#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dm0 s GLU 2 N 0.00 0.50 0.36 1.97 -1.05 -1.26 -1.40 118.70 117.83 1dm0 s GLU 2 Ca 0.00 1.24 0.08 0.00 -0.15 0.00 0.00 54.97 56.14 1dm0 s GLU 2 Cb 0.00 0.53 -0.04 0.00 -0.44 0.00 0.00 34.13 34.18 1dm0 s GLU 2 CO 0.00 -0.21 0.18 -0.06 0.95 0.00 0.00 175.26 176.12 1dm0 s PHE 3 N 2.51 2.68 0.18 4.83 0.40 0.02 -4.94 117.98 123.67 1dm0 s PHE 3 Ca -0.05 -0.44 0.08 0.00 -0.60 0.00 0.00 56.93 55.91 1dm0 s PHE 3 Cb -0.11 -1.77 -0.04 0.00 0.51 0.00 0.00 43.02 41.61 1dm0 s PHE 3 CO -0.17 0.26 -0.05 0.99 0.70 0.00 0.00 175.22 176.95 1dm0 s THR 4 N -2.47 3.45 -0.33 0.64 2.01 -1.26 0.12 115.64 117.79 1dm0 s THR 4 Ca 0.40 -1.54 0.00 0.00 0.31 0.00 0.00 61.69 60.86 1dm0 s THR 4 Cb -0.01 -2.72 0.11 0.00 0.01 0.00 0.00 72.50 69.88 1dm0 s THR 4 CO 0.23 -0.11 0.11 -0.22 -0.69 0.00 0.00 174.62 173.95 1dm0 s LEU 5 N -2.87 2.75 -0.53 4.42 2.96 0.04 -4.76 118.68 120.69 1dm0 s LEU 5 Ca 0.26 -1.88 -0.22 0.00 -0.22 0.00 0.00 54.13 52.07 1dm0 s LEU 5 Cb -0.09 -1.02 0.05 0.00 0.50 0.00 0.00 46.19 45.62 1dm0 s LEU 5 CO 0.17 -0.39 0.83 -0.62 -1.32 0.00 0.00 176.35 175.02 1dm0 s ASP 6 N 1.30 6.30 -0.06 3.68 -1.08 -1.24 -0.98 116.67 124.60 1dm0 s ASP 6 Ca 0.11 -0.54 0.03 0.00 -0.52 0.00 0.00 52.55 51.63 1dm0 s ASP 6 Cb -0.19 -2.38 0.16 0.00 -1.46 0.00 0.00 42.92 39.05 1dm0 s ASP 6 CO -0.18 -1.10 0.84 0.49 0.52 0.00 0.00 175.17 175.73 1dm0 n PHE 7 N 7.00 0.47 0.00 -5.34 3.01 0.35 -2.37 117.46 120.57 1dm0 n PHE 7 Ca -0.01 -0.27 0.00 0.00 1.01 0.00 0.00 57.45 58.18 1dm0 n PHE 7 Cb 0.47 -0.22 0.00 0.00 -0.01 0.00 0.00 39.48 39.71 1dm0 n PHE 7 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1dm0 n SER 8 N 0.14 0.00 -4.73 4.37 7.64 -1.18 -4.64 113.62 115.22 1dm0 n SER 8 Ca 0.07 0.84 -0.24 0.00 1.01 0.00 0.00 58.87 60.55 1dm0 n SER 8 Cb 0.50 -0.34 -0.07 0.00 -1.01 0.00 0.00 64.21 63.29 1dm0 n SER 8 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1dm0 s THR 9 N -2.36 2.44 -0.66 0.44 -4.23 -1.26 -4.90 115.64 105.10 1dm0 s THR 9 Ca 0.00 -1.71 0.08 0.00 -1.18 0.00 0.00 61.69 58.88 1dm0 s THR 9 Cb 0.00 -2.98 0.08 0.00 1.34 0.00 0.00 72.50 70.94 1dm0 s THR 9 CO 0.00 -0.04 1.24 0.00 -0.54 0.00 0.00 174.62 175.28 1dm0 n ALA 10 N -1.21 0.99 -0.11 3.99 0.00 -1.26 -1.40 120.51 121.51 1dm0 n ALA 10 Ca -0.01 0.08 -0.20 0.00 0.00 0.00 0.00 53.44 53.30 1dm0 n ALA 10 Cb 0.64 -1.09 -0.12 0.00 0.00 0.00 0.00 19.45 18.88 1dm0 n ALA 10 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1dm0 n LYS 11 N -1.78 0.66 -0.30 0.00 4.81 -1.26 -3.22 118.16 117.07 1dm0 n LYS 11 Ca -0.01 0.20 -0.00 0.00 -0.87 0.00 0.00 58.31 57.63 1dm0 n LYS 11 Cb 0.03 -1.56 0.12 0.00 0.02 0.00 0.00 35.03 33.65 1dm0 n LYS 11 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 1dm0 h THR 12 N -0.17 1.06 0.63 3.15 1.35 -1.71 -0.27 112.91 116.95 1dm0 h THR 12 Ca -0.56 -0.33 -0.03 0.00 -0.55 0.00 0.00 66.41 64.94 1dm0 h THR 12 Cb 1.86 0.03 0.01 0.00 -1.73 0.00 0.00 68.15 68.31 1dm0 h THR 12 CO -0.11 0.17 -0.30 0.22 -0.25 0.00 0.00 175.52 175.25 1dm0 h TYR 13 N 0.95 -0.79 -0.34 4.73 3.20 -0.85 -2.12 116.97 121.75 1dm0 h TYR 13 Ca 0.35 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.18 1dm0 h TYR 13 Cb 0.13 0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.64 1dm0 h TYR 13 CO -0.04 -0.49 0.10 0.28 -1.64 0.00 0.00 178.16 176.37 1dm0 h VAL 14 N -1.03 1.16 -0.35 1.81 2.07 -1.53 -1.27 116.25 117.11 1dm0 h VAL 14 Ca -0.09 -0.53 0.01 0.00 0.82 0.00 0.00 66.70 66.91 1dm0 h VAL 14 Cb 0.65 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 1dm0 h VAL 14 CO 0.14 0.19 0.22 0.44 0.02 0.00 0.00 177.57 178.59 1dm0 h ASP 15 N 0.49 0.38 0.09 0.57 5.19 -1.03 0.11 116.42 122.22 1dm0 h ASP 15 Ca 0.12 -0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 56.52 1dm0 h ASP 15 Cb 0.17 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 39.59 1dm0 h ASP 15 CO -0.01 0.27 -0.05 0.28 -3.12 0.00 0.00 179.24 176.62 1dm0 h SER 16 N 0.45 -0.11 -1.00 6.45 0.02 -0.90 -1.73 113.55 116.74 1dm0 h SER 16 Ca 0.13 -0.14 0.20 0.00 -0.84 0.00 0.00 61.79 61.14 1dm0 h SER 16 Cb -0.03 0.03 -0.11 0.00 0.14 0.00 0.00 62.40 62.42 1dm0 h SER 16 CO -0.04 0.07 0.60 -0.07 -1.14 0.00 0.00 176.83 176.25 1dm0 h LEU 17 N -0.28 0.76 -1.04 5.07 3.38 -1.13 0.26 115.31 122.31 1dm0 h LEU 17 Ca -0.01 0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.97 1dm0 h LEU 17 Cb 0.24 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1dm0 h LEU 17 CO 0.02 0.24 -0.38 0.78 0.09 0.00 0.00 178.44 179.19 1dm0 h ASN 18 N 0.72 0.19 -0.32 -0.43 2.35 -0.50 -2.84 115.58 114.75 1dm0 h ASN 18 Ca 0.59 -0.07 0.00 0.00 -0.55 0.00 0.00 56.30 56.27 1dm0 h ASN 18 Cb 0.95 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 39.26 1dm0 h ASN 18 CO -0.40 0.56 0.21 0.58 -1.65 0.00 0.00 177.43 176.73 1dm0 h VAL 19 N 0.15 1.09 -0.66 2.81 2.07 0.39 -1.53 116.25 120.58 1dm0 h VAL 19 Ca 0.02 -0.18 -0.07 0.00 0.82 0.00 0.00 66.70 67.29 1dm0 h VAL 19 Cb 0.75 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 1dm0 h VAL 19 CO 0.06 0.09 0.15 0.40 0.02 0.00 0.00 177.57 178.29 1dm0 h ILE 20 N 0.43 1.26 -0.16 4.57 2.04 -1.37 -0.82 117.51 123.46 1dm0 h ILE 20 Ca 0.12 -0.96 -0.08 0.00 1.00 0.00 0.00 64.86 64.94 1dm0 h ILE 20 Cb -0.03 0.62 -0.00 0.00 -0.74 0.00 0.00 36.82 36.66 1dm0 h ILE 20 CO -0.02 0.36 -0.21 0.03 0.00 0.00 0.00 178.15 178.31 1dm0 h ARG 21 N 0.98 0.42 -0.59 2.37 3.08 -1.42 0.38 114.38 119.61 1dm0 h ARG 21 Ca 0.21 -0.24 0.02 0.00 0.07 0.00 0.00 59.98 60.04 1dm0 h ARG 21 Cb 0.38 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 1dm0 h ARG 21 CO 0.00 0.82 0.39 0.77 -1.07 0.00 0.00 179.97 180.89 1dm0 h SER 22 N 0.04 0.62 0.39 7.04 0.02 -1.28 -1.73 113.55 118.65 1dm0 h SER 22 Ca 0.02 -0.01 -0.23 0.00 -0.84 0.00 0.00 61.79 60.73 1dm0 h SER 22 Cb 0.77 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.17 1dm0 h SER 22 CO 0.05 0.43 -0.97 0.00 -1.14 0.00 0.00 176.83 175.20 1dm0 h ALA 23 N 1.65 0.34 -0.29 3.77 0.00 -0.85 -3.38 119.26 120.51 1dm0 h ALA 23 Ca 0.23 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1dm0 h ALA 23 Cb 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1dm0 h ALA 23 CO -0.06 0.84 0.00 0.44 0.00 0.00 0.00 179.25 180.47 1dm0 n ILE 24 N -3.71 0.66 -3.65 0.00 -5.35 0.10 -5.03 119.36 102.38 1dm0 n ILE 24 Ca -0.07 -0.83 -0.14 0.00 -0.27 0.00 0.00 62.75 61.44 1dm0 n ILE 24 Cb 0.86 0.77 -0.08 0.00 -1.74 0.00 0.00 39.64 39.44 1dm0 n ILE 24 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1dm0 s GLY 25 N -1.05 -0.45 0.09 3.28 0.00 -0.67 -3.12 107.32 105.40 1dm0 s GLY 25 Ca 0.25 1.55 0.03 0.00 0.00 0.00 0.00 44.72 46.55 1dm0 s GLY 25 CO 0.19 1.30 0.08 -0.51 0.00 0.00 0.00 173.10 174.15 1dm0 s THR 26 N -0.02 4.48 1.23 0.90 -4.23 -0.81 -4.55 115.64 112.64 1dm0 s THR 26 Ca -0.03 -0.82 -0.19 0.00 -1.18 0.00 0.00 61.69 59.48 1dm0 s THR 26 Cb -0.04 -3.17 0.30 0.00 1.34 0.00 0.00 72.50 70.93 1dm0 s THR 26 CO 0.02 0.10 1.05 -2.16 -0.54 0.00 0.00 174.62 173.10 1dm0 s PRO 27 N -2.45 -1.43 -0.20 3.99 0.04 -1.26 0.57 135.00 134.26 1dm0 s PRO 27 Ca 0.29 0.14 -0.04 0.00 0.04 0.00 0.00 61.00 61.43 1dm0 s PRO 27 Cb -0.12 -1.55 0.06 0.00 0.04 0.00 0.00 34.50 32.93 1dm0 s PRO 27 CO 0.22 -3.89 0.07 -0.51 0.04 0.00 0.00 177.00 172.92 1dm0 s LEU 28 N -7.14 0.81 0.13 -3.56 1.43 0.55 -4.63 118.68 106.26 1dm0 s LEU 28 Ca 0.69 -0.80 0.18 0.00 -1.03 0.00 0.00 54.13 53.18 1dm0 s LEU 28 Cb -0.13 -0.43 0.77 0.00 0.03 0.00 0.00 46.19 46.43 1dm0 s LEU 28 CO 0.58 -0.34 1.56 1.67 0.23 0.00 0.00 176.35 180.05 1dm0 n GLN 29 N 5.16 0.09 -0.19 1.70 7.27 -1.26 -1.86 117.38 128.29 1dm0 n GLN 29 Ca -0.08 0.35 -0.06 0.00 0.07 0.00 0.00 57.00 57.29 1dm0 n GLN 29 Cb 0.47 -1.68 0.10 0.00 2.41 0.00 0.00 30.24 31.54 1dm0 n GLN 29 CO 0.00 0.00 0.00 1.15 0.07 0.00 0.00 177.06 178.28 1dm0 h THR 30 N 0.00 1.25 -3.53 1.69 2.02 -1.94 -3.36 112.91 109.04 1dm0 h THR 30 Ca 0.00 -0.98 -0.70 0.00 0.77 0.00 0.00 66.41 65.51 1dm0 h THR 30 Cb 0.28 0.67 -0.35 0.00 -1.74 0.00 0.00 68.15 67.01 1dm0 h THR 30 CO 0.00 0.36 -0.39 -0.63 0.37 0.00 0.00 175.52 175.23 1dm0 s ILE 31 N -5.17 3.65 -0.12 3.11 1.09 -0.78 -4.90 121.20 118.08 1dm0 s ILE 31 Ca -0.11 -2.82 -0.10 0.00 -1.10 0.00 0.00 60.65 56.51 1dm0 s ILE 31 Cb 0.15 -3.40 0.03 0.00 -1.06 0.00 0.00 42.46 38.18 1dm0 s ILE 31 CO 0.83 -0.85 0.31 -0.55 -0.10 0.00 0.00 174.94 174.58 1dm0 s SER 32 N 0.86 -0.32 -0.23 3.58 0.15 -1.26 -1.61 113.70 114.87 1dm0 s SER 32 Ca 0.16 0.62 -0.19 0.00 0.70 0.00 0.00 55.95 57.24 1dm0 s SER 32 Cb -0.21 0.62 0.06 0.00 -1.71 0.00 0.00 66.02 64.78 1dm0 s SER 32 CO -0.03 -0.11 0.60 -0.55 1.20 0.00 0.00 173.24 174.34 1dm0 s SER 33 N 0.25 -0.68 -1.77 5.45 0.15 -0.69 -4.90 113.70 111.51 1dm0 s SER 33 Ca -0.01 1.23 0.00 0.00 0.70 0.00 0.00 55.95 57.88 1dm0 s SER 33 Cb -0.03 1.20 0.00 0.00 -1.71 0.00 0.00 66.02 65.49 1dm0 s SER 33 CO -0.00 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 174.83 1dm0 n GLY 34 N 3.23 1.00 2.19 9.45 0.00 -1.26 -1.58 105.19 118.23 1dm0 n GLY 34 Ca -0.16 -0.15 -0.05 0.00 0.00 0.00 0.00 46.02 45.65 1dm0 n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dm0 n GLY 35 N -0.87 0.79 3.59 -0.02 0.00 -1.26 -5.03 105.19 102.39 1dm0 n GLY 35 Ca -0.19 -0.68 -0.30 0.00 0.00 0.00 0.00 46.02 44.84 1dm0 n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dm0 s THR 36 N -2.16 3.47 0.11 2.61 2.01 -0.61 -5.13 115.64 115.93 1dm0 s THR 36 Ca 0.00 -1.11 0.04 0.00 0.31 0.00 0.00 61.69 60.93 1dm0 s THR 36 Cb 0.00 -2.59 -0.04 0.00 0.01 0.00 0.00 72.50 69.88 1dm0 s THR 36 CO 0.00 0.20 -0.10 -0.44 -0.69 0.00 0.00 174.62 173.59 1dm0 s SER 37 N -1.97 1.55 0.16 3.53 0.01 -1.26 -1.71 113.70 114.00 1dm0 s SER 37 Ca 0.20 -0.87 -0.28 0.00 1.31 0.00 0.00 55.95 56.31 1dm0 s SER 37 Cb -0.11 0.00 -0.07 0.00 0.21 0.00 0.00 66.02 66.05 1dm0 s SER 37 CO 0.12 -0.28 0.87 -0.22 0.41 0.00 0.00 173.24 174.14 1dm0 s LEU 38 N -2.65 4.57 -0.08 2.44 2.96 -0.63 -4.86 118.68 120.42 1dm0 s LEU 38 Ca 0.09 1.75 -0.00 0.00 -0.22 0.00 0.00 54.13 55.74 1dm0 s LEU 38 Cb -0.01 -3.46 -0.03 0.00 0.50 0.00 0.00 46.19 43.19 1dm0 s LEU 38 CO 0.00 0.09 -0.05 -0.76 -1.32 0.00 0.00 176.35 174.31 1dm0 s LEU 39 N -0.69 3.28 -0.08 -0.68 1.43 -0.90 -0.33 118.68 120.71 1dm0 s LEU 39 Ca 0.41 0.02 -0.01 0.00 -1.03 0.00 0.00 54.13 53.52 1dm0 s LEU 39 Cb -0.24 -1.73 -0.03 0.00 0.03 0.00 0.00 46.19 44.22 1dm0 s LEU 39 CO 0.28 0.35 -0.03 -0.32 0.23 0.00 0.00 176.35 176.87 1dm0 s MET 40 N -0.76 2.90 0.69 1.70 -2.45 0.19 -1.75 119.30 119.83 1dm0 s MET 40 Ca 0.12 -0.48 -0.11 0.00 -1.25 0.00 0.00 55.69 53.97 1dm0 s MET 40 Cb -0.11 -2.70 0.00 0.00 1.25 0.00 0.00 34.83 33.27 1dm0 s MET 40 CO 0.02 0.67 1.06 0.42 1.05 0.00 0.00 175.02 178.24 1dm0 s ILE 41 N -0.80 4.04 -0.28 10.11 1.01 0.16 -1.93 121.20 133.50 1dm0 s ILE 41 Ca 0.12 0.66 -0.03 0.00 0.00 0.00 0.00 60.65 61.41 1dm0 s ILE 41 Cb -0.11 -3.47 0.17 0.00 0.01 0.00 0.00 42.46 39.05 1dm0 s ILE 41 CO 0.02 -0.86 0.55 1.51 0.00 0.00 0.00 174.94 176.15 1dm0 s ASP 42 N -3.92 -0.96 0.31 3.58 -4.77 -1.18 -4.07 116.67 105.65 1dm0 s ASP 42 Ca 0.58 0.83 0.08 0.00 -3.30 0.00 0.00 52.55 50.74 1dm0 s ASP 42 Cb -0.13 1.92 -0.06 0.00 -1.09 0.00 0.00 42.92 43.56 1dm0 s ASP 42 CO 0.55 -0.26 -0.09 -0.62 0.70 0.00 0.00 175.17 175.44 1dm0 s ASP 47 N 2.79 3.30 0.00 2.11 2.15 -1.26 -4.87 116.67 120.89 1dm0 s ASP 47 Ca 0.15 -1.18 0.00 0.00 0.43 0.00 0.00 52.55 51.95 1dm0 s ASP 47 Cb -0.15 -0.27 0.00 0.00 -0.30 0.00 0.00 42.92 42.21 1dm0 s ASP 47 CO -0.19 -0.24 0.00 -0.46 -0.17 0.00 0.00 175.17 174.10 1dm0 n ASN 48 N -0.69 0.00 -4.30 -0.34 0.23 -1.26 -5.02 115.26 103.88 1dm0 n ASN 48 Ca -0.05 0.00 -0.21 0.00 -0.53 0.00 0.00 54.58 53.79 1dm0 n ASN 48 Cb 0.63 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.23 1dm0 n ASN 48 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1dm0 s LEU 49 N 0.00 1.94 -0.08 -4.53 1.43 -1.26 -0.84 118.68 115.34 1dm0 s LEU 49 Ca 0.00 -1.46 -0.30 0.00 -1.03 0.00 0.00 54.13 51.34 1dm0 s LEU 49 Cb 0.00 -0.16 0.10 0.00 0.03 0.00 0.00 46.19 46.16 1dm0 s LEU 49 CO 0.00 -0.74 0.85 0.72 0.23 0.00 0.00 176.35 177.41 1dm0 s PHE 50 N -3.43 -0.47 0.30 0.29 -0.12 -0.63 -4.87 117.98 109.06 1dm0 s PHE 50 Ca 0.34 0.71 0.02 0.00 -0.05 0.00 0.00 56.93 57.95 1dm0 s PHE 50 Cb 0.07 0.46 -0.03 0.00 -0.63 0.00 0.00 43.02 42.88 1dm0 s PHE 50 CO 0.15 -0.49 0.47 0.00 -0.05 0.00 0.00 175.22 175.30 1dm0 s ALA 51 N -1.60 3.79 -0.12 1.99 0.00 -0.50 -0.80 121.76 124.52 1dm0 s ALA 51 Ca -0.04 -1.02 -0.01 0.00 0.00 0.00 0.00 51.96 50.89 1dm0 s ALA 51 Cb -0.00 -1.97 0.03 0.00 0.00 0.00 0.00 23.12 21.18 1dm0 s ALA 51 CO 0.02 0.09 -0.02 0.08 0.00 0.00 0.00 175.76 175.93 1dm0 s VAL 52 N -2.18 0.69 -0.39 0.00 1.01 -0.80 -0.80 120.40 117.93 1dm0 s VAL 52 Ca 0.38 -0.21 -0.21 0.00 0.00 0.00 0.00 61.98 61.93 1dm0 s VAL 52 Cb -0.09 -0.87 0.01 0.00 0.00 0.00 0.00 36.38 35.43 1dm0 s VAL 52 CO 0.33 0.20 0.68 -1.81 0.00 0.00 0.00 175.10 174.50 1dm0 s ASP 53 N 1.83 6.41 0.29 3.32 1.01 0.33 -2.02 116.67 127.84 1dm0 s ASP 53 Ca 0.03 0.00 -0.29 0.00 0.71 0.00 0.00 52.55 53.00 1dm0 s ASP 53 Cb -0.14 -2.34 -0.10 0.00 1.01 0.00 0.00 42.92 41.36 1dm0 s ASP 53 CO -0.07 -0.71 1.17 -0.69 0.21 0.00 0.00 175.17 175.08 1dm0 s VAL 54 N 2.87 3.26 -0.29 -1.27 1.01 -1.17 -0.78 120.40 124.04 1dm0 s VAL 54 Ca 0.26 1.26 -0.16 0.00 0.00 0.00 0.00 61.98 63.34 1dm0 s VAL 54 Cb -0.14 -3.80 0.14 0.00 0.00 0.00 0.00 36.38 32.58 1dm0 s VAL 54 CO 0.17 0.30 0.94 -0.60 0.00 0.00 0.00 175.10 175.91 1dm0 s ARG 55 N -1.48 0.41 0.00 2.72 3.52 -0.15 -4.62 118.95 119.35 1dm0 s ARG 55 Ca 0.46 0.75 0.00 0.00 -0.13 0.00 0.00 55.73 56.81 1dm0 s ARG 55 Cb -0.34 0.14 0.00 0.00 -1.56 0.00 0.00 34.95 33.19 1dm0 s ARG 55 CO 0.44 -0.09 0.00 0.41 -0.81 0.00 0.00 175.30 175.25 1dm0 n GLY 56 N 3.95 1.84 0.25 8.12 0.00 -1.26 0.13 105.19 118.22 1dm0 n GLY 56 Ca -0.18 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.00 1dm0 n GLY 56 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1dm0 h ILE 57 N 0.00 0.00 -1.50 -0.61 5.03 -1.87 -3.12 117.51 115.45 1dm0 h ILE 57 Ca 0.00 -0.62 -0.30 0.00 -0.12 0.00 0.00 64.86 63.82 1dm0 h ILE 57 Cb 0.00 1.60 -0.24 0.00 -3.03 0.00 0.00 36.82 35.15 1dm0 h ILE 57 CO 0.00 0.00 -0.66 -0.62 -0.68 0.00 0.00 178.15 176.19 1dm0 s ASP 58 N -5.72 -0.36 0.50 1.72 -1.08 -1.26 -4.88 116.67 105.59 1dm0 s ASP 58 Ca 0.03 -2.10 0.25 0.00 -0.52 0.00 0.00 52.55 50.21 1dm0 s ASP 58 Cb 0.08 1.07 1.33 0.00 -1.46 0.00 0.00 42.92 43.93 1dm0 s ASP 58 CO 0.57 -0.11 1.93 1.55 0.52 0.00 0.00 175.17 179.62 1dm0 h PRO 59 N 5.45 0.12 0.73 4.34 0.14 -1.91 -1.45 132.00 139.42 1dm0 h PRO 59 Ca 0.13 -0.01 -0.03 0.00 0.14 0.00 0.00 66.00 66.23 1dm0 h PRO 59 Cb 1.05 -0.03 -0.00 0.00 0.14 0.00 0.00 31.00 32.15 1dm0 h PRO 59 CO 0.14 0.08 -0.46 1.49 0.14 0.00 0.00 178.00 179.39 1dm0 h GLU 60 N 0.13 -1.08 0.20 0.86 4.81 -1.96 -3.34 114.58 114.19 1dm0 h GLU 60 Ca 0.36 0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.66 1dm0 h GLU 60 Cb 1.25 0.25 0.00 0.00 0.63 0.00 0.00 28.75 30.88 1dm0 h GLU 60 CO -0.05 -0.72 -0.10 0.93 -0.73 0.00 0.00 179.01 178.34 1dm0 h GLU 61 N -1.12 -0.26 -0.20 1.92 3.07 -1.85 -3.48 114.58 112.65 1dm0 h GLU 61 Ca -0.10 0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.78 1dm0 h GLU 61 Cb 0.90 0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.87 1dm0 h GLU 61 CO 0.09 -0.18 0.00 0.41 -1.40 0.00 0.00 179.01 177.93 1dm0 n GLY 62 N -0.76 0.93 0.12 -3.84 0.00 -0.61 -5.02 105.19 96.01 1dm0 n GLY 62 Ca -0.03 -0.55 -0.18 0.00 0.00 0.00 0.00 46.02 45.26 1dm0 n GLY 62 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dm0 n ARG 63 N -0.80 0.71 -1.92 1.61 5.12 -1.26 -4.72 116.66 115.39 1dm0 n ARG 63 Ca 0.00 0.22 -0.42 0.00 -1.93 0.00 0.00 57.85 55.72 1dm0 n ARG 63 Cb 0.33 -1.66 -0.00 0.00 -1.16 0.00 0.00 32.46 29.98 1dm0 n ARG 63 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 1dm0 n PHE 64 N -3.30 3.21 0.23 -1.55 3.72 -1.26 -4.70 117.46 113.81 1dm0 n PHE 64 Ca -0.33 -2.91 0.05 0.00 -0.05 0.00 0.00 57.45 54.20 1dm0 n PHE 64 Cb 1.04 -2.31 0.06 0.00 -0.94 0.00 0.00 39.48 37.34 1dm0 n PHE 64 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1dm0 n ASN 65 N 4.96 2.04 -2.15 4.37 5.03 -1.26 -4.67 115.26 123.57 1dm0 n ASN 65 Ca 0.50 -1.55 -0.26 0.00 0.87 0.00 0.00 54.58 54.14 1dm0 n ASN 65 Cb 0.36 -0.05 0.11 0.00 -1.02 0.00 0.00 39.78 39.18 1dm0 n ASN 65 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1dm0 n ASN 66 N 0.46 5.74 -4.60 6.41 3.02 -1.26 -4.90 115.26 120.12 1dm0 n ASN 66 Ca 0.06 -3.51 -0.34 0.00 -0.03 0.00 0.00 54.58 50.76 1dm0 n ASN 66 Cb 0.27 -0.91 -0.11 0.00 -0.61 0.00 0.00 39.78 38.43 1dm0 n ASN 66 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1dm0 s LEU 67 N -3.11 3.36 -0.18 3.41 2.96 -1.26 -2.62 118.68 121.25 1dm0 s LEU 67 Ca 0.53 0.02 -0.07 0.00 -0.22 0.00 0.00 54.13 54.39 1dm0 s LEU 67 Cb 0.43 -1.77 0.08 0.00 0.50 0.00 0.00 46.19 45.43 1dm0 s LEU 67 CO 0.04 0.32 0.38 -0.60 -1.32 0.00 0.00 176.35 175.16 1dm0 s ARG 68 N -0.52 0.29 -0.20 1.98 3.52 -1.21 -3.06 118.95 119.75 1dm0 s ARG 68 Ca 0.08 0.92 -0.08 0.00 -0.13 0.00 0.00 55.73 56.52 1dm0 s ARG 68 Cb -0.12 0.18 -0.04 0.00 -1.56 0.00 0.00 34.95 33.41 1dm0 s ARG 68 CO 0.02 -0.24 0.08 -0.51 -0.81 0.00 0.00 175.30 173.84 1dm0 s LEU 69 N 2.34 3.86 -0.19 -0.88 1.43 -0.86 -0.40 118.68 123.98 1dm0 s LEU 69 Ca -0.02 0.07 -0.24 0.00 -1.03 0.00 0.00 54.13 52.91 1dm0 s LEU 69 Cb -0.11 -1.99 -0.02 0.00 0.03 0.00 0.00 46.19 44.10 1dm0 s LEU 69 CO -0.12 0.14 0.76 -0.63 0.23 0.00 0.00 176.35 176.74 1dm0 s ILE 70 N 0.58 4.92 0.07 -0.59 -1.09 -0.69 -1.90 121.20 122.51 1dm0 s ILE 70 Ca 0.04 1.47 0.09 0.00 -2.23 0.00 0.00 60.65 60.02 1dm0 s ILE 70 Cb -0.13 -4.07 -0.03 0.00 -1.58 0.00 0.00 42.46 36.65 1dm0 s ILE 70 CO 0.01 0.04 -0.22 -0.69 -1.23 0.00 0.00 174.94 172.85 1dm0 s VAL 71 N 2.16 2.53 -0.34 2.92 1.01 0.02 -2.79 120.40 125.91 1dm0 s VAL 71 Ca 0.35 -1.40 -0.13 0.00 0.00 0.00 0.00 61.98 60.80 1dm0 s VAL 71 Cb -0.16 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.13 1dm0 s VAL 71 CO 0.11 0.26 0.24 -0.70 0.00 0.00 0.00 175.10 175.02 1dm0 s GLU 72 N -1.61 3.48 0.14 2.72 -6.30 -0.35 -1.60 118.70 115.18 1dm0 s GLU 72 Ca 0.14 -0.65 -0.29 0.00 -2.50 0.00 0.00 54.97 51.67 1dm0 s GLU 72 Cb -0.10 -3.81 -0.04 0.00 0.00 0.00 0.00 34.13 30.17 1dm0 s GLU 72 CO 0.05 -0.45 1.57 -0.09 0.02 0.00 0.00 175.26 176.36 1dm0 h ARG 73 N 8.49 -0.38 -0.74 4.30 2.43 -1.32 0.84 114.38 127.99 1dm0 h ARG 73 Ca -0.31 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.88 1dm0 h ARG 73 Cb 1.16 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 30.76 1dm0 h ARG 73 CO 0.64 -0.26 0.46 -0.91 -1.51 0.00 0.00 179.97 178.39 1dm0 h ASN 74 N -0.40 0.87 -0.01 -3.80 2.35 -1.89 -3.28 115.58 109.42 1dm0 h ASN 74 Ca 0.10 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1dm0 h ASN 74 Cb 0.61 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.76 1dm0 h ASN 74 CO -0.53 0.66 -0.23 0.59 -1.65 0.00 0.00 177.43 176.26 1dm0 n ASN 75 N -4.54 1.74 -2.96 5.81 3.02 -1.19 -4.81 115.26 112.35 1dm0 n ASN 75 Ca 0.07 -1.37 -0.22 0.00 -0.03 0.00 0.00 54.58 53.03 1dm0 n ASN 75 Cb 0.04 0.35 0.04 0.00 -0.61 0.00 0.00 39.78 39.60 1dm0 n ASN 75 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1dm0 n LEU 76 N 0.11 -2.71 -4.74 3.41 4.77 0.28 -4.98 117.00 113.15 1dm0 n LEU 76 Ca 0.07 -0.29 -0.41 0.00 -0.03 0.00 0.00 56.01 55.35 1dm0 n LEU 76 Cb 0.34 -2.92 -0.03 0.00 -2.33 0.00 0.00 43.42 38.48 1dm0 n LEU 76 CO 0.17 0.25 0.89 -0.31 -1.33 0.00 0.00 177.39 177.06 1dm0 s TYR 77 N -3.17 3.40 -1.00 -1.77 2.02 -1.24 -4.76 117.35 110.83 1dm0 s TYR 77 Ca 0.31 1.42 -0.13 0.00 -0.37 0.00 0.00 57.07 58.30 1dm0 s TYR 77 Cb -0.14 -3.45 0.22 0.00 -0.40 0.00 0.00 41.96 38.19 1dm0 s TYR 77 CO 0.38 -1.26 1.04 0.08 -1.57 0.00 0.00 175.55 174.22 1dm0 s VAL 78 N -0.14 5.53 -0.38 0.71 1.01 -1.26 -1.21 120.40 124.65 1dm0 s VAL 78 Ca 0.53 -2.69 0.09 0.00 0.00 0.00 0.00 61.98 59.90 1dm0 s VAL 78 Cb -0.33 -4.63 0.09 0.00 0.00 0.00 0.00 36.38 31.50 1dm0 s VAL 78 CO 0.38 -1.25 1.17 0.35 0.00 0.00 0.00 175.10 175.75 1dm0 n THR 79 N 3.86 1.11 -0.82 3.92 -2.24 -1.12 -4.88 114.28 114.11 1dm0 n THR 79 Ca 0.22 0.63 0.00 0.00 -2.27 0.00 0.00 64.05 62.63 1dm0 n THR 79 Cb 0.44 -1.63 0.00 0.00 -2.10 0.00 0.00 70.33 67.04 1dm0 n THR 79 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dm0 n GLY 80 N -1.32 -0.29 3.14 3.38 0.00 -1.25 -1.73 105.19 107.12 1dm0 n GLY 80 Ca -0.01 -1.66 -0.28 0.00 0.00 0.00 0.00 46.02 44.07 1dm0 n GLY 80 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1dm0 s PHE 81 N -1.91 1.98 0.21 1.61 -0.71 -0.80 -1.70 117.98 116.67 1dm0 s PHE 81 Ca 0.00 -0.73 -0.17 0.00 -1.04 0.00 0.00 56.93 55.00 1dm0 s PHE 81 Cb 0.00 -1.36 -0.08 0.00 -1.21 0.00 0.00 43.02 40.37 1dm0 s PHE 81 CO 0.00 -0.30 0.66 0.08 -1.34 0.00 0.00 175.22 174.32 1dm0 s VAL 82 N 0.35 4.69 -0.80 -2.49 1.01 0.46 -0.81 120.40 122.81 1dm0 s VAL 82 Ca -0.13 1.06 0.02 0.00 0.00 0.00 0.00 61.98 62.92 1dm0 s VAL 82 Cb -0.16 -3.77 0.23 0.00 0.00 0.00 0.00 36.38 32.68 1dm0 s VAL 82 CO 0.05 0.15 0.80 -3.20 0.00 0.00 0.00 175.10 172.91 1dm0 n ASN 83 N 0.56 4.11 0.21 3.32 2.85 -0.13 -3.32 115.26 122.86 1dm0 n ASN 83 Ca -0.02 -3.29 0.00 0.00 -0.11 0.00 0.00 54.58 51.16 1dm0 n ASN 83 Cb 0.52 -0.90 0.00 0.00 1.24 0.00 0.00 39.78 40.64 1dm0 n ASN 83 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1dm0 n ARG 84 N 1.64 0.02 0.01 1.20 5.12 -1.08 0.75 116.66 124.32 1dm0 n ARG 84 Ca 0.24 0.61 -0.18 0.00 -1.93 0.00 0.00 57.85 56.60 1dm0 n ARG 84 Cb 0.37 -1.83 -0.07 0.00 -1.16 0.00 0.00 32.46 29.77 1dm0 n ARG 84 CO 0.00 0.00 0.00 1.15 -1.93 0.00 0.00 177.63 176.85 1dm0 h THR 85 N 0.00 1.29 0.00 0.55 2.02 -1.92 -3.35 112.91 111.50 1dm0 h THR 85 Ca 0.00 -2.09 0.00 0.00 0.77 0.00 0.00 66.41 65.09 1dm0 h THR 85 Cb 1.38 2.13 0.00 0.00 -1.74 0.00 0.00 68.15 69.92 1dm0 h THR 85 CO 0.00 0.65 0.00 -0.46 0.37 0.00 0.00 175.52 176.08 1dm0 n ASN 86 N -3.89 1.25 -2.67 4.18 0.23 0.23 -5.00 115.26 109.59 1dm0 n ASN 86 Ca -0.08 -1.25 -0.18 0.00 -0.53 0.00 0.00 54.58 52.53 1dm0 n ASN 86 Cb 0.79 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.49 1dm0 n ASN 86 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1dm0 n ASN 87 N -0.12 -4.95 -4.69 0.53 4.13 0.23 -4.87 115.26 105.52 1dm0 n ASN 87 Ca 0.00 -0.04 -0.37 0.00 1.68 0.00 0.00 54.58 55.85 1dm0 n ASN 87 Cb 0.06 -4.11 -0.08 0.00 -1.54 0.00 0.00 39.78 34.11 1dm0 n ASN 87 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1dm0 s VAL 88 N -2.90 5.30 -0.27 2.41 1.01 -1.26 -2.04 120.40 122.66 1dm0 s VAL 88 Ca 0.11 0.47 -0.15 0.00 0.00 0.00 0.00 61.98 62.41 1dm0 s VAL 88 Cb -0.05 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 1dm0 s VAL 88 CO 0.14 0.34 0.38 0.12 0.00 0.00 0.00 175.10 176.08 1dm0 s PHE 89 N 0.86 3.25 -0.41 5.22 5.36 -0.25 -0.96 117.98 131.05 1dm0 s PHE 89 Ca 0.14 0.42 -0.14 0.00 -0.96 0.00 0.00 56.93 56.40 1dm0 s PHE 89 Cb -0.13 -2.57 0.03 0.00 -0.34 0.00 0.00 43.02 40.00 1dm0 s PHE 89 CO 0.05 -0.22 0.28 0.71 -1.46 0.00 0.00 175.22 174.58 1dm0 s TYR 90 N 2.05 3.25 0.10 10.12 1.51 0.01 -1.88 117.35 132.51 1dm0 s TYR 90 Ca 0.15 -0.78 -0.02 0.00 -1.01 0.00 0.00 57.07 55.42 1dm0 s TYR 90 Cb -0.16 -2.63 -0.05 0.00 -0.11 0.00 0.00 41.96 39.02 1dm0 s TYR 90 CO 0.10 -0.64 0.28 -0.98 -1.11 0.00 0.00 175.55 173.20 1dm0 s ARG 91 N 1.63 3.51 0.55 -0.62 1.70 -0.83 -1.91 118.95 122.99 1dm0 s ARG 91 Ca 0.04 -0.30 -0.19 0.00 -0.47 0.00 0.00 55.73 54.81 1dm0 s ARG 91 Cb -0.20 -2.96 -0.06 0.00 -0.57 0.00 0.00 34.95 31.17 1dm0 s ARG 91 CO 0.08 0.55 1.14 -0.06 -1.08 0.00 0.00 175.30 175.93 1dm0 s PHE 92 N -1.58 2.63 0.02 5.89 0.08 -0.70 -1.35 117.98 122.96 1dm0 s PHE 92 Ca 0.38 1.54 0.15 0.00 0.12 0.00 0.00 56.93 59.12 1dm0 s PHE 92 Cb -0.13 -3.33 0.83 0.00 -0.57 0.00 0.00 43.02 39.83 1dm0 s PHE 92 CO 0.27 -1.68 1.39 0.00 -0.10 0.00 0.00 175.22 175.09 1dm0 h ALA 93 N 1.17 1.17 -0.01 5.36 0.00 -0.63 0.26 119.26 126.58 1dm0 h ALA 93 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1dm0 h ALA 93 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1dm0 h ALA 93 CO 0.57 -0.17 -0.04 -0.40 0.00 0.00 0.00 179.25 179.20 1dm0 n ASP 94 N -2.13 1.35 -2.05 0.00 5.75 -1.26 -3.91 116.55 114.29 1dm0 n ASP 94 Ca -0.01 -1.36 -0.17 0.00 -0.01 0.00 0.00 54.79 53.24 1dm0 n ASP 94 Cb 0.28 0.02 0.04 0.00 -1.03 0.00 0.00 41.12 40.43 1dm0 n ASP 94 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 1dm0 n PHE 95 N -0.03 2.21 0.35 2.11 3.72 0.91 -4.87 117.46 121.86 1dm0 n PHE 95 Ca 0.18 -2.12 0.03 0.00 -0.05 0.00 0.00 57.45 55.49 1dm0 n PHE 95 Cb 0.34 -0.31 0.17 0.00 -0.94 0.00 0.00 39.48 38.75 1dm0 n PHE 95 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1dm0 n SER 96 N -0.70 0.00 0.00 4.37 2.88 -1.24 -0.70 113.62 118.23 1dm0 n SER 96 Ca 0.34 -0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.84 1dm0 n SER 96 Cb 0.92 -0.11 0.00 0.00 -0.75 0.00 0.00 64.21 64.27 1dm0 n SER 96 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1dm0 n HIS 97 N -1.11 0.00 -2.40 0.66 8.25 -1.26 -5.02 115.22 114.34 1dm0 n HIS 97 Ca 0.04 -0.13 -0.33 0.00 -0.26 0.00 0.00 57.72 57.04 1dm0 n HIS 97 Cb 0.03 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.10 1dm0 n HIS 97 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1dm0 s VAL 98 N -0.26 4.25 0.00 1.59 1.01 0.12 -5.06 120.40 122.05 1dm0 s VAL 98 Ca 0.00 1.16 -0.14 0.00 0.00 0.00 0.00 61.98 63.01 1dm0 s VAL 98 Cb 0.00 -3.59 0.02 0.00 0.00 0.00 0.00 36.38 32.81 1dm0 s VAL 98 CO 0.00 -0.53 0.29 -0.89 0.00 0.00 0.00 175.10 173.96 1dm0 s THR 99 N -2.44 0.07 -0.08 3.92 2.01 -1.26 -5.05 115.64 112.81 1dm0 s THR 99 Ca 0.61 -0.55 0.02 0.00 0.31 0.00 0.00 61.69 62.09 1dm0 s THR 99 Cb -0.12 -0.67 0.01 0.00 0.01 0.00 0.00 72.50 71.73 1dm0 s THR 99 CO 0.28 -0.30 -0.13 0.12 -0.69 0.00 0.00 174.62 173.90 1dm0 s PHE 100 N -1.61 1.63 0.24 4.92 5.36 -1.26 -5.04 117.98 122.21 1dm0 s PHE 100 Ca -0.12 -0.65 -0.29 0.00 -0.96 0.00 0.00 56.93 54.91 1dm0 s PHE 100 Cb -0.04 -1.19 -0.15 0.00 -0.34 0.00 0.00 43.02 41.30 1dm0 s PHE 100 CO 0.02 -0.34 0.95 -2.30 -1.46 0.00 0.00 175.22 172.10 1dm0 n PRO 101 N 3.93 1.00 -1.29 10.12 -0.02 -1.26 -2.44 135.00 145.04 1dm0 n PRO 101 Ca -0.21 0.35 -0.03 0.00 -2.02 0.00 0.00 63.50 61.59 1dm0 n PRO 101 Cb 0.52 -1.68 -0.01 0.00 -0.02 0.00 0.00 33.50 32.30 1dm0 n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dm0 n GLY 102 N 1.57 0.54 3.19 -1.23 0.00 -1.26 -5.04 105.19 102.98 1dm0 n GLY 102 Ca 0.13 -0.90 -0.10 0.00 0.00 0.00 0.00 46.02 45.15 1dm0 n GLY 102 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1dm0 s THR 103 N -2.12 0.12 0.41 2.61 -4.23 -1.02 -4.93 115.64 106.48 1dm0 s THR 103 Ca 0.00 -1.02 -0.00 0.00 -1.18 0.00 0.00 61.69 59.49 1dm0 s THR 103 Cb 0.00 -1.11 -0.02 0.00 1.34 0.00 0.00 72.50 72.71 1dm0 s THR 103 CO 0.00 -0.56 0.63 0.42 -0.54 0.00 0.00 174.62 174.57 1dm0 s THR 104 N -3.16 4.58 0.08 3.99 -4.23 -0.87 -4.80 115.64 111.24 1dm0 s THR 104 Ca -0.00 -0.42 0.10 0.00 -1.18 0.00 0.00 61.69 60.19 1dm0 s THR 104 Cb 0.02 -3.69 -0.03 0.00 1.34 0.00 0.00 72.50 70.14 1dm0 s THR 104 CO -0.07 -0.48 -0.26 0.00 -0.54 0.00 0.00 174.62 173.27 1dm0 s ALA 105 N -2.47 2.34 -0.12 3.99 0.00 -1.26 -1.10 121.76 123.15 1dm0 s ALA 105 Ca 0.44 -1.35 -0.05 0.00 0.00 0.00 0.00 51.96 51.01 1dm0 s ALA 105 Cb -0.10 -0.46 0.06 0.00 0.00 0.00 0.00 23.12 22.62 1dm0 s ALA 105 CO 0.38 0.54 0.26 0.08 0.00 0.00 0.00 175.76 177.01 1dm0 s VAL 106 N -0.92 -0.29 -0.22 0.00 1.01 -0.79 -4.91 120.40 114.28 1dm0 s VAL 106 Ca 0.13 0.24 -0.21 0.00 0.00 0.00 0.00 61.98 62.14 1dm0 s VAL 106 Cb -0.10 -0.42 -0.02 0.00 0.00 0.00 0.00 36.38 35.84 1dm0 s VAL 106 CO 0.04 0.10 0.66 -0.89 0.00 0.00 0.00 175.10 175.01 1dm0 s THR 107 N 2.06 4.98 0.49 3.92 2.01 -1.26 -1.96 115.64 125.88 1dm0 s THR 107 Ca -0.02 1.24 -0.20 0.00 0.31 0.00 0.00 61.69 63.02 1dm0 s THR 107 Cb -0.11 -3.97 -0.09 0.00 0.01 0.00 0.00 72.50 68.34 1dm0 s THR 107 CO -0.08 0.06 1.03 -0.76 -0.69 0.00 0.00 174.62 174.17 1dm0 s LEU 108 N 2.21 3.83 0.05 4.42 1.43 -0.46 -4.70 118.68 125.46 1dm0 s LEU 108 Ca 0.29 1.88 0.20 0.00 -1.03 0.00 0.00 54.13 55.47 1dm0 s LEU 108 Cb -0.16 -4.55 0.82 0.00 0.03 0.00 0.00 46.19 42.33 1dm0 s LEU 108 CO 0.10 -0.74 1.62 -1.54 0.23 0.00 0.00 176.35 176.01 1dm0 n SER 109 N -1.00 0.14 -4.43 2.29 3.41 -0.89 -3.20 113.62 109.94 1dm0 n SER 109 Ca 0.09 0.53 -0.23 0.00 -0.26 0.00 0.00 58.87 59.00 1dm0 n SER 109 Cb 0.53 -0.56 -0.10 0.00 -0.26 0.00 0.00 64.21 63.82 1dm0 n SER 109 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1dm0 s GLY 110 N -3.11 1.73 0.71 5.00 0.00 -1.26 -4.83 107.32 105.56 1dm0 s GLY 110 Ca 0.08 -1.79 -0.02 0.00 0.00 0.00 0.00 44.72 43.00 1dm0 s GLY 110 CO 0.36 -1.87 0.97 2.09 0.00 0.00 0.00 173.10 174.65 1dm0 n ASP 111 N -0.45 1.14 -0.03 1.64 5.75 -1.26 -0.31 116.55 123.02 1dm0 n ASP 111 Ca -0.07 -2.00 0.13 0.00 -0.01 0.00 0.00 54.79 52.84 1dm0 n ASP 111 Cb 0.60 -0.64 0.39 0.00 -1.03 0.00 0.00 41.12 40.43 1dm0 n ASP 111 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1dm0 n SER 112 N -3.01 0.43 -4.45 -1.12 3.41 -1.26 -4.65 113.62 102.97 1dm0 n SER 112 Ca 0.15 -0.17 -0.37 0.00 -0.26 0.00 0.00 58.87 58.22 1dm0 n SER 112 Cb 0.55 0.03 0.05 0.00 -0.26 0.00 0.00 64.21 64.58 1dm0 n SER 112 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1dm0 n SER 113 N -1.36 -1.26 0.16 4.04 3.41 -1.26 -4.79 113.62 112.57 1dm0 n SER 113 Ca 0.07 0.66 0.02 0.00 -0.26 0.00 0.00 58.87 59.36 1dm0 n SER 113 Cb 0.33 -1.18 0.27 0.00 -0.26 0.00 0.00 64.21 63.37 1dm0 n SER 113 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 1dm0 h TYR 114 N -0.05 0.00 -0.52 7.33 0.05 -1.98 -1.62 116.97 120.19 1dm0 h TYR 114 Ca -0.45 0.00 0.10 0.00 0.05 0.00 0.00 58.73 58.43 1dm0 h TYR 114 Cb 1.38 0.00 -0.09 0.00 1.01 0.00 0.00 36.73 39.03 1dm0 h TYR 114 CO 0.32 0.49 -0.00 1.15 -1.05 0.00 0.00 178.16 179.07 1dm0 h THR 115 N 0.00 0.59 0.10 -2.88 2.02 -1.98 0.70 112.91 111.46 1dm0 h THR 115 Ca -0.00 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 67.13 1dm0 h THR 115 Cb 0.93 0.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1dm0 h THR 115 CO 0.06 0.02 -0.05 0.74 0.37 0.00 0.00 175.52 176.67 1dm0 h THR 116 N 0.11 0.96 -0.74 3.16 2.02 -1.88 -2.11 112.91 114.43 1dm0 h THR 116 Ca 0.26 -1.38 0.18 0.00 0.77 0.00 0.00 66.41 66.24 1dm0 h THR 116 Cb 0.40 1.68 -0.04 0.00 -1.74 0.00 0.00 68.15 68.45 1dm0 h THR 116 CO -0.44 0.28 0.51 -0.07 0.37 0.00 0.00 175.52 176.17 1dm0 h LEU 117 N -0.90 0.20 0.00 2.58 3.38 -0.98 0.34 115.31 119.93 1dm0 h LEU 117 Ca -0.01 0.01 -0.24 0.00 0.09 0.00 0.00 57.88 57.74 1dm0 h LEU 117 Cb 0.55 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 1dm0 h LEU 117 CO 0.02 0.10 -1.23 1.56 0.09 0.00 0.00 178.44 178.98 1dm0 h GLN 118 N 0.21 0.00 0.90 1.13 4.20 0.35 -2.07 115.11 119.83 1dm0 h GLN 118 Ca 0.36 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 59.03 1dm0 h GLN 118 Cb 1.12 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.91 1dm0 h GLN 118 CO -0.07 0.83 -0.43 -0.09 -0.67 0.00 0.00 178.83 178.39 1dm0 h ARG 119 N 0.00 -1.17 0.86 1.46 2.43 0.28 -2.13 114.38 116.12 1dm0 h ARG 119 Ca -0.10 0.08 -0.04 0.00 -0.81 0.00 0.00 59.98 59.11 1dm0 h ARG 119 Cb 1.85 0.27 0.00 0.00 -0.42 0.00 0.00 29.97 31.66 1dm0 h ARG 119 CO 0.11 -0.77 -0.49 0.28 -1.51 0.00 0.00 179.97 177.59 1dm0 h VAL 120 N -1.30 0.00 0.00 0.20 2.07 -1.01 -2.28 116.25 113.94 1dm0 h VAL 120 Ca -0.12 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1dm0 h VAL 120 Cb 0.93 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.70 1dm0 h VAL 120 CO 0.20 0.00 0.15 0.00 0.02 0.00 0.00 177.57 177.94 1dm0 h ALA 121 N -1.26 1.11 -4.69 1.67 0.00 -1.49 -3.41 119.26 111.19 1dm0 h ALA 121 Ca -0.12 0.00 -0.40 0.00 0.00 0.00 0.00 54.91 54.40 1dm0 h ALA 121 Cb 0.99 0.00 0.08 0.00 0.00 0.00 0.00 17.79 18.86 1dm0 h ALA 121 CO 0.15 -0.11 -0.61 0.41 0.00 0.00 0.00 179.25 179.09 1dm0 n GLY 122 N -1.26 -0.49 3.10 0.00 0.00 -0.82 -4.79 105.19 100.92 1dm0 n GLY 122 Ca -0.01 0.14 -0.08 0.00 0.00 0.00 0.00 46.02 46.07 1dm0 n GLY 122 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1dm0 s ILE 123 N -3.21 0.30 -0.08 -0.61 -4.36 -1.07 -5.05 121.20 107.12 1dm0 s ILE 123 Ca 0.37 -1.76 -0.01 0.00 -0.26 0.00 0.00 60.65 58.98 1dm0 s ILE 123 Cb -0.16 -1.45 -0.03 0.00 1.25 0.00 0.00 42.46 42.06 1dm0 s ILE 123 CO 0.45 -0.94 -0.02 -0.55 0.24 0.00 0.00 174.94 174.13 1dm0 s SER 124 N -2.83 5.05 0.24 4.36 0.15 -1.26 -4.58 113.70 114.84 1dm0 s SER 124 Ca 0.06 0.09 -0.07 0.00 0.70 0.00 0.00 55.95 56.74 1dm0 s SER 124 Cb 0.06 -1.38 0.24 0.00 -1.71 0.00 0.00 66.02 63.24 1dm0 s SER 124 CO -0.08 0.37 1.92 0.03 1.20 0.00 0.00 173.24 176.68 1dm0 h ARG 125 N 5.18 1.27 -5.86 5.44 3.08 -1.97 -3.36 114.38 118.17 1dm0 h ARG 125 Ca -0.50 -0.08 -0.52 0.00 0.07 0.00 0.00 59.98 58.95 1dm0 h ARG 125 Cb 1.19 -0.29 -0.00 0.00 0.08 0.00 0.00 29.97 30.95 1dm0 h ARG 125 CO 0.54 0.84 1.52 0.99 -1.07 0.00 0.00 179.97 182.79 1dm0 s THR 126 N -6.12 3.09 0.00 2.04 2.01 -1.26 0.13 115.64 115.53 1dm0 s THR 126 Ca -0.13 0.08 0.00 0.00 0.31 0.00 0.00 61.69 61.95 1dm0 s THR 126 Cb 0.18 -3.18 0.00 0.00 0.01 0.00 0.00 72.50 69.51 1dm0 s THR 126 CO 0.81 -0.15 0.00 0.61 -0.69 0.00 0.00 174.62 175.21 1dm0 n GLY 127 N 5.83 0.66 3.75 4.40 0.00 0.25 -4.99 105.19 115.09 1dm0 n GLY 127 Ca 0.31 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.92 1dm0 n GLY 127 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1dm0 s MET 128 N -0.64 4.15 0.11 1.61 0.00 0.12 -4.38 119.30 120.26 1dm0 s MET 128 Ca 0.00 2.53 -0.01 0.00 0.00 0.00 0.00 55.69 58.20 1dm0 s MET 128 Cb 0.00 -3.03 -0.05 0.00 0.00 0.00 0.00 34.83 31.75 1dm0 s MET 128 CO 0.00 -0.58 0.29 -0.65 0.00 0.00 0.00 175.02 174.07 1dm0 s GLN 129 N -0.63 3.51 -0.15 4.11 -0.21 -1.25 -0.16 119.66 124.88 1dm0 s GLN 129 Ca 0.62 -0.33 -0.08 0.00 0.02 0.00 0.00 55.36 55.59 1dm0 s GLN 129 Cb -0.47 -2.95 0.06 0.00 1.00 0.00 0.00 33.01 30.65 1dm0 s GLN 129 CO 0.48 0.54 0.35 0.42 -2.12 0.00 0.00 175.29 174.96 1dm0 s ILE 130 N -1.61 -0.09 0.22 1.08 1.01 0.92 -4.96 121.20 117.78 1dm0 s ILE 130 Ca 0.37 0.12 0.03 0.00 0.00 0.00 0.00 60.65 61.18 1dm0 s ILE 130 Cb -0.12 -0.53 -0.01 0.00 0.01 0.00 0.00 42.46 41.80 1dm0 s ILE 130 CO 0.27 0.05 0.23 -0.46 0.00 0.00 0.00 174.94 175.03 1dm0 n ASN 131 N 4.38 -0.59 -0.22 3.58 0.23 -1.26 -0.55 115.26 120.82 1dm0 n ASN 131 Ca -0.22 -2.37 0.03 0.00 -0.53 0.00 0.00 54.58 51.49 1dm0 n ASN 131 Cb 0.54 1.27 0.28 0.00 -2.08 0.00 0.00 39.78 39.79 1dm0 n ASN 131 CO 0.00 0.00 0.00 -0.09 -0.93 0.00 0.00 177.26 176.24 1dm0 h ARG 132 N 0.00 0.90 0.31 -3.83 2.43 -1.95 -1.80 114.38 110.44 1dm0 h ARG 132 Ca -0.16 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 58.94 1dm0 h ARG 132 Cb 0.78 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 1dm0 h ARG 132 CO 0.23 0.60 -0.15 1.25 -1.51 0.00 0.00 179.97 180.39 1dm0 h HIS 133 N 0.93 -0.39 -1.03 2.20 2.76 -1.95 -0.02 115.15 117.64 1dm0 h HIS 133 Ca 0.31 -0.01 0.26 0.00 -2.20 0.00 0.00 60.37 58.73 1dm0 h HIS 133 Cb 0.07 0.13 -0.11 0.00 1.55 0.00 0.00 27.41 29.05 1dm0 h HIS 133 CO -0.00 -0.24 0.64 0.66 -1.30 0.00 0.00 177.93 177.69 1dm0 h SER 134 N -0.48 0.54 -0.43 3.26 4.64 -1.95 0.23 113.55 119.36 1dm0 h SER 134 Ca -0.04 0.10 -0.12 0.00 -0.47 0.00 0.00 61.79 61.26 1dm0 h SER 134 Cb 0.32 0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 62.41 1dm0 h SER 134 CO 0.07 0.10 -0.18 -0.07 -0.87 0.00 0.00 176.83 175.88 1dm0 h LEU 135 N 0.47 0.93 0.64 5.97 3.38 -1.20 0.73 115.31 126.24 1dm0 h LEU 135 Ca 0.62 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 58.23 1dm0 h LEU 135 Cb 1.40 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 41.90 1dm0 h LEU 135 CO -0.37 1.09 -0.31 0.74 0.09 0.00 0.00 178.44 179.68 1dm0 h THR 136 N 0.81 0.25 -0.82 0.22 2.02 0.13 -0.70 112.91 114.82 1dm0 h THR 136 Ca 0.12 -0.26 0.20 0.00 0.77 0.00 0.00 66.41 67.23 1dm0 h THR 136 Cb 0.73 0.32 -0.13 0.00 -1.74 0.00 0.00 68.15 67.32 1dm0 h THR 136 CO 0.06 0.03 0.14 0.74 0.37 0.00 0.00 175.52 176.85 1dm0 h THR 137 N -1.06 0.34 -0.23 3.16 2.02 -0.71 -0.30 112.91 116.13 1dm0 h THR 137 Ca -0.09 -0.06 -0.06 0.00 0.77 0.00 0.00 66.41 66.97 1dm0 h THR 137 Cb 0.70 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1dm0 h THR 137 CO 0.14 0.03 -0.14 0.28 0.37 0.00 0.00 175.52 176.20 1dm0 h SER 138 N 0.17 0.37 -0.39 4.18 0.02 0.78 -2.67 113.55 116.02 1dm0 h SER 138 Ca 0.48 -0.09 -0.05 0.00 -0.84 0.00 0.00 61.79 61.29 1dm0 h SER 138 Cb 0.91 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.34 1dm0 h SER 138 CO -0.65 0.54 0.05 0.22 -1.14 0.00 0.00 176.83 175.85 1dm0 h TYR 139 N 0.36 0.70 -0.12 3.45 5.03 0.49 -2.95 116.97 123.93 1dm0 h TYR 139 Ca 0.07 -0.10 -0.00 0.00 2.58 0.00 0.00 58.73 61.27 1dm0 h TYR 139 Cb 0.47 -0.19 -0.01 0.00 1.55 0.00 0.00 36.73 38.55 1dm0 h TYR 139 CO 0.01 0.70 0.06 -0.07 -1.32 0.00 0.00 178.16 177.54 1dm0 h LEU 140 N 0.49 0.15 -2.42 2.82 3.38 -1.25 -1.66 115.31 116.82 1dm0 h LEU 140 Ca 0.12 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.00 1dm0 h LEU 140 Cb 0.39 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 1dm0 h LEU 140 CO 0.01 0.21 0.07 0.44 0.09 0.00 0.00 178.44 179.26 1dm0 h ASP 141 N 0.08 0.00 0.38 -0.43 3.32 -1.42 -0.99 116.42 117.36 1dm0 h ASP 141 Ca 0.04 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 56.80 1dm0 h ASP 141 Cb 0.10 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.66 1dm0 h ASP 141 CO -0.01 0.00 -1.24 -0.07 -1.72 0.00 0.00 179.24 176.20 1dm0 h LEU 142 N 0.00 0.65 -0.82 1.55 3.38 -1.31 -3.02 115.31 115.74 1dm0 h LEU 142 Ca 0.03 -0.64 -0.11 0.00 0.09 0.00 0.00 57.88 57.25 1dm0 h LEU 142 Cb 0.17 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1dm0 h LEU 142 CO -0.00 1.47 -0.53 0.24 0.09 0.00 0.00 178.44 179.72 1dm0 h MET 143 N 0.17 0.00 -0.02 1.13 2.86 -0.28 -2.68 114.93 116.12 1dm0 h MET 143 Ca -0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.48 1dm0 h MET 143 Cb 1.93 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.59 1dm0 h MET 143 CO 0.22 0.53 -0.19 0.45 1.06 0.00 0.00 176.91 178.98 1dm0 n SER 144 N -3.70 1.71 -4.69 1.22 2.88 -0.53 -4.86 113.62 105.65 1dm0 n SER 144 Ca -0.01 -1.39 -0.42 0.00 -1.33 0.00 0.00 58.87 55.72 1dm0 n SER 144 Cb 0.58 0.15 -0.03 0.00 -0.75 0.00 0.00 64.21 64.16 1dm0 n SER 144 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 1dm0 s HIS 145 N -2.27 3.30 0.01 0.66 5.04 -1.01 -4.99 115.29 116.03 1dm0 s HIS 145 Ca 0.28 1.31 0.05 0.00 -1.54 0.00 0.00 55.06 55.16 1dm0 s HIS 145 Cb 0.20 -3.37 -0.02 0.00 0.04 0.00 0.00 32.58 29.43 1dm0 s HIS 145 CO 0.44 -1.06 -0.15 -1.54 -2.34 0.00 0.00 174.74 170.09 1dm0 s SER 146 N 1.34 1.74 0.00 9.88 1.04 -1.26 -5.04 113.70 121.40 1dm0 s SER 146 Ca 0.55 -0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.62 1dm0 s SER 146 Cb -0.24 -0.16 0.00 0.00 0.10 0.00 0.00 66.02 65.72 1dm0 s SER 146 CO 0.23 0.12 0.00 0.61 0.98 0.00 0.00 173.24 175.17 1dm0 n GLY 147 N 2.32 1.65 0.08 7.32 0.00 -1.26 -4.95 105.19 110.35 1dm0 n GLY 147 Ca -0.16 -2.21 -0.12 0.00 0.00 0.00 0.00 46.02 43.53 1dm0 n GLY 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dm0 h THR 148 N 0.30 0.75 -3.12 2.61 1.03 -1.97 -3.47 112.91 109.04 1dm0 h THR 148 Ca 0.00 -1.73 -0.58 0.00 -0.01 0.00 0.00 66.41 64.08 1dm0 h THR 148 Cb 0.00 1.59 0.14 0.00 -1.07 0.00 0.00 68.15 68.82 1dm0 h THR 148 CO 0.00 0.26 0.05 -1.54 -0.01 0.00 0.00 175.52 174.27 1dm0 n SER 149 N -4.58 0.73 -4.37 0.00 3.41 -1.26 -2.09 113.62 105.45 1dm0 n SER 149 Ca -0.15 0.94 -0.46 0.00 -0.26 0.00 0.00 58.87 58.94 1dm0 n SER 149 Cb 0.41 -1.32 -0.03 0.00 -0.26 0.00 0.00 64.21 63.01 1dm0 n SER 149 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1dm0 s LEU 150 N -0.57 5.97 0.80 1.04 2.96 -1.26 -4.66 118.68 122.96 1dm0 s LEU 150 Ca 0.67 -2.14 -0.12 0.00 -0.22 0.00 0.00 54.13 52.32 1dm0 s LEU 150 Cb -0.51 -2.28 0.07 0.00 0.50 0.00 0.00 46.19 43.97 1dm0 s LEU 150 CO 0.54 -0.85 1.10 0.28 -1.32 0.00 0.00 176.35 176.11 1dm0 s THR 151 N 1.52 2.97 0.50 3.68 -1.32 -1.26 -4.85 115.64 116.88 1dm0 s THR 151 Ca 0.18 0.31 0.17 0.00 -1.21 0.00 0.00 61.69 61.15 1dm0 s THR 151 Cb -0.14 -3.10 0.30 0.00 -1.51 0.00 0.00 72.50 68.05 1dm0 s THR 151 CO -0.04 -0.41 2.09 -0.61 -2.21 0.00 0.00 174.62 173.43 1dm0 h GLN 152 N -1.08 0.11 -0.09 7.08 4.15 -1.95 0.24 115.11 123.57 1dm0 h GLN 152 Ca -0.47 -0.01 -0.18 0.00 0.77 0.00 0.00 58.65 58.76 1dm0 h GLN 152 Cb 1.28 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.94 1dm0 h GLN 152 CO 0.60 0.07 -0.71 1.03 -1.93 0.00 0.00 178.83 177.89 1dm0 h SER 153 N 0.11 0.50 0.50 -0.69 0.87 -1.93 -1.89 113.55 111.02 1dm0 h SER 153 Ca 0.10 -0.32 -0.26 0.00 -1.23 0.00 0.00 61.79 60.08 1dm0 h SER 153 Cb 0.28 -0.15 0.01 0.00 -0.44 0.00 0.00 62.40 62.10 1dm0 h SER 153 CO -0.01 1.05 -1.17 0.58 -0.53 0.00 0.00 176.83 176.75 1dm0 h VAL 154 N 0.29 1.45 0.25 2.23 2.07 -1.72 -3.25 116.25 117.57 1dm0 h VAL 154 Ca -0.03 -2.83 -0.01 0.00 0.82 0.00 0.00 66.70 64.66 1dm0 h VAL 154 Cb 1.28 2.78 -0.01 0.00 -1.52 0.00 0.00 31.29 33.83 1dm0 h VAL 154 CO 0.12 0.83 -0.26 0.00 0.02 0.00 0.00 177.57 178.29 1dm0 h ALA 155 N 0.59 -0.95 -0.98 1.67 0.00 -0.96 -1.60 119.26 117.04 1dm0 h ALA 155 Ca -0.13 -0.10 0.28 0.00 0.00 0.00 0.00 54.91 54.96 1dm0 h ALA 155 Cb 1.86 0.50 -0.05 0.00 0.00 0.00 0.00 17.79 20.10 1dm0 h ALA 155 CO 0.20 -0.97 0.69 0.00 0.00 0.00 0.00 179.25 179.17 1dm0 h ARG 156 N -0.51 0.07 0.00 0.00 3.08 -1.48 -1.49 114.38 114.05 1dm0 h ARG 156 Ca -0.03 -0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.85 1dm0 h ARG 156 Cb 0.44 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.45 1dm0 h ARG 156 CO -0.03 0.04 -0.94 0.00 -1.07 0.00 0.00 179.97 177.97 1dm0 h ALA 157 N 1.53 0.59 0.06 0.04 0.00 -1.53 -2.76 119.26 117.19 1dm0 h ALA 157 Ca 0.48 -0.76 -0.28 0.00 0.00 0.00 0.00 54.91 54.35 1dm0 h ALA 157 Cb 1.78 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.57 1dm0 h ALA 157 CO -0.05 0.95 -1.42 0.52 0.00 0.00 0.00 179.25 179.25 1dm0 h MET 158 N 0.00 0.13 -0.07 0.00 2.86 -0.58 -2.12 114.93 115.15 1dm0 h MET 158 Ca -0.07 -0.22 0.03 0.00 -2.06 0.00 0.00 59.70 57.38 1dm0 h MET 158 Cb 1.59 0.08 -0.03 0.00 0.06 0.00 0.00 31.60 33.31 1dm0 h MET 158 CO 0.08 0.96 -0.09 -0.07 1.06 0.00 0.00 176.91 178.85 1dm0 h LEU 159 N 0.04 -0.28 -0.62 1.22 3.38 -1.36 0.28 115.31 117.97 1dm0 h LEU 159 Ca -0.19 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 1dm0 h LEU 159 Cb 1.95 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 42.80 1dm0 h LEU 159 CO 0.14 -0.13 0.28 0.03 0.09 0.00 0.00 178.44 178.85 1dm0 h ARG 160 N -0.13 0.90 0.00 1.13 3.08 -1.49 -2.50 114.38 115.38 1dm0 h ARG 160 Ca 0.06 -0.15 -0.15 0.00 0.07 0.00 0.00 59.98 59.81 1dm0 h ARG 160 Cb 0.21 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 1dm0 h ARG 160 CO -0.14 0.74 -0.77 0.74 -1.07 0.00 0.00 179.97 179.47 1dm0 h PHE 161 N 0.85 0.00 -0.01 3.04 0.04 -1.17 -2.92 116.94 116.77 1dm0 h PHE 161 Ca 0.21 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.88 1dm0 h PHE 161 Cb 0.15 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.29 1dm0 h PHE 161 CO 0.00 0.69 -0.46 0.28 -0.60 0.00 0.00 178.31 178.23 1dm0 h VAL 162 N 0.00 1.33 -0.17 -0.55 2.07 -0.40 -2.50 116.25 116.03 1dm0 h VAL 162 Ca -0.02 -1.57 -0.06 0.00 0.82 0.00 0.00 66.70 65.86 1dm0 h VAL 162 Cb 1.55 1.84 -0.00 0.00 -1.52 0.00 0.00 31.29 33.15 1dm0 h VAL 162 CO 0.09 0.45 -0.14 0.74 0.02 0.00 0.00 177.57 178.72 1dm0 h THR 163 N 0.02 1.33 0.00 2.57 2.02 -1.33 -1.43 112.91 116.09 1dm0 h THR 163 Ca -0.00 -1.28 0.00 0.00 0.77 0.00 0.00 66.41 65.90 1dm0 h THR 163 Cb 0.81 1.79 0.00 0.00 -1.74 0.00 0.00 68.15 69.01 1dm0 h THR 163 CO 0.06 0.38 -0.28 1.33 0.37 0.00 0.00 175.52 177.38 1dm0 n VAL 164 N -4.53 0.16 0.00 3.16 0.24 -1.11 -1.42 118.33 114.82 1dm0 n VAL 164 Ca -0.06 -0.09 0.00 0.00 -2.04 0.00 0.00 64.34 62.15 1dm0 n VAL 164 Cb 0.36 -0.20 0.00 0.00 -1.47 0.00 0.00 33.84 32.53 1dm0 n VAL 164 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1dm0 n THR 165 N -1.73 0.00 -0.02 3.34 -1.04 -0.94 -4.50 114.28 109.39 1dm0 n THR 165 Ca 0.06 0.23 -0.16 0.00 -2.04 0.00 0.00 64.05 62.13 1dm0 n THR 165 Cb 0.37 -1.21 -0.09 0.00 -1.82 0.00 0.00 70.33 67.59 1dm0 n THR 165 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1dm0 h ALA 166 N -2.00 0.18 0.82 2.41 0.00 -1.47 -0.75 119.26 118.45 1dm0 h ALA 166 Ca 0.00 -0.52 -0.04 0.00 0.00 0.00 0.00 54.91 54.35 1dm0 h ALA 166 Cb 0.00 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.80 1dm0 h ALA 166 CO 0.00 0.39 -0.39 0.93 0.00 0.00 0.00 179.25 180.17 1dm0 h GLU 167 N 0.10 -1.06 -1.01 0.00 4.39 -1.45 -1.35 114.58 114.20 1dm0 h GLU 167 Ca -0.04 0.07 0.26 0.00 0.34 0.00 0.00 59.36 59.99 1dm0 h GLU 167 Cb 1.18 0.24 -0.07 0.00 -0.10 0.00 0.00 28.75 30.00 1dm0 h GLU 167 CO 0.11 -0.70 0.68 0.00 -1.16 0.00 0.00 179.01 177.93 1dm0 h ALA 168 N -1.47 2.47 0.20 3.43 0.00 -1.38 0.14 119.26 122.65 1dm0 h ALA 168 Ca -0.11 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1dm0 h ALA 168 Cb 0.84 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1dm0 h ALA 168 CO 0.18 -0.82 -0.10 1.25 0.00 0.00 0.00 179.25 179.77 1dm0 h LEU 169 N 0.27 -0.23 -0.75 0.00 5.85 -0.88 -3.19 115.31 116.38 1dm0 h LEU 169 Ca 0.53 -0.09 -0.12 0.00 0.84 0.00 0.00 57.88 59.05 1dm0 h LEU 169 Cb 1.59 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.66 1dm0 h LEU 169 CO -0.17 -0.05 -0.29 0.03 -0.34 0.00 0.00 178.44 177.62 1dm0 h ARG 170 N -0.40 0.63 -5.04 1.25 3.08 0.12 -3.41 114.38 110.62 1dm0 h ARG 170 Ca -0.03 -0.27 -0.67 0.00 0.07 0.00 0.00 59.98 59.08 1dm0 h ARG 170 Cb 0.30 -0.02 -0.35 0.00 0.08 0.00 0.00 29.97 29.98 1dm0 h ARG 170 CO 0.04 0.85 -0.85 -0.06 -1.07 0.00 0.00 179.97 178.88 1dm0 s PHE 171 N -4.46 2.84 0.46 3.04 0.08 0.29 -2.25 117.98 117.98 1dm0 s PHE 171 Ca -0.08 -1.72 0.14 0.00 0.12 0.00 0.00 56.93 55.39 1dm0 s PHE 171 Cb 0.13 -1.92 1.06 0.00 -0.57 0.00 0.00 43.02 41.71 1dm0 s PHE 171 CO 0.82 -0.81 2.04 -0.09 -0.10 0.00 0.00 175.22 177.07 1dm0 h ARG 172 N 7.92 0.05 0.00 0.44 2.43 -1.18 -1.84 114.38 122.20 1dm0 h ARG 172 Ca -0.43 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 58.71 1dm0 h ARG 172 Cb 1.13 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.67 1dm0 h ARG 172 CO 0.62 0.15 -0.11 0.37 -1.51 0.00 0.00 179.97 179.49 1dm0 h GLN 173 N 0.05 0.00 0.01 0.20 4.15 -1.20 -2.54 115.11 115.78 1dm0 h GLN 173 Ca 0.01 0.00 -0.34 0.00 0.77 0.00 0.00 58.65 59.09 1dm0 h GLN 173 Cb 0.21 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 27.85 1dm0 h GLN 173 CO 0.01 0.11 -2.05 -0.89 -1.93 0.00 0.00 178.83 174.08 1dm0 n ILE 174 N -3.30 1.54 -0.17 2.39 5.41 -0.71 -3.54 119.36 120.98 1dm0 n ILE 174 Ca -0.00 -0.78 -0.08 0.00 1.00 0.00 0.00 62.75 62.89 1dm0 n ILE 174 Cb 0.34 -0.95 0.01 0.00 -0.71 0.00 0.00 39.64 38.34 1dm0 n ILE 174 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 1dm0 h GLN 175 N 0.01 0.70 -0.43 0.38 4.15 -1.48 -1.90 115.11 116.53 1dm0 h GLN 175 Ca -0.42 -0.10 -0.01 0.00 0.77 0.00 0.00 58.65 58.89 1dm0 h GLN 175 Cb 2.09 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 29.63 1dm0 h GLN 175 CO 0.05 0.59 0.25 -0.09 -1.93 0.00 0.00 178.83 177.69 1dm0 h ARG 176 N 0.64 0.59 0.00 1.69 2.43 -1.61 0.34 114.38 118.46 1dm0 h ARG 176 Ca 0.17 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.25 1dm0 h ARG 176 Cb 0.12 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1dm0 h ARG 176 CO -0.02 0.45 -0.14 0.78 -1.51 0.00 0.00 179.97 179.54 1dm0 h GLY 177 N 0.56 0.00 0.54 2.80 0.00 -1.59 -3.28 103.07 102.11 1dm0 h GLY 177 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 47.14 1dm0 h GLY 177 CO -0.03 0.00 -2.04 0.33 0.00 0.00 0.00 176.54 174.80 1dm0 n PHE 178 N -3.22 0.78 -0.35 5.60 7.35 -0.72 -4.52 117.46 122.38 1dm0 n PHE 178 Ca 0.01 0.21 -0.07 0.00 -0.76 0.00 0.00 57.45 56.84 1dm0 n PHE 178 Cb 0.44 -1.12 -0.04 0.00 0.35 0.00 0.00 39.48 39.11 1dm0 n PHE 178 CO 0.00 0.00 0.00 -0.09 -0.76 0.00 0.00 176.76 175.91 1dm0 h ARG 179 N 0.03 -0.07 -0.67 -4.13 2.43 -0.39 -2.55 114.38 109.03 1dm0 h ARG 179 Ca -0.42 0.00 0.15 0.00 -0.81 0.00 0.00 59.98 58.90 1dm0 h ARG 179 Cb 2.04 0.02 -0.13 0.00 -0.42 0.00 0.00 29.97 31.48 1dm0 h ARG 179 CO 0.05 -0.05 -0.12 2.41 -1.51 0.00 0.00 179.97 180.75 1dm0 n THR 180 N -5.36 -0.28 0.17 0.20 -1.04 -1.26 -0.87 114.28 105.84 1dm0 n THR 180 Ca 0.04 1.51 0.17 0.00 -2.04 0.00 0.00 64.05 63.73 1dm0 n THR 180 Cb 0.33 -2.12 0.78 0.00 -1.82 0.00 0.00 70.33 67.49 1dm0 n THR 180 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1dm0 h THR 181 N 0.00 0.58 0.00 12.58 2.02 -1.74 -1.35 112.91 125.01 1dm0 h THR 181 Ca 0.34 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.52 1dm0 h THR 181 Cb 0.57 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 67.82 1dm0 h THR 181 CO -0.67 0.00 0.00 0.18 0.37 0.00 0.00 175.52 175.40 1dm0 n LEU 182 N -4.00 0.00 0.00 2.58 4.77 -0.04 -4.66 117.00 115.64 1dm0 n LEU 182 Ca 0.03 0.34 0.00 0.00 -0.03 0.00 0.00 56.01 56.35 1dm0 n LEU 182 Cb 0.36 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 1dm0 n LEU 182 CO 0.30 -0.08 0.05 0.47 -1.33 0.00 0.00 177.39 176.80 1dm0 n ASP 183 N -1.34 0.20 -4.47 -1.43 9.92 -0.51 -4.23 116.55 114.69 1dm0 n ASP 183 Ca 0.09 -0.53 -0.38 0.00 -0.53 0.00 0.00 54.79 53.45 1dm0 n ASP 183 Cb 0.20 0.37 -0.12 0.00 -0.64 0.00 0.00 41.12 40.93 1dm0 n ASP 183 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 1dm0 s SER 189 N -0.37 5.51 0.22 -2.24 0.15 -1.26 -5.08 113.70 110.62 1dm0 s SER 189 Ca 0.00 -0.33 -0.31 0.00 0.70 0.00 0.00 55.95 56.01 1dm0 s SER 189 Cb 0.00 -2.00 -0.10 0.00 -1.71 0.00 0.00 66.02 62.21 1dm0 s SER 189 CO 0.00 -0.12 1.49 -0.47 1.20 0.00 0.00 173.24 175.34 1dm0 s TYR 190 N 1.64 3.03 -0.21 3.44 5.04 0.28 -4.78 117.35 125.79 1dm0 s TYR 190 Ca 0.06 0.87 -0.01 0.00 -2.44 0.00 0.00 57.07 55.55 1dm0 s TYR 190 Cb -0.16 -3.87 0.02 0.00 0.35 0.00 0.00 41.96 38.30 1dm0 s TYR 190 CO 0.06 -2.97 -0.12 0.08 -1.34 0.00 0.00 175.55 171.26 1dm0 s VAL 191 N 0.44 2.57 -0.55 3.14 1.01 -1.26 -0.05 120.40 125.69 1dm0 s VAL 191 Ca 0.63 -0.92 -0.27 0.00 0.00 0.00 0.00 61.98 61.42 1dm0 s VAL 191 Cb -0.43 -2.20 0.03 0.00 0.00 0.00 0.00 36.38 33.79 1dm0 s VAL 191 CO 0.39 0.38 1.12 -0.32 0.00 0.00 0.00 175.10 176.67 1dm0 s MET 192 N 1.33 3.51 1.14 2.72 1.75 0.77 -4.93 119.30 125.58 1dm0 s MET 192 Ca 0.03 0.19 -0.17 0.00 -1.25 0.00 0.00 55.69 54.48 1dm0 s MET 192 Cb -0.15 -4.00 0.26 0.00 2.84 0.00 0.00 34.83 33.78 1dm0 s MET 192 CO -0.08 -1.57 1.11 0.95 -0.65 0.00 0.00 175.02 174.78 1dm0 s THR 193 N 4.62 1.73 0.08 10.11 -4.23 -1.26 0.85 115.64 127.54 1dm0 s THR 193 Ca 0.41 0.00 -0.10 0.00 -1.18 0.00 0.00 61.69 60.82 1dm0 s THR 193 Cb -0.09 -2.50 -0.26 0.00 1.34 0.00 0.00 72.50 70.99 1dm0 s THR 193 CO 0.25 0.00 1.17 0.00 -0.54 0.00 0.00 174.62 175.50 1dm0 h ALA 194 N -2.36 0.11 -0.27 3.99 0.00 -1.94 -1.92 119.26 116.87 1dm0 h ALA 194 Ca -0.48 -0.78 0.06 0.00 0.00 0.00 0.00 54.91 53.71 1dm0 h ALA 194 Cb 1.30 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 1dm0 h ALA 194 CO 0.41 0.78 0.19 0.93 0.00 0.00 0.00 179.25 181.56 1dm0 h GLU 195 N 0.22 0.07 0.12 0.00 3.07 -2.01 -0.41 114.58 115.65 1dm0 h GLU 195 Ca -0.15 -0.00 -0.26 0.00 -0.50 0.00 0.00 59.36 58.45 1dm0 h GLU 195 Cb 1.84 -0.02 0.03 0.00 -0.84 0.00 0.00 28.75 29.76 1dm0 h GLU 195 CO 0.21 0.05 -1.08 -0.44 -1.40 0.00 0.00 179.01 176.34 1dm0 h ASP 196 N 0.07 0.74 -0.28 1.42 5.19 -1.89 -3.17 116.42 118.51 1dm0 h ASP 196 Ca 0.12 -0.85 0.02 0.00 -0.62 0.00 0.00 57.03 55.71 1dm0 h ASP 196 Cb 0.40 -0.24 -0.03 0.00 0.18 0.00 0.00 39.33 39.65 1dm0 h ASP 196 CO -0.01 1.52 0.12 0.58 -3.12 0.00 0.00 179.24 178.33 1dm0 h VAL 197 N 0.07 0.95 -0.93 -1.35 2.07 -0.31 -2.37 116.25 114.39 1dm0 h VAL 197 Ca -0.17 -0.09 0.24 0.00 0.82 0.00 0.00 66.70 67.50 1dm0 h VAL 197 Cb 1.80 0.68 -0.13 0.00 -1.52 0.00 0.00 31.29 32.12 1dm0 h VAL 197 CO 0.21 0.05 0.45 0.44 0.02 0.00 0.00 177.57 178.74 1dm0 h ASP 198 N 0.25 0.42 0.16 0.57 3.32 -1.27 -1.45 116.42 118.43 1dm0 h ASP 198 Ca 0.12 0.15 -0.01 0.00 0.02 0.00 0.00 57.03 57.32 1dm0 h ASP 198 Cb 0.07 0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1dm0 h ASP 198 CO -0.11 0.01 -0.08 0.25 -1.72 0.00 0.00 179.24 177.59 1dm0 h LEU 199 N 0.43 -0.18 -1.17 1.55 5.85 -1.40 -2.43 115.31 117.95 1dm0 h LEU 199 Ca 0.60 -0.07 0.07 0.00 0.84 0.00 0.00 57.88 59.31 1dm0 h LEU 199 Cb 1.16 0.05 -0.06 0.00 0.37 0.00 0.00 40.66 42.17 1dm0 h LEU 199 CO -0.53 -0.04 0.58 0.71 -0.34 0.00 0.00 178.44 178.82 1dm0 h THR 200 N -0.31 1.05 0.00 1.05 1.35 -1.05 0.75 112.91 115.76 1dm0 h THR 200 Ca -0.02 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.50 1dm0 h THR 200 Cb 0.24 -0.03 0.00 0.00 -1.73 0.00 0.00 68.15 66.64 1dm0 h THR 200 CO 0.04 0.18 0.00 -0.07 -0.25 0.00 0.00 175.52 175.42 1dm0 h LEU 201 N 0.99 0.00 -3.05 3.87 3.38 -1.29 -3.15 115.31 116.06 1dm0 h LEU 201 Ca 0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.35 1dm0 h LEU 201 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1dm0 h LEU 201 CO -0.14 0.00 0.00 0.59 0.09 0.00 0.00 178.44 178.98 1dm0 n ASN 202 N -2.52 3.34 -0.07 -0.43 3.02 0.26 -4.77 115.26 114.09 1dm0 n ASN 202 Ca 0.00 -2.44 -0.07 0.00 -0.03 0.00 0.00 54.58 52.04 1dm0 n ASN 202 Cb 0.17 -0.37 -0.01 0.00 -0.61 0.00 0.00 39.78 38.96 1dm0 n ASN 202 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 1dm0 h TRP 203 N 1.91 -0.28 -0.43 3.10 7.01 -1.49 -1.42 115.95 124.36 1dm0 h TRP 203 Ca 0.00 0.03 -0.08 0.00 2.11 0.00 0.00 58.89 60.94 1dm0 h TRP 203 Cb 1.04 0.17 -0.02 0.00 -2.10 0.00 0.00 29.16 28.25 1dm0 h TRP 203 CO 0.35 -0.18 -0.08 0.78 -2.79 0.00 0.00 178.44 176.51 1dm0 h GLY 204 N -0.07 0.80 1.47 2.65 0.00 -1.86 -2.47 103.07 103.59 1dm0 h GLY 204 Ca 0.14 -0.58 -0.26 0.00 0.00 0.00 0.00 47.33 46.63 1dm0 h GLY 204 CO -0.33 0.53 -1.13 3.21 0.00 0.00 0.00 176.54 178.83 1dm0 h ARG 205 N 0.68 0.44 -0.42 4.80 3.08 -1.85 -2.57 114.38 118.54 1dm0 h ARG 205 Ca 0.12 -0.58 0.04 0.00 0.07 0.00 0.00 59.98 59.63 1dm0 h ARG 205 Cb 0.54 0.19 -0.04 0.00 0.08 0.00 0.00 29.97 30.74 1dm0 h ARG 205 CO 0.03 1.23 0.20 -0.07 -1.07 0.00 0.00 179.97 180.29 1dm0 h LEU 206 N 0.20 0.28 -1.79 3.04 3.38 -1.33 -1.79 115.31 117.32 1dm0 h LEU 206 Ca -0.13 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 1dm0 h LEU 206 Cb 1.80 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 42.52 1dm0 h LEU 206 CO 0.20 0.21 -0.09 0.28 0.09 0.00 0.00 178.44 179.12 1dm0 h SER 207 N 0.41 0.01 0.18 -0.43 0.02 -1.43 0.48 113.55 112.79 1dm0 h SER 207 Ca 0.18 -0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.89 1dm0 h SER 207 Cb 0.10 -0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.65 1dm0 h SER 207 CO -0.14 0.11 -0.97 0.28 -1.14 0.00 0.00 176.83 174.97 1dm0 h SER 208 N 0.02 0.70 0.00 3.07 0.02 -1.13 -3.39 113.55 112.84 1dm0 h SER 208 Ca 0.00 -0.56 -0.03 0.00 -0.84 0.00 0.00 61.79 60.37 1dm0 h SER 208 Cb 0.18 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.50 1dm0 h SER 208 CO 0.01 1.35 -0.22 0.58 -1.14 0.00 0.00 176.83 177.42 1dm0 h VAL 209 N 0.31 0.73 -0.74 2.27 2.07 -0.67 -3.40 116.25 116.82 1dm0 h VAL 209 Ca -0.10 -1.61 0.19 0.00 0.82 0.00 0.00 66.70 66.01 1dm0 h VAL 209 Cb 1.61 1.43 -0.14 0.00 -1.52 0.00 0.00 31.29 32.68 1dm0 h VAL 209 CO 0.18 0.25 -0.02 0.18 0.02 0.00 0.00 177.57 178.18 1dm0 n LEU 210 N -4.66 -0.12 0.18 2.57 4.77 0.16 0.11 117.00 120.02 1dm0 n LEU 210 Ca -0.08 1.26 0.18 0.00 -0.03 0.00 0.00 56.01 57.34 1dm0 n LEU 210 Cb 0.28 -0.45 0.76 0.00 -2.33 0.00 0.00 43.42 41.68 1dm0 n LEU 210 CO 0.15 -1.26 1.16 1.55 -1.33 0.00 0.00 177.39 177.66 1dm0 h PRO 211 N 0.00 0.00 0.00 3.23 0.13 -1.77 0.69 132.00 134.28 1dm0 h PRO 211 Ca 0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.56 1dm0 h PRO 211 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1dm0 h PRO 211 CO -0.71 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 176.81 1dm0 n ASP 212 N -3.38 0.00 -4.68 1.44 8.00 0.31 -4.81 116.55 113.43 1dm0 n ASP 212 Ca 0.04 -0.26 -0.44 0.00 0.71 0.00 0.00 54.79 54.83 1dm0 n ASP 212 Cb 0.55 -0.24 -0.04 0.00 -0.02 0.00 0.00 41.12 41.37 1dm0 n ASP 212 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1dm0 n TYR 213 N -1.24 2.48 -1.44 1.24 9.36 0.24 -4.82 117.16 122.98 1dm0 n TYR 213 Ca 0.15 -0.14 0.03 0.00 3.32 0.00 0.00 57.90 61.26 1dm0 n TYR 213 Cb 0.21 -2.72 0.04 0.00 -0.63 0.00 0.00 39.34 36.24 1dm0 n TYR 213 CO 0.00 0.00 0.00 1.58 0.22 0.00 0.00 176.86 178.66 1dm0 n HIS 214 N 6.24 0.00 0.00 2.98 -0.00 -1.26 -4.86 115.22 118.31 1dm0 n HIS 214 Ca 0.20 -0.30 0.00 0.00 0.46 0.00 0.00 57.72 58.08 1dm0 n HIS 214 Cb 0.35 -0.07 0.00 0.00 -0.12 0.00 0.00 29.99 30.16 1dm0 n HIS 214 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1dm0 n GLY 215 N -0.42 0.79 3.89 1.57 0.00 -1.26 -5.10 105.19 104.67 1dm0 n GLY 215 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 1dm0 n GLY 215 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dm0 s GLN 216 N 0.42 3.68 0.31 1.61 1.11 -1.26 -4.98 119.66 120.55 1dm0 s GLN 216 Ca 0.00 0.05 0.05 0.00 0.01 0.00 0.00 55.36 55.47 1dm0 s GLN 216 Cb 0.00 -2.73 0.68 0.00 -1.01 0.00 0.00 33.01 29.95 1dm0 s GLN 216 CO 0.00 0.36 1.82 -0.44 0.01 0.00 0.00 175.29 177.04 1dm0 h ASP 217 N 2.44 0.82 -5.12 5.90 5.19 -0.58 -3.45 116.42 121.62 1dm0 h ASP 217 Ca -0.47 0.06 -0.04 0.00 -0.62 0.00 0.00 57.03 55.97 1dm0 h ASP 217 Cb 1.17 -0.10 -0.11 0.00 0.18 0.00 0.00 39.33 40.48 1dm0 h ASP 217 CO 0.70 0.39 -0.04 -0.94 -3.12 0.00 0.00 179.24 176.22 1dm0 s SER 218 N -5.62 -0.20 -0.04 6.45 1.04 -1.14 -4.05 113.70 110.14 1dm0 s SER 218 Ca -0.11 -0.56 0.01 0.00 0.48 0.00 0.00 55.95 55.77 1dm0 s SER 218 Cb 0.23 0.55 0.02 0.00 0.10 0.00 0.00 66.02 66.92 1dm0 s SER 218 CO 0.80 -1.02 -0.05 -0.69 0.98 0.00 0.00 173.24 173.26 1dm0 s VAL 219 N -3.89 0.60 -0.15 5.02 1.01 -1.01 -1.02 120.40 120.96 1dm0 s VAL 219 Ca 0.11 -0.17 -0.02 0.00 0.00 0.00 0.00 61.98 61.90 1dm0 s VAL 219 Cb -0.00 -0.61 0.05 0.00 0.00 0.00 0.00 36.38 35.82 1dm0 s VAL 219 CO -0.02 0.24 0.01 -0.13 0.00 0.00 0.00 175.10 175.19 1dm0 s ARG 220 N 0.84 0.76 -0.16 2.72 0.52 -0.46 -0.44 118.95 122.73 1dm0 s ARG 220 Ca -0.12 -0.26 0.00 0.00 -0.52 0.00 0.00 55.73 54.83 1dm0 s ARG 220 Cb -0.14 -1.72 0.03 0.00 0.52 0.00 0.00 34.95 33.63 1dm0 s ARG 220 CO 0.01 -0.50 -0.13 0.08 0.02 0.00 0.00 175.30 174.78 1dm0 s VAL 221 N 1.86 1.60 0.00 3.52 1.01 -0.42 -3.33 120.40 124.64 1dm0 s VAL 221 Ca 0.01 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.24 1dm0 s VAL 221 Cb -0.15 -1.56 0.00 0.00 0.00 0.00 0.00 36.38 34.67 1dm0 s VAL 221 CO -0.07 0.38 0.00 0.61 0.00 0.00 0.00 175.10 176.01 1dm0 n GLY 222 N 4.74 3.16 0.30 4.51 0.00 -1.26 -1.05 105.19 115.60 1dm0 n GLY 222 Ca -0.16 -0.08 0.02 0.00 0.00 0.00 0.00 46.02 45.79 1dm0 n GLY 222 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1dm0 n ARG 223 N 14.00 1.31 -5.05 1.61 0.63 -1.26 -4.77 116.66 123.13 1dm0 n ARG 223 Ca 0.00 -0.40 -0.32 0.00 -0.92 0.00 0.00 57.85 56.21 1dm0 n ARG 223 Cb 0.00 -1.18 -0.15 0.00 0.45 0.00 0.00 32.46 31.57 1dm0 n ARG 223 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1dm0 s ILE 224 N -1.74 2.53 0.05 5.15 1.01 -0.21 -5.07 121.20 122.91 1dm0 s ILE 224 Ca 0.07 -0.88 0.03 0.00 0.00 0.00 0.00 60.65 59.88 1dm0 s ILE 224 Cb 0.04 -1.99 -0.02 0.00 0.01 0.00 0.00 42.46 40.50 1dm0 s ILE 224 CO 0.04 0.56 -0.10 -0.94 0.00 0.00 0.00 174.94 174.50 1dm0 s SER 225 N 0.00 1.19 -0.06 3.58 1.04 -1.26 -1.30 113.70 116.89 1dm0 s SER 225 Ca -0.06 -0.55 0.05 0.00 0.48 0.00 0.00 55.95 55.87 1dm0 s SER 225 Cb -0.15 -0.01 -0.01 0.00 0.10 0.00 0.00 66.02 65.96 1dm0 s SER 225 CO 0.05 -0.13 -0.22 -0.36 0.98 0.00 0.00 173.24 173.56 1dm0 s PHE 226 N -1.26 2.15 -0.71 5.02 0.08 0.42 -4.98 117.98 118.70 1dm0 s PHE 226 Ca -0.06 -0.67 0.23 0.00 0.12 0.00 0.00 56.93 56.55 1dm0 s PHE 226 Cb -0.10 -1.43 0.18 0.00 -0.57 0.00 0.00 43.02 41.10 1dm0 s PHE 226 CO 0.01 -0.22 1.15 0.41 -0.10 0.00 0.00 175.22 176.47 1dm0 n GLY 227 N 3.12 -1.25 3.80 4.36 0.00 -1.26 -2.39 105.19 111.56 1dm0 n GLY 227 Ca -0.18 -0.37 -0.02 0.00 0.00 0.00 0.00 46.02 45.45 1dm0 n GLY 227 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dm0 s SER 228 N -3.76 -0.06 0.34 1.61 1.04 -1.26 -4.59 113.70 107.01 1dm0 s SER 228 Ca 0.06 -0.43 0.02 0.00 0.48 0.00 0.00 55.95 56.08 1dm0 s SER 228 Cb 0.15 0.39 0.60 0.00 0.10 0.00 0.00 66.02 67.26 1dm0 s SER 228 CO 0.77 -0.75 1.97 -0.29 0.98 0.00 0.00 173.24 175.92 1dm0 h ILE 229 N 2.00 1.17 0.00 -1.02 6.09 -1.90 -0.59 117.51 123.27 1dm0 h ILE 229 Ca -0.27 -0.42 -0.00 0.00 -1.37 0.00 0.00 64.86 62.81 1dm0 h ILE 229 Cb 1.22 0.36 -0.00 0.00 0.47 0.00 0.00 36.82 38.87 1dm0 h ILE 229 CO 0.31 0.19 -0.01 0.78 -3.07 0.00 0.00 178.15 176.34 1dm0 h ASN 230 N 0.81 0.00 0.36 2.19 2.35 -1.97 0.84 115.58 120.17 1dm0 h ASN 230 Ca 0.21 0.00 -0.32 0.00 -0.55 0.00 0.00 56.30 55.64 1dm0 h ASN 230 Cb 0.00 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.33 1dm0 h ASN 230 CO -0.04 0.01 -1.79 0.00 -1.65 0.00 0.00 177.43 173.96 1dm0 h ALA 231 N 1.99 0.62 -0.16 -0.83 0.00 -1.54 -2.89 119.26 116.45 1dm0 h ALA 231 Ca -0.00 -1.41 -0.00 0.00 0.00 0.00 0.00 54.91 53.49 1dm0 h ALA 231 Cb 0.29 0.55 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1dm0 h ALA 231 CO 0.00 1.46 0.10 0.82 0.00 0.00 0.00 179.25 181.63 1dm0 h ILE 232 N 0.03 1.07 -0.68 0.00 2.04 -0.03 -3.24 117.51 116.71 1dm0 h ILE 232 Ca -0.33 -0.18 -0.03 0.00 1.00 0.00 0.00 64.86 65.32 1dm0 h ILE 232 Cb 2.02 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 38.97 1dm0 h ILE 232 CO 0.09 0.07 0.32 -0.07 0.00 0.00 0.00 178.15 178.55 1dm0 h LEU 233 N 0.19 0.88 0.00 1.44 3.38 -0.98 -1.90 115.31 118.32 1dm0 h LEU 233 Ca 0.06 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1dm0 h LEU 233 Cb 0.03 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.55 1dm0 h LEU 233 CO -0.01 0.75 0.00 0.61 0.09 0.00 0.00 178.44 179.88 1dm0 n GLY 234 N -1.09 -0.79 0.64 0.83 0.00 -1.09 -3.90 105.19 99.78 1dm0 n GLY 234 Ca 0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 46.02 45.99 1dm0 n GLY 234 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1dm0 n SER 235 N -1.25 1.42 -4.37 1.61 7.64 -1.14 -2.91 113.62 114.62 1dm0 n SER 235 Ca 0.09 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.63 1dm0 n SER 235 Cb 0.12 -0.02 -0.14 0.00 -1.01 0.00 0.00 64.21 63.17 1dm0 n SER 235 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1dm0 s VAL 236 N -2.01 3.47 -0.26 0.44 1.01 -0.73 -0.81 120.40 121.51 1dm0 s VAL 236 Ca -0.01 -0.48 -0.01 0.00 0.00 0.00 0.00 61.98 61.48 1dm0 s VAL 236 Cb 0.00 -2.54 -0.17 0.00 0.00 0.00 0.00 36.38 33.67 1dm0 s VAL 236 CO 0.01 0.46 -0.23 0.00 0.00 0.00 0.00 175.10 175.34 1dm0 n ALA 237 N 4.26 1.39 -2.98 5.51 0.00 -0.95 -4.55 120.51 123.19 1dm0 n ALA 237 Ca -0.18 -1.09 -0.18 0.00 0.00 0.00 0.00 53.44 51.99 1dm0 n ALA 237 Cb 0.52 -0.08 -0.15 0.00 0.00 0.00 0.00 19.45 19.73 1dm0 n ALA 237 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1dm0 s LEU 238 N -6.68 1.82 0.20 0.00 2.96 -0.97 -2.12 118.68 113.88 1dm0 s LEU 238 Ca -0.35 -0.13 0.05 0.00 -0.22 0.00 0.00 54.13 53.48 1dm0 s LEU 238 Cb 0.10 -0.39 -0.05 0.00 0.50 0.00 0.00 46.19 46.34 1dm0 s LEU 238 CO 0.59 0.05 -0.08 0.27 -1.32 0.00 0.00 176.35 175.85 1dm0 s ILE 239 N 0.14 1.35 0.97 6.68 -4.36 -0.72 -4.81 121.20 120.44 1dm0 s ILE 239 Ca -0.02 -2.10 -0.12 0.00 -0.26 0.00 0.00 60.65 58.15 1dm0 s ILE 239 Cb -0.06 -2.09 0.17 0.00 1.25 0.00 0.00 42.46 41.73 1dm0 s ILE 239 CO -0.00 -0.55 1.09 -0.76 0.24 0.00 0.00 174.94 174.95 1dm0 s LEU 240 N -3.27 1.83 -0.28 0.37 1.43 -1.26 0.39 118.68 117.88 1dm0 s LEU 240 Ca 0.22 1.32 -0.01 0.00 -1.03 0.00 0.00 54.13 54.64 1dm0 s LEU 240 Cb 0.03 -3.59 0.05 0.00 0.03 0.00 0.00 46.19 42.71 1dm0 s LEU 240 CO 0.05 -2.99 -0.03 0.21 0.23 0.00 0.00 176.35 173.82 1dm0 s ASN 241 N -3.40 4.72 -0.19 2.29 3.04 -1.26 -4.42 114.94 115.71 1dm0 s ASN 241 Ca 0.65 -1.25 -0.04 0.00 0.04 0.00 0.00 52.86 52.25 1dm0 s ASN 241 Cb -0.19 -1.67 -0.02 0.00 -1.54 0.00 0.00 41.25 37.83 1dm0 s ASN 241 CO 0.58 -0.23 -0.02 0.00 -3.04 0.00 0.00 177.10 174.39 1dm0 n PHE 257 N 4.21 -1.23 -1.49 0.00 3.72 -1.26 -5.14 117.46 116.28 1dm0 n PHE 257 Ca -0.17 0.31 -0.40 0.00 -0.05 0.00 0.00 57.45 57.14 1dm0 n PHE 257 Cb 0.52 -1.99 0.02 0.00 -0.94 0.00 0.00 39.48 37.08 1dm0 n PHE 257 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1dm0 n PRO 258 N -3.02 0.68 -1.95 -1.08 -0.02 -1.26 -4.92 135.00 123.42 1dm0 n PRO 258 Ca -0.16 0.25 -0.33 0.00 -2.02 0.00 0.00 63.50 61.24 1dm0 n PRO 258 Cb 0.46 -1.67 0.03 0.00 -0.02 0.00 0.00 33.50 32.29 1dm0 n PRO 258 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1dm0 s SER 259 N -0.99 5.46 0.00 2.55 0.15 -1.26 -4.96 113.70 114.65 1dm0 s SER 259 Ca 0.65 1.96 0.21 0.00 0.70 0.00 0.00 55.95 59.48 1dm0 s SER 259 Cb -0.54 -2.55 -0.02 0.00 -1.71 0.00 0.00 66.02 61.20 1dm0 s SER 259 CO 0.56 -1.39 1.03 0.23 1.20 0.00 0.00 173.24 174.87 1dm0 n MET 260 N -2.07 1.28 -2.64 5.44 2.81 -1.26 -4.94 117.12 115.74 1dm0 n MET 260 Ca 0.10 -0.92 -0.33 0.00 -1.81 0.00 0.00 57.70 54.73 1dm0 n MET 260 Cb 0.52 -1.43 -0.05 0.00 -0.71 0.00 0.00 33.22 31.55 1dm0 n MET 260 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1dm0 s PRO 262 N -3.28 2.83 1.19 0.00 0.04 -1.26 -5.03 135.00 129.50 1dm0 s PRO 262 Ca 0.64 1.10 -0.20 0.00 0.04 0.00 0.00 61.00 62.58 1dm0 s PRO 262 Cb -0.13 -1.97 0.31 0.00 0.04 0.00 0.00 34.50 32.75 1dm0 s PRO 262 CO 0.18 -1.19 0.83 0.00 0.04 0.00 0.00 177.00 176.86 1dm0 n ALA 263 N -2.94 -3.94 -2.33 8.56 0.00 -1.26 -4.93 120.51 113.67 1dm0 n ALA 263 Ca 0.08 -1.36 -0.42 0.00 0.00 0.00 0.00 53.44 51.75 1dm0 n ALA 263 Cb 0.53 -0.11 -0.04 0.00 0.00 0.00 0.00 19.45 19.83 1dm0 n ALA 263 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1dm0 s ASP 264 N -3.39 7.27 0.00 0.00 2.15 -1.26 -3.68 116.67 117.76 1dm0 s ASP 264 Ca 0.59 1.94 0.00 0.00 0.43 0.00 0.00 52.55 55.51 1dm0 s ASP 264 Cb -0.09 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 39.95 1dm0 s ASP 264 CO 0.48 -0.28 0.00 0.61 -0.17 0.00 0.00 175.17 175.81 1dm0 n GLY 265 N 2.60 2.96 0.00 2.66 0.00 -1.26 -4.89 105.19 107.26 1dm0 n GLY 265 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1dm0 n GLY 265 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dm0 n ARG 266 N -2.00 0.00 -2.62 1.61 1.74 -1.24 -4.79 116.66 109.36 1dm0 n ARG 266 Ca 0.00 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.65 1dm0 n ARG 266 Cb 0.00 -0.44 -0.02 0.00 -1.02 0.00 0.00 32.46 30.98 1dm0 n ARG 266 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1dm0 s VAL 267 N -0.18 4.58 -0.00 1.55 1.01 -1.26 -4.70 120.40 121.40 1dm0 s VAL 267 Ca 0.00 1.89 -0.03 0.00 0.00 0.00 0.00 61.98 63.83 1dm0 s VAL 267 Cb 0.00 -4.30 -0.00 0.00 0.00 0.00 0.00 36.38 32.08 1dm0 s VAL 267 CO 0.00 -0.26 0.06 0.00 0.00 0.00 0.00 175.10 174.90 1dm0 s ARG 268 N 3.37 0.28 0.22 2.72 1.70 -1.26 -4.90 118.95 121.08 1dm0 s ARG 268 Ca 0.46 -0.28 -0.23 0.00 -0.47 0.00 0.00 55.73 55.21 1dm0 s ARG 268 Cb -0.15 0.11 -0.08 0.00 -0.57 0.00 0.00 34.95 34.26 1dm0 s ARG 268 CO 0.10 -0.05 0.78 0.20 -1.08 0.00 0.00 175.30 175.25 1dm0 s GLY 269 N -0.87 2.76 -0.11 3.88 0.00 -1.25 -0.02 107.32 111.70 1dm0 s GLY 269 Ca -0.10 0.30 0.01 0.00 0.00 0.00 0.00 44.72 44.93 1dm0 s GLY 269 CO 0.00 0.73 -0.13 -0.42 0.00 0.00 0.00 173.10 173.28 1dm0 s ILE 270 N -1.41 1.35 -0.15 0.90 1.01 0.25 -4.87 121.20 118.27 1dm0 s ILE 270 Ca 0.42 -0.53 -0.07 0.00 0.00 0.00 0.00 60.65 60.47 1dm0 s ILE 270 Cb -0.19 -1.27 -0.04 0.00 0.01 0.00 0.00 42.46 40.97 1dm0 s ILE 270 CO 0.23 0.42 0.10 -0.89 0.00 0.00 0.00 174.94 174.80 1dm0 s THR 271 N 1.25 5.18 -0.14 2.92 2.01 -1.26 -1.05 115.64 124.55 1dm0 s THR 271 Ca -0.02 0.10 -0.05 0.00 0.31 0.00 0.00 61.69 62.03 1dm0 s THR 271 Cb -0.14 -3.30 0.07 0.00 0.01 0.00 0.00 72.50 69.14 1dm0 s THR 271 CO -0.05 0.53 0.28 -2.28 -0.69 0.00 0.00 174.62 172.41 1dm0 s HIS 272 N -0.28 -0.46 -0.84 4.92 5.04 0.13 -4.86 115.29 118.94 1dm0 s HIS 272 Ca 0.10 1.03 -0.01 0.00 -1.54 0.00 0.00 55.06 54.64 1dm0 s HIS 272 Cb -0.12 -0.00 0.00 0.00 0.04 0.00 0.00 32.58 32.50 1dm0 s HIS 272 CO 0.01 -0.37 0.09 -1.71 -2.34 0.00 0.00 174.74 170.42 1dm0 n ASN 273 N 5.36 -3.50 -0.35 9.88 2.85 -1.26 -2.36 115.26 125.88 1dm0 n ASN 273 Ca -0.06 -0.05 -0.05 0.00 -0.11 0.00 0.00 54.58 54.31 1dm0 n ASN 273 Cb 0.50 -2.65 -0.02 0.00 1.24 0.00 0.00 39.78 38.84 1dm0 n ASN 273 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 1dm0 n LYS 274 N -2.08 -0.39 -4.92 1.20 5.02 -1.26 -4.90 118.16 110.83 1dm0 n LYS 274 Ca -0.10 0.61 -0.33 0.00 -2.02 0.00 0.00 58.31 56.47 1dm0 n LYS 274 Cb 0.58 -4.29 -0.15 0.00 -0.02 0.00 0.00 35.03 31.15 1dm0 n LYS 274 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1dm0 s ILE 275 N -2.13 2.75 -0.17 -0.18 1.01 -0.99 0.22 121.20 121.70 1dm0 s ILE 275 Ca 0.00 -0.77 -0.08 0.00 0.00 0.00 0.00 60.65 59.79 1dm0 s ILE 275 Cb 0.00 -2.12 -0.04 0.00 0.01 0.00 0.00 42.46 40.30 1dm0 s ILE 275 CO 0.00 0.54 0.10 -0.22 0.00 0.00 0.00 174.94 175.35 1dm0 s LEU 276 N 0.30 4.05 0.33 2.97 2.96 -0.19 0.22 118.68 129.32 1dm0 s LEU 276 Ca -0.13 0.21 0.06 0.00 -0.22 0.00 0.00 54.13 54.05 1dm0 s LEU 276 Cb -0.16 -2.02 -0.06 0.00 0.50 0.00 0.00 46.19 44.44 1dm0 s LEU 276 CO 0.06 0.23 -0.01 0.26 -1.32 0.00 0.00 176.35 175.57 1dm0 s TRP 277 N 0.06 2.13 -0.17 5.38 0.52 -0.22 -1.35 118.94 125.29 1dm0 s TRP 277 Ca 0.07 -0.75 -0.06 0.00 0.02 0.00 0.00 56.10 55.39 1dm0 s TRP 277 Cb -0.12 -1.34 -0.03 0.00 -1.15 0.00 0.00 33.47 30.83 1dm0 s TRP 277 CO 0.00 0.27 0.02 0.16 0.02 0.00 0.00 176.95 177.42 1dm0 s ASP 278 N -3.53 5.26 0.55 2.95 -4.77 -1.21 -0.58 116.67 115.34 1dm0 s ASP 278 Ca 0.33 -0.02 0.25 0.00 -3.30 0.00 0.00 52.55 49.81 1dm0 s ASP 278 Cb 0.06 -1.89 1.44 0.00 -1.09 0.00 0.00 42.92 41.45 1dm0 s ASP 278 CO 0.15 0.16 2.02 0.77 0.70 0.00 0.00 175.17 178.97 1dm0 h SER 279 N 6.78 0.00 -0.72 2.11 4.64 -0.76 -2.30 113.55 123.30 1dm0 h SER 279 Ca -0.35 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.95 1dm0 h SER 279 Cb 1.18 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.23 1dm0 h SER 279 CO 0.67 0.00 0.36 0.28 -0.87 0.00 0.00 176.83 177.27 1dm0 h SER 280 N 0.00 0.94 0.34 4.97 0.02 -1.84 -2.33 113.55 115.66 1dm0 h SER 280 Ca 0.20 -0.10 -0.32 0.00 -0.84 0.00 0.00 61.79 60.73 1dm0 h SER 280 Cb 0.85 -0.24 0.03 0.00 0.14 0.00 0.00 62.40 63.18 1dm0 h SER 280 CO -0.00 0.79 -1.40 0.74 -1.14 0.00 0.00 176.83 175.82 1dm0 h THR 281 N 1.04 1.34 -0.71 -2.27 2.02 -1.82 -3.14 112.91 109.37 1dm0 h THR 281 Ca 0.26 -2.76 -0.07 0.00 0.77 0.00 0.00 66.41 64.60 1dm0 h THR 281 Cb 0.09 2.98 -0.03 0.00 -1.74 0.00 0.00 68.15 69.46 1dm0 h THR 281 CO -0.03 0.82 0.17 -0.07 0.37 0.00 0.00 175.52 176.78 1dm0 h LEU 282 N 0.14 1.08 -1.27 2.58 3.38 -1.56 -2.51 115.31 117.16 1dm0 h LEU 282 Ca -0.22 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 57.52 1dm0 h LEU 282 Cb 2.10 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 42.53 1dm0 h LEU 282 CO 0.26 1.04 0.50 1.23 0.09 0.00 0.00 178.44 181.55 1dm0 h GLY 283 N 1.08 1.05 2.00 0.83 0.00 -1.53 -2.57 103.07 103.93 1dm0 h GLY 283 Ca 0.22 -0.39 -0.11 0.00 0.00 0.00 0.00 47.33 47.05 1dm0 h GLY 283 CO 0.00 0.38 -0.52 0.00 0.00 0.00 0.00 176.54 176.40 1dm0 h ALA 284 N 1.53 0.75 -0.01 3.60 0.00 -1.46 -3.30 119.26 120.39 1dm0 h ALA 284 Ca 0.27 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1dm0 h ALA 284 Cb -0.11 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1dm0 h ALA 284 CO -0.06 0.65 -0.51 0.44 0.00 0.00 0.00 179.25 179.77 1dm0 n ILE 285 N -3.36 0.00 1.18 0.00 -5.35 -0.96 -4.43 119.36 106.44 1dm0 n ILE 285 Ca 0.01 -0.14 0.13 0.00 -0.27 0.00 0.00 62.75 62.48 1dm0 n ILE 285 Cb 0.68 0.81 0.25 0.00 -1.74 0.00 0.00 39.64 39.63 1dm0 n ILE 285 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1dm0 n LEU 286 N -0.69 2.14 -0.79 7.28 4.77 -0.99 -5.09 117.00 123.63 1dm0 n LEU 286 Ca 0.09 -0.72 0.10 0.00 -0.03 0.00 0.00 56.01 55.45 1dm0 n LEU 286 Cb 0.39 -0.02 0.08 0.00 -2.33 0.00 0.00 43.42 41.55 1dm0 n LEU 286 CO 0.31 0.37 0.56 1.15 -1.33 0.00 0.00 177.39 178.45