 177.68 1r53 h ALA 37 N 1.94 1.00 0.00 3.43 0.00 -1.96 -1.58 119.26 122.09 1r53 h ALA 37 Ca 0.01 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1r53 h ALA 37 Cb 0.10 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1r53 h ALA 37 CO -0.00 0.30 0.00 -0.25 0.00 0.00 0.00 179.25 179.30 1r53 n ASP 38 N -3.38 0.45 -0.06 0.00 8.00 -0.53 -3.97 116.55 117.05 1r53 n ASP 38 Ca 0.00 0.58 -0.07 0.00 0.71 0.00 0.00 54.79 56.01 1r53 n ASP 38 Cb 0.45 -0.69 -0.08 0.00 -0.02 0.00 0.00 41.12 40.79 1r53 n ASP 38 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1r53 n ILE 39 N -1.96 0.75 -0.24 0.53 5.41 -0.79 -4.74 119.36 118.32 1r53 n ILE 39 Ca 0.04 -0.41 -0.06 0.00 1.00 0.00 0.00 62.75 63.33 1r53 n ILE 39 Cb 0.29 -0.80 0.05 0.00 -0.71 0.00 0.00 39.64 38.46 1r53 n ILE 39 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 1r53 h GLN 40 N 0.00 0.91 -0.65 0.38 5.75 -1.44 -3.22 115.11 116.84 1r53 h GLN 40 Ca -0.30 -0.08 0.14 0.00 -0.15 0.00 0.00 58.65 58.25 1r53 h GLN 40 Cb 1.60 -0.19 -0.11 0.00 1.07 0.00 0.00 27.48 29.85 1r53 h GLN 40 CO -0.00 0.65 0.00 -1.35 -2.65 0.00 0.00 178.83 175.48 1r53 h PRO 41 N 0.91 0.11 -0.13 -2.39 0.11 -1.85 0.47 132.00 129.22 1r53 h PRO 41 Ca 0.24 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 66.21 1r53 h PRO 41 Cb -0.02 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.05 1r53 h PRO 41 CO -0.04 0.08 -0.50 1.96 -0.21 0.00 0.00 178.00 179.28 1r53 h GLN 42 N 0.12 0.36 -0.34 1.05 7.50 -1.89 -2.26 115.11 119.65 1r53 h GLN 42 Ca 0.34 -0.21 -0.12 0.00 0.50 0.00 0.00 58.65 59.16 1r53 h GLN 42 Cb 0.56 0.02 -0.01 0.00 0.05 0.00 0.00 27.48 28.10 1r53 h GLN 42 CO -0.55 0.78 -0.27 -0.07 -1.50 0.00 0.00 178.83 177.22 1r53 h LEU 43 N 0.28 0.82 -1.03 1.46 3.38 -1.29 -2.81 115.31 116.13 1r53 h LEU 43 Ca 0.01 -0.45 0.08 0.00 0.09 0.00 0.00 57.88 57.61 1r53 h LEU 43 Cb 0.99 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 41.44 1r53 h LEU 43 CO 0.08 1.10 0.64 0.74 0.09 0.00 0.00 178.44 181.09 1r53 h THR 44 N 0.56 1.05 0.00 0.22 2.02 -0.82 -2.30 112.91 113.64 1r53 h THR 44 Ca 0.06 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 66.86 1r53 h THR 44 Cb 0.84 -0.18 0.00 0.00 -1.74 0.00 0.00 68.15 67.07 1r53 h THR 44 CO 0.07 0.21 0.00 0.54 0.37 0.00 0.00 175.52 176.71 1r53 n ARG 45 N -4.52 0.12 0.13 6.66 1.74 -0.86 -2.40 116.66 117.52 1r53 n ARG 45 Ca 0.16 0.49 0.10 0.00 -0.77 0.00 0.00 57.85 57.83 1r53 n ARG 45 Cb 0.22 -1.80 0.48 0.00 -1.02 0.00 0.00 32.46 30.34 1r53 n ARG 45 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1r53 n ARG 46 N -2.03 0.13 -3.87 5.56 1.74 -0.87 -3.99 116.66 113.33 1r53 n ARG 46 Ca 0.01 0.54 -0.36 0.00 -0.77 0.00 0.00 57.85 57.27 1r53 n ARG 46 Cb 0.11 -1.86 -0.13 0.00 -1.02 0.00 0.00 32.46 29.56 1r53 n ARG 46 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1r53 s ARG 47 N -3.40 2.64 0.00 5.56 0.52 -1.01 -4.84 118.95 118.42 1r53 s ARG 47 Ca 0.00 -1.14 0.00 0.00 -0.52 0.00 0.00 55.73 54.08 1r53 s ARG 47 Cb 0.06 -3.22 0.00 0.00 0.52 0.00 0.00 34.95 32.32 1r53 s ARG 47 CO 0.23 -0.56 0.00 -2.30 0.02 0.00 0.00 175.30 172.69 1r53 n PRO 48 N 4.70 0.00 0.00 3.54 -0.02 -1.26 -5.02 135.00 136.94 1r53 n PRO 48 Ca -0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.34 1r53 n PRO 48 Cb 0.45 -1.10 0.00 0.00 -0.02 0.00 0.00 33.50 32.83 1r53 n PRO 48 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1r53 n ASP 61 N 0.70 0.00 0.00 2.55 2.03 -1.26 -4.53 116.55 116.04 1r53 n ASP 61 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1r53 n ASP 61 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1r53 n ASP 61 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1r53 n ARG 62 N 0.00 0.00 0.00 -0.67 1.74 -1.26 -5.05 116.66 111.42 1r53 n ARG 62 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1r53 n ARG 62 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1r53 n ARG 62 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1r53 n VAL 63 N -0.77 0.00 -4.85 1.55 0.31 -1.25 -4.86 118.33 108.46 1r53 n VAL 63 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.03 1r53 n VAL 63 Cb 0.00 0.00 -0.17 0.00 -0.91 0.00 0.00 33.84 32.76 1r53 n VAL 63 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 1r53 s GLU 64 N -1.34 2.55 -0.07 5.55 -1.05 -0.37 -4.91 118.70 119.05 1r53 s GLU 64 Ca 0.00 -0.70 -0.30 0.00 -0.15 0.00 0.00 54.97 53.83 1r53 s GLU 64 Cb 0.00 -2.01 -0.05 0.00 -0.44 0.00 0.00 34.13 31.62 1r53 s GLU 64 CO 0.00 0.07 1.70 0.42 0.95 0.00 0.00 175.26 178.40 1r53 s ILE 65 N 0.60 3.52 -0.21 1.83 1.01 -1.26 -2.12 121.20 124.58 1r53 s ILE 65 Ca -0.14 0.63 0.19 0.00 0.00 0.00 0.00 60.65 61.33 1r53 s ILE 65 Cb -0.17 -3.43 -0.00 0.00 0.01 0.00 0.00 42.46 38.87 1r53 s ILE 65 CO 0.04 -0.08 1.08 1.56 0.00 0.00 0.00 174.94 177.54 1r53 h GLN 66 N 9.95 0.00 -2.24 2.79 1.08 -0.86 -3.49 115.11 122.34 1r53 h GLN 66 Ca -0.40 0.00 0.20 0.00 -1.45 0.00 0.00 58.65 57.00 1r53 h GLN 66 Cb 1.18 0.00 -0.08 0.00 -0.05 0.00 0.00 27.48 28.53 1r53 h GLN 66 CO 0.96 0.17 0.55 -1.54 -0.95 0.00 0.00 178.83 178.02 1r53 s SER 67 N -5.75 -0.13 0.00 1.46 1.04 -1.24 -4.92 113.70 104.17 1r53 s SER 67 Ca 0.00 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.01 1r53 s SER 67 Cb 0.08 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.65 1r53 s SER 67 CO 0.78 -0.83 0.00 0.61 0.98 0.00 0.00 173.24 174.78 1r53 n GLY 68 N -0.52 1.72 3.43 7.32 0.00 -1.18 -3.86 105.19 112.11 1r53 n GLY 68 Ca -0.06 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.74 1r53 n GLY 68 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1r53 s THR 69 N -2.69 2.09 -0.21 2.61 -4.23 -1.26 -0.47 115.64 111.49 1r53 s THR 69 Ca 0.00 -2.28 -0.11 0.00 -1.18 0.00 0.00 61.69 58.12 1r53 s THR 69 Cb 0.00 -2.27 0.07 0.00 1.34 0.00 0.00 72.50 71.64 1r53 s THR 69 CO 0.00 -0.43 0.50 -0.70 -0.54 0.00 0.00 174.62 173.45 1r53 s GLU 70 N -3.59 0.48 -1.45 3.99 2.12 0.22 -4.89 118.70 115.59 1r53 s GLU 70 Ca 0.28 0.96 -0.05 0.00 0.36 0.00 0.00 54.97 56.52 1r53 s GLU 70 Cb -0.02 0.09 0.04 0.00 0.26 0.00 0.00 34.13 34.50 1r53 s GLU 70 CO 0.12 -0.17 0.65 1.19 -0.54 0.00 0.00 175.26 176.52 1r53 n PHE 71 N 4.44 -1.86 -0.99 5.30 0.99 -1.26 -2.01 117.46 122.07 1r53 n PHE 71 Ca -0.21 0.81 0.00 0.00 -0.00 0.00 0.00 57.45 58.06 1r53 n PHE 71 Cb 0.55 -3.86 0.00 0.00 -1.00 0.00 0.00 39.48 35.18 1r53 n PHE 71 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1r53 n GLY 72 N -1.74 0.55 3.26 1.37 0.00 -1.26 -5.00 105.19 102.36 1r53 n GLY 72 Ca -0.19 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.66 1r53 n GLY 72 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r53 s LYS 73 N -0.18 1.08 0.27 1.61 1.02 -0.85 -1.01 119.74 121.67 1r53 s LYS 73 Ca 0.00 -1.33 -0.23 0.00 0.02 0.00 0.00 55.97 54.44 1r53 s LYS 73 Cb 0.00 -0.90 -0.09 0.00 -0.52 0.00 0.00 37.83 36.32 1r53 s LYS 73 CO 0.00 0.16 0.83 0.95 -0.92 0.00 0.00 175.35 176.37 1r53 s THR 74 N -2.44 4.39 -0.61 2.17 -4.23 0.41 -0.61 115.64 114.72 1r53 s THR 74 Ca 0.12 1.56 0.23 0.00 -1.18 0.00 0.00 61.69 62.42 1r53 s THR 74 Cb -0.03 -3.94 -0.11 0.00 1.34 0.00 0.00 72.50 69.76 1r53 s THR 74 CO 0.03 0.18 1.04 0.18 -0.54 0.00 0.00 174.62 175.51 1r53 n LEU 75 N 0.66 0.62 0.00 4.79 4.77 0.38 -0.37 117.00 127.85 1r53 n LEU 75 Ca -0.00 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1r53 n LEU 75 Cb 0.51 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 1r53 n LEU 75 CO 0.44 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 1r53 n GLY 76 N 1.37 0.65 3.86 -0.72 0.00 -1.26 -4.64 105.19 104.44 1r53 n GLY 76 Ca 0.02 -0.22 -0.25 0.00 0.00 0.00 0.00 46.02 45.57 1r53 n GLY 76 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1r53 s THR 77 N -2.00 2.00 0.21 2.61 -4.23 -1.26 -4.82 115.64 108.15 1r53 s THR 77 Ca 0.00 -1.51 -0.32 0.00 -1.18 0.00 0.00 61.69 58.68 1r53 s THR 77 Cb 0.00 -2.51 -0.12 0.00 1.34 0.00 0.00 72.50 71.21 1r53 s THR 77 CO 0.00 0.00 1.68 -2.65 -0.54 0.00 0.00 174.62 173.11 1r53 n PRO 78 N -1.60 2.62 -3.43 3.99 -0.02 -1.26 -4.70 135.00 130.60 1r53 n PRO 78 Ca -0.01 0.94 -0.44 0.00 -2.02 0.00 0.00 63.50 61.98 1r53 n PRO 78 Cb 0.64 -2.76 -0.07 0.00 -0.02 0.00 0.00 33.50 31.28 1r53 n PRO 78 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1r53 s ILE 79 N 0.99 4.90 -0.01 4.25 1.01 -0.25 -3.08 121.20 129.01 1r53 s ILE 79 Ca 0.75 -1.36 -0.22 0.00 0.00 0.00 0.00 60.65 59.82 1r53 s ILE 79 Cb -0.55 -4.04 -0.05 0.00 0.01 0.00 0.00 42.46 37.83 1r53 s ILE 79 CO 0.35 -0.68 0.64 0.00 0.00 0.00 0.00 174.94 175.25 1r53 s ALA 80 N 1.55 3.43 -0.01 9.38 0.00 -1.25 -0.86 121.76 134.00 1r53 s ALA 80 Ca 0.04 0.09 0.06 0.00 0.00 0.00 0.00 51.96 52.14 1r53 s ALA 80 Cb -0.26 -2.83 -0.01 0.00 0.00 0.00 0.00 23.12 20.01 1r53 s ALA 80 CO 0.04 0.08 -0.18 -1.64 0.00 0.00 0.00 175.76 174.06 1r53 s MET 81 N 0.08 1.45 0.02 0.00 -1.94 -0.44 -0.07 119.30 118.38 1r53 s MET 81 Ca 0.34 -0.67 0.01 0.00 -1.71 0.00 0.00 55.69 53.65 1r53 s MET 81 Cb -0.18 -1.41 -0.01 0.00 2.01 0.00 0.00 34.83 35.23 1r53 s MET 81 CO 0.18 0.39 -0.04 1.41 -0.01 0.00 0.00 175.02 176.95 1r53 s MET 82 N -0.50 0.32 -0.12 2.03 -2.45 -0.90 -1.86 119.30 115.82 1r53 s MET 82 Ca 0.07 -0.45 -0.00 0.00 -1.25 0.00 0.00 55.69 54.06 1r53 s MET 82 Cb -0.07 -0.11 0.03 0.00 1.25 0.00 0.00 34.83 35.92 1r53 s MET 82 CO -0.00 0.02 -0.07 0.42 1.05 0.00 0.00 175.02 176.43 1r53 s ILE 83 N -0.90 1.03 0.48 10.11 1.09 0.29 -1.24 121.20 132.06 1r53 s ILE 83 Ca -0.08 -0.31 -0.23 0.00 -1.10 0.00 0.00 60.65 58.93 1r53 s ILE 83 Cb -0.07 -1.06 -0.07 0.00 -1.06 0.00 0.00 42.46 40.20 1r53 s ILE 83 CO -0.00 0.35 1.20 -0.54 -0.10 0.00 0.00 174.94 175.85 1r53 s LYS 84 N 1.70 3.63 0.11 2.79 1.02 -1.26 -1.72 119.74 126.01 1r53 s LYS 84 Ca 0.05 1.85 0.00 0.00 0.02 0.00 0.00 55.97 57.89 1r53 s LYS 84 Cb -0.13 -2.37 0.00 0.00 -0.52 0.00 0.00 37.83 34.81 1r53 s LYS 84 CO -0.08 -0.68 0.00 0.09 -0.92 0.00 0.00 175.35 173.76 1r53 n ASN 85 N -0.61 -3.96 -4.09 2.83 3.02 -0.90 -4.55 115.26 107.00 1r53 n ASN 85 Ca 0.08 1.18 -0.29 0.00 -0.03 0.00 0.00 54.58 55.52 1r53 n ASN 85 Cb 0.48 -3.09 0.28 0.00 -0.61 0.00 0.00 39.78 36.83 1r53 n ASN 85 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1r53 s ARG 127 N -0.51 -1.89 0.02 3.52 0.52 -1.26 -4.64 118.95 114.70 1r53 s ARG 127 Ca 0.00 0.59 0.01 0.00 -0.52 0.00 0.00 55.73 55.81 1r53 s ARG 127 Cb 0.00 -1.46 -0.02 0.00 0.52 0.00 0.00 34.95 33.99 1r53 s ARG 127 CO 0.00 -4.31 -0.05 -2.00 0.02 0.00 0.00 175.30 168.96 1r53 s GLU 128 N -4.62 0.39 0.00 3.54 2.56 -1.18 -4.70 118.70 114.69 1r53 s GLU 128 Ca 0.69 -0.51 0.19 0.00 0.00 0.00 0.00 54.97 55.34 1r53 s GLU 128 Cb -0.22 -0.19 0.44 0.00 2.00 0.00 0.00 34.13 36.16 1r53 s GLU 128 CO 0.63 0.03 1.36 0.25 -0.56 0.00 0.00 175.26 176.97 1r53 n THR 129 N 2.01 0.75 -0.12 -1.70 -2.24 -1.26 -4.52 114.28 107.20 1r53 n THR 129 Ca -0.20 -0.87 -0.09 0.00 -2.27 0.00 0.00 64.05 60.62 1r53 n THR 129 Cb 0.56 0.73 -0.01 0.00 -2.10 0.00 0.00 70.33 69.51 1r53 n THR 129 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1r53 h ILE 130 N 3.58 1.15 -0.93 2.28 2.04 -1.96 -2.36 117.51 121.30 1r53 h ILE 130 Ca 0.00 -0.38 0.10 0.00 1.00 0.00 0.00 64.86 65.58 1r53 h ILE 130 Cb 0.88 0.70 -0.08 0.00 -0.74 0.00 0.00 36.82 37.59 1r53 h ILE 130 CO 0.00 0.15 0.57 1.23 0.00 0.00 0.00 178.15 180.10 1r53 h GLY 131 N 0.49 1.46 0.65 5.37 0.00 -1.79 0.77 103.07 110.02 1r53 h GLY 131 Ca 0.13 -0.39 0.04 0.00 0.00 0.00 0.00 47.33 47.11 1r53 h GLY 131 CO -0.02 0.19 0.09 3.21 0.00 0.00 0.00 176.54 180.01 1r53 h ARG 132 N 0.96 0.21 -0.22 4.80 3.08 -1.76 -1.23 114.38 120.21 1r53 h ARG 132 Ca 0.44 -0.01 -0.07 0.00 0.07 0.00 0.00 59.98 60.41 1r53 h ARG 132 Cb 0.35 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 1r53 h ARG 132 CO -0.23 0.14 -0.14 0.28 -1.07 0.00 0.00 179.97 178.95 1r53 h VAL 133 N 0.21 1.31 -0.21 2.04 2.07 -0.81 -0.52 116.25 120.34 1r53 h VAL 133 Ca 0.15 -1.24 0.05 0.00 0.82 0.00 0.00 66.70 66.49 1r53 h VAL 133 Cb 0.15 1.66 -0.05 0.00 -1.52 0.00 0.00 31.29 31.52 1r53 h VAL 133 CO -0.18 0.38 -0.14 0.00 0.02 0.00 0.00 177.57 177.64 1r53 h ALA 134 N 0.69 0.01 -0.25 1.67 0.00 -0.88 -1.66 119.26 118.84 1r53 h ALA 134 Ca 0.04 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1r53 h ALA 134 Cb 0.65 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1r53 h ALA 134 CO 0.04 -0.57 -0.23 0.66 0.00 0.00 0.00 179.25 179.15 1r53 h SER 135 N -0.14 0.47 0.26 0.00 4.64 -1.17 -2.63 113.55 114.98 1r53 h SER 135 Ca 0.12 -0.15 -0.07 0.00 -0.47 0.00 0.00 61.79 61.22 1r53 h SER 135 Cb 0.32 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1r53 h SER 135 CO -0.29 0.70 -0.31 1.23 -0.87 0.00 0.00 176.83 177.29 1r53 h GLY 136 N 1.00 0.09 1.52 -0.77 0.00 -0.63 -1.93 103.07 102.35 1r53 h GLY 136 Ca 0.07 -0.07 -0.03 0.00 0.00 0.00 0.00 47.33 47.29 1r53 h GLY 136 CO 0.05 0.07 0.12 0.00 0.00 0.00 0.00 176.54 176.77 1r53 h ALA 137 N 1.61 1.42 0.06 3.60 0.00 -0.93 0.26 119.26 125.28 1r53 h ALA 137 Ca 0.01 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 1r53 h ALA 137 Cb 0.59 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1r53 h ALA 137 CO 0.04 0.43 -0.03 0.82 0.00 0.00 0.00 179.25 180.51 1r53 h ILE 138 N 0.61 1.22 -0.75 0.00 2.04 -1.38 -2.35 117.51 116.90 1r53 h ILE 138 Ca 0.14 -0.99 0.16 0.00 1.00 0.00 0.00 64.86 65.17 1r53 h ILE 138 Cb 0.20 1.86 -0.10 0.00 -0.74 0.00 0.00 36.82 38.04 1r53 h ILE 138 CO -0.01 0.24 0.24 0.00 0.00 0.00 0.00 178.15 178.63 1r53 h ALA 139 N 0.37 1.02 -0.49 1.87 0.00 -1.08 -0.62 119.26 120.34 1r53 h ALA 139 Ca -0.01 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1r53 h ALA 139 Cb 0.46 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1r53 h ALA 139 CO 0.01 -0.29 0.23 1.49 0.00 0.00 0.00 179.25 180.69 1r53 h GLU 140 N 0.35 0.71 -0.40 0.00 4.81 -0.42 0.01 114.58 119.63 1r53 h GLU 140 Ca 0.42 -0.11 -0.03 0.00 -0.13 0.00 0.00 59.36 59.52 1r53 h GLU 140 Cb 0.70 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.93 1r53 h GLU 140 CO -0.47 0.60 0.14 -0.22 -0.73 0.00 0.00 179.01 178.33 1r53 h LYS 141 N 0.64 0.61 -0.74 1.92 3.64 -0.96 0.52 116.57 122.21 1r53 h LYS 141 Ca 0.17 -0.12 0.07 0.00 -1.27 0.00 0.00 60.65 59.50 1r53 h LYS 141 Cb 0.13 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 31.79 1r53 h LYS 141 CO -0.02 0.59 0.42 0.35 -2.27 0.00 0.00 179.45 178.52 1r53 h PHE 142 N 0.50 0.76 -0.21 1.91 3.57 -0.83 -1.86 116.94 120.77 1r53 h PHE 142 Ca 0.13 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.52 1r53 h PHE 142 Cb 0.23 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 1r53 h PHE 142 CO 0.01 0.34 -0.45 -0.07 -2.23 0.00 0.00 178.31 175.90 1r53 h LEU 143 N 0.74 0.57 -0.15 0.59 3.38 -0.78 -2.10 115.31 117.57 1r53 h LEU 143 Ca 0.34 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1r53 h LEU 143 Cb 0.25 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1r53 h LEU 143 CO -0.21 0.95 0.06 0.00 0.09 0.00 0.00 178.44 179.33 1r53 h ALA 144 N 1.08 0.19 0.30 1.53 0.00 -0.34 -2.50 119.26 119.50 1r53 h ALA 144 Ca 0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1r53 h ALA 144 Cb 0.96 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1r53 h ALA 144 CO 0.09 -0.23 -0.14 1.96 0.00 0.00 0.00 179.25 180.92 1r53 h GLN 145 N 0.09 -0.38 -0.87 0.00 4.20 -1.35 0.11 115.11 116.91 1r53 h GLN 145 Ca 0.05 0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.75 1r53 h GLN 145 Cb 0.16 0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.00 1r53 h GLN 145 CO -0.00 -0.13 0.05 0.09 -0.67 0.00 0.00 178.83 178.16 1r53 n ASN 146 N -5.18 2.94 0.00 1.46 3.02 -0.79 -4.42 115.26 112.28 1r53 n ASN 146 Ca -0.10 -2.41 0.00 0.00 -0.03 0.00 0.00 54.58 52.04 1r53 n ASN 146 Cb 0.23 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 38.82 1r53 n ASN 146 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1r53 n SER 147 N 0.17 0.00 -2.20 6.41 3.41 -0.95 -4.99 113.62 115.46 1r53 n SER 147 Ca 0.13 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.59 1r53 n SER 147 Cb 0.69 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.61 1r53 n SER 147 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1r53 n ASN 148 N -0.01 -4.56 -4.74 4.04 4.05 0.39 -4.91 115.26 109.52 1r53 n ASN 148 Ca 0.00 0.18 -0.42 0.00 0.45 0.00 0.00 54.58 54.79 1r53 n ASN 148 Cb 0.00 -3.91 -0.01 0.00 1.23 0.00 0.00 39.78 37.09 1r53 n ASN 148 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 177.26 174.73 1r53 n VAL 149 N -3.26 1.17 -5.03 3.44 0.31 -1.24 -4.68 118.33 109.05 1r53 n VAL 149 Ca -0.18 -0.29 -0.32 0.00 -0.01 0.00 0.00 64.34 63.54 1r53 n VAL 149 Cb 0.61 -1.91 -0.17 0.00 -0.91 0.00 0.00 33.84 31.46 1r53 n VAL 149 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1r53 s GLU 150 N -0.75 3.08 -0.18 5.55 2.02 -0.36 -4.56 118.70 123.50 1r53 s GLU 150 Ca 0.63 -0.85 -0.01 0.00 0.02 0.00 0.00 54.97 54.76 1r53 s GLU 150 Cb -0.51 -2.37 0.00 0.00 0.10 0.00 0.00 34.13 31.35 1r53 s GLU 150 CO 0.51 0.13 -0.14 0.42 0.02 0.00 0.00 175.26 176.20 1r53 s ILE 151 N 0.47 2.64 -0.09 -1.63 1.01 -1.26 -0.67 121.20 121.67 1r53 s ILE 151 Ca -0.15 -0.75 -0.02 0.00 0.00 0.00 0.00 60.65 59.73 1r53 s ILE 151 Cb -0.17 -2.14 0.03 0.00 0.01 0.00 0.00 42.46 40.19 1r53 s ILE 151 CO 0.06 0.50 0.01 -0.69 0.00 0.00 0.00 174.94 174.81 1r53 s VAL 152 N 1.20 0.41 0.18 2.92 1.01 -0.20 -4.89 120.40 121.04 1r53 s VAL 152 Ca 0.02 -0.00 0.06 0.00 0.00 0.00 0.00 61.98 62.06 1r53 s VAL 152 Cb -0.14 -0.63 -0.04 0.00 0.00 0.00 0.00 36.38 35.57 1r53 s VAL 152 CO -0.06 0.18 0.10 0.00 0.00 0.00 0.00 175.10 175.32 1r53 s ALA 153 N 1.95 3.46 0.09 5.51 0.00 -1.26 -1.47 121.76 130.03 1r53 s ALA 153 Ca 0.04 -1.28 -0.26 0.00 0.00 0.00 0.00 51.96 50.46 1r53 s ALA 153 Cb -0.13 -1.25 0.07 0.00 0.00 0.00 0.00 23.12 21.81 1r53 s ALA 153 CO -0.06 0.47 0.65 -0.59 0.00 0.00 0.00 175.76 176.23 1r53 s PHE 154 N -1.79 -0.56 0.03 0.00 -0.12 0.30 -4.97 117.98 110.88 1r53 s PHE 154 Ca 0.30 0.56 -0.30 0.00 -0.05 0.00 0.00 56.93 57.43 1r53 s PHE 154 Cb -0.10 0.51 -0.05 0.00 -0.63 0.00 0.00 43.02 42.76 1r53 s PHE 154 CO 0.22 -0.76 1.14 0.08 -0.05 0.00 0.00 175.22 175.85 1r53 s VAL 155 N -2.94 4.29 0.00 -2.49 1.01 -0.45 -0.44 120.40 119.38 1r53 s VAL 155 Ca -0.02 1.64 0.00 0.00 0.00 0.00 0.00 61.98 63.60 1r53 s VAL 155 Cb -0.01 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.32 1r53 s VAL 155 CO -0.06 0.12 0.39 0.35 0.00 0.00 0.00 175.10 175.90 1r53 n THR 156 N 3.97 0.00 -3.64 3.92 -2.24 -0.61 -4.28 114.28 111.41 1r53 n THR 156 Ca 0.08 -0.49 -0.09 0.00 -2.27 0.00 0.00 64.05 61.29 1r53 n THR 156 Cb 0.48 1.02 -0.07 0.00 -2.10 0.00 0.00 70.33 69.66 1r53 n THR 156 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1r53 s GLN 157 N -0.18 0.75 -0.15 -0.78 0.74 -1.20 -1.05 119.66 117.78 1r53 s GLN 157 Ca 0.00 1.15 -0.01 0.00 0.05 0.00 0.00 55.36 56.56 1r53 s GLN 157 Cb 0.00 0.22 0.04 0.00 1.10 0.00 0.00 33.01 34.37 1r53 s GLN 157 CO 0.00 -0.13 -0.04 0.42 -0.55 0.00 0.00 175.29 174.98 1r53 s ILE 158 N 1.25 0.98 0.00 -2.34 -1.09 -0.64 -1.54 121.20 117.82 1r53 s ILE 158 Ca -0.07 -0.49 0.00 0.00 -2.23 0.00 0.00 60.65 57.86 1r53 s ILE 158 Cb -0.05 -1.15 0.00 0.00 -1.58 0.00 0.00 42.46 39.68 1r53 s ILE 158 CO -0.14 0.16 0.00 0.61 -1.23 0.00 0.00 174.94 174.34 1r53 n GLY 159 N 4.93 3.48 0.00 6.18 0.00 -0.56 -1.17 105.19 118.04 1r53 n GLY 159 Ca -0.11 -0.14 0.14 0.00 0.00 0.00 0.00 46.02 45.90 1r53 n GLY 159 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1r53 n GLU 160 N 13.96 0.30 -3.23 1.61 1.02 -1.26 -4.78 120.64 128.26 1r53 n GLU 160 Ca 0.00 0.02 -0.41 0.00 -0.02 0.00 0.00 57.16 56.75 1r53 n GLU 160 Cb 0.00 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 29.84 1r53 n GLU 160 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1r53 s ILE 161 N -2.68 5.03 -0.18 -3.67 -1.09 -0.32 -5.04 121.20 113.25 1r53 s ILE 161 Ca 0.23 0.56 -0.02 0.00 -2.23 0.00 0.00 60.65 59.20 1r53 s ILE 161 Cb 0.19 -3.92 -0.01 0.00 -1.58 0.00 0.00 42.46 37.14 1r53 s ILE 161 CO 0.45 -0.11 -0.10 -0.54 -1.23 0.00 0.00 174.94 173.41 1r53 s LYS 162 N 2.38 3.32 0.32 2.79 1.02 -1.26 -1.63 119.74 126.68 1r53 s LYS 162 Ca 0.20 -0.68 -0.29 0.00 0.02 0.00 0.00 55.97 55.22 1r53 s LYS 162 Cb -0.15 -2.78 -0.10 0.00 -0.52 0.00 0.00 37.83 34.27 1r53 s LYS 162 CO 0.12 -0.03 1.38 1.41 -0.92 0.00 0.00 175.35 177.31 1r53 s MET 163 N 0.98 4.28 0.03 1.68 -2.45 -0.21 -4.99 119.30 118.63 1r53 s MET 163 Ca -0.01 2.31 -0.32 0.00 -1.25 0.00 0.00 55.69 56.42 1r53 s MET 163 Cb -0.15 -3.06 -0.11 0.00 1.25 0.00 0.00 34.83 32.76 1r53 s MET 163 CO -0.01 -0.32 1.87 -1.71 1.05 0.00 0.00 175.02 175.90 1r53 n ASN 164 N 1.18 3.82 -2.71 1.11 2.85 -1.26 -4.90 115.26 115.35 1r53 n ASN 164 Ca 0.02 0.96 -0.06 0.00 -0.11 0.00 0.00 54.58 55.40 1r53 n ASN 164 Cb 0.41 -1.48 0.04 0.00 1.24 0.00 0.00 39.78 39.99 1r53 n ASN 164 CO 0.00 0.00 0.00 -2.11 -2.11 0.00 0.00 177.26 173.04 1r53 n ARG 165 N 6.35 1.71 -2.40 1.20 1.85 -1.26 -4.86 116.66 119.25 1r53 n ARG 165 Ca 0.20 -3.50 -0.42 0.00 -1.00 0.00 0.00 57.85 53.13 1r53 n ARG 165 Cb 0.35 -1.55 -0.03 0.00 -1.05 0.00 0.00 32.46 30.19 1r53 n ARG 165 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 1r53 s ASP 166 N -3.54 7.00 0.48 2.89 2.15 -1.26 -4.91 116.67 119.48 1r53 s ASP 166 Ca 0.29 1.90 0.20 0.00 0.43 0.00 0.00 52.55 55.36 1r53 s ASP 166 Cb 0.38 -2.56 1.21 0.00 -0.30 0.00 0.00 42.92 41.65 1r53 s ASP 166 CO -0.01 -0.61 2.04 0.77 -0.17 0.00 0.00 175.17 177.19 1r53 h SER 167 N 7.51 0.00 0.22 -0.34 4.64 -1.92 -1.54 113.55 122.13 1r53 h SER 167 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 1r53 h SER 167 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1r53 h SER 167 CO 0.88 0.14 -0.01 0.49 -0.87 0.00 0.00 176.83 177.46 1r53 n PHE 168 N -4.09 0.00 -3.18 4.77 3.72 -1.26 -4.65 117.46 112.77 1r53 n PHE 168 Ca -0.02 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.95 1r53 n PHE 168 Cb 0.22 -0.11 -0.07 0.00 -0.94 0.00 0.00 39.48 38.58 1r53 n PHE 168 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1r53 s ASP 169 N -2.24 6.27 0.44 4.37 2.15 -0.58 -4.96 116.67 122.12 1r53 s ASP 169 Ca 0.39 -0.52 0.28 0.00 0.43 0.00 0.00 52.55 53.13 1r53 s ASP 169 Cb 0.21 -2.29 1.35 0.00 -0.30 0.00 0.00 42.92 41.90 1r53 s ASP 169 CO 0.41 -0.73 1.67 1.55 -0.17 0.00 0.00 175.17 177.90 1r53 h PRO 170 N 8.85 0.16 -0.41 4.34 0.13 -1.87 -1.43 132.00 141.77 1r53 h PRO 170 Ca -0.26 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 64.81 1r53 h PRO 170 Cb 1.10 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.18 1r53 h PRO 170 CO 0.87 0.10 0.05 0.93 -0.23 0.00 0.00 178.00 179.73 1r53 h GLU 171 N 0.16 0.69 -0.30 0.86 5.08 -1.94 0.30 114.58 119.43 1r53 h GLU 171 Ca 0.75 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.92 1r53 h GLU 171 Cb 2.30 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 31.46 1r53 h GLU 171 CO -0.35 0.74 0.19 0.35 -1.00 0.00 0.00 179.01 178.94 1r53 h PHE 172 N 0.53 0.38 -0.94 4.33 3.57 -1.58 -0.63 116.94 122.60 1r53 h PHE 172 Ca 0.12 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.64 1r53 h PHE 172 Cb 0.40 -0.13 -0.05 0.00 2.79 0.00 0.00 35.95 38.96 1r53 h PHE 172 CO 0.03 0.26 0.62 1.96 -2.23 0.00 0.00 178.31 178.94 1r53 h GLN 173 N 0.39 1.22 -0.45 1.11 1.08 -1.23 -0.80 115.11 116.44 1r53 h GLN 173 Ca 0.11 -0.07 -0.07 0.00 -1.45 0.00 0.00 58.65 57.17 1r53 h GLN 173 Cb -0.02 -0.28 -0.02 0.00 -0.05 0.00 0.00 27.48 27.11 1r53 h GLN 173 CO -0.02 0.81 -0.00 1.25 -0.95 0.00 0.00 178.83 179.92 1r53 h HIS 174 N 1.26 0.78 -0.22 2.96 2.76 -0.76 -0.91 115.15 121.02 1r53 h HIS 174 Ca 0.35 -0.10 -0.05 0.00 -2.20 0.00 0.00 60.37 58.37 1r53 h HIS 174 Cb -0.13 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 28.60 1r53 h HIS 174 CO -0.01 0.73 -0.04 1.25 -1.30 0.00 0.00 177.93 178.56 1r53 h LEU 175 N 0.69 0.42 -1.29 0.26 6.46 -0.35 -2.15 115.31 119.34 1r53 h LEU 175 Ca 0.14 -0.35 0.14 0.00 -0.12 0.00 0.00 57.88 57.69 1r53 h LEU 175 Cb 0.43 -0.11 -0.07 0.00 -0.73 0.00 0.00 40.66 40.17 1r53 h LEU 175 CO 0.02 0.67 0.57 -0.07 -0.62 0.00 0.00 178.44 179.01 1r53 h LEU 176 N 0.15 0.65 -0.96 2.25 3.38 -0.90 0.81 115.31 120.69 1r53 h LEU 176 Ca 0.06 0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 1r53 h LEU 176 Cb 0.48 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1r53 h LEU 176 CO 0.02 0.33 -0.43 0.78 0.09 0.00 0.00 178.44 179.24 1r53 h ASN 177 N 0.69 0.00 0.00 -0.43 2.35 -0.85 -3.38 115.58 113.96 1r53 h ASN 177 Ca 0.44 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.19 1r53 h ASN 177 Cb 0.71 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.08 1r53 h ASN 177 CO -0.20 0.43 -1.11 0.35 -1.65 0.00 0.00 177.43 175.25 1r53 n THR 178 N -3.66 0.00 -1.72 2.81 -2.24 -0.77 -5.06 114.28 103.64 1r53 n THR 178 Ca -0.01 -0.05 -0.40 0.00 -2.27 0.00 0.00 64.05 61.32 1r53 n THR 178 Cb 0.51 0.42 0.02 0.00 -2.10 0.00 0.00 70.33 69.19 1r53 n THR 178 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1r53 n ILE 179 N -1.59 2.90 -4.26 2.28 0.13 0.21 -5.01 119.36 114.01 1r53 n ILE 179 Ca -0.00 -0.50 -0.14 0.00 -1.10 0.00 0.00 62.75 61.00 1r53 n ILE 179 Cb 0.07 -1.65 -0.10 0.00 -0.84 0.00 0.00 39.64 37.12 1r53 n ILE 179 CO 0.00 0.00 0.00 0.42 2.80 0.00 0.00 176.55 179.77 1r53 s THR 180 N -1.23 1.00 0.19 9.51 -4.23 -1.26 -4.94 115.64 114.68 1r53 s THR 180 Ca 0.63 -2.03 -0.12 0.00 -1.18 0.00 0.00 61.69 59.00 1r53 s THR 180 Cb -0.47 -2.01 0.10 0.00 1.34 0.00 0.00 72.50 71.46 1r53 s THR 180 CO 0.56 -0.60 1.76 0.03 -0.54 0.00 0.00 174.62 175.83 1r53 h ARG 181 N 2.70 0.40 -0.67 3.99 3.08 -1.93 -0.11 114.38 121.85 1r53 h ARG 181 Ca -0.37 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 59.69 1r53 h ARG 181 Cb 1.20 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 31.11 1r53 h ARG 181 CO 0.64 0.27 0.41 0.93 -1.07 0.00 0.00 179.97 181.14 1r53 h GLU 182 N 0.41 0.77 -0.63 0.04 5.08 -1.99 0.11 114.58 118.38 1r53 h GLU 182 Ca 0.25 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.50 1r53 h GLU 182 Cb 0.25 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.30 1r53 h GLU 182 CO -0.23 0.51 0.15 0.87 -1.00 0.00 0.00 179.01 179.30 1r53 h LYS 183 N 0.79 1.01 -0.35 2.33 1.57 -1.82 -1.65 116.57 118.46 1r53 h LYS 183 Ca 0.27 -0.25 0.04 0.00 -1.87 0.00 0.00 60.65 58.85 1r53 h LYS 183 Cb 0.05 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 1r53 h LYS 183 CO -0.12 0.92 0.11 0.28 -0.57 0.00 0.00 179.45 180.07 1r53 h VAL 184 N 0.93 0.88 0.00 0.50 2.07 -0.13 -2.80 116.25 117.70 1r53 h VAL 184 Ca 0.20 -0.09 -0.05 0.00 0.82 0.00 0.00 66.70 67.58 1r53 h VAL 184 Cb 0.37 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1r53 h VAL 184 CO 0.00 0.05 -0.23 0.44 0.02 0.00 0.00 177.57 177.85 1r53 h ASP 185 N 0.25 0.00 0.29 0.57 3.32 -0.65 -3.10 116.42 117.10 1r53 h ASP 185 Ca 0.16 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.19 1r53 h ASP 185 Cb 0.14 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.69 1r53 h ASP 185 CO -0.17 0.23 -0.08 0.77 -1.72 0.00 0.00 179.24 178.27 1r53 h SER 186 N 0.00 0.00 0.49 6.45 4.64 -1.02 -2.53 113.55 121.58 1r53 h SER 186 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1r53 h SER 186 Cb 0.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 1r53 h SER 186 CO 0.03 0.08 0.00 0.23 -0.87 0.00 0.00 176.83 176.30 1r53 n MET 187 N -3.60 0.02 0.00 4.77 2.81 -1.17 -5.02 117.12 114.93 1r53 n MET 187 Ca -0.02 0.24 0.00 0.00 -1.81 0.00 0.00 57.70 56.11 1r53 n MET 187 Cb 0.19 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.20 1r53 n MET 187 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1r53 n GLY 188 N 0.01 0.45 0.37 3.03 0.00 -0.95 -4.60 105.19 103.49 1r53 n GLY 188 Ca 0.04 -2.04 0.18 0.00 0.00 0.00 0.00 46.02 44.21 1r53 n GLY 188 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1r53 h PRO 189 N 0.00 0.00 0.00 1.61 0.13 -1.84 -2.25 132.00 129.65 1r53 h PRO 189 Ca 0.00 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.07 1r53 h PRO 189 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 1r53 h PRO 189 CO 0.00 0.00 -0.28 0.97 -0.23 0.00 0.00 178.00 178.46 1r53 h ILE 190 N 0.00 1.17 -6.26 -3.56 6.09 -1.94 -3.45 117.51 109.56 1r53 h ILE 190 Ca 0.12 -0.97 -0.47 0.00 -1.37 0.00 0.00 64.86 62.17 1r53 h ILE 190 Cb 0.92 1.53 -0.02 0.00 0.47 0.00 0.00 36.82 39.72 1r53 h ILE 190 CO -0.00 0.27 -0.76 0.54 -3.07 0.00 0.00 178.15 175.14 1r53 n ARG 191 N -4.16 -5.66 -4.00 2.19 1.74 -0.85 -4.55 116.66 101.38 1r53 n ARG 191 Ca -0.02 0.61 -0.34 0.00 -0.77 0.00 0.00 57.85 57.34 1r53 n ARG 191 Cb 0.33 -5.49 -0.15 0.00 -1.02 0.00 0.00 32.46 26.13 1r53 n ARG 191 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1r53 n PRO 193 N 4.59 1.86 -3.62 0.00 -0.04 -1.26 -4.61 135.00 131.91 1r53 n PRO 193 Ca -0.16 -1.25 -0.27 0.00 -0.04 0.00 0.00 63.50 61.78 1r53 n PRO 193 Cb 0.45 -1.75 -0.16 0.00 -0.04 0.00 0.00 33.50 32.00 1r53 n PRO 193 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1r53 s ASP 194 N 1.21 2.91 0.42 3.54 -1.08 -1.26 -5.01 116.67 117.40 1r53 s ASP 194 Ca 0.44 -0.92 0.29 0.00 -0.52 0.00 0.00 52.55 51.84 1r53 s ASP 194 Cb 0.25 -0.38 1.09 0.00 -1.46 0.00 0.00 42.92 42.42 1r53 s ASP 194 CO -0.06 -0.37 1.84 0.00 0.52 0.00 0.00 175.17 177.10 1r53 h ALA 195 N 8.36 1.00 0.00 3.66 0.00 -2.00 0.82 119.26 131.10 1r53 h ALA 195 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1r53 h ALA 195 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1r53 h ALA 195 CO 0.35 0.00 0.00 0.66 0.00 0.00 0.00 179.25 180.26 1r53 h SER 196 N 0.00 0.00 0.00 0.00 4.64 -1.97 -3.34 113.55 112.89 1r53 h SER 196 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1r53 h SER 196 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1r53 h SER 196 CO 0.00 0.00 -0.25 1.33 -0.87 0.00 0.00 176.83 177.04 1r53 n VAL 197 N -2.81 0.00 -0.11 0.95 0.24 -0.84 -4.79 118.33 110.97 1r53 n VAL 197 Ca 0.00 -0.15 -0.07 0.00 -2.04 0.00 0.00 64.34 62.08 1r53 n VAL 197 Cb 0.21 0.67 0.01 0.00 -1.47 0.00 0.00 33.84 33.26 1r53 n VAL 197 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1r53 h ALA 198 N 0.00 0.44 -0.16 2.33 0.00 -0.97 -0.09 119.26 120.81 1r53 h ALA 198 Ca 0.00 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 1r53 h ALA 198 Cb 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1r53 h ALA 198 CO 0.00 -0.19 -0.52 0.78 0.00 0.00 0.00 179.25 179.32 1r53 h GLY 199 N 0.37 0.49 1.58 0.00 0.00 -1.85 -1.51 103.07 102.16 1r53 h GLY 199 Ca 0.15 -0.55 -0.03 0.00 0.00 0.00 0.00 47.33 46.90 1r53 h GLY 199 CO -0.10 0.50 0.12 1.41 0.00 0.00 0.00 176.54 178.46 1r53 h LEU 200 N 0.35 0.49 -0.53 3.11 3.38 -1.71 -2.07 115.31 118.32 1r53 h LEU 200 Ca 0.01 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1r53 h LEU 200 Cb 1.03 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 1r53 h LEU 200 CO 0.09 0.47 0.01 0.24 0.09 0.00 0.00 178.44 179.34 1r53 h MET 201 N 0.53 0.94 -0.79 1.13 2.86 -0.18 -1.35 114.93 118.07 1r53 h MET 201 Ca 0.13 -0.30 -0.05 0.00 -2.06 0.00 0.00 59.70 57.43 1r53 h MET 201 Cb 0.17 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.70 1r53 h MET 201 CO -0.01 0.95 0.31 0.28 1.06 0.00 0.00 176.91 179.51 1r53 h VAL 202 N 0.81 1.26 -0.58 -2.22 2.07 -1.11 -1.12 116.25 115.37 1r53 h VAL 202 Ca 0.15 -0.83 -0.07 0.00 0.82 0.00 0.00 66.70 66.77 1r53 h VAL 202 Cb 0.52 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1r53 h VAL 202 CO 0.03 0.34 0.07 0.50 0.02 0.00 0.00 177.57 178.53 1r53 h LYS 203 N 1.15 0.95 -0.38 1.57 3.64 -1.26 -1.21 116.57 121.03 1r53 h LYS 203 Ca 0.26 -0.24 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1r53 h LYS 203 Cb 0.22 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1r53 h LYS 203 CO -0.02 0.89 0.23 1.49 -2.27 0.00 0.00 179.45 179.77 1r53 h GLU 204 N 0.89 0.52 -0.56 1.90 4.57 -0.83 0.52 114.58 121.59 1r53 h GLU 204 Ca 0.18 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.31 1r53 h GLU 204 Cb 0.42 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.87 1r53 h GLU 204 CO 0.01 0.38 0.34 0.82 -1.18 0.00 0.00 179.01 179.39 1r53 h ILE 205 N 0.50 1.16 0.10 2.32 2.04 -0.86 -2.14 117.51 120.63 1r53 h ILE 205 Ca 0.14 -0.33 -0.27 0.00 1.00 0.00 0.00 64.86 65.39 1r53 h ILE 205 Cb -0.01 0.36 0.01 0.00 -0.74 0.00 0.00 36.82 36.45 1r53 h ILE 205 CO -0.03 0.16 -1.17 -0.33 0.00 0.00 0.00 178.15 176.78 1r53 h GLU 206 N 0.77 0.44 -0.44 2.37 4.39 -0.84 -1.24 114.58 120.02 1r53 h GLU 206 Ca 0.20 -0.60 0.09 0.00 0.34 0.00 0.00 59.36 59.39 1r53 h GLU 206 Cb -0.04 0.20 -0.10 0.00 -0.10 0.00 0.00 28.75 28.71 1r53 h GLU 206 CO -0.04 1.25 -0.30 -0.22 -1.16 0.00 0.00 179.01 178.54 1r53 h LYS 207 N 0.18 -0.20 0.00 2.33 3.64 -0.62 -1.63 116.57 120.28 1r53 h LYS 207 Ca -0.14 0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.12 1r53 h LYS 207 Cb 1.85 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.70 1r53 h LYS 207 CO 0.21 -0.13 -0.64 1.88 -2.27 0.00 0.00 179.45 178.50 1r53 h TYR 208 N -0.21 0.00 -0.25 1.91 0.05 -1.32 -2.66 116.97 114.50 1r53 h TYR 208 Ca 0.19 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.88 1r53 h TYR 208 Cb 0.52 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.25 1r53 h TYR 208 CO -0.54 0.64 -0.25 -0.09 -1.05 0.00 0.00 178.16 176.87 1r53 h ARG 209 N 0.00 0.47 -0.55 4.88 2.43 -1.03 0.78 114.38 121.36 1r53 h ARG 209 Ca -0.01 -0.18 -0.09 0.00 -0.81 0.00 0.00 59.98 58.89 1r53 h ARG 209 Cb 1.14 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.64 1r53 h ARG 209 CO 0.08 0.69 -0.04 0.78 -1.51 0.00 0.00 179.97 179.98 1r53 h GLY 210 N 1.01 1.04 0.15 2.80 0.00 -0.97 -2.44 103.07 104.67 1r53 h GLY 210 Ca 0.06 -0.76 0.00 0.00 0.00 0.00 0.00 47.33 46.63 1r53 h GLY 210 CO 0.05 0.70 0.00 0.70 0.00 0.00 0.00 176.54 177.99 1r53 n ASN 211 N -4.18 0.04 -3.67 0.19 3.02 -1.03 -4.89 115.26 104.75 1r53 n ASN 211 Ca 0.02 -1.82 -0.28 0.00 -0.03 0.00 0.00 54.58 52.48 1r53 n ASN 211 Cb 0.35 -0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.52 1r53 n ASN 211 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1r53 n LYS 212 N -0.57 -4.20 -4.62 3.52 5.02 -0.92 -4.96 118.16 111.43 1r53 n LYS 212 Ca 0.05 0.53 -0.31 0.00 -2.02 0.00 0.00 58.31 56.56 1r53 n LYS 212 Cb 0.03 -5.32 -0.07 0.00 -0.02 0.00 0.00 35.03 29.64 1r53 n LYS 212 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1r53 s ASP 213 N -3.01 4.15 0.16 4.39 -1.08 0.24 -5.03 116.67 116.49 1r53 s ASP 213 Ca 0.54 -1.54 -0.00 0.00 -0.52 0.00 0.00 52.55 51.03 1r53 s ASP 213 Cb -0.28 0.31 -0.04 0.00 -1.46 0.00 0.00 42.92 41.44 1r53 s ASP 213 CO 0.67 -0.80 0.06 -0.94 0.52 0.00 0.00 175.17 174.69 1r53 s SER 214 N -3.89 0.46 0.01 -0.34 1.04 -1.26 -4.07 113.70 105.64 1r53 s SER 214 Ca 0.15 -1.25 -0.15 0.00 0.48 0.00 0.00 55.95 55.19 1r53 s SER 214 Cb 0.03 0.28 0.02 0.00 0.10 0.00 0.00 66.02 66.45 1r53 s SER 214 CO 0.08 -0.73 0.31 -0.51 0.98 0.00 0.00 173.24 173.38 1r53 s ILE 215 N -4.00 0.07 0.00 -1.02 2.07 -1.26 -4.94 121.20 112.12 1r53 s ILE 215 Ca 0.27 -0.55 0.00 0.00 -1.41 0.00 0.00 60.65 58.96 1r53 s ILE 215 Cb 0.07 -0.76 0.00 0.00 0.13 0.00 0.00 42.46 41.90 1r53 s ILE 215 CO 0.05 -0.31 0.00 0.61 -1.91 0.00 0.00 174.94 173.38 1r53 n GLY 216 N 0.96 -0.31 2.94 1.50 0.00 -1.26 -4.57 105.19 104.45 1r53 n GLY 216 Ca -0.20 -1.75 0.01 0.00 0.00 0.00 0.00 46.02 44.08 1r53 n GLY 216 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r53 n GLY 217 N 5.00 0.48 3.22 -0.02 0.00 -1.05 -1.50 105.19 111.32 1r53 n GLY 217 Ca 0.00 -1.03 -0.30 0.00 0.00 0.00 0.00 46.02 44.70 1r53 n GLY 217 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r53 s VAL 218 N -2.10 1.84 -0.16 1.61 1.01 -0.59 -0.36 120.40 121.66 1r53 s VAL 218 Ca 0.21 -0.94 -0.06 0.00 0.00 0.00 0.00 61.98 61.19 1r53 s VAL 218 Cb -0.01 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 1r53 s VAL 218 CO 0.01 0.52 0.04 -0.69 0.00 0.00 0.00 175.10 174.97 1r53 s VAL 219 N -0.08 4.57 -0.06 2.92 1.01 -0.43 -1.57 120.40 126.76 1r53 s VAL 219 Ca -0.04 -0.12 0.03 0.00 0.00 0.00 0.00 61.98 61.85 1r53 s VAL 219 Cb -0.13 -3.02 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 1r53 s VAL 219 CO 0.03 0.50 -0.12 -0.89 0.00 0.00 0.00 175.10 174.62 1r53 s THR 220 N 0.05 3.23 -0.03 3.92 2.01 0.42 -0.53 115.64 124.70 1r53 s THR 220 Ca 0.04 -0.66 0.03 0.00 0.31 0.00 0.00 61.69 61.41 1r53 s THR 220 Cb -0.12 -2.28 0.00 0.00 0.01 0.00 0.00 72.50 70.11 1r53 s THR 220 CO 0.01 0.59 -0.11 0.00 -0.69 0.00 0.00 174.62 174.42 1r53 s VAL 222 N 0.17 3.04 -0.12 0.00 0.11 -0.54 -1.20 120.40 121.87 1r53 s VAL 222 Ca -0.04 -0.98 0.01 0.00 -2.93 0.00 0.00 61.98 58.05 1r53 s VAL 222 Cb -0.10 -2.27 0.02 0.00 -1.53 0.00 0.00 36.38 32.50 1r53 s VAL 222 CO 0.01 0.42 -0.14 -0.69 -3.33 0.00 0.00 175.10 171.37 1r53 s VAL 223 N -0.89 1.45 0.22 2.04 1.01 0.01 -1.03 120.40 123.21 1r53 s VAL 223 Ca 0.14 -0.60 0.08 0.00 0.00 0.00 0.00 61.98 61.61 1r53 s VAL 223 Cb -0.11 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.88 1r53 s VAL 223 CO 0.05 0.43 0.00 -0.13 0.00 0.00 0.00 175.10 175.45 1r53 s ARG 224 N 1.17 2.37 -1.07 2.72 0.52 0.16 -1.77 118.95 123.05 1r53 s ARG 224 Ca -0.03 -1.24 -0.02 0.00 -0.52 0.00 0.00 55.73 53.93 1r53 s ARG 224 Cb -0.14 -2.28 0.00 0.00 0.52 0.00 0.00 34.95 33.05 1r53 s ARG 224 CO -0.04 0.41 0.23 0.09 0.02 0.00 0.00 175.30 176.01 1r53 n ASN 225 N -0.48 -4.36 -4.74 0.23 3.02 -1.26 -1.22 115.26 106.45 1r53 n ASN 225 Ca -0.08 -0.11 -0.40 0.00 -0.03 0.00 0.00 54.58 53.95 1r53 n ASN 225 Cb 0.57 -3.36 -0.05 0.00 -0.61 0.00 0.00 39.78 36.32 1r53 n ASN 225 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1r53 s LEU 226 N -4.21 4.51 0.81 3.41 2.96 -1.26 -4.24 118.68 120.65 1r53 s LEU 226 Ca 0.11 1.67 -0.11 0.00 -0.22 0.00 0.00 54.13 55.58 1r53 s LEU 226 Cb -0.05 -3.42 0.08 0.00 0.50 0.00 0.00 46.19 43.30 1r53 s LEU 226 CO 0.14 0.02 1.10 -2.84 -1.32 0.00 0.00 176.35 173.45 1r53 s PRO 227 N -0.30 1.96 0.55 0.98 0.02 -1.26 -4.37 135.00 132.57 1r53 s PRO 227 Ca 0.42 1.14 -0.17 0.00 0.02 0.00 0.00 61.00 62.40 1r53 s PRO 227 Cb -0.23 -1.87 -0.06 0.00 0.02 0.00 0.00 34.50 32.37 1r53 s PRO 227 CO 0.27 -1.84 1.05 0.99 -0.33 0.00 0.00 177.00 177.13 1r53 s THR 228 N -2.89 3.86 0.00 0.99 2.01 -1.26 -4.26 115.64 114.09 1r53 s THR 228 Ca 0.62 0.98 0.00 0.00 0.31 0.00 0.00 61.69 63.60 1r53 s THR 228 Cb -0.18 -3.43 0.00 0.00 0.01 0.00 0.00 72.50 68.90 1r53 s THR 228 CO 0.56 -0.43 0.00 0.61 -0.69 0.00 0.00 174.62 174.68 1r53 n GLY 229 N -0.77 0.74 3.79 4.40 0.00 -0.76 -4.95 105.19 107.64 1r53 n GLY 229 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 1r53 n GLY 229 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r53 s LEU 230 N 0.00 4.50 0.00 0.99 1.02 -1.26 -4.72 118.68 119.20 1r53 s LEU 230 Ca 0.00 1.52 0.00 0.00 0.02 0.00 0.00 54.13 55.67 1r53 s LEU 230 Cb 0.00 -3.34 0.00 0.00 0.02 0.00 0.00 46.19 42.87 1r53 s LEU 230 CO 0.00 0.16 0.00 0.61 0.02 0.00 0.00 176.35 177.14 1r53 n GLY 231 N 1.31 2.96 2.35 -3.19 0.00 -1.26 -0.30 105.19 107.05 1r53 n GLY 231 Ca -0.05 -1.88 -0.26 0.00 0.00 0.00 0.00 46.02 43.83 1r53 n GLY 231 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1r53 n GLU 232 N -0.05 0.42 -1.01 1.61 -0.58 -0.17 -4.83 120.64 116.03 1r53 n GLU 232 Ca 0.00 -3.25 -0.33 0.00 -0.42 0.00 0.00 57.16 53.16 1r53 n GLU 232 Cb 0.00 -1.56 0.12 0.00 -0.57 0.00 0.00 31.44 29.43 1r53 n GLU 232 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 1r53 n PRO 233 N 2.36 0.01 0.06 3.49 -0.02 -1.26 -1.79 135.00 137.85 1r53 n PRO 233 Ca 0.27 0.07 0.11 0.00 -2.02 0.00 0.00 63.50 61.94 1r53 n PRO 233 Cb 0.49 -2.22 -0.01 0.00 -0.02 0.00 0.00 33.50 31.74 1r53 n PRO 233 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1r53 n PHE 235 N -2.33 0.00 -1.56 0.00 3.72 -1.25 -4.43 117.46 111.60 1r53 n PHE 235 Ca 0.00 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.08 1r53 n PHE 235 Cb 0.51 -0.75 0.06 0.00 -0.94 0.00 0.00 39.48 38.36 1r53 n PHE 235 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1r53 n ASP 236 N -2.51 6.90 -4.52 4.37 8.00 -0.74 -4.84 116.55 123.21 1r53 n ASP 236 Ca -0.21 -3.78 -0.39 0.00 0.71 0.00 0.00 54.79 51.13 1r53 n ASP 236 Cb 0.89 -0.80 0.04 0.00 -0.02 0.00 0.00 41.12 41.23 1r53 n ASP 236 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1r53 n LYS 237 N -0.84 0.71 -0.35 -1.24 5.02 -1.19 -1.00 118.16 119.28 1r53 n LYS 237 Ca 0.57 0.27 0.01 0.00 -2.02 0.00 0.00 58.31 57.15 1r53 n LYS 237 Cb 0.73 -1.85 0.16 0.00 -0.02 0.00 0.00 35.03 34.04 1r53 n LYS 237 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1r53 h LEU 238 N 0.49 0.97 -1.44 -0.35 5.85 -1.45 -1.16 115.31 118.23 1r53 h LEU 238 Ca -0.46 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.21 1r53 h LEU 238 Cb 1.38 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 1r53 h LEU 238 CO 0.49 0.63 -0.27 1.05 -0.34 0.00 0.00 178.44 180.01 1r53 h GLU 239 N 1.12 0.00 -0.01 1.25 9.09 -1.90 0.56 114.58 124.69 1r53 h GLU 239 Ca 0.40 0.00 -0.25 0.00 0.05 0.00 0.00 59.36 59.56 1r53 h GLU 239 Cb 0.14 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.25 1r53 h GLU 239 CO -0.16 0.27 -1.00 0.00 0.05 0.00 0.00 179.01 178.16 1r53 h ALA 240 N 1.73 0.21 -0.58 1.06 0.00 -1.59 -1.38 119.26 118.71 1r53 h ALA 240 Ca -0.00 -0.70 -0.08 0.00 0.00 0.00 0.00 54.91 54.13 1r53 h ALA 240 Cb 0.57 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1r53 h ALA 240 CO 0.03 0.73 0.07 0.52 0.00 0.00 0.00 179.25 180.60 1r53 h MET 241 N 0.35 0.99 -0.43 0.00 2.86 -0.82 -1.70 114.93 116.18 1r53 h MET 241 Ca -0.11 -0.28 -0.06 0.00 -2.06 0.00 0.00 59.70 57.19 1r53 h MET 241 Cb 1.65 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 33.18 1r53 h MET 241 CO 0.19 0.95 0.02 -0.07 1.06 0.00 0.00 176.91 179.06 1r53 h LEU 242 N 0.88 0.64 -0.13 1.22 3.38 -0.87 -2.26 115.31 118.18 1r53 h LEU 242 Ca 0.17 -0.13 -0.21 0.00 0.09 0.00 0.00 57.88 57.80 1r53 h LEU 242 Cb 0.46 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 41.05 1r53 h LEU 242 CO 0.02 0.70 -0.73 0.00 0.09 0.00 0.00 178.44 178.51 1r53 h ALA 243 N 1.38 0.26 -0.41 1.53 0.00 -0.99 -0.55 119.26 120.49 1r53 h ALA 243 Ca 0.13 -0.59 0.05 0.00 0.00 0.00 0.00 54.91 54.51 1r53 h ALA 243 Cb 0.37 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1r53 h ALA 243 CO 0.01 0.61 0.14 1.25 0.00 0.00 0.00 179.25 181.25 1r53 h HIS 244 N 0.42 0.24 -0.43 0.00 -0.00 -1.27 -0.78 115.15 113.33 1r53 h HIS 244 Ca -0.06 0.02 0.03 0.00 -0.00 0.00 0.00 60.37 60.37 1r53 h HIS 244 Cb 1.37 -0.05 -0.04 0.00 -0.00 0.00 0.00 27.41 28.70 1r53 h HIS 244 CO 0.10 0.08 0.22 0.00 -0.00 0.00 0.00 177.93 178.33 1r53 h ALA 245 N 1.27 0.54 -0.01 5.26 0.00 -1.08 -2.92 119.26 122.31 1r53 h ALA 245 Ca 0.19 0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.91 1r53 h ALA 245 Cb 0.19 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1r53 h ALA 245 CO -0.20 -0.13 -0.87 0.52 0.00 0.00 0.00 179.25 178.57 1r53 h MET 246 N 0.45 0.31 0.00 0.00 2.86 -0.72 -3.02 114.93 114.81 1r53 h MET 246 Ca 0.18 -0.32 0.00 0.00 -2.06 0.00 0.00 59.70 57.50 1r53 h MET 246 Cb 0.08 0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.83 1r53 h MET 246 CO -0.12 1.01 0.00 -0.07 1.06 0.00 0.00 176.91 178.78 1r53 h LEU 247 N 0.19 0.00 -0.32 1.22 4.07 -1.17 -2.50 115.31 116.79 1r53 h LEU 247 Ca -0.05 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.91 1r53 h LEU 247 Cb 1.48 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.22 1r53 h LEU 247 CO 0.14 0.00 0.00 0.77 -1.08 0.00 0.00 178.44 178.27 1r53 h SER 248 N 0.00 0.00 -3.40 -0.43 4.64 -1.38 -3.45 113.55 109.54 1r53 h SER 248 Ca 0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 1r53 h SER 248 Cb 0.56 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.68 1r53 h SER 248 CO 0.00 0.00 0.61 -0.63 -0.87 0.00 0.00 176.83 175.94 1r53 s ILE 249 N -3.21 3.40 0.33 0.95 1.01 -0.94 -4.95 121.20 117.77 1r53 s ILE 249 Ca 0.08 1.15 -0.28 0.00 0.00 0.00 0.00 60.65 61.59 1r53 s ILE 249 Cb 0.11 -3.73 -0.13 0.00 0.01 0.00 0.00 42.46 38.72 1r53 s ILE 249 CO 0.53 0.17 1.19 -2.65 0.00 0.00 0.00 174.94 174.18 1r53 n PRO 250 N 2.70 1.85 -0.71 2.79 -0.02 -1.26 -2.22 135.00 138.12 1r53 n PRO 250 Ca 0.06 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 1r53 n PRO 250 Cb 0.44 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 1r53 n PRO 250 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1r53 n ALA 251 N 0.28 0.00 -1.94 3.55 0.00 -1.26 -4.97 120.51 116.16 1r53 n ALA 251 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.09 1r53 n ALA 251 Cb 0.35 -0.42 -0.03 0.00 0.00 0.00 0.00 19.45 19.35 1r53 n ALA 251 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1r53 s SER 252 N -2.61 7.00 0.00 0.00 1.04 -0.94 -0.71 113.70 117.48 1r53 s SER 252 Ca 0.00 2.37 0.00 0.00 0.48 0.00 0.00 55.95 58.80 1r53 s SER 252 Cb 0.00 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.50 1r53 s SER 252 CO 0.00 -0.41 0.87 0.29 0.98 0.00 0.00 173.24 174.97 1r53 n LYS 253 N 2.04 2.17 -3.18 4.02 4.76 -0.33 -4.92 118.16 122.71 1r53 n LYS 253 Ca 0.03 -1.24 0.00 0.00 -2.87 0.00 0.00 58.31 54.23 1r53 n LYS 253 Cb 0.44 -0.92 0.00 0.00 -1.84 0.00 0.00 35.03 32.71 1r53 n LYS 253 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1r53 n GLY 254 N -0.38 -1.37 3.64 0.72 0.00 -1.25 -4.91 105.19 101.64 1r53 n GLY 254 Ca 0.00 -1.00 -0.08 0.00 0.00 0.00 0.00 46.02 44.93 1r53 n GLY 254 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1r53 s PHE 255 N -2.34 -0.81 -0.03 1.61 5.36 -1.26 -4.22 117.98 116.29 1r53 s PHE 255 Ca 0.00 1.73 -0.08 0.00 -0.96 0.00 0.00 56.93 57.63 1r53 s PHE 255 Cb 0.00 0.45 0.01 0.00 -0.34 0.00 0.00 43.02 43.14 1r53 s PHE 255 CO 0.00 -0.40 0.18 -1.83 -1.46 0.00 0.00 175.22 171.72 1r53 s GLU 256 N 1.05 0.40 0.01 10.12 -1.05 -0.60 -4.98 118.70 123.64 1r53 s GLU 256 Ca -0.05 -0.09 0.07 0.00 -0.15 0.00 0.00 54.97 54.75 1r53 s GLU 256 Cb -0.05 0.17 -0.02 0.00 -0.44 0.00 0.00 34.13 33.80 1r53 s GLU 256 CO -0.12 -0.09 -0.23 -1.50 0.95 0.00 0.00 175.26 174.28 1r53 s ILE 257 N -0.75 1.82 0.00 1.83 2.07 -1.26 -0.88 121.20 124.03 1r53 s ILE 257 Ca -0.08 -1.09 0.00 0.00 -1.41 0.00 0.00 60.65 58.06 1r53 s ILE 257 Cb -0.05 -1.54 0.00 0.00 0.13 0.00 0.00 42.46 41.00 1r53 s ILE 257 CO 0.01 0.42 0.00 0.61 -1.91 0.00 0.00 174.94 174.07 1r53 n GLY 258 N 2.25 3.49 0.26 1.50 0.00 -0.73 -2.14 105.19 109.82 1r53 n GLY 258 Ca -0.16 -0.15 0.11 0.00 0.00 0.00 0.00 46.02 45.82 1r53 n GLY 258 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1r53 h SER 259 N 1.67 0.00 0.00 1.61 4.64 -1.26 -3.46 113.55 116.75 1r53 h SER 259 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1r53 h SER 259 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1r53 h SER 259 CO 0.00 0.10 0.00 0.61 -0.87 0.00 0.00 176.83 176.67 1r53 n GLY 260 N -0.97 1.97 0.24 -0.77 0.00 -0.91 -0.82 105.19 103.93 1r53 n GLY 260 Ca -0.02 -0.47 -0.08 0.00 0.00 0.00 0.00 46.02 45.44 1r53 n GLY 260 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1r53 h PHE 261 N 0.00 0.78 -0.16 1.61 0.04 -1.90 -3.21 116.94 114.09 1r53 h PHE 261 Ca 0.00 -0.22 -0.16 0.00 2.80 0.00 0.00 57.97 60.40 1r53 h PHE 261 Cb 0.00 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 37.97 1r53 h PHE 261 CO 0.00 0.93 -0.56 0.37 -0.60 0.00 0.00 178.31 178.44 1r53 h GLN 262 N 0.55 0.49 0.00 1.51 4.15 -1.93 -3.09 115.11 116.79 1r53 h GLN 262 Ca 0.05 -0.32 0.00 0.00 0.77 0.00 0.00 58.65 59.16 1r53 h GLN 262 Cb 0.88 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.61 1r53 h GLN 262 CO 0.08 0.92 0.00 0.41 -1.93 0.00 0.00 178.83 178.31 1r53 n GLY 263 N 0.26 -0.93 0.32 2.39 0.00 0.00 -2.70 105.19 104.53 1r53 n GLY 263 Ca -0.03 -0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.02 1r53 n GLY 263 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1r53 h VAL 264 N 0.00 0.93 0.00 1.61 2.07 -1.63 -1.83 116.25 117.40 1r53 h VAL 264 Ca 0.00 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.46 1r53 h VAL 264 Cb 0.20 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1r53 h VAL 264 CO 0.00 0.03 0.00 -1.20 0.02 0.00 0.00 177.57 176.42 1r53 n SER 265 N -4.48 0.00 -4.43 0.57 7.64 -1.10 -4.82 113.62 107.00 1r53 n SER 265 Ca 0.04 0.23 -0.34 0.00 1.01 0.00 0.00 58.87 59.81 1r53 n SER 265 Cb 0.26 -0.39 -0.13 0.00 -1.01 0.00 0.00 64.21 62.94 1r53 n SER 265 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1r53 s VAL 266 N -2.78 3.52 0.78 0.44 1.01 -0.69 -5.10 120.40 117.57 1r53 s VAL 266 Ca 0.16 -0.49 -0.15 0.00 0.00 0.00 0.00 61.98 61.51 1r53 s VAL 266 Cb 0.15 -2.52 0.03 0.00 0.00 0.00 0.00 36.38 34.04 1r53 s VAL 266 CO 0.38 0.50 0.95 -0.81 0.00 0.00 0.00 175.10 176.11 1r53 n PRO 267 N 3.66 0.27 -0.27 2.72 -0.04 -1.26 -4.86 135.00 135.22 1r53 n PRO 267 Ca -0.18 0.16 0.03 0.00 -0.04 0.00 0.00 63.50 63.46 1r53 n PRO 267 Cb 0.52 -2.22 0.24 0.00 -0.04 0.00 0.00 33.50 32.00 1r53 n PRO 267 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1r53 h GLY 268 N -0.66 1.21 0.23 0.55 0.00 -1.98 -2.63 103.07 99.79 1r53 h GLY 268 Ca -0.46 -0.41 0.11 0.00 0.00 0.00 0.00 47.33 46.57 1r53 h GLY 268 CO 0.45 0.34 0.14 1.48 0.00 0.00 0.00 176.54 178.95 1r53 h SER 269 N 1.04 0.04 0.31 0.19 4.64 -1.98 -1.43 113.55 116.35 1r53 h SER 269 Ca 0.34 0.11 -0.09 0.00 -0.47 0.00 0.00 61.79 61.68 1r53 h SER 269 Cb 0.07 0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 1r53 h SER 269 CO -0.11 0.03 -0.39 0.11 -0.87 0.00 0.00 176.83 175.60 1r53 h LYS 270 N 0.28 0.12 -0.77 4.77 1.57 -1.83 0.98 116.57 121.69 1r53 h LYS 270 Ca 0.31 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.98 1r53 h LYS 270 Cb 0.45 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.72 1r53 h LYS 270 CO -0.38 0.50 0.27 0.45 -0.57 0.00 0.00 179.45 179.71 1r53 h HIS 271 N 0.10 1.22 0.00 -1.35 3.86 -1.20 -3.37 115.15 114.41 1r53 h HIS 271 Ca 0.01 -0.11 0.00 0.00 -1.16 0.00 0.00 60.37 59.11 1r53 h HIS 271 Cb 0.74 -0.36 0.00 0.00 1.06 0.00 0.00 27.41 28.85 1r53 h HIS 271 CO 0.01 0.94 -1.46 0.09 0.86 0.00 0.00 177.93 178.37 1r53 n ASN 272 N -4.26 1.25 -4.77 2.45 4.13 -0.63 -4.83 115.26 108.60 1r53 n ASN 272 Ca 0.07 -0.22 -0.38 0.00 1.68 0.00 0.00 54.58 55.72 1r53 n ASN 272 Cb 0.21 1.53 -0.01 0.00 -1.54 0.00 0.00 39.78 39.97 1r53 n ASN 272 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 1r53 s ASP 273 N -3.45 6.32 0.54 6.41 1.01 0.31 -4.90 116.67 122.91 1r53 s ASP 273 Ca -0.03 2.44 0.36 0.00 0.71 0.00 0.00 52.55 56.03 1r53 s ASP 273 Cb 0.10 -2.62 1.87 0.00 1.01 0.00 0.00 42.92 43.29 1r53 s ASP 273 CO 0.64 -0.82 2.10 1.55 0.21 0.00 0.00 175.17 178.85 1r53 h PRO 274 N 2.46 0.00 -4.13 8.23 0.13 -1.94 -3.41 132.00 133.34 1r53 h PRO 274 Ca -0.49 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.45 1r53 h PRO 274 Cb 1.24 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.17 1r53 h PRO 274 CO 0.62 0.00 -0.71 -0.06 -0.23 0.00 0.00 178.00 177.62 1r53 s PHE 275 N -3.87 0.37 0.00 1.56 0.08 -1.26 -1.06 117.98 113.80 1r53 s PHE 275 Ca -0.03 -0.55 0.00 0.00 0.12 0.00 0.00 56.93 56.47 1r53 s PHE 275 Cb 0.10 -0.25 0.00 0.00 -0.57 0.00 0.00 43.02 42.31 1r53 s PHE 275 CO 0.38 -0.17 0.00 0.98 -0.10 0.00 0.00 175.22 176.31 1r53 n TYR 276 N 1.49 0.00 -0.90 0.36 9.36 -1.26 -4.88 117.16 121.33 1r53 n TYR 276 Ca -0.23 0.00 0.00 0.00 3.32 0.00 0.00 57.90 60.99 1r53 n TYR 276 Cb 0.55 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.26 1r53 n TYR 276 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1r53 n ARG 285 N -0.02 0.00 -1.83 2.98 1.74 -1.26 -5.03 116.66 113.24 1r53 n ARG 285 Ca 0.00 0.30 -0.37 0.00 -0.77 0.00 0.00 57.85 57.01 1r53 n ARG 285 Cb 0.00 -0.90 0.05 0.00 -1.02 0.00 0.00 32.46 30.59 1r53 n ARG 285 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1r53 s THR 286 N -0.60 2.21 0.23 0.55 2.01 -1.26 -4.92 115.64 113.86 1r53 s THR 286 Ca 0.00 0.14 -0.30 0.00 0.31 0.00 0.00 61.69 61.84 1r53 s THR 286 Cb 0.00 -3.06 -0.15 0.00 0.01 0.00 0.00 72.50 69.30 1r53 s THR 286 CO 0.00 -0.02 1.05 2.29 -0.69 0.00 0.00 174.62 177.25 1r53 n LYS 287 N -1.42 1.19 -1.94 4.92 2.85 -0.22 -4.88 118.16 118.66 1r53 n LYS 287 Ca 0.13 0.42 -0.29 0.00 -1.05 0.00 0.00 58.31 57.51 1r53 n LYS 287 Cb 0.47 -1.82 0.06 0.00 -0.65 0.00 0.00 35.03 33.08 1r53 n LYS 287 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1r53 s THR 288 N -0.65 3.10 -0.95 0.58 -4.23 -1.26 -5.01 115.64 107.22 1r53 s THR 288 Ca 0.66 0.30 -0.24 0.00 -1.18 0.00 0.00 61.69 61.23 1r53 s THR 288 Cb -0.78 -3.34 0.00 0.00 1.34 0.00 0.00 72.50 69.72 1r53 s THR 288 CO 0.56 -0.44 1.67 0.21 -0.54 0.00 0.00 174.62 176.08 1r53 s ASN 289 N -4.41 5.86 0.13 3.99 3.84 -1.26 -4.78 114.94 118.30 1r53 s ASN 289 Ca 0.59 -1.02 0.22 0.00 0.21 0.00 0.00 52.86 52.86 1r53 s ASN 289 Cb -0.11 -2.56 -0.10 0.00 -0.55 0.00 0.00 41.25 37.92 1r53 s ASN 289 CO 0.50 -2.08 0.87 0.59 -2.79 0.00 0.00 177.10 174.19 1r53 n ASN 290 N 11.23 0.61 0.21 -4.21 3.02 -1.26 -4.27 115.26 120.60 1r53 n ASN 290 Ca 0.35 0.24 0.10 0.00 -0.03 0.00 0.00 54.58 55.24 1r53 n ASN 290 Cb 0.49 0.85 0.33 0.00 -0.61 0.00 0.00 39.78 40.84 1r53 n ASN 290 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1r53 h SER 291 N 0.00 0.00 -1.24 6.41 4.64 -1.88 0.01 113.55 121.49 1r53 h SER 291 Ca -0.02 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.10 1r53 h SER 291 Cb 1.05 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.12 1r53 h SER 291 CO 0.00 0.18 -0.24 0.61 -0.87 0.00 0.00 176.83 176.51 1r53 n GLY 292 N 0.62 0.17 1.22 -0.77 0.00 -1.26 -4.10 105.19 101.07 1r53 n GLY 292 Ca 0.02 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1r53 n GLY 292 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r53 n GLY 293 N -1.15 0.67 3.08 -0.02 0.00 -1.00 -3.30 105.19 103.47 1r53 n GLY 293 Ca -0.11 -0.21 -0.22 0.00 0.00 0.00 0.00 46.02 45.48 1r53 n GLY 293 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1r53 s VAL 294 N -2.00 1.06 -0.02 1.61 -7.23 -1.26 -1.62 120.40 110.94 1r53 s VAL 294 Ca 0.00 -0.55 0.01 0.00 -1.81 0.00 0.00 61.98 59.63 1r53 s VAL 294 Cb 0.00 -0.89 0.01 0.00 0.56 0.00 0.00 36.38 36.06 1r53 s VAL 294 CO 0.00 0.30 -0.05 -1.10 -0.31 0.00 0.00 175.10 173.95 1r53 s GLN 295 N -0.17 0.63 -1.07 4.82 -0.21 -0.32 -4.81 119.66 118.52 1r53 s GLN 295 Ca 0.02 -0.14 0.00 0.00 0.02 0.00 0.00 55.36 55.26 1r53 s GLN 295 Cb -0.07 -0.64 0.00 0.00 1.00 0.00 0.00 33.01 33.30 1r53 s GLN 295 CO 0.00 0.02 0.00 0.41 -2.12 0.00 0.00 175.29 173.60 1r53 n GLY 296 N 3.52 -0.45 2.17 3.09 0.00 -1.26 -1.66 105.19 110.61 1r53 n GLY 296 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1r53 n GLY 296 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r53 n GLY 297 N -0.79 0.65 3.29 -0.02 0.00 -1.26 -4.78 105.19 102.28 1r53 n GLY 297 Ca -0.15 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.66 1r53 n GLY 297 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1r53 s ILE 298 N -2.54 1.63 0.33 -0.61 -4.36 -0.66 -1.31 121.20 113.68 1r53 s ILE 298 Ca 0.00 -1.72 -0.29 0.00 -0.26 0.00 0.00 60.65 58.38 1r53 s ILE 298 Cb 0.00 -1.64 -0.11 0.00 1.25 0.00 0.00 42.46 41.96 1r53 s ILE 298 CO 0.00 -0.25 1.50 -0.94 0.24 0.00 0.00 174.94 175.49 1r53 s SER 299 N -2.33 6.43 -0.04 4.36 1.04 0.59 -1.18 113.70 122.57 1r53 s SER 299 Ca 0.10 2.94 0.17 0.00 0.48 0.00 0.00 55.95 59.63 1r53 s SER 299 Cb -0.07 -2.65 0.52 0.00 0.10 0.00 0.00 66.02 63.92 1r53 s SER 299 CO 0.05 -0.84 1.44 -0.46 0.98 0.00 0.00 173.24 174.41 1r53 n ASN 300 N 1.31 3.73 0.00 7.02 0.23 -0.64 -1.83 115.26 125.08 1r53 n ASN 300 Ca 0.04 -2.19 0.00 0.00 -0.53 0.00 0.00 54.58 51.90 1r53 n ASN 300 Cb 0.39 -0.41 0.00 0.00 -2.08 0.00 0.00 39.78 37.67 1r53 n ASN 300 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1r53 n GLY 301 N 0.91 2.89 3.76 4.83 0.00 -1.26 -4.89 105.19 111.42 1r53 n GLY 301 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 1r53 n GLY 301 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r53 s GLU 302 N -0.04 1.06 0.29 1.61 0.41 -1.26 -4.68 118.70 116.08 1r53 s GLU 302 Ca 0.00 0.40 -0.30 0.00 -0.41 0.00 0.00 54.97 54.66 1r53 s GLU 302 Cb 0.00 -1.82 -0.11 0.00 -1.78 0.00 0.00 34.13 30.42 1r53 s GLU 302 CO 0.00 -2.28 1.60 -0.80 -0.49 0.00 0.00 175.26 173.29 1r53 s ASN 303 N -3.86 6.37 0.00 -0.19 0.01 -1.26 -4.65 114.94 111.36 1r53 s ASN 303 Ca 0.64 2.95 -0.26 0.00 -0.71 0.00 0.00 52.86 55.48 1r53 s ASN 303 Cb -0.16 -2.63 -0.04 0.00 0.41 0.00 0.00 41.25 38.83 1r53 s ASN 303 CO 0.55 -0.92 0.81 -0.63 -1.51 0.00 0.00 177.10 175.40 1r53 s ILE 304 N 0.01 4.85 -0.04 0.60 -1.09 -0.73 -2.39 121.20 122.42 1r53 s ILE 304 Ca 0.63 1.71 -0.05 0.00 -2.23 0.00 0.00 60.65 60.71 1r53 s ILE 304 Cb -0.48 -4.16 0.01 0.00 -1.58 0.00 0.00 42.46 36.25 1r53 s ILE 304 CO 0.48 0.27 0.14 -0.72 -1.23 0.00 0.00 174.94 173.88 1r53 s TYR 305 N 0.49 -0.11 0.17 3.97 -0.85 -1.21 -0.81 117.35 119.01 1r53 s TYR 305 Ca 0.42 0.26 -0.13 0.00 -0.52 0.00 0.00 57.07 57.10 1r53 s TYR 305 Cb -0.20 0.03 0.01 0.00 0.38 0.00 0.00 41.96 42.18 1r53 s TYR 305 CO 0.23 -0.13 0.39 -0.59 -1.52 0.00 0.00 175.55 173.93 1r53 s PHE 306 N -0.28 0.13 0.06 -3.49 -0.12 -0.34 -1.77 117.98 112.17 1r53 s PHE 306 Ca -0.04 -0.48 0.04 0.00 -0.05 0.00 0.00 56.93 56.40 1r53 s PHE 306 Cb -0.03 0.15 -0.03 0.00 -0.63 0.00 0.00 43.02 42.49 1r53 s PHE 306 CO 0.00 -0.79 -0.12 -1.12 -0.05 0.00 0.00 175.22 173.15 1r53 s SER 307 N -2.91 1.37 -0.06 1.98 0.01 -0.06 -0.54 113.70 113.48 1r53 s SER 307 Ca 0.12 -0.56 0.01 0.00 1.31 0.00 0.00 55.95 56.83 1r53 s SER 307 Cb 0.01 -0.03 0.02 0.00 0.21 0.00 0.00 66.02 66.24 1r53 s SER 307 CO -0.03 -0.10 -0.05 -0.69 0.41 0.00 0.00 173.24 172.78 1r53 s VAL 308 N -1.22 0.68 0.19 3.43 1.01 0.31 -1.55 120.40 123.24 1r53 s VAL 308 Ca -0.04 -0.16 -0.18 0.00 0.00 0.00 0.00 61.98 61.60 1r53 s VAL 308 Cb -0.09 -0.71 -0.08 0.00 0.00 0.00 0.00 36.38 35.50 1r53 s VAL 308 CO 0.01 0.28 0.66 -2.16 0.00 0.00 0.00 175.10 173.89 1r53 s PRO 309 N 1.21 4.16 -0.00 2.72 0.04 -1.26 -1.31 135.00 140.55 1r53 s PRO 309 Ca -0.06 0.74 0.07 0.00 0.04 0.00 0.00 61.00 61.79 1r53 s PRO 309 Cb -0.14 -2.93 -0.02 0.00 0.04 0.00 0.00 34.50 31.46 1r53 s PRO 309 CO -0.02 0.44 -0.22 -0.06 0.04 0.00 0.00 177.00 177.18 1r53 s PHE 310 N -1.47 1.98 0.32 0.56 0.08 0.51 -1.19 117.98 118.77 1r53 s PHE 310 Ca 0.40 -0.38 -0.13 0.00 0.12 0.00 0.00 56.93 56.94 1r53 s PHE 310 Cb -0.16 -1.25 -0.08 0.00 -0.57 0.00 0.00 43.02 40.95 1r53 s PHE 310 CO 0.20 0.00 0.70 0.21 -0.10 0.00 0.00 175.22 176.24 1r53 s LYS 311 N -0.69 3.92 0.09 0.44 2.20 0.11 -2.52 119.74 123.30 1r53 s LYS 311 Ca 0.09 0.55 0.03 0.00 -0.36 0.00 0.00 55.97 56.27 1r53 s LYS 311 Cb -0.09 -2.47 -0.24 0.00 -1.51 0.00 0.00 37.83 33.53 1r53 s LYS 311 CO -0.00 0.16 1.20 1.03 -0.36 0.00 0.00 175.35 177.37 1r53 h SER 312 N 2.14 0.17 -2.01 1.43 0.87 -1.89 -3.46 113.55 110.81 1r53 h SER 312 Ca -0.48 -0.18 -0.59 0.00 -1.23 0.00 0.00 61.79 59.31 1r53 h SER 312 Cb 1.18 -0.05 -0.12 0.00 -0.44 0.00 0.00 62.40 62.97 1r53 h SER 312 CO 0.66 1.15 -0.65 0.68 -0.53 0.00 0.00 176.83 178.13 1r53 s VAL 313 N -2.68 2.64 0.00 2.23 -7.23 -1.26 -3.84 120.40 110.26 1r53 s VAL 313 Ca -0.01 -2.07 0.00 0.00 -1.81 0.00 0.00 61.98 58.08 1r53 s VAL 313 Cb 0.09 -2.70 0.00 0.00 0.56 0.00 0.00 36.38 34.33 1r53 s VAL 313 CO 0.84 -0.25 0.00 0.54 -0.31 0.00 0.00 175.10 175.92 1r53 n ARG 337 N -0.87 0.00 -2.06 4.82 1.74 -1.26 -5.07 116.66 113.96 1r53 n ARG 337 Ca -0.05 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.74 1r53 n ARG 337 Cb 0.62 0.00 0.04 0.00 -1.02 0.00 0.00 32.46 32.10 1r53 n ARG 337 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1r53 s HIS 338 N 0.00 3.28 0.00 -1.55 3.76 -1.26 -5.10 115.29 114.41 1r53 s HIS 338 Ca 0.00 0.89 0.00 0.00 -0.15 0.00 0.00 55.06 55.80 1r53 s HIS 338 Cb 0.00 -2.98 0.00 0.00 1.11 0.00 0.00 32.58 30.71 1r53 s HIS 338 CO 0.00 -1.10 0.00 -0.25 -0.85 0.00 0.00 174.74 172.54 1r53 n ASP 339 N -2.88 0.00 -2.16 1.40 8.00 -1.25 -5.02 116.55 114.64 1r53 n ASP 339 Ca 0.06 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.29 1r53 n ASP 339 Cb 0.58 0.00 0.09 0.00 -0.02 0.00 0.00 41.12 41.76 1r53 n ASP 339 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1r53 n PRO 340 N -0.63 2.34 -0.94 -0.24 -0.05 -1.26 -4.90 135.00 129.32 1r53 n PRO 340 Ca 0.00 -2.72 0.03 0.00 -0.05 0.00 0.00 63.50 60.76 1r53 n PRO 340 Cb 0.00 -2.07 0.38 0.00 -0.05 0.00 0.00 33.50 31.76 1r53 n PRO 340 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1r53 n ALA 341 N -0.62 4.09 -0.24 0.55 0.00 -1.26 -4.56 120.51 118.47 1r53 n ALA 341 Ca 0.53 -2.02 0.04 0.00 0.00 0.00 0.00 53.44 51.99 1r53 n ALA 341 Cb 0.83 -1.17 0.17 0.00 0.00 0.00 0.00 19.45 19.29 1r53 n ALA 341 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1r53 h VAL 342 N 3.62 0.63 0.62 0.00 3.04 -1.90 -2.64 116.25 119.62 1r53 h VAL 342 Ca 0.08 -0.13 -0.03 0.00 -1.01 0.00 0.00 66.70 65.61 1r53 h VAL 342 Cb 2.09 0.22 0.01 0.00 -2.01 0.00 0.00 31.29 31.60 1r53 h VAL 342 CO 0.57 0.07 -0.30 0.74 -1.01 0.00 0.00 177.57 177.63 1r53 h THR 343 N 0.37 0.00 -0.65 3.17 2.02 -1.89 -2.29 112.91 113.64 1r53 h THR 343 Ca 0.39 -0.30 0.09 0.00 0.77 0.00 0.00 66.41 67.37 1r53 h THR 343 Cb 0.61 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 66.98 1r53 h THR 343 CO -0.42 0.00 0.43 1.55 0.37 0.00 0.00 175.52 177.45 1r53 h PRO 344 N -1.14 0.50 0.00 6.66 0.13 -1.85 -1.58 132.00 134.72 1r53 h PRO 344 Ca -0.09 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 65.01 1r53 h PRO 344 Cb 0.64 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 31.66 1r53 h PRO 344 CO 0.14 0.33 -0.02 0.00 -0.23 0.00 0.00 178.00 178.22 1r53 h ARG 345 N 0.51 0.00 -0.00 0.86 3.08 -1.38 -2.94 114.38 114.51 1r53 h ARG 345 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 1r53 h ARG 345 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.55 1r53 h ARG 345 CO -0.09 0.02 -0.14 0.00 -1.07 0.00 0.00 179.97 178.69 1r53 n ALA 346 N -2.11 2.69 -0.11 0.04 0.00 -0.60 -4.28 120.51 116.14 1r53 n ALA 346 Ca -0.01 -0.18 -0.05 0.00 0.00 0.00 0.00 53.44 53.20 1r53 n ALA 346 Cb 0.25 -1.37 0.02 0.00 0.00 0.00 0.00 19.45 18.35 1r53 n ALA 346 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1r53 h ILE 347 N 0.05 0.76 0.00 0.00 2.04 -1.58 -1.67 117.51 117.10 1r53 h ILE 347 Ca 0.00 -0.05 -0.06 0.00 1.00 0.00 0.00 64.86 65.75 1r53 h ILE 347 Cb 0.48 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 1r53 h ILE 347 CO 0.00 0.03 -0.29 -0.65 0.00 0.00 0.00 178.15 177.24 1r53 h PRO 348 N 0.15 0.00 -0.15 2.37 0.11 -1.84 -1.20 132.00 131.43 1r53 h PRO 348 Ca 0.18 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.22 1r53 h PRO 348 Cb 0.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.35 1r53 h PRO 348 CO -0.28 0.29 -0.20 0.82 -0.21 0.00 0.00 178.00 178.42 1r53 h ILE 349 N 0.00 1.36 -0.31 4.15 2.04 -1.65 0.12 117.51 123.21 1r53 h ILE 349 Ca -0.00 -1.41 0.04 0.00 1.00 0.00 0.00 64.86 64.48 1r53 h ILE 349 Cb 0.55 1.93 -0.04 0.00 -0.74 0.00 0.00 36.82 38.52 1r53 h ILE 349 CO 0.04 0.42 0.09 0.58 0.00 0.00 0.00 178.15 179.28 1r53 h VAL 350 N 0.02 0.89 -0.54 1.67 2.07 -1.20 0.12 116.25 119.28 1r53 h VAL 350 Ca 0.02 -0.08 0.02 0.00 0.82 0.00 0.00 66.70 67.48 1r53 h VAL 350 Cb 0.76 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 31.15 1r53 h VAL 350 CO 0.05 0.04 0.33 -0.33 0.02 0.00 0.00 177.57 177.68 1r53 h GLU 351 N 0.22 0.63 -0.30 1.57 5.08 -1.14 -1.04 114.58 119.60 1r53 h GLU 351 Ca 0.14 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1r53 h GLU 351 Cb 0.13 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1r53 h GLU 351 CO -0.16 0.42 0.14 0.00 -1.00 0.00 0.00 179.01 178.41 1r53 h ALA 352 N 1.24 0.39 -0.45 3.43 0.00 -0.31 -1.13 119.26 122.43 1r53 h ALA 352 Ca 0.22 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 1r53 h ALA 352 Cb 0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1r53 h ALA 352 CO -0.09 -0.04 -0.05 0.52 0.00 0.00 0.00 179.25 179.59 1r53 h MET 353 N 0.35 0.77 -0.23 0.00 2.86 -0.64 -0.89 114.93 117.15 1r53 h MET 353 Ca 0.10 -0.23 -0.01 0.00 -2.06 0.00 0.00 59.70 57.51 1r53 h MET 353 Cb 0.13 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 1r53 h MET 353 CO -0.01 0.81 0.12 1.15 1.06 0.00 0.00 176.91 180.04 1r53 h THR 354 N 0.71 1.12 -0.62 2.22 2.02 -0.94 -1.74 112.91 115.68 1r53 h THR 354 Ca 0.13 -0.34 -0.03 0.00 0.77 0.00 0.00 66.41 66.93 1r53 h THR 354 Cb 0.51 0.93 -0.03 0.00 -1.74 0.00 0.00 68.15 67.82 1r53 h THR 354 CO 0.03 0.12 0.27 0.00 0.37 0.00 0.00 175.52 176.31 1r53 h ALA 355 N 1.00 0.81 -0.51 6.16 0.00 -0.64 -0.21 119.26 125.87 1r53 h ALA 355 Ca 0.08 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1r53 h ALA 355 Cb 0.09 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1r53 h ALA 355 CO -0.01 0.41 0.32 -0.07 0.00 0.00 0.00 179.25 179.90 1r53 h LEU 356 N 0.87 0.55 -0.23 0.00 3.38 -1.06 0.44 115.31 119.25 1r53 h LEU 356 Ca 0.21 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1r53 h LEU 356 Cb 0.18 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1r53 h LEU 356 CO -0.02 0.39 0.12 0.58 0.09 0.00 0.00 178.44 179.60 1r53 h VAL 357 N 0.66 1.13 -0.07 1.22 2.07 -0.85 -2.24 116.25 118.17 1r53 h VAL 357 Ca 0.19 -0.37 -0.14 0.00 0.82 0.00 0.00 66.70 67.20 1r53 h VAL 357 Cb -0.04 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1r53 h VAL 357 CO -0.06 0.13 -0.58 -0.07 0.02 0.00 0.00 177.57 177.01 1r53 h LEU 358 N 0.25 0.25 -0.16 2.57 3.38 -0.76 -1.34 115.31 119.50 1r53 h LEU 358 Ca 0.08 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1r53 h LEU 358 Cb 0.10 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1r53 h LEU 358 CO -0.01 0.77 0.01 0.00 0.09 0.00 0.00 178.44 179.30 1r53 h ALA 359 N 1.24 0.21 -0.07 1.53 0.00 -0.91 -0.77 119.26 120.49 1r53 h ALA 359 Ca -0.00 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.76 1r53 h ALA 359 Cb 1.06 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 1r53 h ALA 359 CO 0.09 -0.10 -0.23 0.22 0.00 0.00 0.00 179.25 179.24 1r53 h ASP 360 N 0.03 -0.68 -0.75 0.00 3.58 -1.33 -1.77 116.42 115.50 1r53 h ASP 360 Ca 0.05 0.10 0.04 0.00 0.42 0.00 0.00 57.03 57.64 1r53 h ASP 360 Cb 0.35 0.30 -0.04 0.00 1.72 0.00 0.00 39.33 41.66 1r53 h ASP 360 CO 0.01 -0.28 0.50 0.00 -2.88 0.00 0.00 179.24 176.58 1r53 h ALA 361 N 0.60 1.57 -0.30 -0.78 0.00 -1.18 -0.44 119.26 118.74 1r53 h ALA 361 Ca 0.08 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 1r53 h ALA 361 Cb 0.44 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1r53 h ALA 361 CO -0.26 0.34 -0.23 1.25 0.00 0.00 0.00 179.25 180.36 1r53 h LEU 362 N 0.90 0.72 -0.34 0.00 5.85 -0.87 -0.17 115.31 121.40 1r53 h LEU 362 Ca 0.30 -0.45 0.01 0.00 0.84 0.00 0.00 57.88 58.59 1r53 h LEU 362 Cb 0.08 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 1r53 h LEU 362 CO -0.09 1.02 0.21 -0.07 -0.34 0.00 0.00 178.44 179.16 1r53 h LEU 363 N 0.43 0.34 -0.73 2.25 3.38 -0.65 -1.23 115.31 119.11 1r53 h LEU 363 Ca 0.06 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1r53 h LEU 363 Cb 0.79 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.43 1r53 h LEU 363 CO 0.06 0.25 0.17 0.40 0.09 0.00 0.00 178.44 179.41 1r53 h ILE 364 N 0.42 1.26 -0.45 1.22 2.04 -0.94 -1.57 117.51 119.50 1r53 h ILE 364 Ca 0.13 -0.98 -0.09 0.00 1.00 0.00 0.00 64.86 64.93 1r53 h ILE 364 Cb -0.01 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 1r53 h ILE 364 CO -0.05 0.38 -0.07 -0.61 0.00 0.00 0.00 178.15 177.79 1r53 h GLN 365 N 1.08 0.78 -0.07 2.37 -0.00 -0.87 -2.65 115.11 115.76 1r53 h GLN 365 Ca 0.22 -0.24 -0.10 0.00 -0.00 0.00 0.00 58.65 58.54 1r53 h GLN 365 Cb 0.37 -0.07 -0.01 0.00 0.00 0.00 0.00 27.48 27.77 1r53 h GLN 365 CO 0.00 0.83 -0.40 0.87 0.00 0.00 0.00 178.83 180.14 1r53 h LYS 366 N 0.71 0.15 -0.89 1.69 1.79 -0.66 -2.22 116.57 117.13 1r53 h LYS 366 Ca 0.13 -0.07 0.21 0.00 -2.18 0.00 0.00 60.65 58.74 1r53 h LYS 366 Cb 0.54 -0.00 -0.12 0.00 -1.58 0.00 0.00 32.23 31.06 1r53 h LYS 366 CO 0.03 0.53 0.40 0.00 -1.08 0.00 0.00 179.45 179.33 1r53 h ALA 367 N 1.47 1.42 -0.14 3.86 0.00 -0.93 -2.86 119.26 122.08 1r53 h ALA 367 Ca 0.01 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1r53 h ALA 367 Cb 0.76 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1r53 h ALA 367 CO 0.06 -0.31 0.00 0.54 0.00 0.00 0.00 179.25 179.53 1r53 n ARG 368 N -5.02 1.52 -0.04 0.00 1.74 -1.05 -3.69 116.66 110.10 1r53 n ARG 368 Ca 0.22 -1.59 -0.07 0.00 -0.77 0.00 0.00 57.85 55.63 1r53 n ARG 368 Cb 0.63 -1.29 -0.07 0.00 -1.02 0.00 0.00 32.46 30.71 1r53 n ARG 368 CO 0.00 0.00 0.00 0.22 -1.52 0.00 0.00 177.63 176.33 1r53 h ASP 369 N 2.69 -0.03 -0.08 0.55 3.58 -1.18 -3.24 116.42 118.72 1r53 h ASP 369 Ca 0.00 -0.47 0.01 0.00 0.42 0.00 0.00 57.03 56.99 1r53 h ASP 369 Cb 0.65 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.69 1r53 h ASP 369 CO 0.00 0.69 -0.05 0.33 -2.88 0.00 0.00 179.24 177.34 1r53 n PHE 370 N -4.73 -0.04 0.00 0.28 7.35 -1.16 -5.12 117.46 114.05 1r53 n PHE 370 Ca -0.05 0.10 0.00 0.00 -0.76 0.00 0.00 57.45 56.74 1r53 n PHE 370 Cb 0.24 -0.36 0.00 0.00 0.35 0.00 0.00 39.48 39.71 1r53 n PHE 370 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87