#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d2h h ALA 42 N 0.00 1.06 0.00 2.41 0.00 -1.92 0.41 119.26 121.22 1d2h h ALA 42 Ca 0.00 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.67 1d2h h ALA 42 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1d2h h ALA 42 CO 0.00 -0.02 -1.26 1.05 0.00 0.00 0.00 179.25 179.02 1d2h h GLU 43 N 0.00 0.00 0.00 0.00 4.11 -1.98 -2.33 114.58 114.37 1d2h h GLU 43 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1d2h h GLU 43 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1d2h h GLU 43 CO -0.00 0.77 -0.60 0.10 0.07 0.00 0.00 179.01 179.35 1d2h h TYR 44 N 0.00 0.00 0.14 2.06 -0.00 -0.85 -2.85 116.97 115.47 1d2h h TYR 44 Ca -0.12 0.00 -0.32 0.00 0.00 0.00 0.00 58.73 58.29 1d2h h TYR 44 Cb 1.84 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 38.57 1d2h h TYR 44 CO 0.00 0.00 -1.58 -0.22 -0.00 0.00 0.00 178.16 176.36 1d2h h LYS 45 N 0.00 0.30 -0.35 0.10 3.64 -0.43 -2.65 116.57 117.17 1d2h h LYS 45 Ca 0.00 -0.51 -0.08 0.00 -1.27 0.00 0.00 60.65 58.79 1d2h h LYS 45 Cb 0.81 0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.81 1d2h h LYS 45 CO 0.00 1.17 -0.11 0.00 -2.27 0.00 0.00 179.45 178.24 1d2h h ALA 46 N 0.39 1.14 0.01 5.00 0.00 -1.46 -1.31 119.26 123.04 1d2h h ALA 46 Ca -0.27 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.27 1d2h h ALA 46 Cb 2.04 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 19.69 1d2h h ALA 46 CO 0.17 0.54 -0.34 2.35 0.00 0.00 0.00 179.25 181.97 1d2h h TRP 47 N 0.56 0.33 0.03 0.00 7.01 -1.59 -0.85 115.95 121.43 1d2h h TRP 47 Ca 0.10 -0.18 0.03 0.00 2.11 0.00 0.00 58.89 60.95 1d2h h TRP 47 Cb 0.53 -0.04 -0.04 0.00 -2.10 0.00 0.00 29.16 27.51 1d2h h TRP 47 CO 0.02 1.00 -0.27 1.25 -2.79 0.00 0.00 178.44 177.66 1d2h h LEU 48 N -0.44 -0.79 -1.14 0.65 5.85 -1.42 0.66 115.31 118.69 1d2h h LEU 48 Ca -0.04 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 1d2h h LEU 48 Cb 1.10 0.32 -0.03 0.00 0.37 0.00 0.00 40.66 42.42 1d2h h LEU 48 CO 0.07 -0.34 0.30 -0.07 -0.34 0.00 0.00 178.44 178.06 1d2h h LEU 49 N -0.42 0.82 -0.23 2.25 4.07 -1.34 -1.19 115.31 119.26 1d2h h LEU 49 Ca 0.06 -0.09 -0.02 0.00 0.08 0.00 0.00 57.88 57.91 1d2h h LEU 49 Cb 0.50 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.02 1d2h h LEU 49 CO -0.22 0.70 0.07 1.23 -1.08 0.00 0.00 178.44 179.14 1d2h h GLY 50 N 0.99 0.40 0.90 0.83 0.00 0.04 0.42 103.07 106.65 1d2h h GLY 50 Ca 0.22 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.29 1d2h h GLY 50 CO -0.03 0.22 -0.22 -2.00 0.00 0.00 0.00 176.54 174.51 1d2h h LEU 51 N 0.21 -0.53 0.01 3.11 6.46 0.53 0.42 115.31 125.53 1d2h h LEU 51 Ca 0.08 -0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.80 1d2h h LEU 51 Cb 0.25 0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.31 1d2h h LEU 51 CO -0.00 -0.30 -0.09 -0.07 -0.62 0.00 0.00 178.44 177.36 1d2h h LEU 52 N -0.73 -0.28 -1.26 2.25 4.07 -1.21 -0.31 115.31 117.84 1d2h h LEU 52 Ca -0.06 0.03 0.21 0.00 0.08 0.00 0.00 57.88 58.13 1d2h h LEU 52 Cb 0.53 0.11 -0.09 0.00 1.08 0.00 0.00 40.66 42.29 1d2h h LEU 52 CO 0.10 -0.10 0.62 0.03 -1.08 0.00 0.00 178.44 178.02 1d2h h ARG 53 N -0.13 0.56 -0.60 1.13 3.08 -0.96 -0.43 114.38 117.03 1d2h h ARG 53 Ca 0.00 -0.03 0.02 0.00 0.07 0.00 0.00 59.98 60.04 1d2h h ARG 53 Cb 0.13 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 1d2h h ARG 53 CO -0.06 0.37 0.38 0.37 -1.07 0.00 0.00 179.97 179.96 1d2h h GLN 54 N 0.57 0.73 -0.00 0.04 4.15 0.64 -1.74 115.11 119.50 1d2h h GLN 54 Ca 0.54 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.91 1d2h h GLN 54 Cb 1.09 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.62 1d2h h GLN 54 CO -0.28 0.49 -0.10 0.72 -1.93 0.00 0.00 178.83 177.72 1d2h n HIS 55 N -4.71 0.00 -2.41 3.99 8.25 -0.20 -4.91 115.22 115.23 1d2h n HIS 55 Ca 0.05 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.49 1d2h n HIS 55 Cb 0.06 -0.15 0.01 0.00 1.12 0.00 0.00 29.99 31.02 1d2h n HIS 55 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1d2h n GLY 56 N 1.25 0.59 3.64 -1.41 0.00 -0.60 -5.03 105.19 103.64 1d2h n GLY 56 Ca 0.15 -0.50 -0.38 0.00 0.00 0.00 0.00 46.02 45.29 1d2h n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d2h n HIS 58 N 4.68 0.00 -2.55 0.00 -0.00 -1.26 -4.50 115.22 111.59 1d2h n HIS 58 Ca -0.12 0.00 -0.42 0.00 0.46 0.00 0.00 57.72 57.64 1d2h n HIS 58 Cb 0.51 -0.48 -0.03 0.00 -0.12 0.00 0.00 29.99 29.88 1d2h n HIS 58 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1d2h s ARG 59 N -2.37 4.41 -0.02 1.57 0.52 -1.26 -1.83 118.95 119.97 1d2h s ARG 59 Ca -0.21 1.58 -0.00 0.00 -0.52 0.00 0.00 55.73 56.57 1d2h s ARG 59 Cb 0.07 -3.51 0.02 0.00 0.52 0.00 0.00 34.95 32.05 1d2h s ARG 59 CO 0.27 -0.33 0.03 0.14 0.02 0.00 0.00 175.30 175.44 1d2h s VAL 60 N 1.83 -0.04 -0.28 3.52 -7.23 -0.21 -1.69 120.40 116.30 1d2h s VAL 60 Ca 0.54 0.14 -0.05 0.00 -1.81 0.00 0.00 61.98 60.80 1d2h s VAL 60 Cb -0.23 -0.08 0.02 0.00 0.56 0.00 0.00 36.38 36.65 1d2h s VAL 60 CO 0.23 0.06 0.03 -0.22 -0.31 0.00 0.00 175.10 174.88 1d2h s LEU 61 N 0.71 3.63 -0.48 1.32 2.96 -0.46 -1.82 118.68 124.54 1d2h s LEU 61 Ca -0.06 -0.82 -0.23 0.00 -0.22 0.00 0.00 54.13 52.80 1d2h s LEU 61 Cb -0.08 -1.79 0.03 0.00 0.50 0.00 0.00 46.19 44.85 1d2h s LEU 61 CO -0.02 -0.18 0.82 -0.62 -1.32 0.00 0.00 176.35 175.04 1d2h s ASP 62 N 1.42 6.39 -0.22 3.68 -1.08 -0.81 -1.48 116.67 124.58 1d2h s ASP 62 Ca 0.01 -0.18 0.03 0.00 -0.52 0.00 0.00 52.55 51.89 1d2h s ASP 62 Cb -0.17 -2.40 0.36 0.00 -1.46 0.00 0.00 42.92 39.26 1d2h s ASP 62 CO -0.00 -1.00 1.42 1.33 0.52 0.00 0.00 175.17 177.45 1d2h n VAL 63 N 6.16 2.03 -2.63 1.11 0.24 -0.85 -1.70 118.33 122.68 1d2h n VAL 63 Ca 0.02 -0.96 -0.02 0.00 -2.04 0.00 0.00 64.34 61.35 1d2h n VAL 63 Cb 0.48 -0.66 0.10 0.00 -1.47 0.00 0.00 33.84 32.28 1d2h n VAL 63 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1d2h n ALA 64 N -0.24 1.60 -0.27 2.33 0.00 -1.00 -4.81 120.51 118.12 1d2h n ALA 64 Ca 0.28 -0.78 -0.04 0.00 0.00 0.00 0.00 53.44 52.90 1d2h n ALA 64 Cb 1.05 -0.76 -0.03 0.00 0.00 0.00 0.00 19.45 19.71 1d2h n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1d2h n GLY 66 N -1.24 0.85 0.19 0.00 0.00 -1.26 -0.34 105.19 103.40 1d2h n GLY 66 Ca 0.04 -0.75 0.12 0.00 0.00 0.00 0.00 46.02 45.43 1d2h n GLY 66 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1d2h h THR 67 N 0.00 0.00 0.00 2.61 1.35 -1.89 -3.32 112.91 111.66 1d2h h THR 67 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1d2h h THR 67 Cb 0.00 0.54 0.00 0.00 -1.73 0.00 0.00 68.15 66.96 1d2h h THR 67 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1d2h n GLY 68 N -1.27 0.88 0.36 5.82 0.00 0.54 -2.61 105.19 108.92 1d2h n GLY 68 Ca -0.02 -0.10 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 1d2h n GLY 68 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1d2h h VAL 69 N 0.00 0.00 -0.84 1.61 3.04 -1.87 1.12 116.25 119.30 1d2h h VAL 69 Ca 0.00 0.00 0.05 0.00 -1.01 0.00 0.00 66.70 65.74 1d2h h VAL 69 Cb 0.00 0.00 -0.05 0.00 -2.01 0.00 0.00 31.29 29.23 1d2h h VAL 69 CO 0.00 0.00 0.55 0.44 -1.01 0.00 0.00 177.57 177.55 1d2h h ASP 70 N -0.59 0.85 0.45 3.17 3.32 -1.96 -2.26 116.42 119.41 1d2h h ASP 70 Ca -0.01 -0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 1d2h h ASP 70 Cb 0.57 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.94 1d2h h ASP 70 CO -0.18 0.56 -0.22 -1.28 -1.72 0.00 0.00 179.24 176.40 1d2h h SER 71 N 0.98 -0.51 -0.61 6.45 0.87 -1.72 -3.09 113.55 115.91 1d2h h SER 71 Ca 0.35 0.02 0.11 0.00 -1.23 0.00 0.00 61.79 61.04 1d2h h SER 71 Cb 0.15 0.13 -0.11 0.00 -0.44 0.00 0.00 62.40 62.13 1d2h h SER 71 CO -0.12 -0.21 -0.19 -0.38 -0.53 0.00 0.00 176.83 175.40 1d2h n ILE 72 N -4.48 -0.29 0.00 2.23 5.41 0.38 -0.83 119.36 121.78 1d2h n ILE 72 Ca -0.08 1.42 0.00 0.00 1.00 0.00 0.00 62.75 65.09 1d2h n ILE 72 Cb 0.24 -1.93 0.00 0.00 -0.71 0.00 0.00 39.64 37.24 1d2h n ILE 72 CO 0.00 0.00 0.00 0.80 0.00 0.00 0.00 176.55 177.35 1d2h n MET 73 N -4.96 0.00 -0.19 0.38 1.56 -0.86 -1.90 117.12 111.15 1d2h n MET 73 Ca 0.08 0.45 0.15 0.00 -0.27 0.00 0.00 57.70 58.12 1d2h n MET 73 Cb 0.28 -1.21 0.29 0.00 2.15 0.00 0.00 33.22 34.72 1d2h n MET 73 CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 175.97 176.52 1d2h n LEU 74 N -1.48 0.11 0.13 -0.89 4.77 -0.01 0.77 117.00 120.40 1d2h n LEU 74 Ca 0.00 0.97 -0.10 0.00 -0.03 0.00 0.00 56.01 56.85 1d2h n LEU 74 Cb 0.00 -0.43 -0.06 0.00 -2.33 0.00 0.00 43.42 40.60 1d2h n LEU 74 CO 0.00 -1.05 0.51 0.58 -1.33 0.00 0.00 177.39 176.10 1d2h h VAL 75 N 0.00 0.00 -0.98 4.08 2.07 -0.82 -2.05 116.25 118.56 1d2h h VAL 75 Ca 0.45 0.00 0.28 0.00 0.82 0.00 0.00 66.70 68.25 1d2h h VAL 75 Cb 1.11 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1d2h h VAL 75 CO -0.48 0.00 0.77 -0.33 0.02 0.00 0.00 177.57 177.56 1d2h h GLU 76 N -0.53 0.00 -0.96 1.57 5.08 0.66 0.13 114.58 120.53 1d2h h GLU 76 Ca -0.02 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1d2h h GLU 76 Cb 0.48 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 1d2h h GLU 76 CO -0.08 0.00 0.03 0.39 -1.00 0.00 0.00 179.01 178.35 1d2h n GLU 77 N -4.01 1.42 -3.65 2.33 -0.58 -0.79 -4.84 120.64 110.51 1d2h n GLU 77 Ca 0.21 -0.43 -0.23 0.00 -0.42 0.00 0.00 57.16 56.29 1d2h n GLU 77 Cb 1.10 -1.46 0.06 0.00 -0.57 0.00 0.00 31.44 30.58 1d2h n GLU 77 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1d2h n GLY 78 N 0.15 -0.43 3.48 0.62 0.00 0.44 -4.99 105.19 104.46 1d2h n GLY 78 Ca 0.05 0.17 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 1d2h n GLY 78 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1d2h s PHE 79 N -3.41 2.69 -0.47 1.61 0.40 -1.08 -5.06 117.98 112.66 1d2h s PHE 79 Ca 0.31 -0.16 -0.25 0.00 -0.60 0.00 0.00 56.93 56.22 1d2h s PHE 79 Cb -0.15 -1.61 0.03 0.00 0.51 0.00 0.00 43.02 41.81 1d2h s PHE 79 CO 0.77 0.21 0.94 0.45 0.70 0.00 0.00 175.22 178.29 1d2h s SER 80 N -0.86 6.48 -0.05 1.36 0.15 -0.76 -4.40 113.70 115.62 1d2h s SER 80 Ca 0.12 0.08 0.04 0.00 0.70 0.00 0.00 55.95 56.89 1d2h s SER 80 Cb -0.11 -2.46 0.00 0.00 -1.71 0.00 0.00 66.02 61.75 1d2h s SER 80 CO 0.01 -1.09 -0.16 0.54 1.20 0.00 0.00 173.24 173.74 1d2h s VAL 81 N 3.83 1.41 -0.16 4.45 0.11 -1.26 -1.04 120.40 127.74 1d2h s VAL 81 Ca 0.37 -0.68 -0.04 0.00 -2.93 0.00 0.00 61.98 58.70 1d2h s VAL 81 Cb -0.10 -1.23 -0.03 0.00 -1.53 0.00 0.00 36.38 33.49 1d2h s VAL 81 CO 0.26 0.41 -0.03 0.42 -3.33 0.00 0.00 175.10 172.83 1d2h s THR 82 N 0.24 3.97 -0.08 5.04 -4.23 -0.76 -2.13 115.64 117.69 1d2h s THR 82 Ca -0.08 -0.33 0.05 0.00 -1.18 0.00 0.00 61.69 60.14 1d2h s THR 82 Cb -0.13 -2.74 -0.01 0.00 1.34 0.00 0.00 72.50 70.95 1d2h s THR 82 CO 0.03 0.49 -0.23 -0.44 -0.54 0.00 0.00 174.62 173.93 1d2h s SER 83 N 0.35 3.20 0.01 3.99 0.01 -0.31 -1.92 113.70 119.03 1d2h s SER 83 Ca -0.04 -0.50 0.02 0.00 1.31 0.00 0.00 55.95 56.74 1d2h s SER 83 Cb -0.14 -1.14 -0.01 0.00 0.21 0.00 0.00 66.02 64.94 1d2h s SER 83 CO 0.03 0.21 -0.07 0.68 0.41 0.00 0.00 173.24 174.50 1d2h s VAL 84 N 0.06 0.53 -0.03 3.43 -7.23 -0.69 -0.96 120.40 115.51 1d2h s VAL 84 Ca -0.10 -0.50 -0.15 0.00 -1.81 0.00 0.00 61.98 59.42 1d2h s VAL 84 Cb -0.16 -0.49 0.02 0.00 0.56 0.00 0.00 36.38 36.32 1d2h s VAL 84 CO 0.06 -0.00 0.32 -0.62 -0.31 0.00 0.00 175.10 174.55 1d2h s ASP 85 N -0.55 -0.22 0.32 4.85 2.15 -0.95 -2.31 116.67 119.97 1d2h s ASP 85 Ca -0.01 0.17 0.25 0.00 0.43 0.00 0.00 52.55 53.39 1d2h s ASP 85 Cb -0.05 0.37 0.60 0.00 -0.30 0.00 0.00 42.92 43.54 1d2h s ASP 85 CO 0.00 -0.40 1.70 0.00 -0.17 0.00 0.00 175.17 176.30 1d2h h ALA 86 N 4.09 1.00 -2.83 3.66 0.00 -1.67 -1.10 119.26 122.40 1d2h h ALA 86 Ca -0.29 0.00 -0.69 0.00 0.00 0.00 0.00 54.91 53.93 1d2h h ALA 86 Cb 1.18 0.00 -0.23 0.00 0.00 0.00 0.00 17.79 18.74 1d2h h ALA 86 CO 0.38 0.00 -0.53 0.45 0.00 0.00 0.00 179.25 179.55 1d2h s SER 87 N -5.32 5.65 0.00 0.00 0.15 -1.26 -4.74 113.70 108.18 1d2h s SER 87 Ca 0.09 -0.70 0.00 0.00 0.70 0.00 0.00 55.95 56.04 1d2h s SER 87 Cb 0.09 -2.02 0.00 0.00 -1.71 0.00 0.00 66.02 62.38 1d2h s SER 87 CO 0.63 -0.27 0.68 0.47 1.20 0.00 0.00 173.24 175.95 1d2h n ASP 88 N 5.00 0.00 -0.10 5.45 8.00 -1.26 -0.36 116.55 133.28 1d2h n ASP 88 Ca -0.13 0.68 -0.00 0.00 0.71 0.00 0.00 54.79 56.05 1d2h n ASP 88 Cb 0.48 -0.18 0.01 0.00 -0.02 0.00 0.00 41.12 41.41 1d2h n ASP 88 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1d2h n LYS 89 N -1.49 -0.06 -0.01 -1.24 4.81 -1.26 -0.11 118.16 118.79 1d2h n LYS 89 Ca 0.00 0.39 -0.11 0.00 -0.87 0.00 0.00 58.31 57.72 1d2h n LYS 89 Cb 0.00 -0.58 -0.09 0.00 0.02 0.00 0.00 35.03 34.38 1d2h n LYS 89 CO 0.00 0.00 0.00 0.52 1.17 0.00 0.00 177.40 179.09 1d2h h MET 90 N 0.00 -0.07 -0.74 1.64 2.86 -1.84 -3.28 114.93 113.50 1d2h h MET 90 Ca 0.08 0.01 0.17 0.00 -2.06 0.00 0.00 59.70 57.90 1d2h h MET 90 Cb 0.15 0.02 -0.13 0.00 0.06 0.00 0.00 31.60 31.70 1d2h h MET 90 CO -0.25 0.53 0.02 1.25 1.06 0.00 0.00 176.91 179.52 1d2h h LEU 91 N -0.84 -0.31 -1.61 1.22 5.85 0.24 -0.06 115.31 119.80 1d2h h LEU 91 Ca -0.01 0.19 0.10 0.00 0.84 0.00 0.00 57.88 59.00 1d2h h LEU 91 Cb 0.64 0.32 -0.04 0.00 0.37 0.00 0.00 40.66 41.96 1d2h h LEU 91 CO 0.01 -0.16 0.42 0.07 -0.34 0.00 0.00 178.44 178.44 1d2h h LYS 92 N 0.12 0.43 0.00 1.25 2.10 -0.73 0.50 116.57 120.23 1d2h h LYS 92 Ca 0.40 -0.03 -0.00 0.00 -2.00 0.00 0.00 60.65 59.03 1d2h h LYS 92 Cb 0.71 -0.10 -0.00 0.00 -0.90 0.00 0.00 32.23 31.94 1d2h h LYS 92 CO -0.64 0.28 -0.01 1.88 -2.00 0.00 0.00 179.45 178.96 1d2h h TYR 93 N 0.44 0.00 0.02 0.07 0.05 -1.06 -1.98 116.97 114.51 1d2h h TYR 93 Ca 0.29 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 58.89 1d2h h TYR 93 Cb 0.55 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.27 1d2h h TYR 93 CO -0.00 0.01 -0.96 0.00 -1.05 0.00 0.00 178.16 176.16 1d2h h ALA 94 N 1.99 0.19 -1.46 3.88 0.00 -0.68 -3.30 119.26 119.87 1d2h h ALA 94 Ca -0.00 -1.01 0.42 0.00 0.00 0.00 0.00 54.91 54.32 1d2h h ALA 94 Cb 0.34 0.51 -0.06 0.00 0.00 0.00 0.00 17.79 18.58 1d2h h ALA 94 CO 0.00 0.54 1.07 -0.07 0.00 0.00 0.00 179.25 180.79 1d2h h LEU 95 N -0.88 0.00 0.28 0.00 4.07 -0.86 0.24 115.31 118.15 1d2h h LEU 95 Ca -0.25 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.69 1d2h h LEU 95 Cb 1.30 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.04 1d2h h LEU 95 CO -0.11 0.00 -0.14 0.11 -1.08 0.00 0.00 178.44 177.22 1d2h h LYS 96 N 0.00 -0.37 -0.38 1.13 1.57 -1.45 -2.92 116.57 114.16 1d2h h LYS 96 Ca 0.69 0.03 0.11 0.00 -1.87 0.00 0.00 60.65 59.61 1d2h h LYS 96 Cb 2.82 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 35.20 1d2h h LYS 96 CO -0.01 -0.11 0.28 0.93 -0.57 0.00 0.00 179.45 179.98 1d2h h GLU 97 N -0.59 0.00 0.17 3.15 3.07 -0.66 -1.81 114.58 117.91 1d2h h GLU 97 Ca -0.04 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.81 1d2h h GLU 97 Cb 0.43 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 1d2h h GLU 97 CO 0.06 0.00 -0.08 -0.09 -1.40 0.00 0.00 179.01 177.50 1d2h h ARG 98 N 0.00 -0.22 0.33 2.33 2.43 -1.32 0.62 114.38 118.54 1d2h h ARG 98 Ca 0.18 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.36 1d2h h ARG 98 Cb 0.74 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.33 1d2h h ARG 98 CO -0.00 0.07 -0.25 2.35 -1.51 0.00 0.00 179.97 180.63 1d2h h TRP 99 N -0.52 -0.65 -0.16 2.20 -0.00 -1.25 1.16 115.95 116.73 1d2h h TRP 99 Ca -0.02 -0.00 0.03 0.00 -0.00 0.00 0.00 58.89 58.89 1d2h h TRP 99 Cb 0.40 0.24 -0.05 0.00 -0.00 0.00 0.00 29.16 29.75 1d2h h TRP 99 CO 0.02 -0.37 -0.39 -0.91 -0.00 0.00 0.00 178.44 176.78 1d2h h ASN 100 N -0.57 -1.27 -0.01 2.65 2.35 -1.36 0.26 115.58 117.63 1d2h h ASN 100 Ca -0.03 0.16 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1d2h h ASN 100 Cb 0.50 0.50 0.00 0.00 0.05 0.00 0.00 38.32 39.37 1d2h h ASN 100 CO -0.00 -0.33 0.00 0.54 -1.65 0.00 0.00 177.43 175.99 1d2h n ARG 101 N -4.61 1.01 0.14 0.81 1.74 0.21 -3.90 116.66 112.06 1d2h n ARG 101 Ca -0.04 -0.02 0.08 0.00 -0.77 0.00 0.00 57.85 57.11 1d2h n ARG 101 Cb 0.26 -1.04 0.45 0.00 -1.02 0.00 0.00 32.46 31.11 1d2h n ARG 101 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1d2h n ARG 102 N -0.45 0.11 0.00 5.56 0.63 0.40 0.10 116.66 123.00 1d2h n ARG 102 Ca 0.00 0.59 0.12 0.00 -0.92 0.00 0.00 57.85 57.65 1d2h n ARG 102 Cb 0.02 -1.94 0.72 0.00 0.45 0.00 0.00 32.46 31.72 1d2h n ARG 102 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1d2h n LYS 103 N -2.09 0.94 -3.98 -0.14 4.76 -1.25 -4.55 118.16 111.85 1d2h n LYS 103 Ca -0.01 0.00 -0.34 0.00 -2.87 0.00 0.00 58.31 55.09 1d2h n LYS 103 Cb 0.11 -1.41 -0.15 0.00 -1.84 0.00 0.00 35.03 31.75 1d2h n LYS 103 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1d2h s GLU 104 N -2.00 2.95 0.26 1.97 2.02 0.11 -5.00 118.70 119.01 1d2h s GLU 104 Ca 0.36 -0.89 0.08 0.00 0.02 0.00 0.00 54.97 54.54 1d2h s GLU 104 Cb 0.17 -2.93 0.78 0.00 0.10 0.00 0.00 34.13 32.25 1d2h s GLU 104 CO 0.28 -0.33 1.20 -2.30 0.02 0.00 0.00 175.26 174.13 1d2h n PRO 105 N 4.68 -0.05 -0.11 0.39 -0.02 -1.26 -1.13 135.00 137.50 1d2h n PRO 105 Ca -0.17 1.10 -0.08 0.00 -2.02 0.00 0.00 63.50 62.32 1d2h n PRO 105 Cb 0.48 -1.85 -0.06 0.00 -0.02 0.00 0.00 33.50 32.05 1d2h n PRO 105 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1d2h h ALA 106 N 1.52 -0.57 0.00 3.55 0.00 -1.94 0.76 119.26 122.59 1d2h h ALA 106 Ca 0.54 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.45 1d2h h ALA 106 Cb 1.29 1.00 -0.00 0.00 0.00 0.00 0.00 17.79 20.08 1d2h h ALA 106 CO -0.66 -0.75 -0.05 0.74 0.00 0.00 0.00 179.25 178.53 1d2h h PHE 107 N -0.22 0.00 0.00 0.00 -1.00 -1.37 -0.69 116.94 113.66 1d2h h PHE 107 Ca 0.05 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.83 1d2h h PHE 107 Cb 0.36 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.92 1d2h h PHE 107 CO -0.72 0.05 0.00 -3.47 -1.61 0.00 0.00 178.31 172.56 1d2h n ASP 108 N -3.42 0.40 -0.00 2.17 2.03 0.25 -1.91 116.55 116.06 1d2h n ASP 108 Ca -0.02 0.65 0.03 0.00 0.52 0.00 0.00 54.79 55.97 1d2h n ASP 108 Cb 0.18 -0.72 -0.04 0.00 -0.72 0.00 0.00 41.12 39.82 1d2h n ASP 108 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1d2h n LYS 109 N -2.00 0.17 -1.62 -0.67 4.76 -0.32 -5.02 118.16 113.46 1d2h n LYS 109 Ca 0.00 -0.05 -0.43 0.00 -2.87 0.00 0.00 58.31 54.97 1d2h n LYS 109 Cb 0.09 -1.12 -0.00 0.00 -1.84 0.00 0.00 35.03 32.16 1d2h n LYS 109 CO 0.00 0.00 0.00 1.87 -1.37 0.00 0.00 177.40 177.90 1d2h n TRP 110 N -1.68 1.47 -4.53 2.13 -0.00 -0.80 -4.87 117.44 109.17 1d2h n TRP 110 Ca -0.01 0.61 -0.26 0.00 -0.00 0.00 0.00 57.50 57.84 1d2h n TRP 110 Cb 0.13 -2.28 -0.10 0.00 -0.00 0.00 0.00 31.31 29.06 1d2h n TRP 110 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 177.69 177.77 1d2h s VAL 111 N -1.16 2.28 -0.28 5.87 1.01 -0.91 -4.99 120.40 122.22 1d2h s VAL 111 Ca 0.60 -2.20 -0.17 0.00 0.00 0.00 0.00 61.98 60.20 1d2h s VAL 111 Cb -0.61 -2.64 0.11 0.00 0.00 0.00 0.00 36.38 33.24 1d2h s VAL 111 CO 0.59 -0.21 0.81 -0.63 0.00 0.00 0.00 175.10 175.66 1d2h s ILE 112 N -2.60 0.00 -0.03 2.22 1.01 -1.11 -1.16 121.20 119.53 1d2h s ILE 112 Ca 0.33 0.00 -0.26 0.00 0.00 0.00 0.00 60.65 60.72 1d2h s ILE 112 Cb 0.02 -1.00 0.05 0.00 0.01 0.00 0.00 42.46 41.54 1d2h s ILE 112 CO 0.17 0.00 0.56 -1.61 0.00 0.00 0.00 174.94 174.06 1d2h s GLU 113 N 1.36 0.94 0.54 2.79 0.41 -0.13 -4.96 118.70 119.66 1d2h s GLU 113 Ca -0.08 0.10 -0.18 0.00 -0.41 0.00 0.00 54.97 54.40 1d2h s GLU 113 Cb -0.05 0.44 -0.06 0.00 -1.78 0.00 0.00 34.13 32.68 1d2h s GLU 113 CO -0.16 -0.29 1.06 -1.21 -0.49 0.00 0.00 175.26 174.17 1d2h s GLU 114 N -1.28 3.52 -0.21 1.61 2.02 -1.26 -2.23 118.70 120.87 1d2h s GLU 114 Ca -0.12 1.30 -0.31 0.00 0.02 0.00 0.00 54.97 55.87 1d2h s GLU 114 Cb -0.02 -2.06 0.16 0.00 0.10 0.00 0.00 34.13 32.31 1d2h s GLU 114 CO 0.08 -0.66 1.19 0.00 0.02 0.00 0.00 175.26 175.89 1d2h s ALA 115 N -2.20 -2.04 -0.12 5.21 0.00 -0.42 -4.75 121.76 117.44 1d2h s ALA 115 Ca 0.66 1.70 0.01 0.00 0.00 0.00 0.00 51.96 54.33 1d2h s ALA 115 Cb -0.17 -0.88 0.02 0.00 0.00 0.00 0.00 23.12 22.09 1d2h s ALA 115 CO 0.29 -0.36 -0.14 1.21 0.00 0.00 0.00 175.76 176.76 1d2h s ASN 116 N -1.35 2.47 0.62 0.00 3.84 -1.26 -1.77 114.94 117.48 1d2h s ASN 116 Ca 0.05 -0.43 0.23 0.00 0.21 0.00 0.00 52.86 52.93 1d2h s ASN 116 Cb -0.01 -1.08 0.94 0.00 -0.55 0.00 0.00 41.25 40.55 1d2h s ASN 116 CO -0.04 -0.02 1.42 -0.50 -2.79 0.00 0.00 177.10 175.18 1d2h h TRP 117 N 7.65 0.00 0.00 0.43 6.55 -1.92 0.79 115.95 129.45 1d2h h TRP 117 Ca -0.33 0.00 -0.07 0.00 0.95 0.00 0.00 58.89 59.44 1d2h h TRP 117 Cb 1.16 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.45 1d2h h TRP 117 CO 0.48 0.00 -0.31 -0.07 -1.05 0.00 0.00 178.44 177.48 1d2h h LEU 118 N 0.00 0.00 -2.42 -4.49 4.07 -1.88 -3.31 115.31 107.29 1d2h h LEU 118 Ca 0.32 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.28 1d2h h LEU 118 Cb 2.25 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.99 1d2h h LEU 118 CO -0.00 0.31 -0.10 0.35 -1.08 0.00 0.00 178.44 177.92 1d2h n THR 119 N -3.22 0.88 -0.02 0.22 -2.24 0.25 -4.89 114.28 105.26 1d2h n THR 119 Ca 0.02 -1.00 -0.00 0.00 -2.27 0.00 0.00 64.05 60.80 1d2h n THR 119 Cb 0.61 0.37 -0.00 0.00 -2.10 0.00 0.00 70.33 69.21 1d2h n THR 119 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1d2h n LEU 120 N -0.59 -0.04 -0.19 3.22 7.94 0.43 -0.50 117.00 127.26 1d2h n LEU 120 Ca 0.05 0.72 0.03 0.00 -1.11 0.00 0.00 56.01 55.70 1d2h n LEU 120 Cb 0.51 -0.33 0.07 0.00 0.53 0.00 0.00 43.42 44.20 1d2h n LEU 120 CO 0.00 -0.38 0.35 -0.90 -1.11 0.00 0.00 177.39 175.36 1d2h n ASP 121 N -2.81 -0.20 0.04 1.96 5.68 -1.26 0.10 116.55 120.06 1d2h n ASP 121 Ca 0.00 0.93 -0.06 0.00 -0.50 0.00 0.00 54.79 55.15 1d2h n ASP 121 Cb 0.01 -0.28 -0.11 0.00 -1.14 0.00 0.00 41.12 39.60 1d2h n ASP 121 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 1d2h h LYS 122 N 0.00 0.00 0.11 0.11 3.11 -1.19 -3.36 116.57 115.34 1d2h h LYS 122 Ca 0.26 0.00 -0.27 0.00 -2.81 0.00 0.00 60.65 57.82 1d2h h LYS 122 Cb 0.39 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.62 1d2h h LYS 122 CO -0.55 0.80 -1.27 -0.44 -2.81 0.00 0.00 179.45 175.18 1d2h h ASP 123 N 0.00 0.36 -3.78 4.20 5.19 0.22 -3.42 116.42 119.18 1d2h h ASP 123 Ca -0.09 -0.40 -0.63 0.00 -0.62 0.00 0.00 57.03 55.29 1d2h h ASP 123 Cb 1.80 -0.12 -0.40 0.00 0.18 0.00 0.00 39.33 40.79 1d2h h ASP 123 CO 0.11 1.32 -0.70 -0.69 -3.12 0.00 0.00 179.24 176.16 1d2h s VAL 124 N -2.65 1.95 0.09 -1.35 1.01 0.13 -5.04 120.40 114.54 1d2h s VAL 124 Ca -0.04 -2.56 -0.31 0.00 0.00 0.00 0.00 61.98 59.07 1d2h s VAL 124 Cb 0.07 -2.40 -0.10 0.00 0.00 0.00 0.00 36.38 33.95 1d2h s VAL 124 CO 0.87 -0.74 1.87 -0.81 0.00 0.00 0.00 175.10 176.28 1d2h n PRO 125 N 3.82 2.76 0.20 2.72 -0.04 -1.26 -4.59 135.00 138.60 1d2h n PRO 125 Ca 0.04 1.01 0.08 0.00 -0.04 0.00 0.00 63.50 64.59 1d2h n PRO 125 Cb 0.37 -2.91 0.31 0.00 -0.04 0.00 0.00 33.50 31.23 1d2h n PRO 125 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1d2h h ALA 126 N 9.02 0.92 -0.80 0.55 0.00 -1.89 -3.49 119.26 123.58 1d2h h ALA 126 Ca -0.47 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.16 1d2h h ALA 126 Cb 1.23 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1d2h h ALA 126 CO 0.94 0.38 0.00 0.41 0.00 0.00 0.00 179.25 180.98 1d2h n GLY 127 N 0.51 2.86 0.14 0.00 0.00 -1.26 -1.51 105.19 105.93 1d2h n GLY 127 Ca 0.01 -0.27 -0.14 0.00 0.00 0.00 0.00 46.02 45.62 1d2h n GLY 127 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1d2h h ASP 128 N 2.02 0.44 -1.75 1.61 3.58 -2.01 -3.49 116.42 116.83 1d2h h ASP 128 Ca 0.00 -0.55 0.00 0.00 0.42 0.00 0.00 57.03 56.90 1d2h h ASP 128 Cb 0.00 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 40.92 1d2h h ASP 128 CO 0.00 0.92 0.00 0.61 -2.88 0.00 0.00 179.24 177.89 1d2h n GLY 129 N 0.42 2.86 3.69 -0.78 0.00 -0.57 -4.79 105.19 106.01 1d2h n GLY 129 Ca -0.07 -1.32 -0.35 0.00 0.00 0.00 0.00 46.02 44.28 1d2h n GLY 129 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1d2h s PHE 130 N -2.00 3.21 0.15 1.61 0.40 -0.29 -4.77 117.98 116.29 1d2h s PHE 130 Ca 0.00 0.19 -0.13 0.00 -0.60 0.00 0.00 56.93 56.39 1d2h s PHE 130 Cb 0.00 -1.85 0.03 0.00 0.51 0.00 0.00 43.02 41.71 1d2h s PHE 130 CO 0.00 0.44 1.65 -0.44 0.70 0.00 0.00 175.22 177.57 1d2h h ASP 131 N 5.39 0.75 -3.02 1.36 3.45 -1.80 -0.59 116.42 121.96 1d2h h ASP 131 Ca -0.49 -0.24 -0.37 0.00 0.43 0.00 0.00 57.03 56.37 1d2h h ASP 131 Cb 1.19 -0.20 -0.38 0.00 -0.56 0.00 0.00 39.33 39.38 1d2h h ASP 131 CO 0.57 0.79 -0.70 0.00 -1.57 0.00 0.00 179.24 178.34 1d2h s ALA 132 N -5.29 0.10 -0.19 3.45 0.00 -0.68 -2.06 121.76 117.09 1d2h s ALA 132 Ca -0.13 0.13 -0.07 0.00 0.00 0.00 0.00 51.96 51.89 1d2h s ALA 132 Cb 0.11 -0.93 -0.04 0.00 0.00 0.00 0.00 23.12 22.26 1d2h s ALA 132 CO 0.79 -0.87 0.06 0.08 0.00 0.00 0.00 175.76 175.83 1d2h s VAL 133 N 2.22 4.63 0.07 0.00 1.01 -0.37 -1.35 120.40 126.61 1d2h s VAL 133 Ca 0.04 -0.08 0.10 0.00 0.00 0.00 0.00 61.98 62.03 1d2h s VAL 133 Cb -0.14 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.11 1d2h s VAL 133 CO -0.07 0.44 -0.26 0.27 0.00 0.00 0.00 175.10 175.47 1d2h s ILE 134 N 0.63 2.16 -0.39 2.22 -4.36 -0.55 -1.86 121.20 119.05 1d2h s ILE 134 Ca 0.03 -1.49 0.10 0.00 -0.26 0.00 0.00 60.65 59.04 1d2h s ILE 134 Cb -0.13 -1.87 0.32 0.00 1.25 0.00 0.00 42.46 42.03 1d2h s ILE 134 CO 0.02 0.29 0.68 0.00 0.24 0.00 0.00 174.94 176.17 1d2h n LEU 136 N 0.58 0.00 -3.60 0.00 4.32 -1.15 -2.17 117.00 114.98 1d2h n LEU 136 Ca 0.24 -1.12 -0.23 0.00 -0.02 0.00 0.00 56.01 54.89 1d2h n LEU 136 Cb 0.60 -0.81 0.07 0.00 -1.62 0.00 0.00 43.42 41.66 1d2h n LEU 136 CO 0.21 -1.41 0.18 0.61 -1.22 0.00 0.00 177.39 175.76 1d2h n GLY 137 N -2.26 -0.48 4.32 -0.72 0.00 -1.26 -3.45 105.19 101.35 1d2h n GLY 137 Ca 0.13 0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.99 1d2h n GLY 137 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1d2h n ASN 138 N -3.03 -0.63 -0.05 1.61 5.15 -1.26 -4.83 115.26 112.21 1d2h n ASN 138 Ca -0.08 -1.19 -0.02 0.00 -0.60 0.00 0.00 54.58 52.69 1d2h n ASN 138 Cb 0.59 -1.51 -0.01 0.00 -0.53 0.00 0.00 39.78 38.32 1d2h n ASN 138 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1d2h h SER 139 N -1.16 0.00 -1.17 1.20 0.02 -1.82 -3.36 113.55 107.25 1d2h h SER 139 Ca -0.59 -0.04 0.42 0.00 -0.84 0.00 0.00 61.79 60.74 1d2h h SER 139 Cb 1.32 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.72 1d2h h SER 139 CO 0.78 0.57 0.73 0.33 -1.14 0.00 0.00 176.83 178.10 1d2h n PHE 140 N -4.74 0.75 0.17 3.45 7.35 -1.26 0.12 117.46 123.29 1d2h n PHE 140 Ca -0.02 0.76 0.10 0.00 -0.76 0.00 0.00 57.45 57.53 1d2h n PHE 140 Cb 0.07 -1.18 0.50 0.00 0.35 0.00 0.00 39.48 39.22 1d2h n PHE 140 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1d2h n ALA 141 N -2.48 1.10 0.89 3.13 0.00 -1.26 -1.64 120.51 120.25 1d2h n ALA 141 Ca 0.36 0.16 0.11 0.00 0.00 0.00 0.00 53.44 54.07 1d2h n ALA 141 Cb 1.37 -1.28 0.51 0.00 0.00 0.00 0.00 19.45 20.05 1d2h n ALA 141 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1d2h n HIS 142 N -2.15 0.00 -2.80 0.00 8.25 0.31 -0.63 115.22 118.21 1d2h n HIS 142 Ca -0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.03 1d2h n HIS 142 Cb 0.05 -0.41 -0.03 0.00 1.12 0.00 0.00 29.99 30.72 1d2h n HIS 142 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1d2h s LEU 143 N -2.82 4.08 0.41 2.41 2.96 -0.65 -4.83 118.68 120.24 1d2h s LEU 143 Ca 0.15 1.14 -0.09 0.00 -0.22 0.00 0.00 54.13 55.11 1d2h s LEU 143 Cb 0.15 -3.33 -0.06 0.00 0.50 0.00 0.00 46.19 43.45 1d2h s LEU 143 CO 0.38 -0.60 0.75 -2.16 -1.32 0.00 0.00 176.35 173.40 1d2h s PRO 144 N 3.03 3.70 -0.77 0.98 0.04 -1.26 -4.49 135.00 136.23 1d2h s PRO 144 Ca 0.39 0.35 -0.03 0.00 0.04 0.00 0.00 61.00 61.75 1d2h s PRO 144 Cb -0.15 -2.41 0.19 0.00 0.04 0.00 0.00 34.50 32.17 1d2h s PRO 144 CO 0.08 -0.06 2.37 -3.47 0.04 0.00 0.00 177.00 175.96 1d2h n ASP 145 N -1.52 7.14 -0.36 6.66 4.64 -1.26 -4.79 116.55 127.06 1d2h n ASP 145 Ca 0.01 -3.45 0.06 0.00 -1.38 0.00 0.00 54.79 50.03 1d2h n ASP 145 Cb 0.54 -1.19 0.14 0.00 -1.04 0.00 0.00 41.12 39.57 1d2h n ASP 145 CO 0.00 0.00 0.00 -1.20 -0.82 0.00 0.00 177.20 175.18 1d2h n SER 146 N 0.45 -0.36 0.25 1.67 7.64 -1.26 -0.11 113.62 121.91 1d2h n SER 146 Ca 0.52 1.72 0.17 0.00 1.01 0.00 0.00 58.87 62.29 1d2h n SER 146 Cb 0.37 -0.52 0.86 0.00 -1.01 0.00 0.00 64.21 63.92 1d2h n SER 146 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1d2h h LYS 147 N 0.00 0.00 0.00 1.43 1.57 -2.02 -3.46 116.57 114.09 1d2h h LYS 147 Ca 0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 1d2h h LYS 147 Cb 0.73 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.04 1d2h h LYS 147 CO -1.03 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 178.26 1d2h n GLY 148 N -0.88 2.91 3.89 3.86 0.00 0.85 -5.00 105.19 110.82 1d2h n GLY 148 Ca -0.01 -0.77 -0.33 0.00 0.00 0.00 0.00 46.02 44.91 1d2h n GLY 148 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1d2h s ASP 149 N 0.00 6.53 0.00 1.61 3.84 -1.26 -4.94 116.67 122.45 1d2h s ASP 149 Ca 0.00 0.64 0.00 0.00 -0.00 0.00 0.00 52.55 53.19 1d2h s ASP 149 Cb 0.00 -2.11 0.00 0.00 -1.38 0.00 0.00 42.92 39.43 1d2h s ASP 149 CO 0.00 0.11 0.26 0.00 -0.00 0.00 0.00 175.17 175.54 1d2h n GLN 150 N 0.42 0.00 -0.38 2.11 1.13 -1.26 -3.65 117.38 115.75 1d2h n GLN 150 Ca -0.05 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 55.00 1d2h n GLN 150 Cb 0.52 -1.27 0.04 0.00 0.11 0.00 0.00 30.24 29.64 1d2h n GLN 150 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 1d2h n SER 151 N -0.75 -0.64 -0.18 1.08 3.41 -1.26 0.10 113.62 115.37 1d2h n SER 151 Ca 0.00 1.70 -0.01 0.00 -0.26 0.00 0.00 58.87 60.30 1d2h n SER 151 Cb 0.00 -0.38 0.09 0.00 -0.26 0.00 0.00 64.21 63.65 1d2h n SER 151 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1d2h h GLU 152 N 0.00 0.36 -0.07 4.33 5.08 -1.93 -1.35 114.58 121.01 1d2h h GLU 152 Ca 0.33 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.67 1d2h h GLU 152 Cb 0.58 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 1d2h h GLU 152 CO -0.97 0.24 0.04 0.45 -1.00 0.00 0.00 179.01 177.77 1d2h h HIS 153 N 0.37 0.09 -0.84 4.33 3.86 0.38 -1.29 115.15 122.05 1d2h h HIS 153 Ca 0.28 -0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.57 1d2h h HIS 153 Cb 0.33 -0.03 -0.07 0.00 1.06 0.00 0.00 27.41 28.70 1d2h h HIS 153 CO -0.17 0.10 0.50 0.00 0.86 0.00 0.00 177.93 179.22 1d2h h ARG 154 N 0.05 0.83 -0.66 2.45 -0.00 0.14 0.15 114.38 117.33 1d2h h ARG 154 Ca 0.02 -0.05 -0.05 0.00 -0.50 0.00 0.00 59.98 59.40 1d2h h ARG 154 Cb 0.04 -0.19 -0.03 0.00 0.00 0.00 0.00 29.97 29.80 1d2h h ARG 154 CO -0.00 0.55 0.21 1.25 0.00 0.00 0.00 179.97 181.97 1d2h h LEU 155 N 0.85 0.97 0.72 3.04 5.85 -0.98 0.31 115.31 126.06 1d2h h LEU 155 Ca 0.39 -0.21 -0.04 0.00 0.84 0.00 0.00 57.88 58.87 1d2h h LEU 155 Cb 0.31 -0.25 0.01 0.00 0.37 0.00 0.00 40.66 41.09 1d2h h LEU 155 CO -0.22 0.92 -0.34 0.00 -0.34 0.00 0.00 178.44 178.45 1d2h h ALA 156 N 1.08 -1.13 -0.27 1.25 0.00 0.01 0.43 119.26 120.64 1d2h h ALA 156 Ca 0.21 -0.21 0.07 0.00 0.00 0.00 0.00 54.91 54.98 1d2h h ALA 156 Cb 0.30 0.37 -0.07 0.00 0.00 0.00 0.00 17.79 18.39 1d2h h ALA 156 CO -0.01 -1.06 -0.25 -0.07 0.00 0.00 0.00 179.25 177.86 1d2h h LEU 157 N -1.07 -0.81 -0.74 0.00 -0.00 -0.76 -1.92 115.31 110.03 1d2h h LEU 157 Ca -0.10 0.15 0.16 0.00 -0.00 0.00 0.00 57.88 58.09 1d2h h LEU 157 Cb 0.74 0.38 -0.11 0.00 -0.00 0.00 0.00 40.66 41.67 1d2h h LEU 157 CO 0.16 -0.28 0.19 0.50 -0.00 0.00 0.00 178.44 179.01 1d2h h LYS 158 N -0.24 0.28 -0.42 1.13 3.64 -0.31 -1.36 116.57 119.28 1d2h h LYS 158 Ca 0.14 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.41 1d2h h LYS 158 Cb 0.47 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.21 1d2h h LYS 158 CO -0.41 0.18 -0.13 -0.91 -2.27 0.00 0.00 179.45 175.92 1d2h h ASN 159 N 0.29 0.76 -0.21 4.20 -0.26 -0.14 -2.87 115.58 117.35 1d2h h ASN 159 Ca 0.41 -0.24 -0.12 0.00 -0.56 0.00 0.00 56.30 55.80 1d2h h ASN 159 Cb 0.70 -0.21 -0.00 0.00 -1.06 0.00 0.00 38.32 37.75 1d2h h ASN 159 CO -0.50 0.91 -0.32 0.40 -1.06 0.00 0.00 177.43 176.86 1d2h h ILE 160 N 0.70 1.33 0.00 2.81 2.04 -0.79 -2.95 117.51 120.64 1d2h h ILE 160 Ca 0.11 -1.53 0.00 0.00 1.00 0.00 0.00 64.86 64.44 1d2h h ILE 160 Cb 0.61 1.81 0.00 0.00 -0.74 0.00 0.00 36.82 38.50 1d2h h ILE 160 CO 0.04 0.48 0.00 0.00 0.00 0.00 0.00 178.15 178.67 1d2h h ALA 161 N 0.62 1.00 0.00 1.87 0.00 -1.26 -0.09 119.26 121.41 1d2h h ALA 161 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1d2h h ALA 161 Cb 0.91 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1d2h h ALA 161 CO 0.07 0.00 0.00 0.45 0.00 0.00 0.00 179.25 179.77 1d2h n SER 162 N -2.84 0.00 -0.73 0.00 2.88 -1.09 -2.62 113.62 109.23 1d2h n SER 162 Ca -0.01 -1.17 0.10 0.00 -1.33 0.00 0.00 58.87 56.46 1d2h n SER 162 Cb 0.13 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 63.65 1d2h n SER 162 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 1d2h n MET 163 N -0.90 1.77 -3.78 -1.46 2.81 -0.04 -4.85 117.12 110.66 1d2h n MET 163 Ca 0.19 -1.53 -0.34 0.00 -1.81 0.00 0.00 57.70 54.21 1d2h n MET 163 Cb 0.09 -1.39 -0.05 0.00 -0.71 0.00 0.00 33.22 31.15 1d2h n MET 163 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1d2h s VAL 164 N -1.85 5.32 -0.10 2.03 1.01 -1.08 -1.14 120.40 124.60 1d2h s VAL 164 Ca 0.22 0.11 -0.09 0.00 0.00 0.00 0.00 61.98 62.22 1d2h s VAL 164 Cb 0.17 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.94 1d2h s VAL 164 CO 0.32 0.35 0.20 0.00 0.00 0.00 0.00 175.10 175.97 1d2h s ARG 165 N -1.81 3.62 0.04 2.72 1.70 -0.23 -4.62 118.95 120.36 1d2h s ARG 165 Ca 0.28 -0.01 -0.29 0.00 -0.47 0.00 0.00 55.73 55.24 1d2h s ARG 165 Cb -0.13 -3.22 -0.15 0.00 -0.57 0.00 0.00 34.95 30.88 1d2h s ARG 165 CO 0.17 0.71 0.73 -2.30 -1.08 0.00 0.00 175.30 173.53 1d2h n PRO 166 N 2.09 0.00 -1.94 3.89 -0.02 -1.26 0.11 135.00 137.87 1d2h n PRO 166 Ca -0.18 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.29 1d2h n PRO 166 Cb 0.54 -1.08 -0.00 0.00 -0.02 0.00 0.00 33.50 32.94 1d2h n PRO 166 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1d2h n GLY 167 N 1.27 0.34 4.00 -1.23 0.00 0.84 -5.00 105.19 105.41 1d2h n GLY 167 Ca 0.15 -0.87 -0.24 0.00 0.00 0.00 0.00 46.02 45.07 1d2h n GLY 167 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1d2h s GLY 168 N -2.97 1.75 0.07 -0.02 0.00 0.31 -4.83 107.32 101.62 1d2h s GLY 168 Ca 0.00 -1.84 0.03 0.00 0.00 0.00 0.00 44.72 42.91 1d2h s GLY 168 CO 0.00 -1.24 -0.10 1.08 0.00 0.00 0.00 173.10 172.84 1d2h s LEU 169 N -5.15 2.30 -0.14 0.66 1.02 -0.87 -1.54 118.68 114.95 1d2h s LEU 169 Ca 0.67 -0.64 -0.05 0.00 0.02 0.00 0.00 54.13 54.13 1d2h s LEU 169 Cb -0.04 -0.31 0.07 0.00 0.02 0.00 0.00 46.19 45.93 1d2h s LEU 169 CO 0.45 -0.18 0.30 -0.22 0.02 0.00 0.00 176.35 176.71 1d2h s LEU 170 N -1.87 -0.37 -0.88 1.79 2.96 -0.44 -1.23 118.68 118.64 1d2h s LEU 170 Ca -0.03 0.68 0.00 0.00 -0.22 0.00 0.00 54.13 54.56 1d2h s LEU 170 Cb -0.08 0.84 0.28 0.00 0.50 0.00 0.00 46.19 47.73 1d2h s LEU 170 CO 0.01 -0.24 1.12 0.52 -1.32 0.00 0.00 176.35 176.44 1d2h n VAL 171 N 5.35 3.90 -3.38 1.68 0.31 -0.78 -1.05 118.33 124.36 1d2h n VAL 171 Ca -0.07 -5.57 -0.38 0.00 -0.01 0.00 0.00 64.34 58.32 1d2h n VAL 171 Cb 0.50 -2.11 -0.06 0.00 -0.91 0.00 0.00 33.84 31.25 1d2h n VAL 171 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1d2h s ILE 172 N -2.55 5.18 0.47 2.52 1.01 -0.77 -1.26 121.20 125.81 1d2h s ILE 172 Ca 0.35 0.86 0.02 0.00 0.00 0.00 0.00 60.65 61.88 1d2h s ILE 172 Cb 0.08 -3.77 -0.01 0.00 0.01 0.00 0.00 42.46 38.77 1d2h s ILE 172 CO 0.04 0.38 0.06 1.51 0.00 0.00 0.00 174.94 176.93 1d2h s ASP 173 N 0.30 3.57 -0.29 3.58 1.47 -0.92 -1.15 116.67 123.23 1d2h s ASP 173 Ca 0.24 -1.69 -0.17 0.00 1.18 0.00 0.00 52.55 52.11 1d2h s ASP 173 Cb -0.15 0.58 0.14 0.00 -0.34 0.00 0.00 42.92 43.14 1d2h s ASP 173 CO 0.10 -0.92 0.95 -1.38 0.68 0.00 0.00 175.17 174.60 1d2h s HIS 174 N -3.02 -0.61 0.66 2.11 -3.43 -0.65 -4.48 115.29 105.87 1d2h s HIS 174 Ca 0.12 1.24 -0.17 0.00 -0.80 0.00 0.00 55.06 55.46 1d2h s HIS 174 Cb 0.01 0.38 -0.08 0.00 -1.43 0.00 0.00 32.58 31.46 1d2h s HIS 174 CO 0.08 -0.30 0.30 1.63 -2.00 0.00 0.00 174.74 174.45 1d2h n LYS 175 N 3.58 0.27 -0.86 -0.38 5.02 -1.26 -1.75 118.16 122.78 1d2h n LYS 175 Ca -0.18 0.12 -0.31 0.00 -2.02 0.00 0.00 58.31 55.92 1d2h n LYS 175 Cb 0.58 -1.58 -0.04 0.00 -0.02 0.00 0.00 35.03 33.97 1d2h n LYS 175 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1d2h n ASN 176 N 0.73 3.32 0.00 4.39 4.05 -0.54 -4.64 115.26 122.56 1d2h n ASN 176 Ca 0.09 -2.47 0.03 0.00 0.45 0.00 0.00 54.58 52.68 1d2h n ASN 176 Cb 0.49 -1.04 0.17 0.00 1.23 0.00 0.00 39.78 40.63 1d2h n ASN 176 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 177.26 172.99 1d2h n TYR 177 N 5.96 0.00 0.02 1.20 4.01 -1.26 -2.55 117.16 124.55 1d2h n TYR 177 Ca 0.44 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 58.09 1d2h n TYR 177 Cb 0.26 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.22 1d2h n TYR 177 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1d2h h ASP 178 N 0.00 -0.14 -0.40 7.72 3.32 -1.82 -2.91 116.42 122.18 1d2h h ASP 178 Ca 0.00 -0.37 -0.04 0.00 0.02 0.00 0.00 57.03 56.64 1d2h h ASP 178 Cb 0.00 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 1d2h h ASP 178 CO 0.00 0.47 0.08 0.22 -1.72 0.00 0.00 179.24 178.29 1d2h h TYR 179 N -0.93 0.69 0.00 4.55 5.03 -1.91 -1.50 116.97 122.89 1d2h h TYR 179 Ca -0.02 -0.09 0.00 0.00 2.58 0.00 0.00 58.73 61.21 1d2h h TYR 179 Cb 0.50 -0.19 0.00 0.00 1.55 0.00 0.00 36.73 38.59 1d2h h TYR 179 CO 0.10 0.67 0.25 0.82 -1.32 0.00 0.00 178.16 178.67 1d2h h ILE 180 N 0.51 0.00 0.00 1.81 2.04 -1.65 0.83 117.51 121.05 1d2h h ILE 180 Ca 0.12 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.86 1d2h h ILE 180 Cb 0.34 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 1d2h h ILE 180 CO 0.00 0.00 -0.58 -0.07 0.00 0.00 0.00 178.15 177.51 1d2h h LEU 181 N 0.00 0.00 -2.06 1.44 4.07 -1.06 -0.66 115.31 117.05 1d2h h LEU 181 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1d2h h LEU 181 Cb 0.49 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.23 1d2h h LEU 181 CO 0.00 0.58 0.00 -1.20 -1.08 0.00 0.00 178.44 176.74 1d2h n SER 182 N -3.39 2.95 0.00 -0.43 7.64 0.28 -4.24 113.62 116.42 1d2h n SER 182 Ca 0.01 -1.88 0.00 0.00 1.01 0.00 0.00 58.87 58.01 1d2h n SER 182 Cb 0.70 -0.12 0.00 0.00 -1.01 0.00 0.00 64.21 63.78 1d2h n SER 182 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1d2h n THR 183 N 1.18 0.00 -3.14 0.44 -1.04 -0.47 -5.02 114.28 106.23 1d2h n THR 183 Ca 0.14 -0.38 -0.19 0.00 -2.04 0.00 0.00 64.05 61.58 1d2h n THR 183 Cb 0.52 1.22 -0.04 0.00 -1.82 0.00 0.00 70.33 70.21 1d2h n THR 183 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1d2h n GLY 184 N 0.06 -0.15 3.64 3.41 0.00 -0.26 -4.82 105.19 107.07 1d2h n GLY 184 Ca 0.00 0.05 -0.08 0.00 0.00 0.00 0.00 46.02 45.99 1d2h n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d2h s ALA 186 N 0.12 2.77 -0.04 0.00 0.00 -1.26 -4.81 121.76 118.54 1d2h s ALA 186 Ca 0.04 -1.48 -0.30 0.00 0.00 0.00 0.00 51.96 50.22 1d2h s ALA 186 Cb -0.05 -1.78 -0.03 0.00 0.00 0.00 0.00 23.12 21.26 1d2h s ALA 186 CO -0.07 -0.86 1.15 -1.25 0.00 0.00 0.00 175.76 174.72 1d2h s PRO 187 N 1.35 4.40 1.04 0.00 0.04 -1.26 -4.99 135.00 135.58 1d2h s PRO 187 Ca 0.00 1.62 -0.16 0.00 0.04 0.00 0.00 61.00 62.50 1d2h s PRO 187 Cb -0.17 -3.51 0.22 0.00 0.04 0.00 0.00 34.50 31.08 1d2h s PRO 187 CO -0.03 -0.35 1.20 -1.25 0.04 0.00 0.00 177.00 176.61 1d2h s PRO 188 N 1.86 0.09 -1.80 0.56 0.04 -1.26 -4.32 135.00 130.17 1d2h s PRO 188 Ca 0.55 -0.12 0.00 0.00 0.04 0.00 0.00 61.00 61.47 1d2h s PRO 188 Cb -0.24 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1d2h s PRO 188 CO 0.23 -2.83 0.00 0.41 0.04 0.00 0.00 177.00 174.85 1d2h n GLY 189 N -2.38 -0.26 0.78 0.56 0.00 -1.26 -4.88 105.19 97.75 1d2h n GLY 189 Ca 0.12 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.22 1d2h n GLY 189 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1d2h n LYS 190 N -2.94 2.04 -1.64 1.61 4.01 -1.26 -5.00 118.16 114.98 1d2h n LYS 190 Ca -0.24 -1.88 -0.48 0.00 -0.51 0.00 0.00 58.31 55.19 1d2h n LYS 190 Cb 0.68 -1.34 -0.05 0.00 -0.51 0.00 0.00 35.03 33.81 1d2h n LYS 190 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 1d2h n ASN 191 N 0.92 2.52 -1.79 4.39 2.85 -1.26 -4.86 115.26 118.04 1d2h n ASN 191 Ca 0.13 1.10 -0.14 0.00 -0.11 0.00 0.00 54.58 55.56 1d2h n ASN 191 Cb 0.45 -1.33 0.20 0.00 1.24 0.00 0.00 39.78 40.34 1d2h n ASN 191 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 1d2h n ILE 192 N 3.10 2.92 0.02 -1.44 -5.35 -1.26 -4.56 119.36 112.79 1d2h n ILE 192 Ca 0.18 -2.18 -0.02 0.00 -0.27 0.00 0.00 62.75 60.45 1d2h n ILE 192 Cb 0.25 -0.40 -0.01 0.00 -1.74 0.00 0.00 39.64 37.74 1d2h n ILE 192 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1d2h n TYR 193 N -1.01 0.00 -4.17 4.28 0.53 -1.26 -3.22 117.16 112.31 1d2h n TYR 193 Ca 0.47 0.00 -0.18 0.00 -1.02 0.00 0.00 57.90 57.18 1d2h n TYR 193 Cb 1.39 -0.10 -0.15 0.00 -1.03 0.00 0.00 39.34 39.46 1d2h n TYR 193 CO 0.00 0.00 0.00 0.71 -1.02 0.00 0.00 176.86 176.55 1d2h s TYR 194 N -2.16 0.59 -0.19 -0.72 1.51 -1.26 0.12 117.35 115.23 1d2h s TYR 194 Ca -0.05 -0.13 -0.30 0.00 -1.01 0.00 0.00 57.07 55.58 1d2h s TYR 194 Cb 0.01 -0.46 -0.07 0.00 -0.11 0.00 0.00 41.96 41.33 1d2h s TYR 194 CO 0.08 -0.08 2.17 1.63 -1.11 0.00 0.00 175.55 178.24 1d2h n LYS 195 N 3.39 1.98 -2.89 -0.62 4.76 -1.26 -4.89 118.16 118.63 1d2h n LYS 195 Ca -0.18 0.59 -0.42 0.00 -2.87 0.00 0.00 58.31 55.42 1d2h n LYS 195 Cb 0.55 -3.07 -0.04 0.00 -1.84 0.00 0.00 35.03 30.63 1d2h n LYS 195 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1d2h s SER 196 N 7.41 6.74 -0.06 4.39 0.01 -1.26 -4.93 113.70 126.01 1d2h s SER 196 Ca 1.00 0.81 0.16 0.00 1.31 0.00 0.00 55.95 59.24 1d2h s SER 196 Cb -0.44 -2.43 0.54 0.00 0.21 0.00 0.00 66.02 63.89 1d2h s SER 196 CO 0.39 -0.62 1.45 0.47 0.41 0.00 0.00 173.24 175.35 1d2h n ASP 197 N 6.23 3.84 -4.22 2.44 10.43 -1.26 -4.88 116.55 129.13 1d2h n ASP 197 Ca 0.05 -2.26 -0.41 0.00 2.57 0.00 0.00 54.79 54.74 1d2h n ASP 197 Cb 0.48 -0.43 -0.08 0.00 1.84 0.00 0.00 41.12 42.92 1d2h n ASP 197 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 1d2h s LEU 198 N -1.48 5.76 0.23 0.64 2.96 -1.26 -5.06 118.68 120.47 1d2h s LEU 198 Ca 0.40 -2.00 -0.32 0.00 -0.22 0.00 0.00 54.13 51.99 1d2h s LEU 198 Cb 0.24 -2.03 -0.12 0.00 0.50 0.00 0.00 46.19 44.78 1d2h s LEU 198 CO 0.22 -0.68 1.65 0.41 -1.32 0.00 0.00 176.35 176.63 1d2h n THR 199 N 4.80 0.37 -3.48 3.68 -1.04 -1.26 -4.89 114.28 112.46 1d2h n THR 199 Ca -0.06 -0.09 -0.12 0.00 -2.04 0.00 0.00 64.05 61.74 1d2h n THR 199 Cb 0.41 -1.90 -0.03 0.00 -1.82 0.00 0.00 70.33 66.99 1d2h n THR 199 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 1d2h s LYS 200 N 0.53 1.24 0.50 -2.82 0.00 -1.26 -1.68 119.74 116.24 1d2h s LYS 200 Ca 0.72 -0.54 0.08 0.00 0.00 0.00 0.00 55.97 56.23 1d2h s LYS 200 Cb -0.53 0.56 0.08 0.00 0.00 0.00 0.00 37.83 37.94 1d2h s LYS 200 CO 0.39 -0.53 0.67 -3.47 0.00 0.00 0.00 175.35 172.41 1d2h n ASP 201 N -0.34 1.85 -3.64 0.03 2.03 -0.55 -4.89 116.55 111.03 1d2h n ASP 201 Ca -0.17 -2.34 -0.07 0.00 0.52 0.00 0.00 54.79 52.74 1d2h n ASP 201 Cb 0.65 -0.35 -0.07 0.00 -0.72 0.00 0.00 41.12 40.63 1d2h n ASP 201 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1d2h s ILE 202 N -2.10 0.00 -0.16 5.18 1.01 -1.26 -1.65 121.20 122.22 1d2h s ILE 202 Ca 0.51 0.00 0.01 0.00 0.00 0.00 0.00 60.65 61.17 1d2h s ILE 202 Cb -0.04 -1.00 0.01 0.00 0.01 0.00 0.00 42.46 41.44 1d2h s ILE 202 CO 0.32 0.00 -0.19 -0.89 0.00 0.00 0.00 174.94 174.19 1d2h s THR 203 N 1.05 2.27 -0.39 2.92 2.01 -0.84 -4.92 115.64 117.75 1d2h s THR 203 Ca -0.05 -0.89 -0.15 0.00 0.31 0.00 0.00 61.69 60.91 1d2h s THR 203 Cb -0.05 -1.95 0.01 0.00 0.01 0.00 0.00 72.50 70.53 1d2h s THR 203 CO -0.12 0.53 0.32 -0.89 -0.69 0.00 0.00 174.62 173.77 1d2h s THR 204 N 1.04 5.22 -0.77 -0.82 2.01 -1.26 -1.51 115.64 119.56 1d2h s THR 204 Ca -0.01 -0.40 -0.09 0.00 0.31 0.00 0.00 61.69 61.49 1d2h s THR 204 Cb -0.14 -3.88 0.20 0.00 0.01 0.00 0.00 72.50 68.68 1d2h s THR 204 CO -0.06 -0.23 0.67 -0.44 -0.69 0.00 0.00 174.62 173.87 1d2h s SER 205 N 1.72 6.19 -0.43 3.53 0.01 -0.56 -4.94 113.70 119.22 1d2h s SER 205 Ca 0.07 -2.85 -0.27 0.00 1.31 0.00 0.00 55.95 54.22 1d2h s SER 205 Cb -0.18 -2.07 0.02 0.00 0.21 0.00 0.00 66.02 64.01 1d2h s SER 205 CO 0.11 -0.46 0.98 -0.69 0.41 0.00 0.00 173.24 173.59 1d2h s VAL 206 N -0.07 4.44 0.17 3.43 1.01 -1.26 -1.71 120.40 126.41 1d2h s VAL 206 Ca 0.19 1.03 -0.22 0.00 0.00 0.00 0.00 61.98 62.98 1d2h s VAL 206 Cb -0.14 -4.45 -0.08 0.00 0.00 0.00 0.00 36.38 31.72 1d2h s VAL 206 CO -0.07 -0.78 0.72 -0.22 0.00 0.00 0.00 175.10 174.75 1d2h s LEU 207 N 3.84 4.48 -0.19 3.92 2.96 -0.44 -4.98 118.68 128.27 1d2h s LEU 207 Ca 0.40 1.48 -0.03 0.00 -0.22 0.00 0.00 54.13 55.76 1d2h s LEU 207 Cb -0.10 -3.34 0.06 0.00 0.50 0.00 0.00 46.19 43.32 1d2h s LEU 207 CO 0.25 0.15 0.04 -0.89 -1.32 0.00 0.00 176.35 174.58 1d2h s THR 208 N -1.29 0.46 -0.32 3.68 2.01 -1.26 -1.63 115.64 117.30 1d2h s THR 208 Ca 0.37 -0.53 -0.10 0.00 0.31 0.00 0.00 61.69 61.74 1d2h s THR 208 Cb -0.20 -0.99 -0.01 0.00 0.01 0.00 0.00 72.50 71.31 1d2h s THR 208 CO 0.23 -0.22 0.17 -0.69 -0.69 0.00 0.00 174.62 173.42 1d2h s VAL 209 N 1.88 4.80 -1.45 3.82 1.01 -0.79 -4.49 120.40 125.19 1d2h s VAL 209 Ca -0.01 -0.33 -0.10 0.00 0.00 0.00 0.00 61.98 61.54 1d2h s VAL 209 Cb -0.17 -3.44 0.04 0.00 0.00 0.00 0.00 36.38 32.81 1d2h s VAL 209 CO -0.08 0.06 1.01 0.59 0.00 0.00 0.00 175.10 176.68 1d2h n ASN 210 N 5.02 -5.67 -0.06 3.32 5.03 -1.26 -1.31 115.26 120.32 1d2h n ASN 210 Ca -0.14 -0.59 -0.01 0.00 0.87 0.00 0.00 54.58 54.72 1d2h n ASN 210 Cb 0.49 -4.50 -0.00 0.00 -1.02 0.00 0.00 39.78 34.75 1d2h n ASN 210 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1d2h n ASN 211 N -2.85 -4.05 -4.08 6.41 4.05 -1.26 -4.99 115.26 108.49 1d2h n ASN 211 Ca 0.01 0.02 -0.32 0.00 0.45 0.00 0.00 54.58 54.73 1d2h n ASN 211 Cb 0.55 -1.63 -0.15 0.00 1.23 0.00 0.00 39.78 39.79 1d2h n ASN 211 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 177.26 173.46 1d2h s LYS 212 N -0.93 2.29 -0.25 1.20 2.36 -0.43 -5.07 119.74 118.92 1d2h s LYS 212 Ca 0.00 -1.32 -0.42 0.00 -2.55 0.00 0.00 55.97 51.69 1d2h s LYS 212 Cb 0.00 -2.90 -0.18 0.00 -1.05 0.00 0.00 37.83 33.70 1d2h s LYS 212 CO 0.00 -0.56 1.54 0.00 1.55 0.00 0.00 175.35 177.88 1d2h n ALA 213 N 4.46 -1.16 -0.05 3.13 0.00 -1.26 -1.88 120.51 123.75 1d2h n ALA 213 Ca -0.14 0.47 -0.06 0.00 0.00 0.00 0.00 53.44 53.71 1d2h n ALA 213 Cb 0.42 -2.04 -0.06 0.00 0.00 0.00 0.00 19.45 17.77 1d2h n ALA 213 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1d2h n HIS 214 N 3.96 0.00 -4.01 0.00 -0.00 -0.65 -4.83 115.22 109.69 1d2h n HIS 214 Ca 0.26 0.00 -0.10 0.00 0.46 0.00 0.00 57.72 58.34 1d2h n HIS 214 Cb 0.07 -0.42 -0.07 0.00 -0.12 0.00 0.00 29.99 29.46 1d2h n HIS 214 CO 0.00 0.00 0.00 1.41 0.46 0.00 0.00 176.34 178.21 1d2h s MET 215 N -2.21 1.34 -0.28 1.57 1.75 -1.14 -4.53 119.30 115.80 1d2h s MET 215 Ca -0.09 -1.28 0.00 0.00 -1.25 0.00 0.00 55.69 53.08 1d2h s MET 215 Cb 0.03 0.40 0.15 0.00 2.84 0.00 0.00 34.83 38.25 1d2h s MET 215 CO 0.30 -0.52 0.39 0.08 -0.65 0.00 0.00 175.02 174.63 1d2h s VAL 216 N -4.02 -0.61 -0.36 10.11 1.01 -0.61 -1.33 120.40 124.60 1d2h s VAL 216 Ca 0.23 -0.24 -0.12 0.00 0.00 0.00 0.00 61.98 61.84 1d2h s VAL 216 Cb 0.02 -0.94 0.00 0.00 0.00 0.00 0.00 36.38 35.46 1d2h s VAL 216 CO 0.06 -0.25 0.23 -0.89 0.00 0.00 0.00 175.10 174.25 1d2h s THR 217 N 2.53 5.02 -0.40 3.92 2.01 -0.69 -1.59 115.64 126.45 1d2h s THR 217 Ca 0.11 -0.47 -0.16 0.00 0.31 0.00 0.00 61.69 61.47 1d2h s THR 217 Cb -0.13 -3.66 0.01 0.00 0.01 0.00 0.00 72.50 68.72 1d2h s THR 217 CO -0.26 -0.10 0.38 -0.76 -0.69 0.00 0.00 174.62 173.18 1d2h s LEU 218 N 1.66 4.81 -0.57 4.42 1.02 -0.34 -1.50 118.68 128.17 1d2h s LEU 218 Ca 0.05 -0.61 -0.18 0.00 0.02 0.00 0.00 54.13 53.40 1d2h s LEU 218 Cb -0.18 -2.31 0.10 0.00 0.02 0.00 0.00 46.19 43.83 1d2h s LEU 218 CO 0.09 -0.48 0.64 -1.81 0.02 0.00 0.00 176.35 174.82 1d2h s ASP 219 N 1.76 6.19 -0.26 2.29 1.01 -0.57 -1.90 116.67 125.18 1d2h s ASP 219 Ca 0.10 -1.47 -0.29 0.00 0.71 0.00 0.00 52.55 51.60 1d2h s ASP 219 Cb -0.17 -2.28 0.00 0.00 1.01 0.00 0.00 42.92 41.48 1d2h s ASP 219 CO 0.12 -1.03 1.24 -0.31 0.21 0.00 0.00 175.17 175.41 1d2h s TYR 220 N 2.42 2.83 -1.08 4.23 1.51 -0.52 -1.98 117.35 124.76 1d2h s TYR 220 Ca 0.10 0.99 -0.04 0.00 -1.01 0.00 0.00 57.07 57.10 1d2h s TYR 220 Cb -0.25 -3.73 0.30 0.00 -0.11 0.00 0.00 41.96 38.17 1d2h s TYR 220 CO 0.06 -1.51 1.58 2.41 -1.11 0.00 0.00 175.55 176.98 1d2h n THR 221 N 5.89 5.45 -0.91 -0.71 -1.04 -0.66 -1.19 114.28 121.11 1d2h n THR 221 Ca 0.14 -5.87 -0.32 0.00 -2.04 0.00 0.00 64.05 55.96 1d2h n THR 221 Cb 0.46 -1.99 0.14 0.00 -1.82 0.00 0.00 70.33 67.12 1d2h n THR 221 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1d2h s VAL 222 N -2.93 2.32 0.06 12.58 1.01 -0.66 -1.48 120.40 131.30 1d2h s VAL 222 Ca 0.33 0.11 0.09 0.00 0.00 0.00 0.00 61.98 62.51 1d2h s VAL 222 Cb 0.08 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.13 1d2h s VAL 222 CO 0.06 -0.13 -0.24 -1.58 0.00 0.00 0.00 175.10 173.21 1d2h s GLN 223 N -4.58 1.53 -0.66 2.72 0.74 -0.68 -1.97 119.66 116.76 1d2h s GLN 223 Ca 0.67 -1.09 -0.00 0.00 0.05 0.00 0.00 55.36 54.99 1d2h s GLN 223 Cb -0.23 -1.74 0.17 0.00 1.10 0.00 0.00 33.01 32.31 1d2h s GLN 223 CO 0.56 0.44 0.47 0.54 -0.55 0.00 0.00 175.29 176.74 1d2h s VAL 224 N -0.87 3.47 0.32 1.34 0.11 -0.43 -4.69 120.40 119.65 1d2h s VAL 224 Ca 0.10 -3.39 0.22 0.00 -2.93 0.00 0.00 61.98 55.98 1d2h s VAL 224 Cb -0.10 -3.27 0.35 0.00 -1.53 0.00 0.00 36.38 31.84 1d2h s VAL 224 CO 0.03 -0.92 1.17 -2.65 -3.33 0.00 0.00 175.10 169.41 1d2h n PRO 225 N 2.98 -0.03 0.02 1.54 -0.02 -1.26 0.59 135.00 138.81 1d2h n PRO 225 Ca 0.11 0.96 0.12 0.00 -2.02 0.00 0.00 63.50 62.67 1d2h n PRO 225 Cb 0.36 -1.86 0.18 0.00 -0.02 0.00 0.00 33.50 32.16 1d2h n PRO 225 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1d2h n GLY 226 N -1.34 -1.27 3.01 -1.23 0.00 -1.26 -1.55 105.19 101.55 1d2h n GLY 226 Ca 0.30 -0.34 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1d2h n GLY 226 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d2h n ALA 227 N -1.64 4.07 -3.22 4.61 0.00 0.20 -4.79 120.51 119.74 1d2h n ALA 227 Ca 0.04 -3.53 0.01 0.00 0.00 0.00 0.00 53.44 49.95 1d2h n ALA 227 Cb 0.38 -3.59 0.01 0.00 0.00 0.00 0.00 19.45 16.24 1d2h n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1d2h n GLY 228 N 4.48 1.49 0.00 0.00 0.00 0.15 0.95 105.19 112.26 1d2h n GLY 228 Ca 0.50 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1d2h n GLY 228 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d2h n ARG 229 N -0.16 0.00 -1.02 1.61 3.00 -1.26 -4.41 116.66 114.42 1d2h n ARG 229 Ca -0.02 0.00 -0.13 0.00 -0.01 0.00 0.00 57.85 57.69 1d2h n ARG 229 Cb 0.16 -0.14 -0.15 0.00 0.00 0.00 0.00 32.46 32.33 1d2h n ARG 229 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1d2h n ASP 230 N -0.11 5.37 0.00 0.55 9.92 -1.26 -4.58 116.55 126.44 1d2h n ASP 230 Ca 0.00 -2.55 0.00 0.00 -0.53 0.00 0.00 54.79 51.71 1d2h n ASP 230 Cb 0.00 -1.39 0.00 0.00 -0.64 0.00 0.00 41.12 39.09 1d2h n ASP 230 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1d2h n GLY 231 N 2.29 2.79 2.78 0.44 0.00 -1.26 -5.03 105.19 107.20 1d2h n GLY 231 Ca 0.42 -0.11 -0.37 0.00 0.00 0.00 0.00 46.02 45.95 1d2h n GLY 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d2h n ALA 232 N 0.00 -2.67 -2.76 4.61 0.00 -1.26 -4.20 120.51 114.23 1d2h n ALA 232 Ca 0.00 0.20 -0.33 0.00 0.00 0.00 0.00 53.44 53.31 1d2h n ALA 232 Cb 0.00 -1.27 -0.05 0.00 0.00 0.00 0.00 19.45 18.13 1d2h n ALA 232 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1d2h s PRO 233 N -0.83 3.57 0.75 0.00 0.04 -0.59 0.29 135.00 138.22 1d2h s PRO 233 Ca 0.51 -0.16 -0.03 0.00 0.04 0.00 0.00 61.00 61.36 1d2h s PRO 233 Cb -0.62 -2.99 0.13 0.00 0.04 0.00 0.00 34.50 31.06 1d2h s PRO 233 CO 0.50 0.58 1.03 0.20 0.04 0.00 0.00 177.00 179.35 1d2h s GLY 234 N -2.14 1.76 -0.04 0.56 0.00 0.27 -4.76 107.32 102.98 1d2h s GLY 234 Ca 0.34 -1.64 -0.04 0.00 0.00 0.00 0.00 44.72 43.39 1d2h s GLY 234 CO 0.22 -1.05 0.10 -1.36 0.00 0.00 0.00 173.10 171.01 1d2h s PHE 235 N -3.24 -0.11 0.00 1.90 0.40 -1.26 -1.32 117.98 114.36 1d2h s PHE 235 Ca 0.67 0.26 0.00 0.00 -0.60 0.00 0.00 56.93 57.26 1d2h s PHE 235 Cb -0.05 0.03 0.00 0.00 0.51 0.00 0.00 43.02 43.51 1d2h s PHE 235 CO 0.45 -0.06 0.00 0.43 0.70 0.00 0.00 175.22 176.75 1d2h n SER 236 N 2.99 0.00 -3.71 1.36 7.64 -0.83 -5.03 113.62 116.04 1d2h n SER 236 Ca -0.13 -0.16 -0.07 0.00 1.01 0.00 0.00 58.87 59.52 1d2h n SER 236 Cb 0.59 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.77 1d2h n SER 236 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 1d2h s LYS 237 N 0.51 1.47 0.00 1.43 0.00 -1.25 -1.65 119.74 120.25 1d2h s LYS 237 Ca 0.00 -0.75 -0.03 0.00 0.00 0.00 0.00 55.97 55.19 1d2h s LYS 237 Cb 0.00 0.54 -0.01 0.00 0.00 0.00 0.00 37.83 38.37 1d2h s LYS 237 CO 0.00 -0.67 0.05 -0.59 0.00 0.00 0.00 175.35 174.15 1d2h s PHE 238 N -3.68 0.10 0.06 1.78 -0.71 -0.34 -4.97 117.98 110.22 1d2h s PHE 238 Ca 0.09 -0.21 -0.03 0.00 -1.04 0.00 0.00 56.93 55.73 1d2h s PHE 238 Cb -0.04 -0.09 -0.05 0.00 -1.21 0.00 0.00 43.02 41.64 1d2h s PHE 238 CO 0.00 -0.18 0.27 0.50 -1.34 0.00 0.00 175.22 174.47 1d2h s ARG 239 N -1.05 3.53 -0.18 1.99 3.52 -1.26 -1.44 118.95 124.06 1d2h s ARG 239 Ca -0.11 -0.22 -0.05 0.00 -0.13 0.00 0.00 55.73 55.22 1d2h s ARG 239 Cb -0.07 -3.00 0.09 0.00 -1.56 0.00 0.00 34.95 30.41 1d2h s ARG 239 CO 0.00 0.58 0.32 -1.17 -0.81 0.00 0.00 175.30 174.22 1d2h s LEU 240 N -2.29 -0.42 -0.11 -0.88 2.96 -0.80 -4.98 118.68 112.16 1d2h s LEU 240 Ca 0.34 0.46 0.01 0.00 -0.22 0.00 0.00 54.13 54.72 1d2h s LEU 240 Cb -0.13 0.89 -0.01 0.00 0.50 0.00 0.00 46.19 47.44 1d2h s LEU 240 CO 0.23 -0.27 -0.16 -0.44 -1.32 0.00 0.00 176.35 174.39 1d2h s SER 241 N 2.48 3.77 0.16 3.68 0.01 -1.26 -1.20 113.70 121.34 1d2h s SER 241 Ca 0.04 -0.37 0.08 0.00 1.31 0.00 0.00 55.95 57.01 1d2h s SER 241 Cb -0.13 -1.44 -0.04 0.00 0.21 0.00 0.00 66.02 64.62 1d2h s SER 241 CO -0.12 0.19 -0.16 -0.31 0.41 0.00 0.00 173.24 173.25 1d2h s TYR 242 N 0.19 1.68 -0.01 2.43 4.12 -0.62 -4.72 117.35 120.42 1d2h s TYR 242 Ca -0.10 -0.52 -0.21 0.00 0.02 0.00 0.00 57.07 56.26 1d2h s TYR 242 Cb -0.16 -0.83 -0.05 0.00 -1.52 0.00 0.00 41.96 39.40 1d2h s TYR 242 CO 0.06 0.28 0.62 -0.47 0.02 0.00 0.00 175.55 176.06 1d2h s TYR 243 N -2.32 3.68 1.39 2.71 5.04 0.20 -1.57 117.35 126.48 1d2h s TYR 243 Ca 0.16 1.23 -0.21 0.00 -2.44 0.00 0.00 57.07 55.80 1d2h s TYR 243 Cb -0.04 -2.65 0.36 0.00 0.35 0.00 0.00 41.96 39.98 1d2h s TYR 243 CO 0.06 0.31 0.93 -1.25 -1.34 0.00 0.00 175.55 174.26 1d2h s PRO 244 N -0.07 -2.71 -0.31 4.97 0.04 -1.26 -4.84 135.00 130.82 1d2h s PRO 244 Ca 0.32 0.29 -0.10 0.00 0.04 0.00 0.00 61.00 61.56 1d2h s PRO 244 Cb -0.18 -1.39 0.19 0.00 0.04 0.00 0.00 34.50 33.15 1d2h s PRO 244 CO 0.18 -4.77 1.03 -1.01 0.04 0.00 0.00 177.00 172.47 1d2h s HIS 245 N -2.25 -0.50 0.15 0.56 3.76 -1.26 -5.07 115.29 110.69 1d2h s HIS 245 Ca 0.68 0.22 -0.26 0.00 -0.15 0.00 0.00 55.06 55.56 1d2h s HIS 245 Cb -0.16 0.09 -0.08 0.00 1.11 0.00 0.00 32.58 33.54 1d2h s HIS 245 CO 0.60 -0.30 0.82 0.00 -0.85 0.00 0.00 174.74 175.00 1d2h n LEU 247 N 1.87 -0.12 0.00 0.00 7.94 -1.26 -2.09 117.00 123.35 1d2h n LEU 247 Ca -0.04 0.52 0.00 0.00 -1.11 0.00 0.00 56.01 55.38 1d2h n LEU 247 Cb 0.49 -0.19 0.00 0.00 0.53 0.00 0.00 43.42 44.25 1d2h n LEU 247 CO 0.47 -0.32 0.30 0.00 -1.11 0.00 0.00 177.39 176.74 1d2h n ALA 248 N -2.74 0.00 -0.30 1.96 0.00 -1.26 0.13 120.51 118.29 1d2h n ALA 248 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 1d2h n ALA 248 Cb 0.03 0.30 0.11 0.00 0.00 0.00 0.00 19.45 19.89 1d2h n ALA 248 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1d2h h SER 249 N 0.00 -0.82 -0.07 0.00 0.87 -1.82 -1.39 113.55 110.31 1d2h h SER 249 Ca 0.00 0.26 -0.23 0.00 -1.23 0.00 0.00 61.79 60.59 1d2h h SER 249 Cb 0.00 0.54 0.01 0.00 -0.44 0.00 0.00 62.40 62.51 1d2h h SER 249 CO 0.00 -0.28 -0.84 0.15 -0.53 0.00 0.00 176.83 175.32 1d2h h PHE 250 N -0.00 0.98 -1.01 2.24 3.57 -1.14 -0.26 116.94 121.32 1d2h h PHE 250 Ca 0.41 -0.49 0.25 0.00 3.53 0.00 0.00 57.97 61.67 1d2h h PHE 250 Cb 0.63 -0.13 -0.09 0.00 2.79 0.00 0.00 35.95 39.15 1d2h h PHE 250 CO -0.68 1.31 0.66 1.15 -2.23 0.00 0.00 178.31 178.52 1d2h h THR 251 N 0.37 0.57 0.02 4.41 2.02 0.21 -0.38 112.91 120.13 1d2h h THR 251 Ca -0.09 -0.14 -0.26 0.00 0.77 0.00 0.00 66.41 66.70 1d2h h THR 251 Cb 1.49 0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 1d2h h THR 251 CO 0.17 0.07 -1.41 1.21 0.37 0.00 0.00 175.52 175.93 1d2h n GLU 252 N -4.59 0.60 -0.30 6.66 2.13 -0.88 -3.74 120.64 120.52 1d2h n GLU 252 Ca 0.24 0.52 0.13 0.00 0.66 0.00 0.00 57.16 58.71 1d2h n GLU 252 Cb 0.83 -1.74 0.30 0.00 0.27 0.00 0.00 31.44 31.11 1d2h n GLU 252 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1d2h h LEU 253 N -0.83 0.31 -0.14 4.31 5.85 -0.60 -2.02 115.31 122.19 1d2h h LEU 253 Ca -0.37 0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.47 1d2h h LEU 253 Cb 1.43 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 42.60 1d2h h LEU 253 CO -0.17 -0.01 -0.05 1.62 -0.34 0.00 0.00 178.44 179.49 1d2h h VAL 254 N 0.39 1.30 -0.90 1.05 3.04 -1.26 -3.12 116.25 116.75 1d2h h VAL 254 Ca 0.56 -1.04 0.10 0.00 -1.01 0.00 0.00 66.70 65.31 1d2h h VAL 254 Cb 1.06 1.71 -0.08 0.00 -2.01 0.00 0.00 31.29 31.97 1d2h h VAL 254 CO -0.53 0.30 0.54 1.56 -1.01 0.00 0.00 177.57 178.43 1d2h h GLN 255 N -0.05 0.86 -0.44 4.17 4.20 -1.47 0.39 115.11 122.77 1d2h h GLN 255 Ca 0.03 -0.05 0.12 0.00 0.06 0.00 0.00 58.65 58.81 1d2h h GLN 255 Cb 0.49 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 1d2h h GLN 255 CO 0.02 0.57 0.31 1.49 -0.67 0.00 0.00 178.83 180.55 1d2h h GLU 256 N 0.89 0.02 -0.96 1.46 4.22 -1.36 0.45 114.58 119.30 1d2h h GLU 256 Ca 0.44 -0.00 0.16 0.00 0.08 0.00 0.00 59.36 60.04 1d2h h GLU 256 Cb 0.41 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.57 1d2h h GLU 256 CO -0.25 0.01 0.61 0.00 -2.18 0.00 0.00 179.01 177.20 1d2h h ALA 257 N 1.78 1.74 0.00 2.92 0.00 -0.17 0.16 119.26 125.70 1d2h h ALA 257 Ca 0.21 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1d2h h ALA 257 Cb 0.81 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1d2h h ALA 257 CO -0.01 -0.03 -1.35 1.19 0.00 0.00 0.00 179.25 179.05 1d2h n PHE 258 N -4.63 0.06 -3.01 0.00 3.72 0.37 -4.70 117.46 109.27 1d2h n PHE 258 Ca 0.20 0.02 -0.13 0.00 -0.05 0.00 0.00 57.45 57.49 1d2h n PHE 258 Cb 0.50 -0.28 0.06 0.00 -0.94 0.00 0.00 39.48 38.83 1d2h n PHE 258 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1d2h n GLY 259 N 1.39 -0.49 1.85 1.37 0.00 0.13 -3.65 105.19 105.79 1d2h n GLY 259 Ca 0.01 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1d2h n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d2h n GLY 260 N -1.20 2.21 3.40 -0.02 0.00 -1.20 -4.93 105.19 103.44 1d2h n GLY 260 Ca -0.14 -0.40 -0.12 0.00 0.00 0.00 0.00 46.02 45.37 1d2h n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d2h n ARG 261 N 0.00 0.15 0.00 1.61 1.74 -1.24 -4.70 116.66 114.22 1d2h n ARG 261 Ca 0.00 -0.68 0.00 0.00 -0.77 0.00 0.00 57.85 56.40 1d2h n ARG 261 Cb 0.00 -2.45 0.00 0.00 -1.02 0.00 0.00 32.46 28.99 1d2h n ARG 261 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1d2h s GLN 263 N -1.77 2.55 0.32 0.00 -0.21 -0.39 -4.79 119.66 115.37 1d2h s GLN 263 Ca 0.00 -1.84 -0.06 0.00 0.02 0.00 0.00 55.36 53.49 1d2h s GLN 263 Cb 0.00 -3.95 -0.05 0.00 1.00 0.00 0.00 33.01 30.01 1d2h s GLN 263 CO 0.00 -1.20 0.61 -1.58 -2.12 0.00 0.00 175.29 170.99 1d2h s HIS 264 N 1.24 3.48 -0.20 0.91 5.65 -1.26 -1.66 115.29 123.45 1d2h s HIS 264 Ca 0.07 0.71 -0.28 0.00 0.25 0.00 0.00 55.06 55.81 1d2h s HIS 264 Cb -0.25 -2.17 0.10 0.00 -1.18 0.00 0.00 32.58 29.08 1d2h s HIS 264 CO -0.01 0.09 0.89 -1.54 -0.65 0.00 0.00 174.74 173.52 1d2h s SER 265 N -3.27 -0.53 -0.16 9.88 1.04 -0.81 -4.99 113.70 114.86 1d2h s SER 265 Ca 0.45 0.83 -0.02 0.00 0.48 0.00 0.00 55.95 57.69 1d2h s SER 265 Cb -0.11 0.78 0.05 0.00 0.10 0.00 0.00 66.02 66.84 1d2h s SER 265 CO 0.31 -0.31 0.01 0.54 0.98 0.00 0.00 173.24 174.78 1d2h s VAL 266 N -0.37 0.58 0.12 5.02 0.11 -1.25 -0.72 120.40 123.88 1d2h s VAL 266 Ca -0.02 -0.41 -0.29 0.00 -2.93 0.00 0.00 61.98 58.34 1d2h s VAL 266 Cb -0.03 -0.95 -0.06 0.00 -1.53 0.00 0.00 36.38 33.81 1d2h s VAL 266 CO 0.00 -0.05 0.91 -0.76 -3.33 0.00 0.00 175.10 171.88 1d2h s LEU 267 N 1.85 4.51 0.00 2.54 1.02 -0.41 -3.80 118.68 124.40 1d2h s LEU 267 Ca 0.01 1.74 0.00 0.00 0.02 0.00 0.00 54.13 55.89 1d2h s LEU 267 Cb -0.16 -3.51 0.00 0.00 0.02 0.00 0.00 46.19 42.55 1d2h s LEU 267 CO -0.07 -0.01 0.51 0.61 0.02 0.00 0.00 176.35 177.41 1d2h n GLY 268 N 2.16 -3.49 0.00 -3.19 0.00 0.16 -1.60 105.19 99.22 1d2h n GLY 268 Ca 0.01 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.61 1d2h n GLY 268 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1d2h n ASP 269 N -0.93 0.00 -0.24 1.61 -0.08 -1.25 -2.92 116.55 112.74 1d2h n ASP 269 Ca 0.00 0.02 0.01 0.00 -1.51 0.00 0.00 54.79 53.30 1d2h n ASP 269 Cb 0.00 -0.14 0.01 0.00 2.34 0.00 0.00 41.12 43.32 1d2h n ASP 269 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1d2h n PHE 270 N -1.68 0.00 -4.53 -0.67 0.99 -1.26 -4.36 117.46 105.94 1d2h n PHE 270 Ca 0.00 -0.10 -0.25 0.00 -0.00 0.00 0.00 57.45 57.10 1d2h n PHE 270 Cb 0.00 -0.04 -0.11 0.00 -1.00 0.00 0.00 39.48 38.34 1d2h n PHE 270 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.76 176.91 1d2h s LYS 271 N -0.25 1.79 -0.00 -1.08 -0.14 -1.26 -5.01 119.74 113.79 1d2h s LYS 271 Ca 0.02 -1.96 -0.30 0.00 -1.36 0.00 0.00 55.97 52.38 1d2h s LYS 271 Cb 0.02 -1.50 -0.08 0.00 -1.68 0.00 0.00 37.83 34.59 1d2h s LYS 271 CO 0.00 0.04 1.99 -2.14 -0.76 0.00 0.00 175.35 174.48 1d2h s PRO 272 N -3.69 4.00 0.24 -1.68 0.02 -1.26 0.39 135.00 133.02 1d2h s PRO 272 Ca 0.33 2.52 -0.08 0.00 0.02 0.00 0.00 61.00 63.79 1d2h s PRO 272 Cb 0.05 -4.19 -0.06 0.00 0.02 0.00 0.00 34.50 30.32 1d2h s PRO 272 CO 0.16 -1.11 0.54 -0.47 -0.33 0.00 0.00 177.00 175.79 1d2h s TYR 273 N 4.97 3.44 -0.08 6.54 5.04 -1.25 -4.58 117.35 131.44 1d2h s TYR 273 Ca 0.90 0.78 -0.03 0.00 -2.44 0.00 0.00 57.07 56.28 1d2h s TYR 273 Cb -0.41 -2.20 0.05 0.00 0.35 0.00 0.00 41.96 39.75 1d2h s TYR 273 CO 0.40 0.25 0.15 1.03 -1.34 0.00 0.00 175.55 176.05 1d2h s ARG 274 N -3.01 0.04 0.58 4.97 3.00 -1.26 -4.84 118.95 118.42 1d2h s ARG 274 Ca 0.46 0.53 -0.19 0.00 0.00 0.00 0.00 55.73 56.53 1d2h s ARG 274 Cb -0.11 -0.27 -0.06 0.00 0.00 0.00 0.00 34.95 34.51 1d2h s ARG 274 CO 0.24 -0.29 0.87 -2.30 0.00 0.00 0.00 175.30 173.82 1d2h n PRO 275 N 5.15 0.85 -2.54 3.54 -0.02 -1.26 -0.83 135.00 139.88 1d2h n PRO 275 Ca -0.08 0.33 -0.21 0.00 -2.02 0.00 0.00 63.50 61.52 1d2h n PRO 275 Cb 0.50 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1d2h n PRO 275 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1d2h n GLY 276 N 1.39 -0.51 3.99 -1.23 0.00 -1.26 -4.97 105.19 102.60 1d2h n GLY 276 Ca 0.13 0.03 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 1d2h n GLY 276 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1d2h s GLN 277 N -5.20 2.17 0.00 1.61 0.74 -0.01 -5.09 119.66 113.88 1d2h s GLN 277 Ca 0.07 -1.00 0.00 0.00 0.05 0.00 0.00 55.36 54.48 1d2h s GLN 277 Cb -0.03 -2.44 0.00 0.00 1.10 0.00 0.00 33.01 31.64 1d2h s GLN 277 CO 0.09 -1.02 0.09 0.00 -0.55 0.00 0.00 175.29 173.89 1d2h n ALA 278 N -2.53 0.00 -1.44 1.58 0.00 -1.26 -4.78 120.51 112.08 1d2h n ALA 278 Ca 0.11 0.00 -0.56 0.00 0.00 0.00 0.00 53.44 53.00 1d2h n ALA 278 Cb 0.60 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.96 1d2h n ALA 278 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1d2h n TYR 279 N -0.39 1.54 -2.45 0.00 4.19 -1.26 -4.86 117.16 113.94 1d2h n TYR 279 Ca 0.00 0.52 -0.43 0.00 3.31 0.00 0.00 57.90 61.30 1d2h n TYR 279 Cb 0.00 -2.43 -0.02 0.00 0.49 0.00 0.00 39.34 37.38 1d2h n TYR 279 CO 0.00 0.00 0.00 0.54 0.91 0.00 0.00 176.86 178.31 1d2h s VAL 280 N 6.06 4.07 0.00 2.97 0.11 -1.26 -5.00 120.40 127.34 1d2h s VAL 280 Ca 1.11 1.12 0.00 0.00 -2.93 0.00 0.00 61.98 61.28 1d2h s VAL 280 Cb -1.13 -4.32 0.00 0.00 -1.53 0.00 0.00 36.38 29.40 1d2h s VAL 280 CO 0.59 -0.76 0.00 -2.65 -3.33 0.00 0.00 175.10 168.95 1d2h n PRO 281 N 7.79 -0.53 0.00 1.54 -0.02 -1.26 -5.00 135.00 137.53 1d2h n PRO 281 Ca 0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 1d2h n PRO 281 Cb 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.96 1d2h n PRO 281 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1d2h s TYR 283 N 0.00 -0.30 0.19 0.00 1.51 -1.25 -1.46 117.35 116.03 1d2h s TYR 283 Ca 0.00 -0.66 -0.30 0.00 -1.01 0.00 0.00 57.07 55.10 1d2h s TYR 283 Cb 0.00 -0.45 -0.08 0.00 -0.11 0.00 0.00 41.96 41.32 1d2h s TYR 283 CO 0.00 -0.95 1.24 -0.06 -1.11 0.00 0.00 175.55 174.67 1d2h s PHE 284 N 1.71 3.36 -0.26 2.71 2.99 -0.72 -3.81 117.98 123.97 1d2h s PHE 284 Ca 0.15 1.36 0.03 0.00 0.00 0.00 0.00 56.93 58.46 1d2h s PHE 284 Cb -0.15 -3.49 0.06 0.00 0.00 0.00 0.00 43.02 39.43 1d2h s PHE 284 CO -0.13 -1.44 -0.11 0.42 -0.00 0.00 0.00 175.22 173.97 1d2h s ILE 285 N -0.03 2.11 -0.34 0.64 1.01 -0.63 -1.63 121.20 122.34 1d2h s ILE 285 Ca 0.54 -1.59 -0.17 0.00 0.00 0.00 0.00 60.65 59.43 1d2h s ILE 285 Cb -0.34 -2.23 -0.01 0.00 0.01 0.00 0.00 42.46 39.89 1d2h s ILE 285 CO 0.37 -0.02 0.46 -1.00 0.00 0.00 0.00 174.94 174.75 1d2h s HIS 286 N 1.13 3.20 -0.17 3.97 3.76 -0.30 -1.28 115.29 125.60 1d2h s HIS 286 Ca -0.08 0.14 -0.06 0.00 -0.15 0.00 0.00 55.06 54.90 1d2h s HIS 286 Cb -0.20 -2.82 -0.04 0.00 1.11 0.00 0.00 32.58 30.64 1d2h s HIS 286 CO -0.05 -0.48 0.04 0.54 -0.85 0.00 0.00 174.74 173.93 1d2h s VAL 287 N 2.25 4.60 -0.12 -0.90 0.11 0.10 -1.84 120.40 124.61 1d2h s VAL 287 Ca 0.16 -0.11 0.02 0.00 -2.93 0.00 0.00 61.98 59.13 1d2h s VAL 287 Cb -0.16 -3.05 0.01 0.00 -1.53 0.00 0.00 36.38 31.66 1d2h s VAL 287 CO 0.12 0.49 -0.17 -0.76 -3.33 0.00 0.00 175.10 171.45 1d2h s LEU 288 N 0.19 1.84 -1.01 2.54 2.01 -0.21 -1.93 118.68 122.11 1d2h s LEU 288 Ca 0.03 -0.49 -0.05 0.00 0.01 0.00 0.00 54.13 53.63 1d2h s LEU 288 Cb -0.13 -1.22 0.25 0.00 0.01 0.00 0.00 46.19 45.11 1d2h s LEU 288 CO 0.01 0.03 0.98 1.17 1.01 0.00 0.00 176.35 179.55 1d2h n LYS 289 N 4.23 3.17 -1.71 1.70 0.00 -0.66 -1.33 118.16 123.56 1d2h n LYS 289 Ca -0.19 -4.48 -0.60 0.00 0.00 0.00 0.00 58.31 53.04 1d2h n LYS 289 Cb 0.51 -2.48 -0.08 0.00 0.00 0.00 0.00 35.03 32.99 1d2h n LYS 289 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1d2h n LYS 290 N 2.37 0.88 -3.67 1.64 4.81 -0.59 -1.27 118.16 122.33 1d2h n LYS 290 Ca 0.23 0.32 -0.27 0.00 -0.87 0.00 0.00 58.31 57.72 1d2h n LYS 290 Cb 0.38 -1.96 -0.10 0.00 0.02 0.00 0.00 35.03 33.36 1d2h n LYS 290 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1d2h n THR 291 N 4.27 1.41 0.00 3.15 -2.24 -0.66 -0.11 114.28 120.09 1d2h n THR 291 Ca 0.27 -4.77 0.00 0.00 -2.27 0.00 0.00 64.05 57.28 1d2h n THR 291 Cb 0.09 -2.09 0.00 0.00 -2.10 0.00 0.00 70.33 66.23 1d2h n THR 291 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11