#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dtg n GLY 5 N 0.00 -0.95 3.00 -1.23 0.00 -1.26 -4.99 105.19 99.76 2dtg n GLY 5 Ca 0.00 -0.31 -0.11 0.00 0.00 0.00 0.00 46.02 45.60 2dtg n GLY 5 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dtg s GLU 6 N -2.50 0.37 0.01 1.61 2.56 -1.26 -5.00 118.70 114.49 2dtg s GLU 6 Ca -0.12 -0.60 0.03 0.00 0.00 0.00 0.00 54.97 54.29 2dtg s GLU 6 Cb 0.06 -0.06 -0.01 0.00 2.00 0.00 0.00 34.13 36.12 2dtg s GLU 6 CO 0.81 -0.00 -0.10 0.54 -0.56 0.00 0.00 175.26 175.95 2dtg s VAL 7 N -1.26 0.76 0.20 3.70 0.11 -1.26 0.23 120.40 122.87 2dtg s VAL 7 Ca -0.12 -0.64 0.03 0.00 -2.93 0.00 0.00 61.98 58.32 2dtg s VAL 7 Cb -0.09 -0.68 -0.05 0.00 -1.53 0.00 0.00 36.38 34.03 2dtg s VAL 7 CO -0.00 0.04 -0.01 0.00 -3.33 0.00 0.00 175.10 171.80 2dtg s PRO 9 N -3.87 3.23 0.96 0.00 0.02 -1.26 0.28 135.00 134.37 2dtg s PRO 9 Ca 0.25 -0.21 -0.16 0.00 0.02 0.00 0.00 61.00 60.91 2dtg s PRO 9 Cb 0.05 -2.48 -0.10 0.00 0.02 0.00 0.00 34.50 31.99 2dtg s PRO 9 CO 0.06 -0.25 -0.43 0.41 -0.33 0.00 0.00 177.00 176.46 2dtg n GLY 10 N -2.16 -3.84 3.34 0.52 0.00 -1.26 -4.66 105.19 97.14 2dtg n GLY 10 Ca 0.01 -0.76 -0.14 0.00 0.00 0.00 0.00 46.02 45.13 2dtg n GLY 10 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2dtg s MET 11 N -2.43 0.63 -0.17 1.61 1.75 0.14 -4.88 119.30 115.95 2dtg s MET 11 Ca 0.46 0.38 -0.00 0.00 -1.25 0.00 0.00 55.69 55.27 2dtg s MET 11 Cb -0.20 0.30 0.04 0.00 2.84 0.00 0.00 34.83 37.81 2dtg s MET 11 CO 0.78 -0.13 -0.06 -0.51 -0.65 0.00 0.00 175.02 174.45 2dtg s ASP 12 N -0.34 2.88 -0.14 1.11 -0.00 -1.26 0.39 116.67 119.31 2dtg s ASP 12 Ca -0.05 -0.68 -0.00 0.00 -0.00 0.00 0.00 52.55 51.82 2dtg s ASP 12 Cb -0.03 -0.94 -0.01 0.00 -0.00 0.00 0.00 42.92 41.93 2dtg s ASP 12 CO 0.03 -0.18 -0.12 -0.63 -0.00 0.00 0.00 175.17 174.26 2dtg s ILE 13 N 1.61 3.07 -0.11 0.77 -1.09 0.70 -4.96 121.20 121.19 2dtg s ILE 13 Ca 0.01 -0.65 -0.10 0.00 -2.23 0.00 0.00 60.65 57.68 2dtg s ILE 13 Cb -0.15 -2.30 0.03 0.00 -1.58 0.00 0.00 42.46 38.46 2dtg s ILE 13 CO -0.08 0.52 0.29 0.00 -1.23 0.00 0.00 174.94 174.44 2dtg s ARG 14 N 0.45 0.33 7.58 2.79 3.03 -1.25 -0.30 118.95 131.58 2dtg s ARG 14 Ca -0.09 0.41 0.00 0.00 2.03 0.00 0.00 55.73 58.08 2dtg s ARG 14 Cb -0.16 0.15 0.00 0.00 -1.03 0.00 0.00 34.95 33.91 2dtg s ARG 14 CO 0.05 -0.05 0.00 0.09 -1.13 0.00 0.00 175.30 174.26 2dtg n ASN 15 N 2.99 0.00 -4.62 -2.89 5.03 -0.05 -4.84 115.26 110.88 2dtg n ASN 15 Ca -0.13 0.00 -0.46 0.00 0.87 0.00 0.00 54.58 54.86 2dtg n ASN 15 Cb 0.58 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 39.31 2dtg n ASN 15 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2dtg n ASN 16 N 9.25 1.93 -0.33 6.41 4.13 -1.26 -4.61 115.26 130.79 2dtg n ASN 16 Ca 0.00 1.15 0.14 0.00 1.68 0.00 0.00 54.58 57.55 2dtg n ASN 16 Cb 0.00 -1.33 0.63 0.00 -1.54 0.00 0.00 39.78 37.54 2dtg n ASN 16 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2dtg n LEU 17 N 1.80 1.01 -0.31 3.41 4.77 -1.26 -4.32 117.00 122.10 2dtg n LEU 17 Ca 0.12 -0.35 0.14 0.00 -0.03 0.00 0.00 56.01 55.89 2dtg n LEU 17 Cb 0.29 -0.01 0.30 0.00 -2.33 0.00 0.00 43.42 41.67 2dtg n LEU 17 CO 0.61 0.18 0.88 0.71 -1.33 0.00 0.00 177.39 178.44 2dtg h THR 18 N 1.53 0.17 0.00 -5.08 1.35 -1.96 -0.97 112.91 107.95 2dtg h THR 18 Ca 0.00 -0.03 -0.10 0.00 -0.55 0.00 0.00 66.41 65.73 2dtg h THR 18 Cb 0.33 0.07 -0.01 0.00 -1.73 0.00 0.00 68.15 66.80 2dtg h THR 18 CO 0.00 0.02 -0.49 0.03 -0.25 0.00 0.00 175.52 174.83 2dtg h ARG 19 N 0.09 0.00 -0.98 4.72 3.08 -1.98 -3.22 114.38 116.09 2dtg h ARG 19 Ca 0.58 0.00 0.22 0.00 0.07 0.00 0.00 59.98 60.85 2dtg h ARG 19 Cb 1.20 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 31.13 2dtg h ARG 19 CO -0.78 0.49 0.57 1.25 -1.07 0.00 0.00 179.97 180.42 2dtg h LEU 20 N 0.00 0.66 -1.50 3.04 5.85 -1.48 0.71 115.31 122.59 2dtg h LEU 20 Ca -0.00 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.84 2dtg h LEU 20 Cb 0.90 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.96 2dtg h LEU 20 CO 0.06 0.14 0.00 1.41 -0.34 0.00 0.00 178.44 179.72 2dtg n HIS 21 N -4.87 0.00 0.88 1.25 8.25 -1.22 -2.14 115.22 117.37 2dtg n HIS 21 Ca 0.25 -0.09 0.09 0.00 -0.26 0.00 0.00 57.72 57.71 2dtg n HIS 21 Cb 0.67 -0.09 -0.06 0.00 1.12 0.00 0.00 29.99 31.62 2dtg n HIS 21 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2dtg n GLU 22 N 0.57 1.10 -0.23 -0.41 1.02 0.24 -4.14 120.64 118.80 2dtg n GLU 22 Ca 0.00 -0.40 0.08 0.00 -0.02 0.00 0.00 57.16 56.82 2dtg n GLU 22 Cb 0.13 -1.38 0.21 0.00 -0.02 0.00 0.00 31.44 30.37 2dtg n GLU 22 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2dtg n LEU 23 N -0.84 3.24 0.00 -4.62 4.77 -0.91 -4.66 117.00 113.98 2dtg n LEU 23 Ca 0.06 -1.88 0.00 0.00 -0.03 0.00 0.00 56.01 54.16 2dtg n LEU 23 Cb 0.34 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 2dtg n LEU 23 CO 0.32 0.79 0.16 1.21 -1.33 0.00 0.00 177.39 178.54 2dtg n GLU 24 N 0.98 0.00 -0.08 3.23 2.13 -1.26 -1.66 120.64 123.98 2dtg n GLU 24 Ca 0.16 0.17 0.26 0.00 0.66 0.00 0.00 57.16 58.41 2dtg n GLU 24 Cb 0.50 -0.83 0.69 0.00 0.27 0.00 0.00 31.44 32.07 2dtg n GLU 24 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 2dtg h ASN 25 N 0.00 0.00 -3.61 4.31 -0.26 -1.90 -3.43 115.58 110.68 2dtg h ASN 25 Ca 0.00 0.00 -0.57 0.00 -0.56 0.00 0.00 56.30 55.17 2dtg h ASN 25 Cb 0.00 0.00 0.17 0.00 -1.06 0.00 0.00 38.32 37.43 2dtg h ASN 25 CO 0.00 0.00 0.08 0.00 -1.06 0.00 0.00 177.43 176.45 2dtg n SER 27 N -0.99 0.97 -4.39 0.00 2.88 -1.12 -4.04 113.62 106.93 2dtg n SER 27 Ca 0.14 0.16 -0.30 0.00 -1.33 0.00 0.00 58.87 57.53 2dtg n SER 27 Cb 0.48 -0.27 -0.14 0.00 -0.75 0.00 0.00 64.21 63.54 2dtg n SER 27 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2dtg s VAL 28 N -2.00 2.41 -0.34 2.46 1.01 0.14 -2.74 120.40 121.35 2dtg s VAL 28 Ca 0.00 -1.31 -0.11 0.00 0.00 0.00 0.00 61.98 60.56 2dtg s VAL 28 Cb 0.00 -1.97 -0.00 0.00 0.00 0.00 0.00 36.38 34.40 2dtg s VAL 28 CO 0.00 0.35 0.20 -0.63 0.00 0.00 0.00 175.10 175.03 2dtg s ILE 29 N -0.86 4.91 -0.79 2.22 -1.09 -0.30 0.18 121.20 125.46 2dtg s ILE 29 Ca 0.13 -0.41 -0.05 0.00 -2.23 0.00 0.00 60.65 58.08 2dtg s ILE 29 Cb -0.10 -3.55 0.02 0.00 -1.58 0.00 0.00 42.46 37.24 2dtg s ILE 29 CO 0.03 -0.03 2.79 1.21 -1.23 0.00 0.00 174.94 177.72 2dtg n GLU 30 N 5.04 3.20 0.00 2.79 2.13 0.80 -1.01 120.64 133.60 2dtg n GLU 30 Ca -0.13 -2.50 0.00 0.00 0.66 0.00 0.00 57.16 55.19 2dtg n GLU 30 Cb 0.49 -2.35 0.00 0.00 0.27 0.00 0.00 31.44 29.85 2dtg n GLU 30 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2dtg n GLY 31 N 1.67 -0.41 3.09 8.31 0.00 -1.26 -4.06 105.19 112.53 2dtg n GLY 31 Ca 0.56 0.29 -0.18 0.00 0.00 0.00 0.00 46.02 46.68 2dtg n GLY 31 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2dtg s HIS 32 N 0.00 0.98 -0.17 1.61 -3.43 -1.26 0.21 115.29 113.23 2dtg s HIS 32 Ca 0.00 -0.34 -0.05 0.00 -0.80 0.00 0.00 55.06 53.87 2dtg s HIS 32 Cb 0.00 -0.59 -0.03 0.00 -1.43 0.00 0.00 32.58 30.53 2dtg s HIS 32 CO 0.00 0.00 -0.00 -1.17 -2.00 0.00 0.00 174.74 171.57 2dtg s LEU 33 N -1.04 3.43 -0.16 5.38 0.20 -0.46 0.25 118.68 126.27 2dtg s LEU 33 Ca -0.01 -0.07 -0.01 0.00 0.69 0.00 0.00 54.13 54.73 2dtg s LEU 33 Cb -0.07 -1.84 0.05 0.00 -0.43 0.00 0.00 46.19 43.89 2dtg s LEU 33 CO 0.01 0.17 -0.02 -1.10 -0.29 0.00 0.00 176.35 175.11 2dtg s GLN 34 N 0.39 1.11 -0.14 1.98 -0.21 0.16 -1.40 119.66 121.55 2dtg s GLN 34 Ca -0.02 -0.42 0.02 0.00 0.02 0.00 0.00 55.36 54.96 2dtg s GLN 34 Cb -0.14 -1.90 0.00 0.00 1.00 0.00 0.00 33.01 31.98 2dtg s GLN 34 CO 0.02 -0.48 -0.19 0.42 -2.12 0.00 0.00 175.29 172.94 2dtg s ILE 35 N 1.73 2.33 0.16 1.08 1.01 -0.74 0.25 121.20 127.03 2dtg s ILE 35 Ca 0.01 -0.89 -0.23 0.00 0.00 0.00 0.00 60.65 59.53 2dtg s ILE 35 Cb -0.15 -1.95 0.07 0.00 0.01 0.00 0.00 42.46 40.44 2dtg s ILE 35 CO -0.07 0.54 1.03 -1.48 0.00 0.00 0.00 174.94 174.95 2dtg s LEU 36 N 0.76 -0.06 -1.45 2.97 2.34 0.58 -2.06 118.68 121.77 2dtg s LEU 36 Ca -0.08 -0.56 -0.02 0.00 0.06 0.00 0.00 54.13 53.53 2dtg s LEU 36 Cb -0.16 2.07 0.00 0.00 -0.56 0.00 0.00 46.19 47.55 2dtg s LEU 36 CO 0.00 -0.93 0.27 0.18 -1.06 0.00 0.00 176.35 174.81 2dtg n LEU 37 N -0.61 -1.65 -4.20 1.48 4.32 -0.64 -3.05 117.00 112.65 2dtg n LEU 37 Ca -0.04 -1.13 -0.35 0.00 -0.02 0.00 0.00 56.01 54.47 2dtg n LEU 37 Cb 0.60 -1.95 -0.14 0.00 -1.62 0.00 0.00 43.42 40.31 2dtg n LEU 37 CO 0.18 0.47 -0.39 -0.04 -1.22 0.00 0.00 177.39 176.39 2dtg s MET 38 N -6.91 2.73 -0.12 3.23 -1.94 -0.47 -0.87 119.30 114.95 2dtg s MET 38 Ca 0.04 -1.06 0.07 0.00 -1.71 0.00 0.00 55.69 53.04 2dtg s MET 38 Cb -0.02 -3.05 -0.12 0.00 2.01 0.00 0.00 34.83 33.65 2dtg s MET 38 CO 0.94 -0.46 -0.00 1.19 -0.01 0.00 0.00 175.02 176.67 2dtg n PHE 39 N 4.66 0.00 0.01 -0.03 3.01 -1.26 -0.72 117.46 123.13 2dtg n PHE 39 Ca -0.15 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.28 2dtg n PHE 39 Cb 0.46 -0.53 0.24 0.00 -0.01 0.00 0.00 39.48 39.63 2dtg n PHE 39 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 2dtg h LYS 40 N 0.00 0.49 -6.39 -1.08 1.57 -1.91 -3.45 116.57 105.80 2dtg h LYS 40 Ca -0.30 -0.15 -0.61 0.00 -1.87 0.00 0.00 60.65 57.72 2dtg h LYS 40 Cb 1.62 -0.04 0.13 0.00 0.08 0.00 0.00 32.23 34.01 2dtg h LYS 40 CO -0.00 0.64 -0.13 -2.37 -0.57 0.00 0.00 179.45 177.02 2dtg n THR 41 N -4.18 1.99 -4.11 -0.16 5.66 -1.26 -5.01 114.28 107.21 2dtg n THR 41 Ca 0.00 -0.50 -0.08 0.00 -3.05 0.00 0.00 64.05 60.42 2dtg n THR 41 Cb 0.35 -0.74 -0.10 0.00 -1.55 0.00 0.00 70.33 68.29 2dtg n THR 41 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2dtg s ARG 42 N -1.56 0.67 0.19 1.09 1.81 -1.23 -4.05 118.95 115.87 2dtg s ARG 42 Ca 0.62 -1.24 -0.14 0.00 -1.72 0.00 0.00 55.73 53.25 2dtg s ARG 42 Cb -0.68 0.08 0.19 0.00 -0.45 0.00 0.00 34.95 34.09 2dtg s ARG 42 CO 0.58 -0.08 1.67 -1.00 -0.68 0.00 0.00 175.30 175.79 2dtg h PRO 43 N 3.14 0.07 0.00 3.54 0.13 -1.81 0.41 132.00 137.47 2dtg h PRO 43 Ca -0.34 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 2dtg h PRO 43 Cb 1.15 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2dtg h PRO 43 CO 0.65 0.04 0.52 0.93 -0.23 0.00 0.00 178.00 179.92 2dtg h GLU 44 N 0.07 0.00 0.00 0.86 5.08 -1.97 0.91 114.58 119.52 2dtg h GLU 44 Ca 0.25 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.38 2dtg h GLU 44 Cb 0.39 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.60 2dtg h GLU 44 CO -0.46 0.00 -1.22 -0.44 -1.00 0.00 0.00 179.01 175.89 2dtg h ASP 45 N 0.00 0.00 -0.20 1.42 3.45 -0.56 -3.35 116.42 117.18 2dtg h ASP 45 Ca 0.00 0.00 -0.08 0.00 0.43 0.00 0.00 57.03 57.38 2dtg h ASP 45 Cb 1.05 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 39.77 2dtg h ASP 45 CO 0.00 0.99 0.10 0.49 -1.57 0.00 0.00 179.24 179.25 2dtg n PHE 46 N -3.25 0.65 0.00 4.55 0.99 0.31 -4.46 117.46 116.26 2dtg n PHE 46 Ca -0.05 -0.57 0.00 0.00 -0.00 0.00 0.00 57.45 56.83 2dtg n PHE 46 Cb 0.97 -0.33 0.00 0.00 -1.00 0.00 0.00 39.48 39.12 2dtg n PHE 46 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 176.76 179.65 2dtg n ARG 47 N 0.12 0.00 -0.30 -1.08 0.00 -1.25 -3.94 116.66 110.21 2dtg n ARG 47 Ca 0.11 0.40 0.01 0.00 -0.00 0.00 0.00 57.85 58.37 2dtg n ARG 47 Cb 0.66 -1.14 0.20 0.00 -0.00 0.00 0.00 32.46 32.19 2dtg n ARG 47 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.63 177.85 2dtg h ASP 48 N 0.00 0.97 -0.16 2.89 3.58 -1.91 -3.42 116.42 118.37 2dtg h ASP 48 Ca 0.00 -0.01 -0.42 0.00 0.42 0.00 0.00 57.03 57.02 2dtg h ASP 48 Cb 0.00 -0.23 -0.09 0.00 1.72 0.00 0.00 39.33 40.74 2dtg h ASP 48 CO 0.00 0.67 1.74 0.18 -2.88 0.00 0.00 179.24 178.96 2dtg n LEU 49 N -4.44 -0.06 -3.66 2.28 7.99 -1.25 -4.85 117.00 113.02 2dtg n LEU 49 Ca 0.12 -0.23 -0.06 0.00 -0.01 0.00 0.00 56.01 55.83 2dtg n LEU 49 Cb 0.09 -0.89 -0.08 0.00 -0.11 0.00 0.00 43.42 42.44 2dtg n LEU 49 CO 0.35 -1.16 0.13 -0.55 -1.51 0.00 0.00 177.39 174.65 2dtg s SER 50 N 6.30 -0.63 -0.82 -1.43 0.15 -1.26 -4.16 113.70 111.84 2dtg s SER 50 Ca 1.29 1.22 0.01 0.00 0.70 0.00 0.00 55.95 59.17 2dtg s SER 50 Cb -0.96 1.65 0.22 0.00 -1.71 0.00 0.00 66.02 65.22 2dtg s SER 50 CO 0.47 -0.23 0.79 0.49 1.20 0.00 0.00 173.24 175.96 2dtg n PHE 51 N 5.27 3.71 -0.14 3.44 3.72 0.03 -4.91 117.46 128.57 2dtg n PHE 51 Ca -0.11 -4.03 -0.09 0.00 -0.05 0.00 0.00 57.45 53.17 2dtg n PHE 51 Cb 0.50 -0.92 -0.00 0.00 -0.94 0.00 0.00 39.48 38.12 2dtg n PHE 51 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2dtg h PRO 52 N 5.42 0.64 -1.03 -1.08 0.13 -1.91 -3.03 132.00 131.14 2dtg h PRO 52 Ca 0.17 -0.12 0.26 0.00 -0.87 0.00 0.00 66.00 65.44 2dtg h PRO 52 Cb 0.75 -0.10 -0.09 0.00 0.13 0.00 0.00 31.00 31.68 2dtg h PRO 52 CO 0.87 0.60 0.66 0.87 -0.23 0.00 0.00 178.00 180.77 2dtg h LYS 53 N 0.54 0.40 -6.33 0.86 6.56 -1.86 -3.40 116.57 113.34 2dtg h LYS 53 Ca 0.14 -0.02 -0.54 0.00 -1.06 0.00 0.00 60.65 59.16 2dtg h LYS 53 Cb 0.21 -0.09 0.00 0.00 -0.57 0.00 0.00 32.23 31.78 2dtg h LYS 53 CO -0.01 0.27 1.04 -1.17 -2.06 0.00 0.00 179.45 177.52 2dtg s LEU 54 N -9.66 4.34 0.00 2.94 2.96 -1.14 -4.52 118.68 113.59 2dtg s LEU 54 Ca -0.09 2.30 0.00 0.00 -0.22 0.00 0.00 54.13 56.12 2dtg s LEU 54 Cb 0.25 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.40 2dtg s LEU 54 CO 0.80 -0.89 0.00 2.30 -1.32 0.00 0.00 176.35 177.23 2dtg n ILE 55 N 5.18 0.00 -3.71 6.68 -0.00 -1.11 -1.91 119.36 124.50 2dtg n ILE 55 Ca 0.16 -0.07 -0.12 0.00 -0.00 0.00 0.00 62.75 62.73 2dtg n ILE 55 Cb 0.42 0.63 -0.10 0.00 -0.00 0.00 0.00 39.64 40.58 2dtg n ILE 55 CO 0.00 0.00 0.00 -0.32 -0.00 0.00 0.00 176.55 176.23 2dtg s MET 56 N -0.35 0.45 -0.04 6.28 1.75 -1.26 0.36 119.30 126.49 2dtg s MET 56 Ca 0.00 0.70 0.05 0.00 -1.25 0.00 0.00 55.69 55.19 2dtg s MET 56 Cb 0.00 0.10 -0.01 0.00 2.84 0.00 0.00 34.83 37.77 2dtg s MET 56 CO 0.00 -0.11 -0.19 0.42 -0.65 0.00 0.00 175.02 174.49 2dtg s ILE 57 N 0.86 1.54 -0.03 10.11 1.01 -0.48 -1.15 121.20 133.05 2dtg s ILE 57 Ca -0.05 -0.78 -0.16 0.00 0.00 0.00 0.00 60.65 59.65 2dtg s ILE 57 Cb -0.06 -1.31 -0.09 0.00 0.01 0.00 0.00 42.46 41.01 2dtg s ILE 57 CO -0.07 0.44 0.67 0.71 0.00 0.00 0.00 174.94 176.69 2dtg h THR 58 N 5.14 0.02 0.00 2.92 1.35 -1.11 -2.41 112.91 118.81 2dtg h THR 58 Ca -0.33 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 64.94 2dtg h THR 58 Cb 1.17 0.03 0.00 0.00 -1.73 0.00 0.00 68.15 67.62 2dtg h THR 58 CO 0.48 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 176.22 2dtg n ASP 59 N -5.16 0.00 -4.46 5.36 10.43 0.56 0.34 116.55 123.63 2dtg n ASP 59 Ca -0.07 0.00 -0.24 0.00 2.57 0.00 0.00 54.79 57.05 2dtg n ASP 59 Cb 0.23 0.00 -0.10 0.00 1.84 0.00 0.00 41.12 43.09 2dtg n ASP 59 CO 0.00 0.00 0.00 -0.72 -1.07 0.00 0.00 177.20 175.41 2dtg s TYR 60 N 0.22 2.03 -0.30 1.24 -0.85 -1.24 -1.76 117.35 116.69 2dtg s TYR 60 Ca 0.00 -0.94 0.01 0.00 -0.52 0.00 0.00 57.07 55.62 2dtg s TYR 60 Cb 0.00 -1.37 0.09 0.00 0.38 0.00 0.00 41.96 41.06 2dtg s TYR 60 CO 0.00 0.06 0.05 -1.17 -1.52 0.00 0.00 175.55 172.97 2dtg s LEU 61 N -3.55 3.18 -0.09 -3.49 2.96 -0.83 -1.36 118.68 115.50 2dtg s LEU 61 Ca 0.34 -1.71 -0.05 0.00 -0.22 0.00 0.00 54.13 52.49 2dtg s LEU 61 Cb 0.08 -1.20 -0.04 0.00 0.50 0.00 0.00 46.19 45.53 2dtg s LEU 61 CO 0.15 -0.36 0.11 -0.22 -1.32 0.00 0.00 176.35 174.71 2dtg s LEU 62 N 1.32 4.16 -0.24 -0.68 0.20 -0.49 -2.35 118.68 120.60 2dtg s LEU 62 Ca 0.07 0.35 -0.04 0.00 0.69 0.00 0.00 54.13 55.20 2dtg s LEU 62 Cb -0.18 -2.09 0.08 0.00 -0.43 0.00 0.00 46.19 43.57 2dtg s LEU 62 CO -0.15 0.37 0.10 -0.76 -0.29 0.00 0.00 176.35 175.63 2dtg s LEU 63 N -1.16 0.70 0.00 -0.68 1.02 -0.59 -1.78 118.68 116.18 2dtg s LEU 63 Ca 0.17 -1.03 0.00 0.00 0.02 0.00 0.00 54.13 53.28 2dtg s LEU 63 Cb -0.12 -0.39 0.00 0.00 0.02 0.00 0.00 46.19 45.70 2dtg s LEU 63 CO 0.06 -0.39 0.00 0.33 0.02 0.00 0.00 176.35 176.37 2dtg n PHE 64 N 5.20 -1.99 -1.52 0.29 7.35 -0.88 -2.86 117.46 123.06 2dtg n PHE 64 Ca -0.06 0.00 -0.22 0.00 -0.76 0.00 0.00 57.45 56.41 2dtg n PHE 64 Cb 0.45 0.00 -0.17 0.00 0.35 0.00 0.00 39.48 40.11 2dtg n PHE 64 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2dtg n ARG 65 N -0.60 0.20 -3.89 -4.13 1.74 -1.25 -4.44 116.66 104.28 2dtg n ARG 65 Ca 0.00 -0.23 -0.34 0.00 -0.77 0.00 0.00 57.85 56.51 2dtg n ARG 65 Cb 0.00 -1.89 -0.13 0.00 -1.02 0.00 0.00 32.46 29.42 2dtg n ARG 65 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2dtg s VAL 66 N 5.41 2.85 0.19 1.55 1.01 -1.26 -1.37 120.40 128.77 2dtg s VAL 66 Ca 1.20 -2.36 -0.30 0.00 0.00 0.00 0.00 61.98 60.53 2dtg s VAL 66 Cb -0.66 -3.00 -0.08 0.00 0.00 0.00 0.00 36.38 32.64 2dtg s VAL 66 CO 0.42 -0.68 1.25 -0.31 0.00 0.00 0.00 175.10 175.78 2dtg s TYR 67 N 0.82 3.35 0.00 5.22 1.51 0.10 -3.48 117.35 124.86 2dtg s TYR 67 Ca 0.11 1.33 0.00 0.00 -1.01 0.00 0.00 57.07 57.50 2dtg s TYR 67 Cb -0.21 -3.51 0.00 0.00 -0.11 0.00 0.00 41.96 38.13 2dtg s TYR 67 CO -0.05 -1.51 0.00 0.41 -1.11 0.00 0.00 175.55 173.29 2dtg n GLY 68 N 2.25 3.39 3.67 0.71 0.00 -1.26 -3.51 105.19 110.43 2dtg n GLY 68 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2dtg n GLY 68 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dtg s LEU 69 N 0.00 4.16 0.00 0.99 0.20 -1.23 -3.15 118.68 119.65 2dtg s LEU 69 Ca 0.00 1.16 0.09 0.00 0.69 0.00 0.00 54.13 56.07 2dtg s LEU 69 Cb 0.00 -3.24 -0.10 0.00 -0.43 0.00 0.00 46.19 42.42 2dtg s LEU 69 CO 0.00 -0.43 0.41 -0.62 -0.29 0.00 0.00 176.35 175.42 2dtg n GLU 70 N 5.39 3.81 -3.44 1.98 1.02 -1.26 -1.98 120.64 126.17 2dtg n GLU 70 Ca 0.05 -0.04 0.01 0.00 -0.02 0.00 0.00 57.16 57.16 2dtg n GLU 70 Cb 0.48 -0.95 -0.05 0.00 -0.02 0.00 0.00 31.44 30.91 2dtg n GLU 70 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2dtg s SER 71 N -1.85 -0.46 0.40 1.62 0.15 -1.26 -1.48 113.70 110.82 2dtg s SER 71 Ca 0.04 0.66 0.28 0.00 0.70 0.00 0.00 55.95 57.63 2dtg s SER 71 Cb 0.07 1.44 1.39 0.00 -1.71 0.00 0.00 66.02 67.21 2dtg s SER 71 CO 0.37 -0.09 1.86 -0.07 1.20 0.00 0.00 173.24 176.51 2dtg h LEU 72 N 6.99 0.00 -0.87 3.45 -0.00 -0.78 -3.10 115.31 120.98 2dtg h LEU 72 Ca -0.19 0.00 0.23 0.00 -0.00 0.00 0.00 57.88 57.93 2dtg h LEU 72 Cb 1.14 0.00 -0.14 0.00 -0.00 0.00 0.00 40.66 41.65 2dtg h LEU 72 CO 0.11 0.00 0.23 0.50 -0.00 0.00 0.00 178.44 179.28 2dtg h LYS 73 N 0.00 0.20 0.00 1.13 3.11 -1.50 0.19 116.57 119.70 2dtg h LYS 73 Ca 0.00 -0.01 -0.14 0.00 -2.81 0.00 0.00 60.65 57.69 2dtg h LYS 73 Cb 0.18 -0.04 -0.02 0.00 -1.00 0.00 0.00 32.23 31.35 2dtg h LYS 73 CO 0.00 0.13 -0.80 -0.44 -2.81 0.00 0.00 179.45 175.53 2dtg h ASP 74 N 0.20 0.00 0.01 4.20 3.45 -1.83 -3.23 116.42 119.23 2dtg h ASP 74 Ca 0.55 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 58.01 2dtg h ASP 74 Cb 1.10 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.87 2dtg h ASP 74 CO -0.66 0.61 -0.01 0.25 -1.57 0.00 0.00 179.24 177.87 2dtg h LEU 75 N 0.00 -0.01 -5.35 1.55 5.85 -0.93 -3.38 115.31 113.04 2dtg h LEU 75 Ca -0.04 -0.77 -0.55 0.00 0.84 0.00 0.00 57.88 57.35 2dtg h LEU 75 Cb 1.50 0.00 -0.41 0.00 0.37 0.00 0.00 40.66 42.12 2dtg h LEU 75 CO 0.07 0.80 -0.82 0.49 -0.34 0.00 0.00 178.44 178.63 2dtg n PHE 76 N -4.71 2.84 0.32 1.25 0.99 0.39 -0.79 117.46 117.76 2dtg n PHE 76 Ca -0.09 -3.77 0.21 0.00 -0.00 0.00 0.00 57.45 53.80 2dtg n PHE 76 Cb 0.38 -0.41 1.07 0.00 -1.00 0.00 0.00 39.48 39.52 2dtg n PHE 76 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.76 175.76 2dtg h PRO 77 N 2.93 0.00 -0.01 -1.08 0.13 -1.73 -2.92 132.00 129.32 2dtg h PRO 77 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2dtg h PRO 77 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 2dtg h PRO 77 CO 0.73 0.01 -0.12 0.09 -0.23 0.00 0.00 178.00 178.47 2dtg n ASN 78 N -3.20 1.63 -4.62 1.44 3.02 -1.26 -4.21 115.26 108.06 2dtg n ASN 78 Ca -0.02 -1.31 -0.43 0.00 -0.03 0.00 0.00 54.58 52.79 2dtg n ASN 78 Cb 0.12 0.25 -0.03 0.00 -0.61 0.00 0.00 39.78 39.51 2dtg n ASN 78 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2dtg s LEU 79 N -1.36 3.82 -0.15 3.41 2.96 -0.80 -4.04 118.68 122.51 2dtg s LEU 79 Ca 0.11 2.19 0.12 0.00 -0.22 0.00 0.00 54.13 56.34 2dtg s LEU 79 Cb 0.09 -3.52 -0.18 0.00 0.50 0.00 0.00 46.19 43.09 2dtg s LEU 79 CO 0.22 -1.62 0.03 0.41 -1.32 0.00 0.00 176.35 174.07 2dtg n THR 80 N 6.92 1.02 -3.84 3.68 -1.04 0.16 -1.01 114.28 120.18 2dtg n THR 80 Ca 0.26 -0.61 -0.12 0.00 -2.04 0.00 0.00 64.05 61.54 2dtg n THR 80 Cb 0.43 -0.65 -0.13 0.00 -1.82 0.00 0.00 70.33 68.16 2dtg n THR 80 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2dtg s VAL 81 N -2.36 0.01 -0.31 12.58 1.01 -0.93 -1.05 120.40 129.35 2dtg s VAL 81 Ca -0.09 -0.04 0.01 0.00 0.00 0.00 0.00 61.98 61.86 2dtg s VAL 81 Cb 0.05 -0.18 0.10 0.00 0.00 0.00 0.00 36.38 36.34 2dtg s VAL 81 CO 0.59 -0.02 0.06 -0.63 0.00 0.00 0.00 175.10 175.10 2dtg s ILE 82 N -0.03 1.44 0.22 2.22 1.01 -0.73 -1.38 121.20 123.95 2dtg s ILE 82 Ca -0.01 -1.70 0.14 0.00 0.00 0.00 0.00 60.65 59.08 2dtg s ILE 82 Cb -0.01 -2.03 0.04 0.00 0.01 0.00 0.00 42.46 40.47 2dtg s ILE 82 CO 0.00 -0.58 1.66 0.08 0.00 0.00 0.00 174.94 176.10 2dtg h ARG 83 N 7.91 0.00 -5.95 2.79 0.11 -1.44 -2.54 114.38 115.26 2dtg h ARG 83 Ca -0.11 0.00 -0.40 0.00 0.10 0.00 0.00 59.98 59.58 2dtg h ARG 83 Cb 1.02 0.00 0.09 0.00 1.11 0.00 0.00 29.97 32.19 2dtg h ARG 83 CO 0.48 0.51 -0.78 0.41 0.10 0.00 0.00 179.97 180.69 2dtg n GLY 84 N 0.26 -0.37 0.19 0.08 0.00 1.06 -0.06 105.19 106.34 2dtg n GLY 84 Ca -0.01 0.14 0.12 0.00 0.00 0.00 0.00 46.02 46.28 2dtg n GLY 84 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2dtg h SER 85 N -2.01 0.00 -1.90 1.61 4.64 -0.87 -3.26 113.55 111.76 2dtg h SER 85 Ca -0.60 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 60.46 2dtg h SER 85 Cb 1.36 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 63.14 2dtg h SER 85 CO 0.56 0.00 -0.59 -0.60 -0.87 0.00 0.00 176.83 175.33 2dtg s ARG 86 N -3.61 0.41 0.35 4.77 3.00 -1.26 -4.99 118.95 117.62 2dtg s ARG 86 Ca -0.03 -0.11 -0.25 0.00 -1.00 0.00 0.00 55.73 54.34 2dtg s ARG 86 Cb 0.07 -0.49 -0.10 0.00 0.00 0.00 0.00 34.95 34.44 2dtg s ARG 86 CO 0.22 -1.06 0.99 -0.48 0.00 0.00 0.00 175.30 174.97 2dtg s LEU 87 N 2.32 4.26 -0.84 -0.88 0.05 -1.23 -3.82 118.68 118.54 2dtg s LEU 87 Ca 0.11 1.91 -0.25 0.00 0.05 0.00 0.00 54.13 55.95 2dtg s LEU 87 Cb -0.13 -4.09 -0.04 0.00 -2.05 0.00 0.00 46.19 39.87 2dtg s LEU 87 CO -0.28 -0.23 1.94 0.12 -0.55 0.00 0.00 176.35 177.36 2dtg s PHE 88 N -1.65 1.76 -0.97 3.48 5.36 -0.10 -4.04 117.98 121.81 2dtg s PHE 88 Ca 0.53 0.70 -0.28 0.00 -0.96 0.00 0.00 56.93 56.92 2dtg s PHE 88 Cb -0.20 -4.04 0.04 0.00 -0.34 0.00 0.00 43.02 38.48 2dtg s PHE 88 CO 0.25 -1.87 0.52 1.19 -1.46 0.00 0.00 175.22 173.86 2dtg n PHE 89 N 13.83 -1.07 0.00 10.12 3.01 -1.26 -1.51 117.46 140.58 2dtg n PHE 89 Ca 0.36 0.04 0.00 0.00 1.01 0.00 0.00 57.45 58.86 2dtg n PHE 89 Cb 0.48 -2.18 0.00 0.00 -0.01 0.00 0.00 39.48 37.77 2dtg n PHE 89 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2dtg n ASN 90 N -1.50 0.00 -4.56 4.37 4.05 -1.26 -5.06 115.26 111.31 2dtg n ASN 90 Ca -0.09 0.00 -0.34 0.00 0.45 0.00 0.00 54.58 54.60 2dtg n ASN 90 Cb 0.45 0.00 -0.11 0.00 1.23 0.00 0.00 39.78 41.34 2dtg n ASN 90 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 177.26 173.90 2dtg s TYR 91 N -1.78 3.00 0.14 1.20 1.51 -0.57 -3.81 117.35 117.05 2dtg s TYR 91 Ca 0.00 -0.11 0.07 0.00 -1.01 0.00 0.00 57.07 56.03 2dtg s TYR 91 Cb 0.00 -1.83 -0.12 0.00 -0.11 0.00 0.00 41.96 39.90 2dtg s TYR 91 CO 0.00 0.18 1.33 0.00 -1.11 0.00 0.00 175.55 175.96 2dtg h ALA 92 N 5.88 0.45 -3.88 3.71 0.00 0.30 -0.24 119.26 125.48 2dtg h ALA 92 Ca -0.41 -0.85 -0.43 0.00 0.00 0.00 0.00 54.91 53.22 2dtg h ALA 92 Cb 1.18 -0.15 -0.26 0.00 0.00 0.00 0.00 17.79 18.57 2dtg h ALA 92 CO 0.57 1.16 -0.79 -1.17 0.00 0.00 0.00 179.25 179.02 2dtg s LEU 93 N -6.88 2.11 -0.20 0.00 2.96 -0.95 -1.96 118.68 113.77 2dtg s LEU 93 Ca 0.00 -0.35 -0.04 0.00 -0.22 0.00 0.00 54.13 53.52 2dtg s LEU 93 Cb 0.10 -0.57 0.09 0.00 0.50 0.00 0.00 46.19 46.32 2dtg s LEU 93 CO 0.81 0.07 0.25 0.68 -1.32 0.00 0.00 176.35 176.83 2dtg s VAL 94 N -0.63 -0.37 -0.33 1.68 -7.23 -0.99 0.35 120.40 112.87 2dtg s VAL 94 Ca 0.02 -0.06 -0.04 0.00 -1.81 0.00 0.00 61.98 60.10 2dtg s VAL 94 Cb -0.06 -0.66 0.05 0.00 0.56 0.00 0.00 36.38 36.27 2dtg s VAL 94 CO 0.00 -0.15 0.07 -0.63 -0.31 0.00 0.00 175.10 174.08 2dtg s ILE 95 N 2.37 3.35 -0.02 -0.62 -1.09 0.22 -1.54 121.20 123.87 2dtg s ILE 95 Ca 0.07 -1.38 0.01 0.00 -2.23 0.00 0.00 60.65 57.13 2dtg s ILE 95 Cb -0.15 -2.96 0.00 0.00 -1.58 0.00 0.00 42.46 37.77 2dtg s ILE 95 CO -0.12 -0.22 -0.05 0.12 -1.23 0.00 0.00 174.94 173.45 2dtg s PHE 96 N 1.30 0.53 -0.45 3.97 5.36 -1.13 0.49 117.98 128.04 2dtg s PHE 96 Ca -0.02 -0.11 0.00 0.00 -0.96 0.00 0.00 56.93 55.84 2dtg s PHE 96 Cb -0.20 -0.40 0.00 0.00 -0.34 0.00 0.00 43.02 42.08 2dtg s PHE 96 CO 0.00 -0.06 0.00 0.39 -1.46 0.00 0.00 175.22 174.09 2dtg n GLU 97 N 3.31 -1.56 -2.26 10.12 1.02 -0.16 -3.90 120.64 127.21 2dtg n GLU 97 Ca -0.17 0.34 -0.35 0.00 -0.02 0.00 0.00 57.16 56.96 2dtg n GLU 97 Cb 0.56 -4.08 -0.03 0.00 -0.02 0.00 0.00 31.44 27.87 2dtg n GLU 97 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 2dtg n MET 98 N -0.64 2.32 0.00 3.49 2.81 -1.26 -4.17 117.12 119.67 2dtg n MET 98 Ca -0.04 -2.81 0.00 0.00 -1.81 0.00 0.00 57.70 53.04 2dtg n MET 98 Cb 0.23 -3.60 0.00 0.00 -0.71 0.00 0.00 33.22 29.14 2dtg n MET 98 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 2dtg n VAL 99 N 7.09 0.00 0.19 2.03 0.24 -1.26 -3.14 118.33 123.48 2dtg n VAL 99 Ca 0.47 0.20 0.01 0.00 -2.04 0.00 0.00 64.34 62.98 2dtg n VAL 99 Cb 0.46 -0.79 0.02 0.00 -1.47 0.00 0.00 33.84 32.06 2dtg n VAL 99 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2dtg n HIS 100 N 0.00 0.00 -1.88 6.34 8.25 -1.26 -4.43 115.22 122.24 2dtg n HIS 100 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.04 2dtg n HIS 100 Cb 0.00 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.07 2dtg n HIS 100 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2dtg s LEU 101 N -3.74 4.36 -0.05 2.41 0.20 -0.84 -4.25 118.68 116.77 2dtg s LEU 101 Ca -0.00 2.40 0.11 0.00 0.69 0.00 0.00 54.13 57.33 2dtg s LEU 101 Cb 0.01 -3.53 -0.17 0.00 -0.43 0.00 0.00 46.19 42.07 2dtg s LEU 101 CO 0.02 -0.98 0.18 2.29 -0.29 0.00 0.00 176.35 177.57 2dtg n LYS 102 N 7.30 1.00 -3.78 1.98 2.85 -0.55 -1.53 118.16 125.42 2dtg n LYS 102 Ca 0.18 -0.07 -0.13 0.00 -1.05 0.00 0.00 58.31 57.24 2dtg n LYS 102 Cb 0.42 -1.28 -0.10 0.00 -0.65 0.00 0.00 35.03 33.42 2dtg n LYS 102 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 177.40 175.52 2dtg s GLU 103 N -2.63 0.44 0.03 -1.58 -1.05 -1.20 0.16 118.70 112.88 2dtg s GLU 103 Ca -0.05 0.15 -0.27 0.00 -0.15 0.00 0.00 54.97 54.65 2dtg s GLU 103 Cb 0.06 0.20 -0.15 0.00 -0.44 0.00 0.00 34.13 33.81 2dtg s GLU 103 CO 0.48 -0.09 1.30 -0.07 0.95 0.00 0.00 175.26 177.83 2dtg h LEU 104 N 5.03 -0.81 0.00 1.83 3.38 -1.76 -3.34 115.31 119.64 2dtg h LEU 104 Ca -0.28 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2dtg h LEU 104 Cb 1.19 0.21 0.00 0.00 0.09 0.00 0.00 40.66 42.15 2dtg h LEU 104 CO 0.35 -0.54 0.00 0.61 0.09 0.00 0.00 178.44 178.95 2dtg n GLY 105 N -1.18 2.03 3.56 0.83 0.00 -1.26 -0.31 105.19 108.86 2dtg n GLY 105 Ca -0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 2dtg n GLY 105 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dtg s LEU 106 N 0.00 3.48 0.07 0.99 1.43 -1.26 -3.70 118.68 119.68 2dtg s LEU 106 Ca 0.00 -1.39 0.23 0.00 -1.03 0.00 0.00 54.13 51.94 2dtg s LEU 106 Cb 0.00 -2.57 0.09 0.00 0.03 0.00 0.00 46.19 43.74 2dtg s LEU 106 CO 0.00 -1.56 1.07 0.00 0.23 0.00 0.00 176.35 176.09 2dtg n TYR 107 N 9.07 0.34 0.12 0.29 0.18 -1.26 -3.95 117.16 121.96 2dtg n TYR 107 Ca 0.32 0.10 0.07 0.00 1.88 0.00 0.00 57.90 60.27 2dtg n TYR 107 Cb 0.51 -0.50 0.03 0.00 -0.38 0.00 0.00 39.34 39.00 2dtg n TYR 107 CO 0.00 0.00 0.00 -0.91 -2.08 0.00 0.00 176.86 173.87 2dtg h ASN 108 N 0.00 0.00 -2.07 9.48 2.35 -1.73 -3.42 115.58 120.19 2dtg h ASN 108 Ca 0.00 0.00 -0.61 0.00 -0.55 0.00 0.00 56.30 55.14 2dtg h ASN 108 Cb 0.75 0.00 0.03 0.00 0.05 0.00 0.00 38.32 39.15 2dtg h ASN 108 CO 0.00 0.26 1.02 -0.11 -1.65 0.00 0.00 177.43 176.95 2dtg n LEU 109 N -2.97 3.33 0.00 1.61 0.00 -0.18 -4.17 117.00 114.62 2dtg n LEU 109 Ca -0.01 1.00 0.00 0.00 0.00 0.00 0.00 56.01 57.00 2dtg n LEU 109 Cb 0.66 -1.38 0.00 0.00 0.00 0.00 0.00 43.42 42.70 2dtg n LEU 109 CO 0.39 -0.13 0.00 0.23 0.00 0.00 0.00 177.39 177.89 2dtg n MET 110 N 5.82 0.60 -3.56 1.96 2.81 -0.22 -4.97 117.12 119.56 2dtg n MET 110 Ca 0.21 0.00 -0.09 0.00 -1.81 0.00 0.00 57.70 56.02 2dtg n MET 110 Cb 0.29 -0.05 -0.09 0.00 -0.71 0.00 0.00 33.22 32.66 2dtg n MET 110 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 2dtg s ASN 111 N 0.00 -0.10 -0.87 7.83 3.04 -1.21 -4.18 114.94 119.45 2dtg s ASN 111 Ca 0.00 0.75 0.01 0.00 0.04 0.00 0.00 52.86 53.66 2dtg s ASN 111 Cb 0.00 1.26 0.31 0.00 -1.54 0.00 0.00 41.25 41.28 2dtg s ASN 111 CO 0.00 -0.25 1.33 -0.38 -3.04 0.00 0.00 177.10 174.75 2dtg n ILE 112 N 5.38 4.50 -0.00 -5.21 5.41 -0.88 -1.77 119.36 126.79 2dtg n ILE 112 Ca -0.07 -5.74 -0.00 0.00 1.00 0.00 0.00 62.75 57.94 2dtg n ILE 112 Cb 0.50 -1.77 -0.00 0.00 -0.71 0.00 0.00 39.64 37.65 2dtg n ILE 112 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2dtg n THR 113 N 0.46 -0.00 -3.89 1.39 -2.24 -0.96 -4.06 114.28 104.98 2dtg n THR 113 Ca 0.34 0.01 -0.30 0.00 -2.27 0.00 0.00 64.05 61.84 2dtg n THR 113 Cb 0.34 -0.02 -0.16 0.00 -2.10 0.00 0.00 70.33 68.39 2dtg n THR 113 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2dtg s ARG 114 N -3.56 1.36 0.00 -0.78 3.52 0.91 -4.81 118.95 115.58 2dtg s ARG 114 Ca -0.00 -0.94 0.00 0.00 -0.13 0.00 0.00 55.73 54.66 2dtg s ARG 114 Cb 0.00 -2.48 0.00 0.00 -1.56 0.00 0.00 34.95 30.91 2dtg s ARG 114 CO 0.00 -0.66 0.00 0.41 -0.81 0.00 0.00 175.30 174.24 2dtg n GLY 115 N 4.73 1.18 2.00 8.12 0.00 -1.26 -4.05 105.19 115.92 2dtg n GLY 115 Ca -0.10 -1.94 -0.18 0.00 0.00 0.00 0.00 46.02 43.80 2dtg n GLY 115 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dtg n SER 116 N 0.00 2.71 -4.06 1.61 3.41 -1.25 -4.77 113.62 111.27 2dtg n SER 116 Ca 0.00 -2.23 -0.26 0.00 -0.26 0.00 0.00 58.87 56.12 2dtg n SER 116 Cb 0.00 0.21 -0.17 0.00 -0.26 0.00 0.00 64.21 64.00 2dtg n SER 116 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2dtg s VAL 117 N -2.03 1.30 -0.38 -3.33 0.11 -1.26 0.25 120.40 115.05 2dtg s VAL 117 Ca 0.00 -0.58 -0.03 0.00 -2.93 0.00 0.00 61.98 58.44 2dtg s VAL 117 Cb 0.00 -1.16 0.09 0.00 -1.53 0.00 0.00 36.38 33.78 2dtg s VAL 117 CO 0.00 0.39 0.16 -0.60 -3.33 0.00 0.00 175.10 171.72 2dtg s ARG 118 N 0.56 2.16 -0.25 1.54 6.06 0.15 -2.58 118.95 126.59 2dtg s ARG 118 Ca -0.14 -1.65 0.02 0.00 -2.50 0.00 0.00 55.73 51.46 2dtg s ARG 118 Cb -0.16 -3.50 0.06 0.00 0.06 0.00 0.00 34.95 31.41 2dtg s ARG 118 CO 0.04 -0.95 -0.09 0.42 -2.50 0.00 0.00 175.30 172.23 2dtg s ILE 119 N 1.19 1.92 -0.04 4.11 1.01 -0.37 0.71 121.20 129.73 2dtg s ILE 119 Ca 0.05 -1.48 -0.30 0.00 0.00 0.00 0.00 60.65 58.91 2dtg s ILE 119 Cb -0.22 -2.09 0.07 0.00 0.01 0.00 0.00 42.46 40.23 2dtg s ILE 119 CO -0.03 -0.06 0.67 -1.83 0.00 0.00 0.00 174.94 173.69 2dtg s GLU 120 N 1.21 1.06 -0.75 2.79 -1.05 0.18 -2.71 118.70 119.43 2dtg s GLU 120 Ca -0.08 0.22 -0.03 0.00 -0.15 0.00 0.00 54.97 54.93 2dtg s GLU 120 Cb -0.20 0.50 -0.04 0.00 -0.44 0.00 0.00 34.13 33.96 2dtg s GLU 120 CO -0.05 -0.34 0.67 1.63 0.95 0.00 0.00 175.26 178.12 2dtg n LYS 121 N 0.86 -1.54 -0.00 -4.83 5.02 0.31 -2.85 118.16 115.14 2dtg n LYS 121 Ca -0.19 0.89 0.00 0.00 -2.02 0.00 0.00 58.31 56.99 2dtg n LYS 121 Cb 0.57 -4.92 -0.00 0.00 -0.02 0.00 0.00 35.03 30.66 2dtg n LYS 121 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2dtg n ASN 122 N -2.45 4.17 -1.14 4.39 3.02 -0.83 -0.99 115.26 121.43 2dtg n ASN 122 Ca -0.04 -0.08 -0.01 0.00 -0.03 0.00 0.00 54.58 54.43 2dtg n ASN 122 Cb 0.56 1.02 -0.00 0.00 -0.61 0.00 0.00 39.78 40.75 2dtg n ASN 122 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2dtg n ASN 123 N -1.44 -0.25 0.00 6.41 2.85 -1.25 -4.01 115.26 117.56 2dtg n ASN 123 Ca -0.00 0.06 0.00 0.00 -0.11 0.00 0.00 54.58 54.52 2dtg n ASN 123 Cb 0.01 -0.68 0.00 0.00 1.24 0.00 0.00 39.78 40.35 2dtg n ASN 123 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2dtg n GLU 124 N -1.17 1.77 -1.64 1.20 -0.58 -1.26 -4.43 120.64 114.53 2dtg n GLU 124 Ca -0.01 0.00 -0.43 0.00 -0.42 0.00 0.00 57.16 56.31 2dtg n GLU 124 Cb 0.06 -0.19 -0.03 0.00 -0.57 0.00 0.00 31.44 30.71 2dtg n GLU 124 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2dtg s LEU 125 N -0.22 3.92 -0.03 -4.62 1.98 -0.58 -3.63 118.68 115.49 2dtg s LEU 125 Ca 0.00 2.26 -0.04 0.00 -2.89 0.00 0.00 54.13 53.46 2dtg s LEU 125 Cb 0.00 -3.52 -0.01 0.00 0.66 0.00 0.00 46.19 43.32 2dtg s LEU 125 CO 0.00 -1.52 -0.08 0.00 -1.89 0.00 0.00 176.35 172.86 2dtg n TYR 127 N -2.97 2.61 0.00 0.00 0.53 -1.23 -4.12 117.16 111.98 2dtg n TYR 127 Ca -0.03 -1.55 0.00 0.00 -1.02 0.00 0.00 57.90 55.30 2dtg n TYR 127 Cb 0.11 -2.45 0.00 0.00 -1.03 0.00 0.00 39.34 35.98 2dtg n TYR 127 CO 0.00 0.00 0.00 -0.11 -1.02 0.00 0.00 176.86 175.73 2dtg n LEU 128 N 12.98 0.00 -0.00 7.72 0.00 -1.26 -4.35 117.00 132.08 2dtg n LEU 128 Ca 0.46 0.00 0.09 0.00 0.00 0.00 0.00 56.01 56.56 2dtg n LEU 128 Cb 0.45 0.00 -0.11 0.00 0.00 0.00 0.00 43.42 43.76 2dtg n LEU 128 CO 0.75 0.00 -0.14 0.00 0.00 0.00 0.00 177.39 178.00 2dtg n ALA 129 N -1.15 4.25 0.12 1.96 0.00 -1.26 -4.17 120.51 120.27 2dtg n ALA 129 Ca 0.00 -0.53 0.02 0.00 0.00 0.00 0.00 53.44 52.93 2dtg n ALA 129 Cb 0.10 -0.69 0.00 0.00 0.00 0.00 0.00 19.45 18.86 2dtg n ALA 129 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2dtg h THR 130 N 0.00 0.77 -3.58 0.00 1.35 -1.84 -3.45 112.91 106.15 2dtg h THR 130 Ca 0.00 -2.14 -0.52 0.00 -0.55 0.00 0.00 66.41 63.21 2dtg h THR 130 Cb 0.51 2.32 -0.03 0.00 -1.73 0.00 0.00 68.15 69.23 2dtg h THR 130 CO 0.00 0.44 0.11 0.27 -0.25 0.00 0.00 175.52 176.08 2dtg s ILE 131 N -2.96 4.58 -0.52 6.82 -4.36 -1.19 -1.80 121.20 121.76 2dtg s ILE 131 Ca 0.03 1.25 -0.08 0.00 -0.26 0.00 0.00 60.65 61.59 2dtg s ILE 131 Cb 0.08 -3.83 0.13 0.00 1.25 0.00 0.00 42.46 40.09 2dtg s ILE 131 CO 0.76 0.17 0.38 -0.62 0.24 0.00 0.00 174.94 175.87 2dtg s ASP 132 N -1.71 5.67 0.32 4.36 3.68 -1.26 -4.92 116.67 122.81 2dtg s ASP 132 Ca 0.44 -2.14 0.24 0.00 2.13 0.00 0.00 52.55 53.22 2dtg s ASP 132 Cb -0.16 -1.98 1.16 0.00 -1.45 0.00 0.00 42.92 40.49 2dtg s ASP 132 CO 0.21 -0.62 1.74 -0.50 0.13 0.00 0.00 175.17 176.13 2dtg h TRP 133 N 8.13 0.00 -0.48 -5.34 4.06 -1.95 -2.45 115.95 117.92 2dtg h TRP 133 Ca -0.14 0.00 0.06 0.00 2.06 0.00 0.00 58.89 60.86 2dtg h TRP 133 Cb 1.05 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 29.18 2dtg h TRP 133 CO 0.67 0.00 0.32 1.03 -3.56 0.00 0.00 178.44 176.90 2dtg h SER 134 N 0.00 0.37 0.80 -3.49 0.87 -1.91 0.21 113.55 110.40 2dtg h SER 134 Ca 0.00 -0.00 -0.24 0.00 -1.23 0.00 0.00 61.79 60.32 2dtg h SER 134 Cb 0.19 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 62.05 2dtg h SER 134 CO 0.00 0.25 -1.21 -0.09 -0.53 0.00 0.00 176.83 175.25 2dtg h ARG 135 N 0.43 0.07 0.02 2.24 1.12 -1.82 -3.39 114.38 113.05 2dtg h ARG 135 Ca 0.21 -0.12 -0.00 0.00 -1.11 0.00 0.00 59.98 58.95 2dtg h ARG 135 Cb 0.28 0.05 0.00 0.00 -0.01 0.00 0.00 29.97 30.28 2dtg h ARG 135 CO -0.05 0.97 -0.01 0.82 -3.11 0.00 0.00 179.97 178.59 2dtg h ILE 136 N 0.02 0.71 -2.58 1.20 2.04 -1.36 -3.44 117.51 114.09 2dtg h ILE 136 Ca -0.10 -1.48 -0.46 0.00 1.00 0.00 0.00 64.86 63.82 2dtg h ILE 136 Cb 1.87 1.32 0.02 0.00 -0.74 0.00 0.00 36.82 39.29 2dtg h ILE 136 CO 0.14 0.24 -0.18 -0.76 0.00 0.00 0.00 178.15 177.58 2dtg s LEU 137 N -8.48 3.85 0.00 1.44 1.02 0.64 -2.08 118.68 115.07 2dtg s LEU 137 Ca -0.08 0.25 0.24 0.00 0.02 0.00 0.00 54.13 54.57 2dtg s LEU 137 Cb -0.01 -3.13 0.35 0.00 0.02 0.00 0.00 46.19 43.42 2dtg s LEU 137 CO 0.29 -0.49 1.31 0.47 0.02 0.00 0.00 176.35 177.95 2dtg n ASP 138 N -1.88 1.23 -3.60 2.29 9.92 -1.26 -4.55 116.55 118.70 2dtg n ASP 138 Ca -0.01 -0.98 -0.02 0.00 -0.53 0.00 0.00 54.79 53.24 2dtg n ASP 138 Cb 0.57 0.37 -0.06 0.00 -0.64 0.00 0.00 41.12 41.37 2dtg n ASP 138 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 2dtg s SER 139 N -2.65 -0.68 0.00 -2.24 0.15 -1.26 -5.06 113.70 101.97 2dtg s SER 139 Ca 0.18 1.03 0.10 0.00 0.70 0.00 0.00 55.95 57.96 2dtg s SER 139 Cb 0.18 1.44 0.23 0.00 -1.71 0.00 0.00 66.02 66.17 2dtg s SER 139 CO 0.61 -0.16 1.13 1.33 1.20 0.00 0.00 173.24 177.36 2dtg n VAL 140 N 4.25 0.75 -0.32 4.45 0.24 -1.26 -4.57 118.33 121.87 2dtg n VAL 140 Ca -0.16 -0.87 0.03 0.00 -2.04 0.00 0.00 64.34 61.29 2dtg n VAL 140 Cb 0.56 0.68 0.18 0.00 -1.47 0.00 0.00 33.84 33.79 2dtg n VAL 140 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 2dtg h GLU 141 N 1.91 0.88 0.00 7.34 4.81 -2.01 0.31 114.58 127.82 2dtg h GLU 141 Ca 0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2dtg h GLU 141 Cb 0.64 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.82 2dtg h GLU 141 CO 0.00 0.58 0.00 -0.40 -0.73 0.00 0.00 179.01 178.46 2dtg n ASP 142 N -4.67 0.00 -4.75 1.04 5.68 -1.26 -4.85 116.55 107.74 2dtg n ASP 142 Ca 0.14 -1.08 -0.29 0.00 -0.50 0.00 0.00 54.79 53.07 2dtg n ASP 142 Cb 0.26 0.00 0.13 0.00 -1.14 0.00 0.00 41.12 40.37 2dtg n ASP 142 CO 0.00 0.00 0.00 0.20 -1.33 0.00 0.00 177.20 176.07 2dtg s ASN 143 N -1.68 3.57 -0.30 -1.12 -0.87 0.11 -4.68 114.94 109.97 2dtg s ASN 143 Ca 0.21 1.23 -0.01 0.00 -1.57 0.00 0.00 52.86 52.71 2dtg s ASN 143 Cb 0.10 -1.89 0.19 0.00 -0.02 0.00 0.00 41.25 39.62 2dtg s ASN 143 CO 0.16 -2.55 0.60 -2.28 -2.57 0.00 0.00 177.10 170.46 2dtg s HIS 144 N -3.10 -1.58 -0.28 2.20 2.46 -1.06 -5.01 115.29 108.91 2dtg s HIS 144 Ca 0.63 1.74 -0.03 0.00 0.47 0.00 0.00 55.06 57.87 2dtg s HIS 144 Cb -0.16 0.57 0.09 0.00 -0.13 0.00 0.00 32.58 32.96 2dtg s HIS 144 CO 0.55 -0.87 0.11 0.42 -2.47 0.00 0.00 174.74 172.48 2dtg s ILE 145 N 2.86 0.37 0.15 0.89 1.01 -1.25 -1.24 121.20 124.00 2dtg s ILE 145 Ca 0.20 -0.98 0.05 0.00 0.00 0.00 0.00 60.65 59.92 2dtg s ILE 145 Cb -0.15 -1.25 -0.04 0.00 0.01 0.00 0.00 42.46 41.03 2dtg s ILE 145 CO -0.21 -0.64 -0.10 -0.69 0.00 0.00 0.00 174.94 173.30 2dtg s VAL 146 N 1.88 1.21 -0.80 2.92 1.01 -1.10 -4.94 120.40 120.57 2dtg s VAL 146 Ca 0.08 -2.06 -0.01 0.00 0.00 0.00 0.00 61.98 59.99 2dtg s VAL 146 Cb -0.17 -1.85 0.00 0.00 0.00 0.00 0.00 36.38 34.37 2dtg s VAL 146 CO -0.28 -0.73 0.62 0.18 0.00 0.00 0.00 175.10 174.89 2dtg n LEU 147 N -0.19 -2.83 0.00 3.92 4.77 -1.26 -1.43 117.00 119.98 2dtg n LEU 147 Ca -0.10 -0.78 -0.18 0.00 -0.03 0.00 0.00 56.01 54.92 2dtg n LEU 147 Cb 0.60 -1.94 -0.05 0.00 -2.33 0.00 0.00 43.42 39.70 2dtg n LEU 147 CO 0.32 0.08 -0.12 0.59 -1.33 0.00 0.00 177.39 176.94 2dtg n ASN 148 N -2.39 1.11 -0.05 -1.43 3.02 -1.26 -0.53 115.26 113.73 2dtg n ASN 148 Ca -0.26 -2.57 -0.10 0.00 -0.03 0.00 0.00 54.58 51.62 2dtg n ASN 148 Cb 0.66 0.76 -0.04 0.00 -0.61 0.00 0.00 39.78 40.55 2dtg n ASN 148 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2dtg h LYS 149 N 0.00 0.28 -0.39 3.52 3.64 -1.68 -2.96 116.57 118.97 2dtg h LYS 149 Ca -0.23 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.06 2dtg h LYS 149 Cb 0.88 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.62 2dtg h LYS 149 CO 0.36 0.22 -0.05 0.22 -2.27 0.00 0.00 179.45 177.93 2dtg h ASP 150 N 0.25 0.61 0.00 4.20 -0.00 -1.58 -2.66 116.42 117.24 2dtg h ASP 150 Ca 0.07 -0.15 0.00 0.00 -0.00 0.00 0.00 57.03 56.96 2dtg h ASP 150 Cb 0.01 -0.16 0.00 0.00 -0.00 0.00 0.00 39.33 39.18 2dtg h ASP 150 CO -0.01 0.71 0.01 0.47 -0.00 0.00 0.00 179.24 180.42 2dtg n ASP 151 N -4.22 0.00 -3.88 2.28 9.92 -1.12 -4.01 116.55 115.52 2dtg n ASP 151 Ca 0.02 0.44 -0.30 0.00 -0.53 0.00 0.00 54.79 54.42 2dtg n ASP 151 Cb 0.30 -0.44 -0.13 0.00 -0.64 0.00 0.00 41.12 40.20 2dtg n ASP 151 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 2dtg s ASN 152 N -2.88 4.17 0.90 -2.24 2.47 -1.00 -4.91 114.94 111.44 2dtg s ASN 152 Ca 0.00 -3.04 0.00 0.00 0.42 0.00 0.00 52.86 50.24 2dtg s ASN 152 Cb 0.00 -1.47 0.00 0.00 -1.45 0.00 0.00 41.25 38.33 2dtg s ASN 152 CO 0.00 -0.22 0.00 1.21 -3.72 0.00 0.00 177.10 174.37 2dtg n GLU 153 N 3.05 0.00 -1.87 0.43 2.13 -1.26 -4.71 120.64 118.42 2dtg n GLU 153 Ca 0.08 0.00 -0.41 0.00 0.66 0.00 0.00 57.16 57.49 2dtg n GLU 153 Cb 0.33 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 32.02 2dtg n GLU 153 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2dtg s GLU 154 N 0.00 4.18 0.00 5.31 0.41 -1.26 -4.88 118.70 122.45 2dtg s GLU 154 Ca 0.00 2.47 0.00 0.00 -0.41 0.00 0.00 54.97 57.03 2dtg s GLU 154 Cb 0.00 -3.06 0.00 0.00 -1.78 0.00 0.00 34.13 29.29 2dtg s GLU 154 CO 0.00 -0.56 0.00 0.00 -0.49 0.00 0.00 175.26 174.21 2dtg n GLY 156 N 2.95 0.69 3.12 0.00 0.00 -1.26 -5.05 105.19 105.63 2dtg n GLY 156 Ca 0.00 -0.40 -0.43 0.00 0.00 0.00 0.00 46.02 45.19 2dtg n GLY 156 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dtg n ASP 157 N 0.00 4.88 -4.50 1.61 10.43 -1.26 -4.91 116.55 122.80 2dtg n ASP 157 Ca 0.00 -2.99 -0.44 0.00 2.57 0.00 0.00 54.79 53.93 2dtg n ASP 157 Cb 0.00 -1.58 -0.00 0.00 1.84 0.00 0.00 41.12 41.38 2dtg n ASP 157 CO 0.00 0.00 0.00 0.27 -1.07 0.00 0.00 177.20 176.40 2dtg s ILE 158 N 1.82 4.72 0.00 0.53 -5.25 -1.26 -4.96 121.20 116.80 2dtg s ILE 158 Ca 0.44 -2.35 0.00 0.00 -0.99 0.00 0.00 60.65 57.75 2dtg s ILE 158 Cb 0.06 -5.00 0.00 0.00 2.95 0.00 0.00 42.46 40.47 2dtg s ILE 158 CO -0.00 -1.75 0.00 0.00 -1.79 0.00 0.00 174.94 171.39 2dtg n PRO 160 N 0.00 0.00 -3.82 0.00 -0.02 -1.26 -4.47 135.00 125.42 2dtg n PRO 160 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2dtg n PRO 160 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2dtg n PRO 160 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dtg n GLY 161 N 0.00 -0.67 1.03 -1.23 0.00 -0.98 -4.64 105.19 98.71 2dtg n GLY 161 Ca 0.00 -1.05 0.03 0.00 0.00 0.00 0.00 46.02 45.00 2dtg n GLY 161 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2dtg n THR 162 N 7.41 1.09 0.99 2.61 5.66 -1.26 -3.49 114.28 127.29 2dtg n THR 162 Ca 0.00 -0.59 0.12 0.00 -3.05 0.00 0.00 64.05 60.53 2dtg n THR 162 Cb 0.00 -0.29 0.08 0.00 -1.55 0.00 0.00 70.33 68.57 2dtg n THR 162 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2dtg n ALA 163 N 0.31 2.67 -0.38 1.79 0.00 -1.26 -5.08 120.51 118.57 2dtg n ALA 163 Ca 0.12 -0.68 0.00 0.00 0.00 0.00 0.00 53.44 52.88 2dtg n ALA 163 Cb 0.60 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 19.25 2dtg n ALA 163 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2dtg n LYS 164 N 1.08 0.00 0.00 0.00 4.76 -1.23 -5.03 118.16 117.74 2dtg n LYS 164 Ca 0.13 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.57 2dtg n LYS 164 Cb 0.57 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.76 2dtg n LYS 164 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dtg n GLY 165 N 0.00 0.23 0.00 0.72 0.00 -1.26 -4.55 105.19 100.33 2dtg n GLY 165 Ca 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.06 2dtg n GLY 165 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2dtg n LYS 166 N 10.33 3.55 -4.18 1.61 2.85 -1.26 -5.09 118.16 125.97 2dtg n LYS 166 Ca 0.00 0.00 -0.17 0.00 -1.05 0.00 0.00 58.31 57.09 2dtg n LYS 166 Cb 0.00 -0.33 -0.06 0.00 -0.65 0.00 0.00 35.03 33.99 2dtg n LYS 166 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 2dtg s THR 167 N -0.09 0.00 0.00 0.58 -1.32 -1.26 -4.76 115.64 108.78 2dtg s THR 167 Ca 0.00 -1.80 0.00 0.00 -1.21 0.00 0.00 61.69 58.68 2dtg s THR 167 Cb 0.00 -2.58 0.00 0.00 -1.51 0.00 0.00 72.50 68.41 2dtg s THR 167 CO 0.00 0.00 0.00 -3.20 -2.21 0.00 0.00 174.62 169.21 2dtg n ASN 168 N -1.46 0.00 -4.79 8.08 2.85 -1.26 -4.88 115.26 113.80 2dtg n ASN 168 Ca 0.04 0.00 -0.35 0.00 -0.11 0.00 0.00 54.58 54.16 2dtg n ASN 168 Cb 0.62 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.61 2dtg n ASN 168 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2dtg s PRO 170 N -3.07 1.23 0.03 0.00 0.02 -1.26 -4.76 135.00 127.19 2dtg s PRO 170 Ca 0.66 1.10 -0.02 0.00 0.02 0.00 0.00 61.00 62.76 2dtg s PRO 170 Cb -0.18 -1.78 -0.02 0.00 0.02 0.00 0.00 34.50 32.53 2dtg s PRO 170 CO 0.22 -2.34 0.01 0.00 -0.33 0.00 0.00 177.00 174.56 2dtg s ALA 171 N -2.80 0.16 0.41 -1.55 0.00 -1.26 -2.09 121.76 114.63 2dtg s ALA 171 Ca 0.64 -0.73 0.05 0.00 0.00 0.00 0.00 51.96 51.91 2dtg s ALA 171 Cb -0.20 0.21 -0.02 0.00 0.00 0.00 0.00 23.12 23.11 2dtg s ALA 171 CO 0.58 -0.26 0.17 -0.08 0.00 0.00 0.00 175.76 176.17 2dtg s THR 172 N -2.44 0.42 -0.52 0.00 -1.32 -0.38 -4.92 115.64 106.48 2dtg s THR 172 Ca -0.07 -2.00 0.04 0.00 -1.21 0.00 0.00 61.69 58.45 2dtg s THR 172 Cb -0.03 -2.32 0.17 0.00 -1.51 0.00 0.00 72.50 68.81 2dtg s THR 172 CO -0.04 0.00 0.38 -0.69 -2.21 0.00 0.00 174.62 172.06 2dtg s VAL 173 N -3.22 1.42 -0.09 5.08 1.01 -1.25 0.03 120.40 123.38 2dtg s VAL 173 Ca 0.25 -3.24 -0.16 0.00 0.00 0.00 0.00 61.98 58.83 2dtg s VAL 173 Cb 0.02 -1.96 -0.05 0.00 0.00 0.00 0.00 36.38 34.39 2dtg s VAL 173 CO 0.17 -1.11 0.41 -0.63 0.00 0.00 0.00 175.10 173.95 2dtg s ILE 174 N -0.46 5.16 -0.37 2.22 -1.09 -1.03 -3.90 121.20 121.73 2dtg s ILE 174 Ca 0.28 0.82 0.00 0.00 -2.23 0.00 0.00 60.65 59.52 2dtg s ILE 174 Cb -0.03 -3.74 0.00 0.00 -1.58 0.00 0.00 42.46 37.11 2dtg s ILE 174 CO -0.16 0.42 0.00 0.59 -1.23 0.00 0.00 174.94 174.57 2dtg n ASN 175 N 3.03 -2.15 0.00 3.58 4.13 -1.26 -3.45 115.26 119.15 2dtg n ASN 175 Ca -0.10 0.01 0.00 0.00 1.68 0.00 0.00 54.58 56.16 2dtg n ASN 175 Cb 0.52 -1.39 0.00 0.00 -1.54 0.00 0.00 39.78 37.37 2dtg n ASN 175 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2dtg n GLY 176 N -1.16 2.96 3.81 7.41 0.00 -1.25 -4.99 105.19 111.97 2dtg n GLY 176 Ca -0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 2dtg n GLY 176 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dtg s GLN 177 N -0.00 4.06 -0.13 1.61 -0.21 -1.22 -5.00 119.66 118.77 2dtg s GLN 177 Ca 0.00 0.51 -0.19 0.00 0.02 0.00 0.00 55.36 55.70 2dtg s GLN 177 Cb 0.00 -3.26 -0.04 0.00 1.00 0.00 0.00 33.01 30.71 2dtg s GLN 177 CO 0.00 0.59 0.50 0.12 -2.12 0.00 0.00 175.29 174.39 2dtg s PHE 178 N -0.82 3.49 0.08 0.91 2.19 -1.26 -2.47 117.98 120.10 2dtg s PHE 178 Ca 0.25 0.90 -0.10 0.00 0.33 0.00 0.00 56.93 58.31 2dtg s PHE 178 Cb -0.17 -2.59 0.00 0.00 -1.31 0.00 0.00 43.02 38.95 2dtg s PHE 178 CO 0.14 0.11 0.22 0.54 1.83 0.00 0.00 175.22 178.07 2dtg s VAL 179 N 0.82 0.12 0.80 3.12 0.11 0.10 -4.97 120.40 120.51 2dtg s VAL 179 Ca 0.27 -1.02 -0.11 0.00 -2.93 0.00 0.00 61.98 58.18 2dtg s VAL 179 Cb -0.15 -1.20 0.07 0.00 -1.53 0.00 0.00 36.38 33.57 2dtg s VAL 179 CO 0.11 -0.56 1.09 -1.61 -3.33 0.00 0.00 175.10 170.79 2dtg s GLU 180 N -3.48 2.05 -0.09 1.54 2.02 -1.26 -1.24 118.70 118.23 2dtg s GLU 180 Ca 0.02 0.83 -0.00 0.00 0.02 0.00 0.00 54.97 55.84 2dtg s GLU 180 Cb 0.03 -1.90 0.02 0.00 0.10 0.00 0.00 34.13 32.38 2dtg s GLU 180 CO -0.09 -1.69 -0.06 1.03 0.02 0.00 0.00 175.26 174.46 2dtg s ARG 181 N -5.04 1.30 0.30 1.61 3.00 -0.89 -4.75 118.95 114.48 2dtg s ARG 181 Ca 0.61 -0.19 -0.14 0.00 0.00 0.00 0.00 55.73 56.02 2dtg s ARG 181 Cb -0.16 -1.37 0.01 0.00 0.00 0.00 0.00 34.95 33.44 2dtg s ARG 181 CO 0.55 -0.22 0.60 0.00 0.00 0.00 0.00 175.30 176.24 2dtg n TRP 183 N -0.46 0.00 -3.53 0.00 7.02 -1.16 -3.18 117.44 116.13 2dtg n TRP 183 Ca -0.03 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.45 2dtg n TRP 183 Cb 0.61 -0.84 0.00 0.00 -2.42 0.00 0.00 31.31 28.66 2dtg n TRP 183 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 2dtg n THR 184 N -3.44 0.00 0.04 -0.99 -2.24 -1.24 -4.25 114.28 102.16 2dtg n THR 184 Ca -0.41 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.38 2dtg n THR 184 Cb 0.88 0.00 0.34 0.00 -2.10 0.00 0.00 70.33 69.45 2dtg n THR 184 CO 0.00 0.00 0.00 1.12 -0.57 0.00 0.00 175.07 175.62 2dtg h HIS 185 N 0.53 0.44 0.00 4.78 2.07 -1.84 -3.38 115.15 117.75 2dtg h HIS 185 Ca 0.00 -0.04 0.00 0.00 -2.85 0.00 0.00 60.37 57.48 2dtg h HIS 185 Cb 0.00 -0.13 0.00 0.00 2.57 0.00 0.00 27.41 29.85 2dtg h HIS 185 CO 0.00 0.46 -0.33 -1.13 -3.07 0.00 0.00 177.93 173.85 2dtg n SER 186 N -4.30 0.72 -4.74 3.10 3.41 -1.26 -2.31 113.62 108.24 2dtg n SER 186 Ca 0.01 0.18 -0.42 0.00 -0.26 0.00 0.00 58.87 58.38 2dtg n SER 186 Cb 0.23 -0.60 -0.02 0.00 -0.26 0.00 0.00 64.21 63.56 2dtg n SER 186 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2dtg s HIS 187 N -1.66 2.80 0.21 7.33 4.02 -1.26 -4.19 115.29 122.53 2dtg s HIS 187 Ca -0.10 0.58 -0.03 0.00 1.02 0.00 0.00 55.06 56.54 2dtg s HIS 187 Cb 0.01 -4.12 -0.05 0.00 -1.02 0.00 0.00 32.58 27.41 2dtg s HIS 187 CO 0.14 -3.96 0.42 0.00 1.02 0.00 0.00 174.74 172.36 2dtg s GLN 189 N -3.21 4.23 -0.28 0.00 0.74 -0.80 -4.76 119.66 115.59 2dtg s GLN 189 Ca 0.40 1.75 -0.28 0.00 0.05 0.00 0.00 55.36 57.28 2dtg s GLN 189 Cb -0.11 -3.79 -0.05 0.00 1.10 0.00 0.00 33.01 30.17 2dtg s GLN 189 CO 0.28 -0.71 2.18 0.21 -0.55 0.00 0.00 175.29 176.69 2dtg s LYS 190 N 3.50 3.01 0.12 1.67 2.20 -1.26 -4.73 119.74 124.25 2dtg s LYS 190 Ca 0.58 1.83 0.05 0.00 -0.36 0.00 0.00 55.97 58.07 2dtg s LYS 190 Cb -0.24 -4.38 -0.04 0.00 -1.51 0.00 0.00 37.83 31.67 2dtg s LYS 190 CO 0.17 -2.24 0.03 0.08 -0.36 0.00 0.00 175.35 173.04 2dtg s VAL 191 N 8.64 4.10 0.12 4.02 1.01 -1.26 -5.06 120.40 131.96 2dtg s VAL 191 Ca 0.97 -1.07 0.06 0.00 0.00 0.00 0.00 61.98 61.94 2dtg s VAL 191 Cb -0.29 -3.01 -0.04 0.00 0.00 0.00 0.00 36.38 33.05 2dtg s VAL 191 CO 0.33 0.03 -0.16 0.00 0.00 0.00 0.00 175.10 175.31 2dtg s PRO 193 N -2.40 4.22 0.62 0.00 0.04 -1.26 -4.83 135.00 131.38 2dtg s PRO 193 Ca 0.07 2.38 0.24 0.00 0.04 0.00 0.00 61.00 63.73 2dtg s PRO 193 Cb -0.07 -3.12 1.06 0.00 0.04 0.00 0.00 34.50 32.40 2dtg s PRO 193 CO 0.04 -0.56 1.53 1.79 0.04 0.00 0.00 177.00 179.83 2dtg h THR 194 N 3.81 0.11 0.00 1.26 1.35 -2.00 1.87 112.91 119.32 2dtg h THR 194 Ca -0.44 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.41 2dtg h THR 194 Cb 1.21 0.29 -0.00 0.00 -1.73 0.00 0.00 68.15 67.91 2dtg h THR 194 CO 0.87 0.00 -0.07 0.16 -0.25 0.00 0.00 175.52 176.23 2dtg h ILE 195 N 0.00 0.13 0.00 6.82 3.07 -2.03 -3.00 117.51 122.51 2dtg h ILE 195 Ca 0.26 -1.04 -0.10 0.00 1.55 0.00 0.00 64.86 65.54 2dtg h ILE 195 Cb 1.93 1.92 -0.01 0.00 -0.27 0.00 0.00 36.82 40.39 2dtg h ILE 195 CO -0.00 0.07 -0.48 0.00 -1.05 0.00 0.00 178.15 176.69 2dtg n LYS 197 N -3.21 0.00 -0.00 0.00 5.02 -1.14 -1.78 118.16 117.06 2dtg n LYS 197 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 2dtg n LYS 197 Cb 0.72 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.73 2dtg n LYS 197 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2dtg n SER 198 N -0.08 0.44 0.02 4.39 3.41 -1.26 -4.01 113.62 116.53 2dtg n SER 198 Ca 0.00 -2.00 -0.12 0.00 -0.26 0.00 0.00 58.87 56.49 2dtg n SER 198 Cb 0.00 -0.22 -0.14 0.00 -0.26 0.00 0.00 64.21 63.60 2dtg n SER 198 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 2dtg h HIS 199 N 0.01 0.20 0.00 7.33 3.86 -1.39 -3.34 115.15 121.82 2dtg h HIS 199 Ca 0.00 -0.15 0.00 0.00 -1.16 0.00 0.00 60.37 59.06 2dtg h HIS 199 Cb 0.22 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.68 2dtg h HIS 199 CO 0.00 1.21 0.00 0.41 0.86 0.00 0.00 177.93 180.42 2dtg n GLY 200 N 1.61 2.07 3.91 2.45 0.00 -1.26 -3.37 105.19 110.60 2dtg n GLY 200 Ca -0.16 -1.96 -0.21 0.00 0.00 0.00 0.00 46.02 43.70 2dtg n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dtg n THR 202 N -1.68 0.00 -0.54 0.00 -2.24 -1.15 -4.60 114.28 104.07 2dtg n THR 202 Ca 0.05 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.67 2dtg n THR 202 Cb 0.62 -0.20 -0.02 0.00 -2.10 0.00 0.00 70.33 68.63 2dtg n THR 202 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dtg n ALA 203 N -3.00 3.75 -1.38 6.98 0.00 -1.26 -4.33 120.51 121.27 2dtg n ALA 203 Ca 0.00 -1.44 0.00 0.00 0.00 0.00 0.00 53.44 52.00 2dtg n ALA 203 Cb 0.00 -2.83 0.00 0.00 0.00 0.00 0.00 19.45 16.62 2dtg n ALA 203 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2dtg n GLU 204 N 4.29 0.00 0.00 0.00 1.02 -1.26 -4.92 120.64 119.77 2dtg n GLU 204 Ca 0.32 0.46 0.00 0.00 -0.02 0.00 0.00 57.16 57.92 2dtg n GLU 204 Cb 0.12 -0.92 0.00 0.00 -0.02 0.00 0.00 31.44 30.62 2dtg n GLU 204 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dtg n GLY 205 N 0.07 1.16 0.67 0.62 0.00 -1.26 -5.08 105.19 101.38 2dtg n GLY 205 Ca 0.00 -0.76 -0.08 0.00 0.00 0.00 0.00 46.02 45.18 2dtg n GLY 205 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dtg n LEU 206 N 0.00 -1.03 -4.63 0.99 7.99 -1.26 -4.44 117.00 114.62 2dtg n LEU 206 Ca 0.00 0.09 -0.35 0.00 -0.01 0.00 0.00 56.01 55.75 2dtg n LEU 206 Cb 0.00 -0.17 -0.10 0.00 -0.11 0.00 0.00 43.42 43.04 2dtg n LEU 206 CO 0.00 -1.16 -0.29 0.00 -1.51 0.00 0.00 177.39 174.43 2dtg n HIS 209 N -4.92 -1.44 0.00 0.00 -0.00 -1.26 -4.50 115.22 103.10 2dtg n HIS 209 Ca 0.04 0.20 -0.12 0.00 0.46 0.00 0.00 57.72 58.29 2dtg n HIS 209 Cb 0.56 -1.55 -0.08 0.00 -0.12 0.00 0.00 29.99 28.80 2dtg n HIS 209 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 2dtg h SER 210 N -1.93 0.06 -1.54 0.26 0.87 -1.97 -3.29 113.55 106.01 2dtg h SER 210 Ca -0.52 -0.24 -0.76 0.00 -1.23 0.00 0.00 61.79 59.04 2dtg h SER 210 Cb 1.36 -0.01 -0.17 0.00 -0.44 0.00 0.00 62.40 63.14 2dtg h SER 210 CO 0.36 0.28 1.96 -0.62 -0.53 0.00 0.00 176.83 178.28 2dtg n GLU 211 N -4.94 4.59 -3.86 2.24 1.02 -1.26 -4.90 120.64 113.53 2dtg n GLU 211 Ca -0.07 -3.79 -0.09 0.00 -0.02 0.00 0.00 57.16 53.18 2dtg n GLU 211 Cb 0.14 -2.64 -0.07 0.00 -0.02 0.00 0.00 31.44 28.86 2dtg n GLU 211 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dtg s LEU 213 N -2.89 1.29 0.00 0.00 2.34 0.10 -3.51 118.68 116.01 2dtg s LEU 213 Ca 0.09 -0.11 0.00 0.00 0.06 0.00 0.00 54.13 54.17 2dtg s LEU 213 Cb 0.04 0.91 0.00 0.00 -0.56 0.00 0.00 46.19 46.57 2dtg s LEU 213 CO -0.07 -0.41 0.00 0.61 -1.06 0.00 0.00 176.35 175.42 2dtg n GLY 214 N 1.35 1.76 1.30 -3.48 0.00 -1.22 -4.26 105.19 100.64 2dtg n GLY 214 Ca -0.22 -0.29 -0.11 0.00 0.00 0.00 0.00 46.02 45.40 2dtg n GLY 214 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2dtg n ASN 215 N 4.99 1.79 -3.63 1.61 5.03 -1.26 -3.82 115.26 119.96 2dtg n ASN 215 Ca 0.00 -1.82 -0.04 0.00 0.87 0.00 0.00 54.58 53.59 2dtg n ASN 215 Cb 0.00 0.26 -0.05 0.00 -1.02 0.00 0.00 39.78 38.97 2dtg n ASN 215 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2dtg n SER 217 N 0.76 1.55 0.00 0.00 7.64 0.16 -4.84 113.62 118.88 2dtg n SER 217 Ca -0.04 -2.08 0.00 0.00 1.01 0.00 0.00 58.87 57.76 2dtg n SER 217 Cb 0.58 -0.52 0.00 0.00 -1.01 0.00 0.00 64.21 63.27 2dtg n SER 217 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dtg n GLN 218 N 0.08 0.00 -3.13 1.43 10.64 -1.26 -5.06 117.38 120.08 2dtg n GLN 218 Ca 0.03 0.00 -0.19 0.00 -1.83 0.00 0.00 57.00 55.00 2dtg n GLN 218 Cb 0.35 0.00 0.04 0.00 -0.86 0.00 0.00 30.24 29.77 2dtg n GLN 218 CO 0.00 0.00 0.00 -2.14 -1.83 0.00 0.00 177.06 173.09 2dtg s PRO 219 N -2.15 2.46 -1.52 2.61 0.02 -1.26 -4.58 135.00 130.58 2dtg s PRO 219 Ca 0.00 -1.56 -0.08 0.00 0.02 0.00 0.00 61.00 59.39 2dtg s PRO 219 Cb 0.00 -2.62 0.06 0.00 0.02 0.00 0.00 34.50 31.96 2dtg s PRO 219 CO 0.00 -0.64 0.61 -0.25 -0.33 0.00 0.00 177.00 176.39 2dtg n ASP 220 N -2.05 -1.82 -3.12 2.53 10.43 -1.26 -4.83 116.55 116.42 2dtg n ASP 220 Ca 0.11 -0.98 0.03 0.00 2.57 0.00 0.00 54.79 56.53 2dtg n ASP 220 Cb 0.61 -3.08 -0.00 0.00 1.84 0.00 0.00 41.12 40.49 2dtg n ASP 220 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 2dtg s ASP 221 N -3.90 -1.17 0.21 -2.24 3.68 -1.26 -5.00 116.67 106.98 2dtg s ASP 221 Ca 0.32 -0.09 -0.09 0.00 2.13 0.00 0.00 52.55 54.82 2dtg s ASP 221 Cb -0.17 1.65 0.15 0.00 -1.45 0.00 0.00 42.92 43.11 2dtg s ASP 221 CO 0.89 -0.19 1.80 1.55 0.13 0.00 0.00 175.17 179.35 2dtg h PRO 222 N 7.31 1.14 -0.99 4.34 0.13 -1.92 -2.86 132.00 139.14 2dtg h PRO 222 Ca -0.02 -0.18 0.25 0.00 -0.87 0.00 0.00 66.00 65.19 2dtg h PRO 222 Cb 1.19 -0.20 -0.07 0.00 0.13 0.00 0.00 31.00 32.05 2dtg h PRO 222 CO 0.05 0.89 0.67 1.15 -0.23 0.00 0.00 178.00 180.53 2dtg h THR 223 N 1.11 0.56 -0.64 1.56 2.02 -1.92 0.53 112.91 116.13 2dtg h THR 223 Ca 0.27 -0.10 -0.11 0.00 0.77 0.00 0.00 66.41 67.23 2dtg h THR 223 Cb 0.14 0.24 -0.07 0.00 -1.74 0.00 0.00 68.15 66.72 2dtg h THR 223 CO -0.03 0.05 0.14 0.29 0.37 0.00 0.00 175.52 176.34 2dtg n LYS 224 N -4.48 4.18 -4.41 6.66 4.76 -1.08 -4.85 118.16 118.93 2dtg n LYS 224 Ca 0.22 -3.12 -0.30 0.00 -2.87 0.00 0.00 58.31 52.24 2dtg n LYS 224 Cb 0.88 -2.22 -0.11 0.00 -1.84 0.00 0.00 35.03 31.73 2dtg n LYS 224 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2dtg s VAL 226 N -1.08 3.70 -0.03 0.00 1.01 -1.22 -4.90 120.40 117.88 2dtg s VAL 226 Ca 0.17 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.67 2dtg s VAL 226 Cb -0.11 -2.54 0.01 0.00 0.00 0.00 0.00 36.38 33.74 2dtg s VAL 226 CO 0.09 0.57 0.04 0.00 0.00 0.00 0.00 175.10 175.81 2dtg n ALA 227 N 2.58 -3.03 -2.85 5.51 0.00 -1.26 -4.10 120.51 117.35 2dtg n ALA 227 Ca -0.18 0.46 -0.35 0.00 0.00 0.00 0.00 53.44 53.38 2dtg n ALA 227 Cb 0.53 -0.95 -0.10 0.00 0.00 0.00 0.00 19.45 18.92 2dtg n ALA 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dtg n ARG 229 N 3.86 0.42 0.00 0.00 5.12 -1.26 -4.60 116.66 120.19 2dtg n ARG 229 Ca -0.16 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.76 2dtg n ARG 229 Cb 0.52 -1.35 0.00 0.00 -1.16 0.00 0.00 32.46 30.47 2dtg n ARG 229 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2dtg n ASN 230 N -0.85 0.00 -4.50 0.55 3.02 -1.26 -5.07 115.26 107.16 2dtg n ASN 230 Ca 0.07 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.32 2dtg n ASN 230 Cb 0.03 0.00 -0.12 0.00 -0.61 0.00 0.00 39.78 39.09 2dtg n ASN 230 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2dtg s PHE 231 N 3.28 2.59 -0.07 3.10 0.40 -1.09 -4.42 117.98 121.77 2dtg s PHE 231 Ca 0.00 -0.23 -0.15 0.00 -0.60 0.00 0.00 56.93 55.95 2dtg s PHE 231 Cb 0.00 -1.41 -0.05 0.00 0.51 0.00 0.00 43.02 42.07 2dtg s PHE 231 CO 0.00 0.34 0.38 -0.47 0.70 0.00 0.00 175.22 176.17 2dtg s TYR 232 N -1.07 3.61 -0.15 0.36 5.04 0.69 -1.53 117.35 124.31 2dtg s TYR 232 Ca 0.17 0.85 -0.07 0.00 -2.44 0.00 0.00 57.07 55.58 2dtg s TYR 232 Cb -0.11 -2.34 0.06 0.00 0.35 0.00 0.00 41.96 39.93 2dtg s TYR 232 CO 0.09 0.45 0.33 -1.17 -1.34 0.00 0.00 175.55 173.91 2dtg s LEU 233 N -0.33 -0.10 0.00 6.97 2.96 -0.96 -2.39 118.68 124.82 2dtg s LEU 233 Ca 0.22 0.73 0.00 0.00 -0.22 0.00 0.00 54.13 54.86 2dtg s LEU 233 Cb -0.15 1.01 0.00 0.00 0.50 0.00 0.00 46.19 47.55 2dtg s LEU 233 CO 0.10 -0.20 0.00 0.47 -1.32 0.00 0.00 176.35 175.39 2dtg n ASP 234 N 4.72 0.00 0.00 3.68 8.00 -1.26 0.26 116.55 131.95 2dtg n ASP 234 Ca -0.17 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.33 2dtg n ASP 234 Cb 0.52 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.52 2dtg n ASP 234 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dtg n GLY 235 N 0.76 3.12 3.81 0.44 0.00 -1.26 -5.13 105.19 106.93 2dtg n GLY 235 Ca 0.00 -0.39 -0.29 0.00 0.00 0.00 0.00 46.02 45.34 2dtg n GLY 235 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dtg s ARG 236 N 0.00 1.24 -0.69 1.61 0.52 0.14 -4.04 118.95 117.73 2dtg s ARG 236 Ca 0.00 0.25 0.05 0.00 -0.52 0.00 0.00 55.73 55.50 2dtg s ARG 236 Cb 0.00 -1.85 0.25 0.00 0.52 0.00 0.00 34.95 33.86 2dtg s ARG 236 CO 0.00 -2.12 0.78 0.00 0.02 0.00 0.00 175.30 173.98 2dtg n VAL 238 N 1.03 0.40 0.18 0.00 0.31 -0.58 -4.71 118.33 114.95 2dtg n VAL 238 Ca 0.28 -0.48 0.10 0.00 -0.01 0.00 0.00 64.34 64.23 2dtg n VAL 238 Cb 0.40 -0.15 0.10 0.00 -0.91 0.00 0.00 33.84 33.28 2dtg n VAL 238 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2dtg h GLU 239 N -0.29 0.00 -1.06 5.55 4.81 -1.99 -2.88 114.58 118.73 2dtg h GLU 239 Ca -0.43 0.00 0.20 0.00 -0.13 0.00 0.00 59.36 59.01 2dtg h GLU 239 Cb 1.40 0.00 -0.33 0.00 0.63 0.00 0.00 28.75 30.44 2dtg h GLU 239 CO 0.38 0.09 0.81 -0.08 -0.73 0.00 0.00 179.01 179.48 2dtg s THR 240 N -3.19 0.00 0.02 0.32 -1.32 -1.26 -4.77 115.64 105.44 2dtg s THR 240 Ca 0.05 0.00 -0.34 0.00 -1.21 0.00 0.00 61.69 60.19 2dtg s THR 240 Cb 0.06 -1.00 -0.12 0.00 -1.51 0.00 0.00 72.50 69.93 2dtg s THR 240 CO 0.71 0.00 1.76 0.00 -2.21 0.00 0.00 174.62 174.88 2dtg s PRO 242 N 2.74 3.54 0.25 0.00 0.04 -1.26 -4.79 135.00 135.53 2dtg s PRO 242 Ca 0.87 -0.15 -0.31 0.00 0.04 0.00 0.00 61.00 61.45 2dtg s PRO 242 Cb -0.67 -3.08 -0.13 0.00 0.04 0.00 0.00 34.50 30.66 2dtg s PRO 242 CO 0.45 0.65 1.42 -0.35 0.04 0.00 0.00 177.00 179.21 2dtg n PRO 243 N 1.03 2.12 -2.77 0.56 -0.04 -1.26 0.10 135.00 134.75 2dtg n PRO 243 Ca -0.11 0.75 -0.42 0.00 -0.04 0.00 0.00 63.50 63.69 2dtg n PRO 243 Cb 0.53 -2.42 0.01 0.00 -0.04 0.00 0.00 33.50 31.58 2dtg n PRO 243 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 2dtg n PRO 244 N 1.92 4.77 -4.39 0.54 -0.04 -1.26 -5.13 135.00 131.41 2dtg n PRO 244 Ca 0.11 -4.45 -0.26 0.00 -0.04 0.00 0.00 63.50 58.85 2dtg n PRO 244 Cb 0.32 -2.54 -0.13 0.00 -0.04 0.00 0.00 33.50 31.12 2dtg n PRO 244 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2dtg s TYR 245 N -3.00 1.95 -0.18 0.54 1.51 0.28 -4.71 117.35 113.74 2dtg s TYR 245 Ca 0.36 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 56.02 2dtg s TYR 245 Cb 0.11 -1.08 0.01 0.00 -0.11 0.00 0.00 41.96 40.89 2dtg s TYR 245 CO 0.01 0.22 -0.16 0.71 -1.11 0.00 0.00 175.55 175.21 2dtg s TYR 246 N -1.07 2.80 -0.53 2.71 1.51 0.07 -4.50 117.35 118.34 2dtg s TYR 246 Ca 0.09 -1.32 -0.20 0.00 -1.01 0.00 0.00 57.07 54.63 2dtg s TYR 246 Cb -0.10 -1.93 -0.20 0.00 -0.11 0.00 0.00 41.96 39.62 2dtg s TYR 246 CO 0.04 -0.65 1.62 0.72 -1.11 0.00 0.00 175.55 176.17 2dtg n HIS 247 N 4.43 0.43 -2.35 2.71 8.25 0.44 -2.13 115.22 127.00 2dtg n HIS 247 Ca -0.20 -0.18 -0.39 0.00 -0.26 0.00 0.00 57.72 56.69 2dtg n HIS 247 Cb 0.51 -1.57 -0.03 0.00 1.12 0.00 0.00 29.99 30.02 2dtg n HIS 247 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 2dtg s PHE 248 N 10.26 3.24 0.00 4.41 5.99 0.47 -3.68 117.98 138.68 2dtg s PHE 248 Ca 0.54 1.59 0.00 0.00 0.00 0.00 0.00 56.93 59.06 2dtg s PHE 248 Cb 0.01 -3.37 0.00 0.00 0.00 0.00 0.00 43.02 39.65 2dtg s PHE 248 CO 0.17 -1.08 0.00 1.04 -0.00 0.00 0.00 175.22 175.34 2dtg n GLN 249 N 0.51 0.00 -2.21 10.12 1.13 -1.26 -2.97 117.38 122.70 2dtg n GLN 249 Ca 0.02 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.08 2dtg n GLN 249 Cb 0.46 0.00 0.04 0.00 0.11 0.00 0.00 30.24 30.85 2dtg n GLN 249 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 2dtg n ASP 250 N 7.23 0.62 0.00 1.08 2.03 -1.26 -4.93 116.55 121.32 2dtg n ASP 250 Ca 0.00 -2.04 0.00 0.00 0.52 0.00 0.00 54.79 53.27 2dtg n ASP 250 Cb 0.00 -0.15 0.00 0.00 -0.72 0.00 0.00 41.12 40.25 2dtg n ASP 250 CO 0.00 0.00 0.00 -2.67 -1.92 0.00 0.00 177.20 172.61 2dtg n TRP 251 N -0.37 -1.10 -2.07 -0.67 4.27 -1.16 -4.81 117.44 111.54 2dtg n TRP 251 Ca -0.01 0.00 -0.41 0.00 -3.89 0.00 0.00 57.50 53.19 2dtg n TRP 251 Cb 0.90 0.22 -0.02 0.00 -1.36 0.00 0.00 31.31 31.05 2dtg n TRP 251 CO 0.00 0.00 0.00 0.50 -2.29 0.00 0.00 177.69 175.90 2dtg s ARG 252 N -1.84 4.31 0.19 -2.67 3.52 -1.18 0.25 118.95 121.53 2dtg s ARG 252 Ca 0.00 2.24 0.05 0.00 -0.13 0.00 0.00 55.73 57.89 2dtg s ARG 252 Cb 0.00 -3.11 -0.04 0.00 -1.56 0.00 0.00 34.95 30.25 2dtg s ARG 252 CO 0.00 -0.32 0.21 0.00 -0.81 0.00 0.00 175.30 174.39 2dtg s VAL 254 N -1.86 0.02 0.26 0.00 -7.23 -0.91 -4.83 120.40 105.86 2dtg s VAL 254 Ca 0.33 -0.68 -0.01 0.00 -1.81 0.00 0.00 61.98 59.80 2dtg s VAL 254 Cb -0.10 -1.51 -0.04 0.00 0.56 0.00 0.00 36.38 35.30 2dtg s VAL 254 CO 0.26 -0.11 0.47 0.54 -0.31 0.00 0.00 175.10 175.95 2dtg s ASN 255 N -2.86 6.37 0.18 4.85 4.22 -1.26 -0.75 114.94 125.69 2dtg s ASN 255 Ca 0.08 0.47 -0.18 0.00 -2.14 0.00 0.00 52.86 51.08 2dtg s ASN 255 Cb -0.01 -2.04 0.13 0.00 1.28 0.00 0.00 41.25 40.61 2dtg s ASN 255 CO -0.04 -0.15 1.62 0.15 -2.04 0.00 0.00 177.10 176.64 2dtg h PHE 256 N 1.54 -0.56 0.00 1.54 3.57 -1.98 -1.09 116.94 119.95 2dtg h PHE 256 Ca -0.49 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.07 2dtg h PHE 256 Cb 1.20 0.32 0.00 0.00 2.79 0.00 0.00 35.95 40.26 2dtg h PHE 256 CO 0.54 -0.30 0.09 0.45 -2.23 0.00 0.00 178.31 176.86 2dtg n SER 257 N -5.40 0.00 -0.12 0.41 2.88 -1.26 0.18 113.62 110.30 2dtg n SER 257 Ca 0.04 0.39 -0.22 0.00 -1.33 0.00 0.00 58.87 57.74 2dtg n SER 257 Cb 0.31 -0.39 -0.07 0.00 -0.75 0.00 0.00 64.21 63.31 2dtg n SER 257 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 2dtg n PHE 258 N -1.38 0.00 -0.28 0.66 7.35 -0.48 -3.18 117.46 120.16 2dtg n PHE 258 Ca 0.00 0.00 0.07 0.00 -0.76 0.00 0.00 57.45 56.76 2dtg n PHE 258 Cb 0.09 -0.80 0.21 0.00 0.35 0.00 0.00 39.48 39.33 2dtg n PHE 258 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2dtg h GLN 260 N 0.51 -0.39 -0.89 0.00 4.15 0.16 -3.17 115.11 115.48 2dtg h GLN 260 Ca 0.45 0.03 0.19 0.00 0.77 0.00 0.00 58.65 60.08 2dtg h GLN 260 Cb 0.68 0.09 -0.17 0.00 0.21 0.00 0.00 27.48 28.29 2dtg h GLN 260 CO -0.40 -0.16 -0.17 -0.44 -1.93 0.00 0.00 178.83 175.73 2dtg h ASP 261 N -0.56 -0.74 0.31 -0.69 3.32 -0.94 -0.74 116.42 116.37 2dtg h ASP 261 Ca -0.04 0.26 -0.00 0.00 0.02 0.00 0.00 57.03 57.27 2dtg h ASP 261 Cb 0.41 0.53 -0.04 0.00 0.22 0.00 0.00 39.33 40.45 2dtg h ASP 261 CO 0.07 -0.29 -0.52 -0.07 -1.72 0.00 0.00 179.24 176.71 2dtg h LEU 262 N 0.01 -1.49 -6.35 1.55 -0.00 -1.32 -3.14 115.31 104.56 2dtg h LEU 262 Ca 0.45 0.14 -0.26 0.00 -0.00 0.00 0.00 57.88 58.21 2dtg h LEU 262 Cb 0.73 0.52 0.06 0.00 -0.00 0.00 0.00 40.66 41.98 2dtg h LEU 262 CO -0.90 -0.61 1.26 1.57 -0.00 0.00 0.00 178.44 179.77 2dtg n HIS 263 N -5.48 0.14 -3.70 1.13 -0.00 -0.28 -4.74 115.22 102.28 2dtg n HIS 263 Ca -0.10 -0.62 -0.13 0.00 0.46 0.00 0.00 57.72 57.32 2dtg n HIS 263 Cb 0.44 -0.75 -0.14 0.00 -0.12 0.00 0.00 29.99 29.42 2dtg n HIS 263 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 2dtg s HIS 264 N 5.65 -0.32 -1.22 1.57 3.76 -1.19 -4.90 115.29 118.64 2dtg s HIS 264 Ca 0.29 0.78 -0.03 0.00 -0.15 0.00 0.00 55.06 55.96 2dtg s HIS 264 Cb 0.07 -0.04 0.00 0.00 1.11 0.00 0.00 32.58 33.72 2dtg s HIS 264 CO 0.13 -0.27 0.05 1.63 -0.85 0.00 0.00 174.74 175.43 2dtg n LYS 265 N 4.74 -0.90 0.00 1.40 5.02 -1.26 -4.71 118.16 122.45 2dtg n LYS 265 Ca -0.16 0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.18 2dtg n LYS 265 Cb 0.51 -2.78 0.00 0.00 -0.02 0.00 0.00 35.03 32.75 2dtg n LYS 265 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2dtg n LYS 267 N -0.83 0.00 -2.24 0.00 5.02 -1.26 -4.05 118.16 114.79 2dtg n LYS 267 Ca 0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.92 2dtg n LYS 267 Cb 0.22 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.20 2dtg n LYS 267 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2dtg s ASN 268 N -4.00 5.63 0.44 4.39 6.03 -1.26 -4.98 114.94 121.18 2dtg s ASN 268 Ca 0.00 -0.24 -0.15 0.00 -1.03 0.00 0.00 52.86 51.44 2dtg s ASN 268 Cb 0.00 -2.55 -0.08 0.00 -3.03 0.00 0.00 41.25 35.59 2dtg s ASN 268 CO 0.00 -2.20 0.87 -0.94 -2.03 0.00 0.00 177.10 172.80 2dtg s SER 269 N 6.54 6.65 0.00 3.54 1.04 -1.26 -2.82 113.70 127.39 2dtg s SER 269 Ca 0.56 1.39 0.00 0.00 0.48 0.00 0.00 55.95 58.39 2dtg s SER 269 Cb -0.09 -2.43 0.00 0.00 0.10 0.00 0.00 66.02 63.60 2dtg s SER 269 CO 0.12 -0.44 0.00 -1.14 0.98 0.00 0.00 173.24 172.76 2dtg n ARG 270 N -1.18 0.00 0.00 4.02 0.63 -1.26 -4.44 116.66 114.42 2dtg n ARG 270 Ca 0.05 0.00 0.04 0.00 -0.92 0.00 0.00 57.85 57.02 2dtg n ARG 270 Cb 0.54 -0.83 0.24 0.00 0.45 0.00 0.00 32.46 32.86 2dtg n ARG 270 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 2dtg n ARG 271 N 0.00 0.22 -0.74 -0.14 3.00 -1.25 -4.79 116.66 112.95 2dtg n ARG 271 Ca 0.00 0.08 0.00 0.00 -0.00 0.00 0.00 57.85 57.93 2dtg n ARG 271 Cb 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 30.96 2dtg n ARG 271 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 2dtg n GLN 272 N -1.10 0.00 0.03 -0.14 6.02 -1.25 -4.83 117.38 116.11 2dtg n GLN 272 Ca 0.06 0.00 0.22 0.00 -0.01 0.00 0.00 57.00 57.27 2dtg n GLN 272 Cb 0.04 -3.10 0.72 0.00 1.02 0.00 0.00 30.24 28.92 2dtg n GLN 272 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 2dtg h GLY 273 N 0.00 0.00 -5.50 1.08 0.00 -1.82 -3.39 103.07 93.44 2dtg h GLY 273 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.44 2dtg h GLY 273 CO 0.00 0.00 0.20 0.00 0.00 0.00 0.00 176.54 176.74 2dtg n HIS 275 N 4.41 0.00 -3.08 0.00 -0.00 -1.26 -4.68 115.22 110.61 2dtg n HIS 275 Ca -0.15 0.00 -0.03 0.00 -0.00 0.00 0.00 57.72 57.53 2dtg n HIS 275 Cb 0.55 -0.18 0.00 0.00 -0.00 0.00 0.00 29.99 30.37 2dtg n HIS 275 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 2dtg n GLN 276 N -0.93 -1.52 -1.79 -0.41 6.02 -1.26 -4.39 117.38 113.10 2dtg n GLN 276 Ca 0.14 1.56 -0.41 0.00 -0.01 0.00 0.00 57.00 58.28 2dtg n GLN 276 Cb 0.28 -5.49 0.01 0.00 1.02 0.00 0.00 30.24 26.06 2dtg n GLN 276 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 2dtg s TYR 277 N -2.91 2.52 0.05 1.08 2.02 -1.19 -4.46 117.35 114.45 2dtg s TYR 277 Ca 0.05 1.19 0.00 0.00 -0.37 0.00 0.00 57.07 57.94 2dtg s TYR 277 Cb -0.01 -4.01 -0.00 0.00 -0.40 0.00 0.00 41.96 37.54 2dtg s TYR 277 CO 0.76 -3.03 0.01 1.33 -1.57 0.00 0.00 175.55 173.05 2dtg n VAL 278 N 0.23 0.00 -4.16 0.71 0.24 0.51 -4.34 118.33 111.52 2dtg n VAL 278 Ca 0.02 -0.24 -0.27 0.00 -2.04 0.00 0.00 64.34 61.82 2dtg n VAL 278 Cb 0.40 0.06 -0.17 0.00 -1.47 0.00 0.00 33.84 32.66 2dtg n VAL 278 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2dtg s ILE 279 N -1.36 1.19 -0.07 1.34 1.09 0.39 0.31 121.20 124.09 2dtg s ILE 279 Ca 0.01 -0.43 -0.12 0.00 -1.10 0.00 0.00 60.65 59.00 2dtg s ILE 279 Cb 0.00 -1.15 0.03 0.00 -1.06 0.00 0.00 42.46 40.28 2dtg s ILE 279 CO 0.01 0.39 0.30 -2.28 -0.10 0.00 0.00 174.94 173.26 2dtg s HIS 280 N 1.32 -0.26 -1.74 3.97 2.46 -0.17 -3.03 115.29 117.85 2dtg s HIS 280 Ca -0.01 0.57 -0.16 0.00 0.47 0.00 0.00 55.06 55.93 2dtg s HIS 280 Cb -0.14 0.10 0.15 0.00 -0.13 0.00 0.00 32.58 32.57 2dtg s HIS 280 CO -0.05 -0.26 0.49 -1.71 -2.47 0.00 0.00 174.74 170.75 2dtg n ASN 281 N 2.21 -1.42 -0.12 9.88 2.85 -1.26 0.11 115.26 127.51 2dtg n ASN 281 Ca -0.17 -1.19 -0.02 0.00 -0.11 0.00 0.00 54.58 53.10 2dtg n ASN 281 Cb 0.57 -1.95 -0.01 0.00 1.24 0.00 0.00 39.78 39.63 2dtg n ASN 281 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 2dtg n ASN 282 N -2.64 -4.14 -4.33 1.20 5.03 -1.26 -4.97 115.26 104.15 2dtg n ASN 282 Ca -0.02 0.04 -0.28 0.00 0.87 0.00 0.00 54.58 55.19 2dtg n ASN 282 Cb 0.53 -1.78 -0.14 0.00 -1.02 0.00 0.00 39.78 37.37 2dtg n ASN 282 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2dtg s LYS 283 N -1.16 1.52 -0.74 3.52 1.02 0.12 -0.42 119.74 123.59 2dtg s LYS 283 Ca 0.00 -1.16 -0.22 0.00 0.02 0.00 0.00 55.97 54.62 2dtg s LYS 283 Cb 0.00 -1.79 0.08 0.00 -0.52 0.00 0.00 37.83 35.60 2dtg s LYS 283 CO 0.00 0.45 1.03 0.00 -0.92 0.00 0.00 175.35 175.90 2dtg s ILE 285 N 3.81 4.12 -0.11 0.00 1.09 0.15 -4.48 121.20 125.77 2dtg s ILE 285 Ca 0.26 -0.09 -0.23 0.00 -1.10 0.00 0.00 60.65 59.49 2dtg s ILE 285 Cb -0.13 -3.58 -0.20 0.00 -1.06 0.00 0.00 42.46 37.49 2dtg s ILE 285 CO 0.05 -0.53 0.70 1.55 -0.10 0.00 0.00 174.94 176.60 2dtg h PRO 286 N 0.11 -0.03 -3.20 2.79 0.13 -1.86 1.49 132.00 131.43 2dtg h PRO 286 Ca -0.46 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.49 2dtg h PRO 286 Cb 1.24 0.01 -0.27 0.00 0.13 0.00 0.00 31.00 32.11 2dtg h PRO 286 CO 0.60 0.68 -0.49 -1.21 -0.23 0.00 0.00 178.00 177.35 2dtg s GLU 287 N -2.44 0.22 1.09 0.86 8.01 -1.26 -3.18 118.70 121.99 2dtg s GLU 287 Ca -0.15 0.34 -0.19 0.00 0.01 0.00 0.00 54.97 54.99 2dtg s GLU 287 Cb -0.02 0.05 0.09 0.00 -4.31 0.00 0.00 34.13 29.94 2dtg s GLU 287 CO 0.54 -0.07 -0.09 0.00 0.01 0.00 0.00 175.26 175.66 2dtg n PRO 289 N -1.57 0.64 -1.57 0.00 -0.04 -1.26 -4.99 135.00 126.20 2dtg n PRO 289 Ca 0.02 0.00 -0.48 0.00 -0.04 0.00 0.00 63.50 63.00 2dtg n PRO 289 Cb 0.58 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 34.00 2dtg n PRO 289 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2dtg n SER 290 N -2.67 1.17 0.00 3.54 3.41 -1.26 -3.34 113.62 114.47 2dtg n SER 290 Ca 0.00 1.15 0.00 0.00 -0.26 0.00 0.00 58.87 59.76 2dtg n SER 290 Cb 0.00 -1.22 0.00 0.00 -0.26 0.00 0.00 64.21 62.73 2dtg n SER 290 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dtg n GLY 291 N 1.77 1.33 0.00 5.00 0.00 -1.26 -4.90 105.19 107.13 2dtg n GLY 291 Ca 0.14 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.54 2dtg n GLY 291 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2dtg n TYR 292 N 0.00 0.00 -4.24 1.61 4.01 -1.11 -4.72 117.16 112.71 2dtg n TYR 292 Ca 0.00 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.59 2dtg n TYR 292 Cb 0.00 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 38.93 2dtg n TYR 292 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2dtg s THR 293 N 0.00 1.19 0.36 -0.72 -1.32 -0.38 -4.38 115.64 110.39 2dtg s THR 293 Ca 0.00 -1.96 -0.27 0.00 -1.21 0.00 0.00 61.69 58.25 2dtg s THR 293 Cb 0.00 -1.74 -0.09 0.00 -1.51 0.00 0.00 72.50 69.16 2dtg s THR 293 CO 0.00 -0.66 1.25 -0.32 -2.21 0.00 0.00 174.62 172.68 2dtg s MET 294 N -3.43 4.20 -0.34 7.08 1.75 -1.26 -0.50 119.30 126.79 2dtg s MET 294 Ca 0.14 2.05 0.09 0.00 -1.25 0.00 0.00 55.69 56.72 2dtg s MET 294 Cb 0.00 -2.89 0.63 0.00 2.84 0.00 0.00 34.83 35.41 2dtg s MET 294 CO 0.01 -0.26 1.70 -1.71 -0.65 0.00 0.00 175.02 174.11 2dtg n ASN 295 N 0.46 3.71 0.00 1.11 4.05 -1.03 -4.89 115.26 118.67 2dtg n ASN 295 Ca 0.02 -3.48 0.00 0.00 0.45 0.00 0.00 54.58 51.57 2dtg n ASN 295 Cb 0.44 -0.72 0.00 0.00 1.23 0.00 0.00 39.78 40.73 2dtg n ASN 295 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 177.26 173.01 2dtg n SER 296 N -0.78 0.00 0.00 1.20 7.64 -1.26 -4.30 113.62 116.11 2dtg n SER 296 Ca 0.42 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.30 2dtg n SER 296 Cb 1.32 -0.07 0.00 0.00 -1.01 0.00 0.00 64.21 64.45 2dtg n SER 296 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2dtg n SER 297 N 0.00 0.00 0.00 6.43 3.41 -1.26 -4.57 113.62 117.63 2dtg n SER 297 Ca 0.00 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.72 2dtg n SER 297 Cb 0.00 0.00 0.63 0.00 -0.26 0.00 0.00 64.21 64.58 2dtg n SER 297 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2dtg n ASN 298 N -0.37 0.00 -1.79 4.04 6.94 -1.26 -4.83 115.26 117.99 2dtg n ASN 298 Ca 0.00 -0.48 -0.20 0.00 -0.02 0.00 0.00 54.58 53.89 2dtg n ASN 298 Cb 0.00 -0.10 -0.06 0.00 -2.36 0.00 0.00 39.78 37.27 2dtg n ASN 298 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 2dtg n LEU 299 N -1.10 -1.61 -4.85 -4.53 4.77 -1.26 -4.75 117.00 103.67 2dtg n LEU 299 Ca 0.15 0.31 -0.35 0.00 -0.03 0.00 0.00 56.01 56.09 2dtg n LEU 299 Cb 0.11 -2.78 -0.06 0.00 -2.33 0.00 0.00 43.42 38.36 2dtg n LEU 299 CO 0.14 -0.74 0.20 -0.22 -1.33 0.00 0.00 177.39 175.44 2dtg s LEU 300 N -4.95 4.32 -0.25 2.23 2.96 -1.26 0.15 118.68 121.87 2dtg s LEU 300 Ca 0.00 1.01 -0.19 0.00 -0.22 0.00 0.00 54.13 54.72 2dtg s LEU 300 Cb 0.00 -3.26 -0.02 0.00 0.50 0.00 0.00 46.19 43.41 2dtg s LEU 300 CO 0.00 0.10 0.59 0.00 -1.32 0.00 0.00 176.35 175.71 2dtg s THR 302 N 2.41 5.13 0.08 0.00 -4.23 0.34 -4.82 115.64 114.55 2dtg s THR 302 Ca 0.24 -0.18 -0.25 0.00 -1.18 0.00 0.00 61.69 60.33 2dtg s THR 302 Cb -0.16 -3.73 -0.10 0.00 1.34 0.00 0.00 72.50 69.86 2dtg s THR 302 CO 0.09 -0.22 1.40 1.55 -0.54 0.00 0.00 174.62 176.89 2dtg h PRO 303 N 1.91 -0.43 -2.67 3.99 0.13 -1.96 -1.01 132.00 131.96 2dtg h PRO 303 Ca -0.48 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2dtg h PRO 303 Cb 1.19 0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2dtg h PRO 303 CO 0.67 -0.29 -0.48 0.00 -0.23 0.00 0.00 178.00 177.67 2dtg s LEU 305 N -0.29 3.89 0.00 0.00 2.96 -1.26 -4.69 118.68 119.29 2dtg s LEU 305 Ca 0.00 0.26 0.00 0.00 -0.22 0.00 0.00 54.13 54.17 2dtg s LEU 305 Cb 0.00 -1.92 0.00 0.00 0.50 0.00 0.00 46.19 44.77 2dtg s LEU 305 CO 0.00 0.38 0.00 0.61 -1.32 0.00 0.00 176.35 176.02 2dtg n GLY 306 N 2.14 -2.57 3.67 7.98 0.00 -1.26 -4.77 105.19 110.37 2dtg n GLY 306 Ca -0.19 -1.62 -0.48 0.00 0.00 0.00 0.00 46.02 43.73 2dtg n GLY 306 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2dtg n PRO 307 N -0.83 2.20 -2.78 1.61 -0.02 -1.26 -4.90 135.00 129.02 2dtg n PRO 307 Ca 0.00 0.80 -0.42 0.00 -2.02 0.00 0.00 63.50 61.86 2dtg n PRO 307 Cb 0.00 -2.71 -0.03 0.00 -0.02 0.00 0.00 33.50 30.74 2dtg n PRO 307 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2dtg n PRO 309 N 4.64 -0.02 -3.45 0.00 -0.04 -1.26 -4.93 135.00 129.93 2dtg n PRO 309 Ca 0.06 -0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.53 2dtg n PRO 309 Cb 0.50 -1.06 -0.05 0.00 -0.04 0.00 0.00 33.50 32.84 2dtg n PRO 309 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2dtg s LYS 310 N -2.12 0.16 0.27 0.54 2.20 -1.26 -4.95 119.74 114.59 2dtg s LYS 310 Ca 0.41 0.35 0.06 0.00 -0.36 0.00 0.00 55.97 56.43 2dtg s LYS 310 Cb -0.18 0.14 -0.02 0.00 -1.51 0.00 0.00 37.83 36.25 2dtg s LYS 310 CO 0.82 -0.05 0.37 0.08 -0.36 0.00 0.00 175.35 176.21 2dtg s VAL 311 N 1.72 4.74 -0.24 4.02 1.01 -1.26 -1.14 120.40 129.26 2dtg s VAL 311 Ca -0.04 -1.06 -0.03 0.00 0.00 0.00 0.00 61.98 60.84 2dtg s VAL 311 Cb -0.03 -3.65 0.10 0.00 0.00 0.00 0.00 36.38 32.80 2dtg s VAL 311 CO -0.14 -0.28 0.19 0.00 0.00 0.00 0.00 175.10 174.87 2dtg s HIS 313 N 2.23 2.45 0.20 0.00 3.76 -1.26 0.01 115.29 122.68 2dtg s HIS 313 Ca 0.07 -0.59 -0.29 0.00 -0.15 0.00 0.00 55.06 54.10 2dtg s HIS 313 Cb -0.15 -4.67 -0.17 0.00 1.11 0.00 0.00 32.58 28.70 2dtg s HIS 313 CO -0.24 -1.98 0.71 1.28 -0.85 0.00 0.00 174.74 173.67 2dtg n LEU 314 N 9.02 -0.33 -4.56 0.89 4.77 -1.19 -4.74 117.00 120.86 2dtg n LEU 314 Ca 0.23 1.14 -0.18 0.00 -0.03 0.00 0.00 56.01 57.17 2dtg n LEU 314 Cb 0.50 -1.03 -0.07 0.00 -2.33 0.00 0.00 43.42 40.49 2dtg n LEU 314 CO 0.67 -2.46 1.26 -0.76 -1.33 0.00 0.00 177.39 174.78 2dtg s LEU 315 N 2.06 2.94 0.00 2.23 1.02 -1.26 -2.31 118.68 123.37 2dtg s LEU 315 Ca 0.66 -0.31 0.00 0.00 0.02 0.00 0.00 54.13 54.50 2dtg s LEU 315 Cb -0.91 -2.56 0.00 0.00 0.02 0.00 0.00 46.19 42.75 2dtg s LEU 315 CO 0.57 -3.52 0.00 -0.62 0.02 0.00 0.00 176.35 172.80 2dtg n GLU 316 N 8.78 0.00 0.00 1.70 -0.58 -1.26 -4.22 120.64 125.06 2dtg n GLU 316 Ca 0.44 0.29 0.00 0.00 -0.42 0.00 0.00 57.16 57.47 2dtg n GLU 316 Cb 0.45 -3.24 0.00 0.00 -0.57 0.00 0.00 31.44 28.08 2dtg n GLU 316 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2dtg n GLY 317 N -2.88 2.46 0.00 0.62 0.00 -0.98 -4.94 105.19 99.47 2dtg n GLY 317 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.51 2dtg n GLY 317 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2dtg n GLU 318 N 0.00 0.00 -1.50 1.61 0.28 -1.26 0.98 120.64 120.74 2dtg n GLU 318 Ca 0.00 0.00 -0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2dtg n GLU 318 Cb 0.00 0.00 -0.00 0.00 1.43 0.00 0.00 31.44 32.87 2dtg n GLU 318 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2dtg n LYS 319 N 0.00 -0.43 -4.36 3.44 4.76 -1.26 -4.22 118.16 116.09 2dtg n LYS 319 Ca 0.00 0.78 -0.25 0.00 -2.87 0.00 0.00 58.31 55.97 2dtg n LYS 319 Cb 0.00 -1.28 -0.09 0.00 -1.84 0.00 0.00 35.03 31.82 2dtg n LYS 319 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2dtg s THR 320 N -0.06 2.97 -0.11 -0.18 -4.23 -1.26 -3.98 115.64 108.79 2dtg s THR 320 Ca -0.02 -2.02 -0.10 0.00 -1.18 0.00 0.00 61.69 58.37 2dtg s THR 320 Cb 0.00 -2.53 -0.05 0.00 1.34 0.00 0.00 72.50 71.26 2dtg s THR 320 CO 0.06 -0.29 0.22 0.27 -0.54 0.00 0.00 174.62 174.33 2dtg s ILE 321 N -2.16 5.37 0.00 2.99 -0.00 -1.16 -4.92 121.20 121.31 2dtg s ILE 321 Ca 0.28 0.39 0.00 0.00 -0.00 0.00 0.00 60.65 61.32 2dtg s ILE 321 Cb -0.07 -3.51 0.00 0.00 -0.00 0.00 0.00 42.46 38.89 2dtg s ILE 321 CO 0.16 0.56 0.00 -0.90 -0.00 0.00 0.00 174.94 174.76 2dtg n ASP 322 N 2.34 0.00 -3.85 4.36 5.75 -1.26 -0.30 116.55 123.59 2dtg n ASP 322 Ca -0.17 -0.04 -0.09 0.00 -0.01 0.00 0.00 54.79 54.48 2dtg n ASP 322 Cb 0.54 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.55 2dtg n ASP 322 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2dtg s SER 323 N 0.00 0.09 0.11 -1.12 1.04 -1.26 -3.96 113.70 108.61 2dtg s SER 323 Ca 0.00 -0.56 -0.32 0.00 0.48 0.00 0.00 55.95 55.54 2dtg s SER 323 Cb 0.00 0.32 -0.12 0.00 0.10 0.00 0.00 66.02 66.32 2dtg s SER 323 CO 0.00 -0.68 1.53 0.58 0.98 0.00 0.00 173.24 175.65 2dtg h VAL 324 N 2.96 0.00 -0.80 5.02 2.07 -1.95 -1.99 116.25 121.57 2dtg h VAL 324 Ca -0.33 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.30 2dtg h VAL 324 Cb 1.20 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.89 2dtg h VAL 324 CO 0.54 0.00 0.41 0.71 0.02 0.00 0.00 177.57 179.25 2dtg h THR 325 N -0.52 0.81 0.00 2.57 1.35 -2.00 0.36 112.91 115.48 2dtg h THR 325 Ca 0.04 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 2dtg h THR 325 Cb 0.64 0.10 0.00 0.00 -1.73 0.00 0.00 68.15 67.16 2dtg h THR 325 CO -0.45 0.12 0.06 -1.54 -0.25 0.00 0.00 175.52 173.46 2dtg n SER 326 N -4.84 0.32 -0.08 5.36 3.41 -0.77 -1.25 113.62 115.78 2dtg n SER 326 Ca 0.14 0.62 -0.23 0.00 -0.26 0.00 0.00 58.87 59.14 2dtg n SER 326 Cb 0.34 -0.65 -0.12 0.00 -0.26 0.00 0.00 64.21 63.52 2dtg n SER 326 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dtg n ALA 327 N -1.63 0.91 -0.04 7.33 0.00 0.12 -4.01 120.51 123.19 2dtg n ALA 327 Ca -0.01 -0.63 0.24 0.00 0.00 0.00 0.00 53.44 53.04 2dtg n ALA 327 Cb 0.08 -0.48 0.69 0.00 0.00 0.00 0.00 19.45 19.73 2dtg n ALA 327 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2dtg h GLN 328 N -0.61 0.00 0.00 0.00 4.20 -0.77 2.43 115.11 120.36 2dtg h GLN 328 Ca -0.43 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.28 2dtg h GLN 328 Cb 1.61 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.39 2dtg h GLN 328 CO -0.14 0.00 0.00 -0.85 -0.67 0.00 0.00 178.83 177.17 2dtg n GLU 329 N -3.72 0.07 -0.02 1.46 0.28 -1.00 -1.74 120.64 115.97 2dtg n GLU 329 Ca 0.14 0.26 0.03 0.00 -0.16 0.00 0.00 57.16 57.42 2dtg n GLU 329 Cb 0.90 -1.62 0.03 0.00 1.43 0.00 0.00 31.44 32.19 2dtg n GLU 329 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 2dtg n LEU 330 N -1.74 1.68 -4.15 -1.84 0.00 0.81 -5.05 117.00 106.71 2dtg n LEU 330 Ca 0.04 -1.23 -0.37 0.00 0.00 0.00 0.00 56.01 54.44 2dtg n LEU 330 Cb 0.22 -0.03 0.03 0.00 0.00 0.00 0.00 43.42 43.64 2dtg n LEU 330 CO 0.18 0.38 -0.92 -1.14 0.00 0.00 0.00 177.39 175.89 2dtg n ARG 331 N 0.23 0.01 0.00 1.96 0.63 -0.71 -2.11 116.66 116.68 2dtg n ARG 331 Ca 0.04 0.01 0.00 0.00 -0.92 0.00 0.00 57.85 56.97 2dtg n ARG 331 Cb 0.18 -1.05 0.00 0.00 0.45 0.00 0.00 32.46 32.04 2dtg n ARG 331 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2dtg n GLY 332 N 2.90 0.00 3.63 5.14 0.00 -1.19 -4.85 105.19 110.83 2dtg n GLY 332 Ca 0.04 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.59 2dtg n GLY 332 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dtg n THR 334 N 2.01 0.00 -3.39 0.00 -2.24 -0.29 -2.98 114.28 107.38 2dtg n THR 334 Ca 0.14 -0.23 -0.06 0.00 -2.27 0.00 0.00 64.05 61.63 2dtg n THR 334 Cb 0.28 0.97 -0.07 0.00 -2.10 0.00 0.00 70.33 69.41 2dtg n THR 334 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2dtg s VAL 335 N -2.09 -0.73 -0.23 2.28 -7.23 -0.84 -0.79 120.40 110.77 2dtg s VAL 335 Ca 0.04 0.00 -0.19 0.00 -1.81 0.00 0.00 61.98 60.02 2dtg s VAL 335 Cb 0.08 -0.83 -0.03 0.00 0.56 0.00 0.00 36.38 36.17 2dtg s VAL 335 CO 0.46 -0.05 0.56 -0.63 -0.31 0.00 0.00 175.10 175.14 2dtg s ILE 336 N 2.65 5.05 -1.18 -0.62 1.09 -1.16 -0.77 121.20 126.26 2dtg s ILE 336 Ca 0.10 1.01 -0.06 0.00 -1.10 0.00 0.00 60.65 60.60 2dtg s ILE 336 Cb -0.14 -3.87 0.23 0.00 -1.06 0.00 0.00 42.46 37.61 2dtg s ILE 336 CO -0.16 0.10 1.82 -3.20 -0.10 0.00 0.00 174.94 173.39 2dtg n ASN 337 N 5.29 6.36 0.00 3.58 5.15 0.10 -2.66 115.26 133.08 2dtg n ASN 337 Ca -0.03 -3.31 0.00 0.00 -0.60 0.00 0.00 54.58 50.64 2dtg n ASN 337 Cb 0.50 -1.34 0.00 0.00 -0.53 0.00 0.00 39.78 38.40 2dtg n ASN 337 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2dtg n GLY 338 N 1.69 0.26 3.14 8.20 0.00 -1.26 -3.19 105.19 114.03 2dtg n GLY 338 Ca 0.40 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.86 2dtg n GLY 338 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dtg s SER 339 N 2.00 -1.26 0.34 1.61 0.01 0.27 0.09 113.70 116.76 2dtg s SER 339 Ca 0.00 -0.52 -0.26 0.00 1.31 0.00 0.00 55.95 56.48 2dtg s SER 339 Cb 0.00 1.84 -0.09 0.00 0.21 0.00 0.00 66.02 67.98 2dtg s SER 339 CO 0.00 -0.23 1.01 -1.48 0.41 0.00 0.00 173.24 172.95 2dtg s LEU 340 N 2.16 4.31 -0.32 2.44 2.34 -1.26 -4.43 118.68 123.92 2dtg s LEU 340 Ca 0.14 1.98 0.02 0.00 0.06 0.00 0.00 54.13 56.33 2dtg s LEU 340 Cb -0.07 -4.01 0.09 0.00 -0.56 0.00 0.00 46.19 41.64 2dtg s LEU 340 CO -0.14 -0.23 0.05 -0.63 -1.06 0.00 0.00 176.35 174.34 2dtg s ILE 341 N -1.55 1.76 0.14 1.48 -1.09 -1.26 -3.32 121.20 117.35 2dtg s ILE 341 Ca 0.52 -1.90 -0.31 0.00 -2.23 0.00 0.00 60.65 56.73 2dtg s ILE 341 Cb -0.22 -2.26 -0.09 0.00 -1.58 0.00 0.00 42.46 38.31 2dtg s ILE 341 CO 0.28 -0.54 1.57 -0.63 -1.23 0.00 0.00 174.94 174.38 2dtg s ILE 342 N 1.19 2.80 -0.41 2.92 -1.09 -0.75 -2.98 121.20 122.87 2dtg s ILE 342 Ca 0.08 0.52 0.09 0.00 -2.23 0.00 0.00 60.65 59.11 2dtg s ILE 342 Cb -0.18 -3.33 0.34 0.00 -1.58 0.00 0.00 42.46 37.70 2dtg s ILE 342 CO -0.13 0.03 0.94 -3.20 -1.23 0.00 0.00 174.94 171.35 2dtg n ASN 343 N 4.35 -0.74 -4.57 3.58 5.15 0.59 -1.79 115.26 121.82 2dtg n ASN 343 Ca 0.14 -3.32 -0.41 0.00 -0.60 0.00 0.00 54.58 50.39 2dtg n ASN 343 Cb 0.39 0.65 -0.07 0.00 -0.53 0.00 0.00 39.78 40.22 2dtg n ASN 343 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2dtg s ILE 344 N -1.09 4.94 -0.21 -1.44 -1.09 -1.25 -4.11 121.20 116.93 2dtg s ILE 344 Ca 0.31 0.57 -0.13 0.00 -2.23 0.00 0.00 60.65 59.17 2dtg s ILE 344 Cb 0.33 -4.03 -0.19 0.00 -1.58 0.00 0.00 42.46 36.99 2dtg s ILE 344 CO -0.06 -0.25 0.03 -1.14 -1.23 0.00 0.00 174.94 172.29 2dtg n ARG 345 N 5.92 0.63 -2.68 2.79 0.00 -1.25 -2.76 116.66 119.31 2dtg n ARG 345 Ca -0.02 0.36 -0.06 0.00 -0.00 0.00 0.00 57.85 58.12 2dtg n ARG 345 Cb 0.49 -1.64 -0.02 0.00 0.00 0.00 0.00 32.46 31.29 2dtg n ARG 345 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2dtg n GLY 346 N 1.64 3.36 0.00 5.14 0.00 -1.26 -3.26 105.19 110.80 2dtg n GLY 346 Ca -0.40 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 43.96 2dtg n GLY 346 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dtg n GLY 347 N -0.22 4.54 3.74 -0.02 0.00 -1.26 -4.70 105.19 107.27 2dtg n GLY 347 Ca 0.02 -0.83 -0.31 0.00 0.00 0.00 0.00 46.02 44.90 2dtg n GLY 347 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2dtg s ASN 348 N 0.00 4.02 0.00 1.61 0.02 -1.26 -3.34 114.94 115.99 2dtg s ASN 348 Ca 0.00 1.73 0.00 0.00 -1.02 0.00 0.00 52.86 53.57 2dtg s ASN 348 Cb 0.00 -2.41 0.00 0.00 0.02 0.00 0.00 41.25 38.86 2dtg s ASN 348 CO 0.00 -2.33 0.00 -3.20 0.02 0.00 0.00 177.10 171.59 2dtg n ASN 349 N -3.71 0.00 0.00 -1.22 2.85 -1.26 -4.73 115.26 107.20 2dtg n ASN 349 Ca 0.08 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.55 2dtg n ASN 349 Cb 0.54 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.56 2dtg n ASN 349 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2dtg n LEU 350 N 0.00 0.00 -0.03 1.20 4.32 -1.21 -4.06 117.00 117.21 2dtg n LEU 350 Ca 0.00 0.00 0.04 0.00 -0.02 0.00 0.00 56.01 56.03 2dtg n LEU 350 Cb 0.00 0.00 -0.15 0.00 -1.62 0.00 0.00 43.42 41.65 2dtg n LEU 350 CO 0.00 0.00 -0.85 0.00 -1.22 0.00 0.00 177.39 175.32 2dtg n ALA 351 N 2.79 2.36 0.31 -1.18 0.00 -1.26 -3.87 120.51 119.66 2dtg n ALA 351 Ca 0.00 -0.70 0.19 0.00 0.00 0.00 0.00 53.44 52.93 2dtg n ALA 351 Cb 0.00 -0.50 1.03 0.00 0.00 0.00 0.00 19.45 19.98 2dtg n ALA 351 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dtg h ALA 352 N 1.51 1.24 0.00 0.00 0.00 -1.94 0.73 119.26 120.80 2dtg h ALA 352 Ca -0.16 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 2dtg h ALA 352 Cb 1.28 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 2dtg h ALA 352 CO 0.01 0.01 -0.01 0.93 0.00 0.00 0.00 179.25 180.19 2dtg h GLU 353 N 0.00 0.00 -1.10 0.00 4.39 -1.86 -2.68 114.58 113.33 2dtg h GLU 353 Ca -0.00 0.00 0.33 0.00 0.34 0.00 0.00 59.36 60.03 2dtg h GLU 353 Cb 0.05 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 28.58 2dtg h GLU 353 CO 0.00 0.02 0.68 -0.07 -1.16 0.00 0.00 179.01 178.48 2dtg h LEU 354 N -1.00 0.44 0.00 1.33 -0.00 -1.61 -2.67 115.31 111.80 2dtg h LEU 354 Ca -0.00 0.14 0.00 0.00 -0.00 0.00 0.00 57.88 58.02 2dtg h LEU 354 Cb 0.03 0.09 0.00 0.00 -0.00 0.00 0.00 40.66 40.78 2dtg h LEU 354 CO -0.00 -0.06 0.00 1.21 -0.00 0.00 0.00 178.44 179.59 2dtg n GLU 355 N -4.82 0.00 0.27 1.13 2.13 0.23 -2.05 120.64 117.52 2dtg n GLU 355 Ca 0.31 0.00 0.03 0.00 0.66 0.00 0.00 57.16 58.15 2dtg n GLU 355 Cb 1.05 -0.71 0.04 0.00 0.27 0.00 0.00 31.44 32.09 2dtg n GLU 355 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2dtg n ALA 356 N -1.74 0.09 -0.05 4.31 0.00 -1.01 0.14 120.51 122.25 2dtg n ALA 356 Ca 0.00 0.03 -0.20 0.00 0.00 0.00 0.00 53.44 53.27 2dtg n ALA 356 Cb 0.00 -0.05 -0.13 0.00 0.00 0.00 0.00 19.45 19.27 2dtg n ALA 356 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2dtg n ASN 357 N -2.48 2.07 -0.00 0.00 5.03 -1.02 -4.48 115.26 114.38 2dtg n ASN 357 Ca 0.02 0.10 0.03 0.00 0.87 0.00 0.00 54.58 55.60 2dtg n ASN 357 Cb 1.00 -0.71 -0.04 0.00 -1.02 0.00 0.00 39.78 39.01 2dtg n ASN 357 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 2dtg n LEU 358 N -3.45 0.28 0.00 3.41 4.77 -0.03 -3.18 117.00 118.80 2dtg n LEU 358 Ca -0.37 -0.44 0.00 0.00 -0.03 0.00 0.00 56.01 55.18 2dtg n LEU 358 Cb 1.01 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 42.12 2dtg n LEU 358 CO 0.36 0.07 0.09 0.61 -1.33 0.00 0.00 177.39 177.19 2dtg n GLY 359 N 1.28 -0.10 0.02 -0.72 0.00 0.37 -0.21 105.19 105.82 2dtg n GLY 359 Ca 0.01 -0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.06 2dtg n GLY 359 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dtg n LEU 360 N -0.57 0.00 -4.73 0.99 7.99 -1.26 -2.71 117.00 116.71 2dtg n LEU 360 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 56.01 55.58 2dtg n LEU 360 Cb 0.00 0.06 -0.02 0.00 -0.11 0.00 0.00 43.42 43.35 2dtg n LEU 360 CO 0.00 0.06 1.26 -0.38 -1.51 0.00 0.00 177.39 176.82 2dtg n ILE 361 N -2.01 0.63 -0.04 -0.08 5.41 0.71 -4.49 119.36 119.50 2dtg n ILE 361 Ca -0.05 -0.16 -0.03 0.00 1.00 0.00 0.00 62.75 63.51 2dtg n ILE 361 Cb 0.42 -1.91 -0.07 0.00 -0.71 0.00 0.00 39.64 37.38 2dtg n ILE 361 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2dtg n GLU 362 N 2.80 2.32 -3.66 0.38 1.02 0.03 -0.09 120.64 123.44 2dtg n GLU 362 Ca 0.12 -0.01 -0.15 0.00 -0.02 0.00 0.00 57.16 57.09 2dtg n GLU 362 Cb 0.35 -1.21 -0.08 0.00 -0.02 0.00 0.00 31.44 30.48 2dtg n GLU 362 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2dtg s GLU 363 N -2.26 0.79 -0.10 3.49 2.12 -1.24 -0.46 118.70 121.04 2dtg s GLU 363 Ca -0.04 0.21 0.04 0.00 0.36 0.00 0.00 54.97 55.54 2dtg s GLU 363 Cb 0.03 0.37 0.00 0.00 0.26 0.00 0.00 34.13 34.79 2dtg s GLU 363 CO 0.34 -0.20 -0.22 0.42 -0.54 0.00 0.00 175.26 175.06 2dtg s ILE 364 N -0.84 1.91 0.01 -3.70 -1.09 0.21 -2.99 121.20 114.71 2dtg s ILE 364 Ca -0.09 -0.93 -0.19 0.00 -2.23 0.00 0.00 60.65 57.21 2dtg s ILE 364 Cb -0.03 -1.66 -0.10 0.00 -1.58 0.00 0.00 42.46 39.08 2dtg s ILE 364 CO 0.05 0.53 0.98 0.77 -1.23 0.00 0.00 174.94 176.04 2dtg h SER 365 N 6.76 -0.57 0.00 3.58 4.64 -1.67 0.42 113.55 126.71 2dtg h SER 365 Ca -0.21 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2dtg h SER 365 Cb 1.23 0.15 0.00 0.00 -0.31 0.00 0.00 62.40 63.47 2dtg h SER 365 CO 0.47 -0.30 0.00 0.61 -0.87 0.00 0.00 176.83 176.74 2dtg n GLY 366 N -0.48 -0.92 3.53 -0.77 0.00 0.11 0.22 105.19 106.88 2dtg n GLY 366 Ca -0.08 -1.00 -0.32 0.00 0.00 0.00 0.00 46.02 44.61 2dtg n GLY 366 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2dtg s TYR 367 N 0.00 2.78 -0.22 1.61 -0.85 -1.25 -1.26 117.35 118.16 2dtg s TYR 367 Ca 0.00 -0.10 -0.12 0.00 -0.52 0.00 0.00 57.07 56.33 2dtg s TYR 367 Cb 0.00 -1.61 -0.05 0.00 0.38 0.00 0.00 41.96 40.68 2dtg s TYR 367 CO 0.00 0.28 0.22 -1.17 -1.52 0.00 0.00 175.55 173.36 2dtg s LEU 368 N -1.06 4.14 -0.07 -3.49 2.96 0.05 -4.13 118.68 117.08 2dtg s LEU 368 Ca 0.14 0.24 0.04 0.00 -0.22 0.00 0.00 54.13 54.32 2dtg s LEU 368 Cb -0.11 -2.21 0.00 0.00 0.50 0.00 0.00 46.19 44.38 2dtg s LEU 368 CO 0.04 0.05 -0.19 -0.75 -1.32 0.00 0.00 176.35 174.18 2dtg s LYS 369 N 0.98 2.27 -0.19 1.98 2.20 -1.21 -0.98 119.74 124.79 2dtg s LYS 369 Ca 0.11 -0.67 -0.01 0.00 -0.36 0.00 0.00 55.97 55.04 2dtg s LYS 369 Cb -0.13 -1.82 0.00 0.00 -1.51 0.00 0.00 37.83 34.37 2dtg s LYS 369 CO 0.04 0.16 -0.13 0.42 -0.36 0.00 0.00 175.35 175.49 2dtg s ILE 370 N 0.33 2.76 -0.02 5.43 1.01 1.09 -1.80 121.20 129.99 2dtg s ILE 370 Ca -0.13 -0.72 -0.01 0.00 0.00 0.00 0.00 60.65 59.80 2dtg s ILE 370 Cb -0.15 -2.20 0.02 0.00 0.01 0.00 0.00 42.46 40.14 2dtg s ILE 370 CO 0.05 0.49 0.05 -0.60 0.00 0.00 0.00 174.94 174.93 2dtg s ARG 371 N 1.18 0.01 -1.42 2.79 3.52 -0.74 -1.75 118.95 122.54 2dtg s ARG 371 Ca 0.02 0.15 -0.05 0.00 -0.13 0.00 0.00 55.73 55.72 2dtg s ARG 371 Cb -0.14 -0.12 0.00 0.00 -1.56 0.00 0.00 34.95 33.13 2dtg s ARG 371 CO -0.05 -0.10 0.32 0.54 -0.81 0.00 0.00 175.30 175.20 2dtg n ARG 372 N 3.71 -2.02 -2.72 5.12 1.74 -0.95 -4.16 116.66 117.38 2dtg n ARG 372 Ca -0.21 0.26 -0.41 0.00 -0.77 0.00 0.00 57.85 56.72 2dtg n ARG 372 Cb 0.54 -3.97 0.02 0.00 -1.02 0.00 0.00 32.46 28.03 2dtg n ARG 372 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2dtg n SER 373 N -2.85 7.16 0.19 0.55 7.64 -1.26 -4.31 113.62 120.73 2dtg n SER 373 Ca -0.28 -3.62 0.18 0.00 1.01 0.00 0.00 58.87 56.15 2dtg n SER 373 Cb 0.67 -1.19 0.74 0.00 -1.01 0.00 0.00 64.21 63.42 2dtg n SER 373 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 2dtg h TYR 374 N 4.50 0.00 0.00 1.43 3.20 -1.82 -0.59 116.97 123.69 2dtg h TYR 374 Ca 0.46 0.00 -0.28 0.00 3.14 0.00 0.00 58.73 62.05 2dtg h TYR 374 Cb 0.39 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 38.61 2dtg h TYR 374 CO 1.27 0.00 -1.59 0.00 -1.64 0.00 0.00 178.16 176.20 2dtg h ALA 375 N 1.34 0.70 -2.39 1.82 0.00 -1.49 -3.37 119.26 115.87 2dtg h ALA 375 Ca 0.12 -1.37 -0.50 0.00 0.00 0.00 0.00 54.91 53.16 2dtg h ALA 375 Cb 1.02 0.38 0.08 0.00 0.00 0.00 0.00 17.79 19.27 2dtg h ALA 375 CO -0.00 1.53 0.38 -0.51 0.00 0.00 0.00 179.25 180.65 2dtg s LEU 376 N -6.20 3.46 0.00 0.00 1.43 -0.23 -4.95 118.68 112.18 2dtg s LEU 376 Ca -0.04 1.88 0.00 0.00 -1.03 0.00 0.00 54.13 54.94 2dtg s LEU 376 Cb 0.08 -4.54 0.00 0.00 0.03 0.00 0.00 46.19 41.76 2dtg s LEU 376 CO 0.82 -1.33 0.00 1.33 0.23 0.00 0.00 176.35 177.40 2dtg n VAL 377 N -2.17 0.00 -3.74 -1.59 0.24 -1.26 -1.48 118.33 108.33 2dtg n VAL 377 Ca 0.09 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.24 2dtg n VAL 377 Cb 0.53 -0.20 -0.15 0.00 -1.47 0.00 0.00 33.84 32.54 2dtg n VAL 377 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2dtg s SER 378 N -1.59 0.15 0.00 -1.34 0.15 -1.24 0.18 113.70 110.00 2dtg s SER 378 Ca 0.00 0.20 0.09 0.00 0.70 0.00 0.00 55.95 56.94 2dtg s SER 378 Cb 0.00 0.08 0.53 0.00 -1.71 0.00 0.00 66.02 64.93 2dtg s SER 378 CO 0.00 -0.16 1.00 0.18 1.20 0.00 0.00 173.24 175.46 2dtg n LEU 379 N 4.42 0.00 -0.29 3.45 4.77 -0.63 -4.05 117.00 124.67 2dtg n LEU 379 Ca -0.23 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 55.86 2dtg n LEU 379 Cb 0.51 0.00 0.26 0.00 -2.33 0.00 0.00 43.42 41.85 2dtg n LEU 379 CO 0.17 0.00 0.93 0.77 -1.33 0.00 0.00 177.39 177.93 2dtg h SER 380 N 0.00 -0.02 0.00 -1.43 4.64 -1.79 -2.22 113.55 112.74 2dtg h SER 380 Ca 0.00 0.19 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 2dtg h SER 380 Cb 0.00 0.26 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 2dtg h SER 380 CO 0.00 -0.13 0.66 2.19 -0.87 0.00 0.00 176.83 178.68 2dtg h PHE 381 N 0.22 0.00 -0.57 4.77 -5.15 -1.92 0.54 116.94 114.82 2dtg h PHE 381 Ca 0.51 0.00 -0.35 0.00 -0.20 0.00 0.00 57.97 57.93 2dtg h PHE 381 Cb 0.99 0.00 -0.17 0.00 0.22 0.00 0.00 35.95 37.00 2dtg h PHE 381 CO -0.28 0.00 0.45 1.19 -2.00 0.00 0.00 178.31 177.67 2dtg n PHE 382 N -1.94 1.81 -0.24 6.09 3.72 -0.83 -2.81 117.46 123.26 2dtg n PHE 382 Ca -0.00 -1.79 0.14 0.00 -0.05 0.00 0.00 57.45 55.74 2dtg n PHE 382 Cb 0.67 -0.88 0.27 0.00 -0.94 0.00 0.00 39.48 38.59 2dtg n PHE 382 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 2dtg n ARG 383 N -0.11 -0.05 0.02 -1.08 0.00 0.19 -0.64 116.66 114.99 2dtg n ARG 383 Ca 0.35 1.06 0.13 0.00 -0.00 0.00 0.00 57.85 59.38 2dtg n ARG 383 Cb 0.83 -1.73 0.35 0.00 0.00 0.00 0.00 32.46 31.91 2dtg n ARG 383 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2dtg n LYS 384 N -4.89 0.08 -1.71 -0.14 5.02 -1.10 -4.93 118.16 110.49 2dtg n LYS 384 Ca 0.20 0.04 -0.39 0.00 -2.02 0.00 0.00 58.31 56.13 2dtg n LYS 384 Cb 0.65 -1.57 0.03 0.00 -0.02 0.00 0.00 35.03 34.13 2dtg n LYS 384 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2dtg n LEU 385 N -1.70 4.65 0.00 -0.35 0.00 0.88 -4.23 117.00 116.25 2dtg n LEU 385 Ca 0.05 1.01 0.00 0.00 0.00 0.00 0.00 56.01 57.08 2dtg n LEU 385 Cb 0.37 -1.52 0.00 0.00 0.00 0.00 0.00 43.42 42.26 2dtg n LEU 385 CO 0.33 -0.76 0.00 0.54 0.00 0.00 0.00 177.39 177.50 2dtg n ARG 386 N -0.54 0.00 -3.73 1.96 1.74 0.40 -4.70 116.66 111.79 2dtg n ARG 386 Ca 0.09 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 57.05 2dtg n ARG 386 Cb 0.43 -0.08 -0.11 0.00 -1.02 0.00 0.00 32.46 31.68 2dtg n ARG 386 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2dtg s LEU 387 N 0.00 0.38 -0.53 0.55 2.96 -0.97 0.33 118.68 121.39 2dtg s LEU 387 Ca 0.00 0.76 0.04 0.00 -0.22 0.00 0.00 54.13 54.71 2dtg s LEU 387 Cb 0.00 1.22 0.16 0.00 0.50 0.00 0.00 46.19 48.07 2dtg s LEU 387 CO 0.00 -0.15 0.37 -0.63 -1.32 0.00 0.00 176.35 174.62 2dtg s ILE 388 N 0.67 1.66 0.48 6.68 1.01 0.13 0.64 121.20 132.47 2dtg s ILE 388 Ca -0.04 -3.26 0.29 0.00 0.00 0.00 0.00 60.65 57.64 2dtg s ILE 388 Cb -0.05 -2.12 0.48 0.00 0.01 0.00 0.00 42.46 40.78 2dtg s ILE 388 CO -0.04 -1.04 1.80 0.03 0.00 0.00 0.00 174.94 175.68 2dtg h ARG 389 N 5.87 0.15 -4.79 2.79 3.08 -0.12 -3.12 114.38 118.24 2dtg h ARG 389 Ca 0.14 -0.01 -0.33 0.00 0.07 0.00 0.00 59.98 59.85 2dtg h ARG 389 Cb 0.85 -0.03 0.11 0.00 0.08 0.00 0.00 29.97 30.97 2dtg h ARG 389 CO 0.54 0.10 -0.55 0.41 -1.07 0.00 0.00 179.97 179.40 2dtg n GLY 390 N -1.64 -0.29 0.16 0.04 0.00 0.59 -2.59 105.19 101.46 2dtg n GLY 390 Ca 0.25 0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.47 2dtg n GLY 390 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2dtg h GLU 391 N -2.07 0.00 -1.14 1.61 4.57 0.20 -3.31 114.58 114.45 2dtg h GLU 391 Ca -0.46 0.00 -0.41 0.00 -1.18 0.00 0.00 59.36 57.31 2dtg h GLU 391 Cb 1.30 0.00 -0.28 0.00 -0.16 0.00 0.00 28.75 29.61 2dtg h GLU 391 CO 0.46 0.00 -0.85 0.25 -1.18 0.00 0.00 179.01 177.70 2dtg n THR 392 N -2.39 -0.37 -0.59 0.32 -2.24 -1.26 -4.89 114.28 102.86 2dtg n THR 392 Ca 0.01 -2.96 -0.28 0.00 -2.27 0.00 0.00 64.05 58.55 2dtg n THR 392 Cb 0.22 -0.38 0.25 0.00 -2.10 0.00 0.00 70.33 68.32 2dtg n THR 392 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2dtg s LEU 393 N -1.10 0.65 0.39 3.22 1.43 -1.25 -3.86 118.68 118.16 2dtg s LEU 393 Ca 0.34 1.39 0.08 0.00 -1.03 0.00 0.00 54.13 54.90 2dtg s LEU 393 Cb 0.21 -3.26 -0.02 0.00 0.03 0.00 0.00 46.19 43.15 2dtg s LEU 393 CO -0.16 -4.26 0.37 -1.83 0.23 0.00 0.00 176.35 170.69 2dtg s GLU 394 N -4.55 2.63 -0.78 1.70 -1.05 -1.15 -4.88 118.70 110.63 2dtg s GLU 394 Ca 0.68 -1.43 -0.35 0.00 -0.15 0.00 0.00 54.97 53.72 2dtg s GLU 394 Cb -0.24 -2.45 -0.20 0.00 -0.44 0.00 0.00 34.13 30.81 2dtg s GLU 394 CO 0.64 -0.10 2.47 1.51 0.95 0.00 0.00 175.26 180.73 2dtg n ILE 395 N -1.51 0.01 0.00 1.83 3.06 -1.26 0.20 119.36 121.68 2dtg n ILE 395 Ca 0.02 -0.05 0.00 0.00 -2.50 0.00 0.00 62.75 60.22 2dtg n ILE 395 Cb 0.61 -0.66 0.00 0.00 0.54 0.00 0.00 39.64 40.13 2dtg n ILE 395 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2dtg n GLY 396 N 6.82 1.22 2.23 4.50 0.00 -1.26 -4.73 105.19 113.97 2dtg n GLY 396 Ca 0.60 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.50 2dtg n GLY 396 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2dtg n ASN 397 N 0.00 -3.82 -4.78 1.61 3.02 0.55 -4.93 115.26 106.90 2dtg n ASN 397 Ca 0.00 -0.01 -0.38 0.00 -0.03 0.00 0.00 54.58 54.15 2dtg n ASN 397 Cb 0.00 -3.04 -0.06 0.00 -0.61 0.00 0.00 39.78 36.08 2dtg n ASN 397 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2dtg s TYR 398 N -2.60 3.68 -0.03 3.10 4.12 -1.19 -1.99 117.35 122.44 2dtg s TYR 398 Ca 0.00 1.11 0.20 0.00 0.02 0.00 0.00 57.07 58.41 2dtg s TYR 398 Cb -0.00 -2.52 -0.31 0.00 -1.52 0.00 0.00 41.96 37.61 2dtg s TYR 398 CO 0.00 0.41 0.44 -1.13 0.02 0.00 0.00 175.55 175.29 2dtg n SER 399 N 2.56 0.41 -3.66 2.29 3.41 0.92 -2.92 113.62 116.64 2dtg n SER 399 Ca -0.09 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.23 2dtg n SER 399 Cb 0.51 1.91 -0.15 0.00 -0.26 0.00 0.00 64.21 66.21 2dtg n SER 399 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2dtg s PHE 400 N -3.38 1.02 -0.21 7.33 5.36 -1.17 -0.77 117.98 126.16 2dtg s PHE 400 Ca -0.07 -1.19 -0.07 0.00 -0.96 0.00 0.00 56.93 54.64 2dtg s PHE 400 Cb 0.13 -1.24 -0.03 0.00 -0.34 0.00 0.00 43.02 41.53 2dtg s PHE 400 CO 0.83 -0.79 0.06 -0.47 -1.46 0.00 0.00 175.22 173.39 2dtg s TYR 401 N 1.86 3.14 -0.26 10.12 5.04 -0.15 -1.15 117.35 135.95 2dtg s TYR 401 Ca 0.07 -0.19 -0.04 0.00 -2.44 0.00 0.00 57.07 54.47 2dtg s TYR 401 Cb -0.17 -2.14 0.09 0.00 0.35 0.00 0.00 41.96 40.09 2dtg s TYR 401 CO -0.25 -0.11 0.13 0.00 -1.34 0.00 0.00 175.55 173.98 2dtg s ALA 402 N 0.97 0.52 0.05 3.97 0.00 0.12 0.35 121.76 127.73 2dtg s ALA 402 Ca 0.03 -0.87 0.04 0.00 0.00 0.00 0.00 51.96 51.17 2dtg s ALA 402 Cb -0.14 -1.33 -0.02 0.00 0.00 0.00 0.00 23.12 21.62 2dtg s ALA 402 CO 0.03 -1.55 -0.12 -0.48 0.00 0.00 0.00 175.76 173.64 2dtg s LEU 403 N 2.12 2.22 -0.89 0.00 2.34 -0.72 -1.52 118.68 122.23 2dtg s LEU 403 Ca 0.08 -0.52 0.00 0.00 0.06 0.00 0.00 54.13 53.75 2dtg s LEU 403 Cb -0.16 -0.46 0.00 0.00 -0.56 0.00 0.00 46.19 45.01 2dtg s LEU 403 CO -0.31 -0.06 0.00 -0.67 -1.06 0.00 0.00 176.35 174.26 2dtg n ASP 404 N 1.63 -3.90 -4.58 1.48 4.64 0.16 -2.25 116.55 113.73 2dtg n ASP 404 Ca -0.20 0.21 -0.39 0.00 -1.38 0.00 0.00 54.79 53.03 2dtg n ASP 404 Cb 0.55 -3.10 -0.02 0.00 -1.04 0.00 0.00 41.12 37.51 2dtg n ASP 404 CO 0.00 0.00 0.00 0.20 -0.82 0.00 0.00 177.20 176.58 2dtg s ASN 405 N -1.86 6.37 0.00 1.67 0.01 -1.18 -4.25 114.94 115.69 2dtg s ASN 405 Ca 0.00 -2.19 0.00 0.00 -0.71 0.00 0.00 52.86 49.96 2dtg s ASN 405 Cb 0.00 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 39.08 2dtg s ASN 405 CO 0.00 -1.66 0.23 1.67 -1.51 0.00 0.00 177.10 175.82 2dtg n GLN 406 N 8.40 0.00 0.00 -0.60 -0.06 -1.26 -2.42 117.38 121.44 2dtg n GLN 406 Ca 0.47 0.23 0.03 0.00 -2.00 0.00 0.00 57.00 55.73 2dtg n GLN 406 Cb 0.46 -0.65 0.17 0.00 -4.06 0.00 0.00 30.24 26.16 2dtg n GLN 406 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 2dtg n ASN 407 N -0.49 0.00 -4.57 1.69 3.02 -1.26 -3.92 115.26 109.73 2dtg n ASN 407 Ca 0.00 0.21 -0.42 0.00 -0.03 0.00 0.00 54.58 54.34 2dtg n ASN 407 Cb 0.00 -0.30 -0.04 0.00 -0.61 0.00 0.00 39.78 38.84 2dtg n ASN 407 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 2dtg n LEU 408 N -1.30 2.82 -0.03 3.41 7.94 -0.55 -4.18 117.00 125.12 2dtg n LEU 408 Ca 0.03 0.00 -0.14 0.00 -1.11 0.00 0.00 56.01 54.79 2dtg n LEU 408 Cb 0.06 -1.53 -0.14 0.00 0.53 0.00 0.00 43.42 42.34 2dtg n LEU 408 CO 0.05 -0.96 -0.79 -1.14 -1.11 0.00 0.00 177.39 173.44 2dtg n ARG 409 N 8.79 0.69 -3.84 1.96 0.63 0.47 -2.70 116.66 122.65 2dtg n ARG 409 Ca 0.34 0.23 -0.12 0.00 -0.92 0.00 0.00 57.85 57.38 2dtg n ARG 409 Cb 0.45 -1.70 -0.12 0.00 0.45 0.00 0.00 32.46 31.54 2dtg n ARG 409 CO 0.00 0.00 0.00 -1.14 -2.51 0.00 0.00 177.63 173.98 2dtg s GLN 410 N -2.56 0.20 0.00 -0.14 0.74 0.33 -4.09 119.66 114.14 2dtg s GLN 410 Ca -0.15 0.07 0.00 0.00 0.05 0.00 0.00 55.36 55.34 2dtg s GLN 410 Cb 0.07 0.09 0.00 0.00 1.10 0.00 0.00 33.01 34.28 2dtg s GLN 410 CO 0.78 -0.03 0.08 1.28 -0.55 0.00 0.00 175.29 176.85 2dtg n LEU 411 N 2.74 1.53 -4.12 3.68 4.77 -1.26 -1.61 117.00 122.74 2dtg n LEU 411 Ca -0.14 0.08 -0.08 0.00 -0.03 0.00 0.00 56.01 55.84 2dtg n LEU 411 Cb 0.58 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.57 2dtg n LEU 411 CO 0.22 0.00 -0.36 0.26 -1.33 0.00 0.00 177.39 176.18 2dtg s TRP 412 N -0.16 0.66 -1.27 -1.77 0.51 -1.26 -1.65 118.94 113.99 2dtg s TRP 412 Ca 0.00 -1.06 -0.18 0.00 -2.12 0.00 0.00 56.10 52.74 2dtg s TRP 412 Cb 0.00 -0.44 0.02 0.00 -0.81 0.00 0.00 33.47 32.24 2dtg s TRP 412 CO 0.00 -0.35 1.87 -3.47 -0.51 0.00 0.00 176.95 174.50 2dtg n ASP 413 N 0.04 4.24 -0.30 2.95 4.64 -1.26 -4.75 116.55 122.12 2dtg n ASP 413 Ca -0.12 -2.85 0.35 0.00 -1.38 0.00 0.00 54.79 50.79 2dtg n ASP 413 Cb 0.61 -1.69 0.73 0.00 -1.04 0.00 0.00 41.12 39.73 2dtg n ASP 413 CO 0.00 0.00 0.00 -0.50 -0.82 0.00 0.00 177.20 175.88 2dtg h TRP 414 N 7.73 0.00 -0.40 -0.67 4.06 -1.98 1.57 115.95 126.26 2dtg h TRP 414 Ca 0.42 0.00 0.08 0.00 2.06 0.00 0.00 58.89 61.46 2dtg h TRP 414 Cb 0.83 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.97 2dtg h TRP 414 CO 1.38 0.00 0.28 0.66 -3.56 0.00 0.00 178.44 177.20 2dtg h SER 415 N 0.00 0.16 0.00 -3.49 4.64 -2.04 -3.39 113.55 109.43 2dtg h SER 415 Ca 0.55 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.87 2dtg h SER 415 Cb 2.33 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 64.39 2dtg h SER 415 CO -0.01 0.10 0.00 0.29 -0.87 0.00 0.00 176.83 176.35 2dtg n LYS 416 N -4.46 0.00 -0.94 4.77 5.02 0.52 -5.09 118.16 117.98 2dtg n LYS 416 Ca 0.06 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 56.00 2dtg n LYS 416 Cb 0.35 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 35.39 2dtg n LYS 416 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 2dtg n HIS 417 N 0.00 -3.75 -3.63 2.13 -0.00 -0.29 -5.01 115.22 104.66 2dtg n HIS 417 Ca 0.00 0.18 -0.06 0.00 0.46 0.00 0.00 57.72 58.30 2dtg n HIS 417 Cb 0.00 -1.33 -0.06 0.00 -0.12 0.00 0.00 29.99 28.48 2dtg n HIS 417 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 2dtg s ASN 418 N -0.94 -0.20 0.29 0.26 4.22 -1.26 -4.28 114.94 113.03 2dtg s ASN 418 Ca 0.36 0.30 0.04 0.00 -2.14 0.00 0.00 52.86 51.43 2dtg s ASN 418 Cb -0.08 0.27 -0.02 0.00 1.28 0.00 0.00 41.25 42.70 2dtg s ASN 418 CO 0.73 -0.13 0.29 0.00 -2.04 0.00 0.00 177.10 175.95 2dtg n LEU 419 N 1.15 0.00 -3.84 3.54 -0.00 -1.26 -4.50 117.00 112.10 2dtg n LEU 419 Ca -0.08 -2.63 -0.13 0.00 -0.00 0.00 0.00 56.01 53.18 2dtg n LEU 419 Cb 0.58 1.64 -0.14 0.00 -0.00 0.00 0.00 43.42 45.49 2dtg n LEU 419 CO 0.07 -0.48 -0.34 -0.89 -0.00 0.00 0.00 177.39 175.75 2dtg s THR 420 N -3.04 -0.02 -0.76 1.47 2.01 0.15 -4.27 115.64 111.18 2dtg s THR 420 Ca 0.31 0.06 -0.02 0.00 0.31 0.00 0.00 61.69 62.35 2dtg s THR 420 Cb 0.01 -0.06 0.19 0.00 0.01 0.00 0.00 72.50 72.65 2dtg s THR 420 CO 0.22 0.02 0.61 -0.63 -0.69 0.00 0.00 174.62 174.16 2dtg s ILE 421 N 0.30 4.04 0.30 1.82 1.09 -1.15 0.19 121.20 127.80 2dtg s ILE 421 Ca -0.02 -3.42 0.06 0.00 -1.10 0.00 0.00 60.65 56.16 2dtg s ILE 421 Cb -0.04 -3.57 0.31 0.00 -1.06 0.00 0.00 42.46 38.10 2dtg s ILE 421 CO -0.01 -0.99 1.67 0.71 -0.10 0.00 0.00 174.94 176.23 2dtg h THR 422 N 4.66 0.37 -4.49 2.92 1.35 -1.72 -3.43 112.91 112.58 2dtg h THR 422 Ca 0.08 -0.11 -0.21 0.00 -0.55 0.00 0.00 66.41 65.62 2dtg h THR 422 Cb 0.88 0.03 -0.15 0.00 -1.73 0.00 0.00 68.15 67.19 2dtg h THR 422 CO 0.78 0.06 -0.60 -1.10 -0.25 0.00 0.00 175.52 174.40 2dtg s GLN 423 N -5.85 1.12 0.00 4.72 -0.21 -1.07 -5.04 119.66 113.33 2dtg s GLN 423 Ca -0.11 -1.54 0.00 0.00 0.02 0.00 0.00 55.36 53.72 2dtg s GLN 423 Cb 0.27 0.27 0.00 0.00 1.00 0.00 0.00 33.01 34.55 2dtg s GLN 423 CO 0.78 -0.36 0.00 0.41 -2.12 0.00 0.00 175.29 174.00 2dtg n GLY 424 N -0.21 -0.59 3.40 3.09 0.00 -1.26 -4.51 105.19 105.10 2dtg n GLY 424 Ca -0.01 -1.76 -0.20 0.00 0.00 0.00 0.00 46.02 44.05 2dtg n GLY 424 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dtg s LYS 425 N -1.13 1.51 0.19 1.61 -2.85 -0.84 -4.74 119.74 113.49 2dtg s LYS 425 Ca 0.00 -1.79 -0.09 0.00 -1.00 0.00 0.00 55.97 53.09 2dtg s LYS 425 Cb 0.00 -0.89 -0.07 0.00 -2.06 0.00 0.00 37.83 34.82 2dtg s LYS 425 CO 0.00 -0.08 0.50 -0.51 0.10 0.00 0.00 175.35 175.36 2dtg s LEU 426 N -3.41 4.22 -0.09 2.77 1.02 -1.26 -0.05 118.68 121.88 2dtg s LEU 426 Ca 0.31 0.85 -0.03 0.00 0.02 0.00 0.00 54.13 55.28 2dtg s LEU 426 Cb 0.06 -3.49 0.04 0.00 0.02 0.00 0.00 46.19 42.81 2dtg s LEU 426 CO 0.12 -0.00 0.05 0.12 0.02 0.00 0.00 176.35 176.66 2dtg s PHE 427 N -1.71 0.29 -0.08 0.29 5.36 -0.30 -4.53 117.98 117.30 2dtg s PHE 427 Ca 0.44 -0.04 0.00 0.00 -0.96 0.00 0.00 56.93 56.37 2dtg s PHE 427 Cb -0.12 -0.63 0.02 0.00 -0.34 0.00 0.00 43.02 41.95 2dtg s PHE 427 CO 0.21 -0.32 -0.06 -0.06 -1.46 0.00 0.00 175.22 173.54 2dtg s PHE 428 N 2.10 1.13 -0.20 10.12 2.99 -0.70 0.13 117.98 133.55 2dtg s PHE 428 Ca 0.04 -0.46 -0.05 0.00 0.00 0.00 0.00 56.93 56.46 2dtg s PHE 428 Cb -0.13 -0.99 0.10 0.00 0.00 0.00 0.00 43.02 42.00 2dtg s PHE 428 CO -0.05 -0.37 0.37 -1.01 -0.00 0.00 0.00 175.22 174.16 2dtg s HIS 429 N 1.45 -0.72 -0.09 0.36 3.76 -0.58 -0.66 115.29 118.82 2dtg s HIS 429 Ca -0.01 1.21 -0.00 0.00 -0.15 0.00 0.00 55.06 56.10 2dtg s HIS 429 Cb -0.13 0.15 -0.00 0.00 1.11 0.00 0.00 32.58 33.70 2dtg s HIS 429 CO -0.04 -0.52 0.08 0.66 -0.85 0.00 0.00 174.74 174.07 2dtg n TYR 430 N 5.37 -0.19 -2.73 1.40 4.02 -0.73 0.36 117.16 124.66 2dtg n TYR 430 Ca -0.07 0.07 -0.18 0.00 -0.01 0.00 0.00 57.90 57.72 2dtg n TYR 430 Cb 0.50 -2.49 0.00 0.00 -0.02 0.00 0.00 39.34 37.33 2dtg n TYR 430 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2dtg n ASN 431 N -1.47 2.58 0.24 7.72 4.13 -1.14 -2.73 115.26 124.60 2dtg n ASN 431 Ca -0.01 -3.15 0.01 0.00 1.68 0.00 0.00 54.58 53.11 2dtg n ASN 431 Cb 0.51 -0.53 0.06 0.00 -1.54 0.00 0.00 39.78 38.28 2dtg n ASN 431 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2dtg h PRO 432 N 2.88 0.00 0.00 3.52 0.13 -1.79 0.82 132.00 137.56 2dtg h PRO 432 Ca 0.07 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.03 2dtg h PRO 432 Cb 1.00 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.10 2dtg h PRO 432 CO 0.63 0.00 -1.10 0.87 -0.23 0.00 0.00 178.00 178.17 2dtg h LYS 433 N 0.00 0.00 -6.56 0.86 6.56 -1.71 -1.71 116.57 114.01 2dtg h LYS 433 Ca 0.00 0.00 -0.55 0.00 -1.06 0.00 0.00 60.65 59.04 2dtg h LYS 433 Cb 1.60 0.00 -0.07 0.00 -0.57 0.00 0.00 32.23 33.19 2dtg h LYS 433 CO 0.00 0.50 0.99 -0.51 -2.06 0.00 0.00 179.45 178.36 2dtg s LEU 434 N -6.18 3.42 0.11 2.94 2.01 0.28 -4.54 118.68 116.72 2dtg s LEU 434 Ca -0.00 0.06 -0.31 0.00 0.01 0.00 0.00 54.13 53.89 2dtg s LEU 434 Cb 0.08 -3.12 -0.09 0.00 0.01 0.00 0.00 46.19 43.08 2dtg s LEU 434 CO 0.79 -1.51 1.58 0.00 1.01 0.00 0.00 176.35 178.22 2dtg h LEU 436 N 7.71 0.00 -0.34 0.00 3.38 -1.90 0.16 115.31 124.31 2dtg h LEU 436 Ca -0.42 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.62 2dtg h LEU 436 Cb 1.20 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.87 2dtg h LEU 436 CO 0.92 0.00 -0.29 0.28 0.09 0.00 0.00 178.44 179.44 2dtg h SER 437 N 0.00 -0.95 0.36 -0.43 0.02 -1.96 0.11 113.55 110.70 2dtg h SER 437 Ca 0.63 0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 61.72 2dtg h SER 437 Cb 2.74 0.45 -0.00 0.00 0.14 0.00 0.00 62.40 65.73 2dtg h SER 437 CO -0.01 -0.30 -0.11 -0.33 -1.14 0.00 0.00 176.83 174.94 2dtg h GLU 438 N -0.25 0.00 0.20 3.45 4.39 -1.04 -1.63 114.58 119.71 2dtg h GLU 438 Ca 0.16 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.85 2dtg h GLU 438 Cb 0.51 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 2dtg h GLU 438 CO -0.48 0.11 -0.10 0.82 -1.16 0.00 0.00 179.01 178.20 2dtg h ILE 439 N 0.00 0.73 0.00 3.13 2.04 -0.90 -2.81 117.51 119.69 2dtg h ILE 439 Ca -0.00 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 64.84 2dtg h ILE 439 Cb 0.32 1.20 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 2dtg h ILE 439 CO 0.01 0.18 0.09 0.45 0.00 0.00 0.00 178.15 178.89 2dtg h HIS 440 N -0.88 0.00 0.40 1.37 3.86 -0.61 0.57 115.15 119.85 2dtg h HIS 440 Ca -0.03 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.16 2dtg h HIS 440 Cb 0.51 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.98 2dtg h HIS 440 CO 0.07 0.00 -0.19 -0.22 0.86 0.00 0.00 177.93 178.45 2dtg h LYS 441 N 0.00 -0.51 0.09 2.45 3.11 -1.19 -2.90 116.57 117.61 2dtg h LYS 441 Ca 0.00 0.03 0.02 0.00 -2.81 0.00 0.00 60.65 57.90 2dtg h LYS 441 Cb 0.18 0.12 -0.05 0.00 -1.00 0.00 0.00 32.23 31.48 2dtg h LYS 441 CO 0.00 -0.26 -0.41 1.98 -2.81 0.00 0.00 179.45 177.94 2dtg h MET 442 N -1.08 -0.60 -1.25 1.90 4.05 -1.05 0.16 114.93 117.06 2dtg h MET 442 Ca -0.05 0.04 0.36 0.00 -0.28 0.00 0.00 59.70 59.77 2dtg h MET 442 Cb 0.49 0.14 -0.05 0.00 -0.80 0.00 0.00 31.60 31.37 2dtg h MET 442 CO 0.09 -0.40 0.91 -1.91 0.23 0.00 0.00 176.91 175.82 2dtg n GLU 443 N -5.46 0.00 -0.01 0.39 2.13 0.10 0.23 120.64 118.02 2dtg n GLU 443 Ca -0.07 0.69 -0.01 0.00 0.66 0.00 0.00 57.16 58.43 2dtg n GLU 443 Cb 0.37 -1.59 -0.00 0.00 0.27 0.00 0.00 31.44 30.49 2dtg n GLU 443 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2dtg n GLU 444 N -3.20 0.04 0.02 5.31 2.13 -0.00 -0.84 120.64 124.10 2dtg n GLU 444 Ca 0.28 0.02 0.20 0.00 0.66 0.00 0.00 57.16 58.32 2dtg n GLU 444 Cb 1.28 -0.53 0.71 0.00 0.27 0.00 0.00 31.44 33.17 2dtg n GLU 444 CO 0.00 0.00 0.00 -0.24 -0.41 0.00 0.00 177.13 176.48 2dtg h VAL 445 N -0.08 0.68 0.25 6.31 3.04 0.35 -0.56 116.25 126.23 2dtg h VAL 445 Ca 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.68 2dtg h VAL 445 Cb 0.08 0.73 0.00 0.00 -2.01 0.00 0.00 31.29 30.10 2dtg h VAL 445 CO 0.00 0.00 -0.12 0.77 -1.01 0.00 0.00 177.57 177.21 2dtg h SER 446 N 0.00 -0.29 0.00 3.17 4.64 0.27 -3.42 113.55 117.92 2dtg h SER 446 Ca 0.24 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2dtg h SER 446 Cb 1.00 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2dtg h SER 446 CO -0.00 -0.16 0.00 0.61 -0.87 0.00 0.00 176.83 176.41 2dtg n GLY 447 N -1.09 0.98 0.00 -0.77 0.00 -0.22 -2.93 105.19 101.16 2dtg n GLY 447 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2dtg n GLY 447 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2dtg n THR 448 N 0.00 0.00 -2.06 2.61 -1.04 -0.95 -4.72 114.28 108.12 2dtg n THR 448 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2dtg n THR 448 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 2dtg n THR 448 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 2dtg n LYS 449 N 0.00 -4.28 -0.86 -2.82 3.00 -0.02 -4.40 118.16 108.78 2dtg n LYS 449 Ca 0.00 3.03 0.00 0.00 -0.00 0.00 0.00 58.31 61.34 2dtg n LYS 449 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 35.03 31.50 2dtg n LYS 449 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2dtg n GLY 450 N 1.88 1.27 0.63 3.14 0.00 -1.26 -4.83 105.19 106.02 2dtg n GLY 450 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2dtg n GLY 450 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dtg n ARG 451 N -2.00 1.85 -3.77 1.61 1.74 -1.26 -4.90 116.66 109.93 2dtg n ARG 451 Ca 0.00 -1.26 -0.22 0.00 -0.77 0.00 0.00 57.85 55.60 2dtg n ARG 451 Cb 0.00 -1.44 -0.05 0.00 -1.02 0.00 0.00 32.46 29.96 2dtg n ARG 451 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2dtg s GLN 452 N -1.83 2.45 0.00 5.56 1.11 -1.26 -4.60 119.66 121.09 2dtg s GLN 452 Ca 0.34 -1.61 0.00 0.00 0.01 0.00 0.00 55.36 54.10 2dtg s GLN 452 Cb 0.19 -2.26 0.00 0.00 -1.01 0.00 0.00 33.01 29.93 2dtg s GLN 452 CO 0.29 -0.14 0.00 0.39 0.01 0.00 0.00 175.29 175.84 2dtg n GLU 453 N -1.43 0.10 0.00 2.91 1.02 -1.26 -5.11 120.64 116.86 2dtg n GLU 453 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 2dtg n GLU 453 Cb 0.62 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.04 2dtg n GLU 453 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 2dtg n ARG 454 N 0.00 0.00 0.00 3.49 0.63 -1.26 -4.69 116.66 114.83 2dtg n ARG 454 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2dtg n ARG 454 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 2dtg n ARG 454 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 2dtg n ASN 455 N 0.00 0.00 0.00 6.15 0.23 -1.26 -4.67 115.26 115.71 2dtg n ASN 455 Ca 0.00 0.28 0.00 0.00 -0.53 0.00 0.00 54.58 54.33 2dtg n ASN 455 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 2dtg n ASN 455 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2dtg n ASP 456 N -0.46 0.00 -4.21 0.53 8.00 -1.26 -4.39 116.55 114.76 2dtg n ASP 456 Ca 0.00 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.10 2dtg n ASP 456 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.00 2dtg n ASP 456 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2dtg s ILE 457 N 0.00 4.01 -0.03 0.53 -1.09 -1.26 -1.72 121.20 121.63 2dtg s ILE 457 Ca 0.00 -1.71 -0.30 0.00 -2.23 0.00 0.00 60.65 56.41 2dtg s ILE 457 Cb 0.00 -3.59 -0.05 0.00 -1.58 0.00 0.00 42.46 37.23 2dtg s ILE 457 CO 0.00 -0.66 1.52 0.00 -1.23 0.00 0.00 174.94 174.57 2dtg s ALA 458 N 1.34 3.62 -0.15 9.38 0.00 0.17 -4.90 121.76 131.21 2dtg s ALA 458 Ca 0.05 0.89 -0.04 0.00 0.00 0.00 0.00 51.96 52.86 2dtg s ALA 458 Cb -0.24 -3.67 -0.24 0.00 0.00 0.00 0.00 23.12 18.96 2dtg s ALA 458 CO -0.01 -1.17 0.22 1.47 0.00 0.00 0.00 175.76 176.28 2dtg n LEU 459 N 6.27 2.71 0.00 0.00 -0.00 -1.26 -4.02 117.00 120.69 2dtg n LEU 459 Ca 0.15 0.13 0.10 0.00 -0.00 0.00 0.00 56.01 56.39 2dtg n LEU 459 Cb 0.43 -1.06 0.52 0.00 -0.00 0.00 0.00 43.42 43.32 2dtg n LEU 459 CO 0.60 0.87 0.83 0.29 -0.00 0.00 0.00 177.39 179.99 2dtg n LYS 460 N -3.42 0.29 -3.19 1.47 5.02 -1.26 -3.79 118.16 113.27 2dtg n LYS 460 Ca -0.35 0.09 -0.20 0.00 -2.02 0.00 0.00 58.31 55.82 2dtg n LYS 460 Cb 1.03 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 34.50 2dtg n LYS 460 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2dtg n THR 461 N -1.29 -0.30 -3.57 -0.18 -2.24 -1.26 -4.91 114.28 100.53 2dtg n THR 461 Ca 0.10 -4.40 -0.02 0.00 -2.27 0.00 0.00 64.05 57.46 2dtg n THR 461 Cb 0.17 -0.87 -0.06 0.00 -2.10 0.00 0.00 70.33 67.47 2dtg n THR 461 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2dtg s ASN 462 N -2.01 -0.67 0.00 3.42 0.01 -1.25 -1.78 114.94 112.67 2dtg s ASN 462 Ca 0.38 0.99 0.00 0.00 -0.71 0.00 0.00 52.86 53.53 2dtg s ASN 462 Cb 0.29 1.50 0.00 0.00 0.41 0.00 0.00 41.25 43.45 2dtg s ASN 462 CO -0.09 -0.15 0.00 0.61 -1.51 0.00 0.00 177.10 175.96 2dtg n GLY 463 N 4.38 0.00 0.00 0.66 0.00 0.30 -4.35 105.19 106.19 2dtg n GLY 463 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2dtg n GLY 463 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2dtg n ASP 464 N 0.00 0.00 -0.15 1.61 5.68 -1.16 0.10 116.55 122.64 2dtg n ASP 464 Ca 0.00 0.08 0.02 0.00 -0.50 0.00 0.00 54.79 54.39 2dtg n ASP 464 Cb 0.00 -0.08 0.03 0.00 -1.14 0.00 0.00 41.12 39.93 2dtg n ASP 464 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2dtg n GLN 465 N -0.94 0.89 -4.48 0.11 1.13 -0.67 -5.06 117.38 108.36 2dtg n GLN 465 Ca 0.00 -1.23 -0.27 0.00 -1.94 0.00 0.00 57.00 53.56 2dtg n GLN 465 Cb 0.05 -0.79 -0.13 0.00 0.11 0.00 0.00 30.24 29.48 2dtg n GLN 465 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2dtg s ALA 466 N -0.74 2.02 -0.06 -1.58 0.00 0.28 -4.87 121.76 116.82 2dtg s ALA 466 Ca 0.06 -1.27 -0.14 0.00 0.00 0.00 0.00 51.96 50.61 2dtg s ALA 466 Cb 0.05 -0.34 -0.05 0.00 0.00 0.00 0.00 23.12 22.78 2dtg s ALA 466 CO 0.01 0.44 0.36 0.45 0.00 0.00 0.00 175.76 177.02 2dtg s SER 467 N -1.69 6.68 0.00 0.00 0.15 -1.26 -4.96 113.70 112.62 2dtg s SER 467 Ca 0.10 0.81 0.00 0.00 0.70 0.00 0.00 55.95 57.55 2dtg s SER 467 Cb -0.10 -2.22 0.00 0.00 -1.71 0.00 0.00 66.02 61.99 2dtg s SER 467 CO 0.04 0.26 0.00 0.00 1.20 0.00 0.00 173.24 174.74 2dtg n GLU 469 N 0.00 -1.38 -1.35 0.00 1.02 -1.26 -4.42 120.64 113.25 2dtg n GLU 469 Ca 0.00 0.04 0.13 0.00 -0.02 0.00 0.00 57.16 57.30 2dtg n GLU 469 Cb 0.00 -2.32 -0.07 0.00 -0.02 0.00 0.00 31.44 29.03 2dtg n GLU 469 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2dtg n ASN 470 N 1.79 -6.78 0.00 1.62 2.85 -1.16 -3.99 115.26 109.58 2dtg n ASN 470 Ca 0.00 1.31 0.00 0.00 -0.11 0.00 0.00 54.58 55.78 2dtg n ASN 470 Cb 0.04 -4.54 0.00 0.00 1.24 0.00 0.00 39.78 36.52 2dtg n ASN 470 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2dtg n GLU 471 N -3.96 0.00 -1.64 1.20 -0.58 -1.26 -4.18 120.64 110.22 2dtg n GLU 471 Ca -0.07 0.00 -0.47 0.00 -0.42 0.00 0.00 57.16 56.20 2dtg n GLU 471 Cb 0.57 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 31.39 2dtg n GLU 471 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 2dtg n LEU 472 N 0.00 3.37 -4.60 -4.62 0.00 -1.25 -0.51 117.00 109.39 2dtg n LEU 472 Ca 0.00 0.78 -0.38 0.00 0.00 0.00 0.00 56.01 56.41 2dtg n LEU 472 Cb 0.00 -1.41 -0.10 0.00 0.00 0.00 0.00 43.42 41.91 2dtg n LEU 472 CO 0.00 -0.19 -0.10 -0.76 0.00 0.00 0.00 177.39 176.34 2dtg s LEU 473 N 5.15 4.04 0.35 -1.96 1.43 -0.99 -4.93 118.68 121.76 2dtg s LEU 473 Ca 0.95 0.09 0.02 0.00 -1.03 0.00 0.00 54.13 54.17 2dtg s LEU 473 Cb -0.62 -2.21 -0.02 0.00 0.03 0.00 0.00 46.19 43.36 2dtg s LEU 473 CO 0.48 -0.07 0.53 -0.54 0.23 0.00 0.00 176.35 176.98 2dtg s LYS 474 N 1.75 3.37 -0.26 1.70 1.02 -1.26 -3.99 119.74 122.07 2dtg s LYS 474 Ca 0.09 -0.49 -0.16 0.00 0.02 0.00 0.00 55.97 55.43 2dtg s LYS 474 Cb -0.16 -2.69 -0.03 0.00 -0.52 0.00 0.00 37.83 34.43 2dtg s LYS 474 CO 0.10 0.11 0.42 -0.06 -0.92 0.00 0.00 175.35 175.00 2dtg s PHE 475 N -2.29 3.26 0.20 3.18 0.40 -1.26 -1.13 117.98 120.33 2dtg s PHE 475 Ca 0.41 0.49 0.16 0.00 -0.60 0.00 0.00 56.93 57.39 2dtg s PHE 475 Cb -0.10 -2.61 0.57 0.00 0.51 0.00 0.00 43.02 41.39 2dtg s PHE 475 CO 0.35 -0.23 1.69 1.03 0.70 0.00 0.00 175.22 178.76 2dtg h SER 476 N 8.08 0.00 -2.97 1.36 0.87 0.24 -3.46 113.55 117.67 2dtg h SER 476 Ca -0.31 0.00 0.10 0.00 -1.23 0.00 0.00 61.79 60.35 2dtg h SER 476 Cb 1.16 0.00 -0.28 0.00 -0.44 0.00 0.00 62.40 62.84 2dtg h SER 476 CO 0.67 0.45 0.58 -0.47 -0.53 0.00 0.00 176.83 177.53 2dtg s TYR 477 N -3.61 -0.35 -0.16 2.24 6.14 -0.61 -4.90 117.35 116.10 2dtg s TYR 477 Ca -0.00 0.84 -0.04 0.00 0.64 0.00 0.00 57.07 58.51 2dtg s TYR 477 Cb 0.11 0.40 0.05 0.00 0.42 0.00 0.00 41.96 42.95 2dtg s TYR 477 CO 0.71 -0.18 0.06 0.96 0.64 0.00 0.00 175.55 177.74 2dtg s ILE 478 N 0.08 0.21 0.05 3.14 -0.00 -1.26 0.25 121.20 123.67 2dtg s ILE 478 Ca 0.04 -0.25 0.02 0.00 -0.00 0.00 0.00 60.65 60.45 2dtg s ILE 478 Cb -0.05 -0.73 -0.04 0.00 -0.00 0.00 0.00 42.46 41.65 2dtg s ILE 478 CO -0.08 -0.16 0.09 -0.60 -0.00 0.00 0.00 174.94 174.18 2dtg s ARG 479 N 2.01 3.00 -0.01 0.37 3.52 0.31 -4.96 118.95 123.20 2dtg s ARG 479 Ca 0.01 -0.59 0.03 0.00 -0.13 0.00 0.00 55.73 55.05 2dtg s ARG 479 Cb -0.16 -2.80 -0.01 0.00 -1.56 0.00 0.00 34.95 30.42 2dtg s ARG 479 CO -0.08 0.60 -0.09 -0.08 -0.81 0.00 0.00 175.30 174.84 2dtg s THR 480 N -1.33 0.71 0.00 4.11 -1.32 -1.26 -0.38 115.64 116.17 2dtg s THR 480 Ca 0.28 -0.38 0.00 0.00 -1.21 0.00 0.00 61.69 60.38 2dtg s THR 480 Cb -0.12 -0.60 0.00 0.00 -1.51 0.00 0.00 72.50 70.27 2dtg s THR 480 CO 0.20 0.20 0.00 -1.20 -2.21 0.00 0.00 174.62 171.61 2dtg n SER 481 N 2.90 0.00 -0.17 8.08 7.64 -0.19 -4.86 113.62 127.02 2dtg n SER 481 Ca -0.14 0.00 0.05 0.00 1.01 0.00 0.00 58.87 59.79 2dtg n SER 481 Cb 0.57 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.75 2dtg n SER 481 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25 2dtg n PHE 482 N 0.00 0.00 -1.02 1.43 1.16 -1.26 0.99 117.46 118.76 2dtg n PHE 482 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.58 2dtg n PHE 482 Cb 0.00 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 37.87 2dtg n PHE 482 CO 0.00 0.00 0.00 -0.40 -1.87 0.00 0.00 176.76 174.49 2dtg n ASP 483 N -0.53 0.00 -3.56 5.98 5.75 -1.26 -2.91 116.55 120.03 2dtg n ASP 483 Ca 0.04 -0.88 -0.11 0.00 -0.01 0.00 0.00 54.79 53.82 2dtg n ASP 483 Cb 0.20 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.25 2dtg n ASP 483 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 2dtg s LYS 484 N 0.00 1.14 -0.07 0.11 -2.85 -1.26 0.42 119.74 117.22 2dtg s LYS 484 Ca 0.00 -0.59 -0.03 0.00 -1.00 0.00 0.00 55.97 54.35 2dtg s LYS 484 Cb 0.00 0.51 0.04 0.00 -2.06 0.00 0.00 37.83 36.32 2dtg s LYS 484 CO 0.00 -0.46 0.16 0.96 0.10 0.00 0.00 175.35 176.11 2dtg s ILE 485 N -3.67 -0.04 0.04 3.79 -4.36 -1.05 -1.02 121.20 114.88 2dtg s ILE 485 Ca 0.02 0.16 -0.03 0.00 -0.26 0.00 0.00 60.65 60.54 2dtg s ILE 485 Cb 0.01 -0.27 -0.04 0.00 1.25 0.00 0.00 42.46 43.41 2dtg s ILE 485 CO -0.12 0.07 0.23 -0.22 0.24 0.00 0.00 174.94 175.14 2dtg s LEU 486 N 1.12 4.35 -0.06 0.37 0.20 0.49 -1.58 118.68 123.58 2dtg s LEU 486 Ca -0.09 0.39 -0.28 0.00 0.69 0.00 0.00 54.13 54.85 2dtg s LEU 486 Cb -0.11 -2.83 0.06 0.00 -0.43 0.00 0.00 46.19 42.88 2dtg s LEU 486 CO -0.06 0.20 0.62 -1.48 -0.29 0.00 0.00 176.35 175.34 2dtg s LEU 487 N -2.19 -0.39 0.20 -0.68 2.34 -1.00 0.11 118.68 117.07 2dtg s LEU 487 Ca 0.32 0.65 0.10 0.00 0.06 0.00 0.00 54.13 55.25 2dtg s LEU 487 Cb -0.13 2.30 -0.04 0.00 -0.56 0.00 0.00 46.19 47.76 2dtg s LEU 487 CO 0.22 -0.56 -0.19 -0.13 -1.06 0.00 0.00 176.35 174.63 2dtg s ARG 488 N -1.12 1.41 0.03 1.48 1.81 0.71 -2.15 118.95 121.11 2dtg s ARG 488 Ca -0.11 -1.53 -0.23 0.00 -1.72 0.00 0.00 55.73 52.14 2dtg s ARG 488 Cb -0.01 -1.48 0.05 0.00 -0.45 0.00 0.00 34.95 33.06 2dtg s ARG 488 CO 0.08 0.29 0.53 1.67 -0.68 0.00 0.00 175.30 177.20 2dtg s TRP 489 N -2.23 -0.44 0.46 -0.53 1.48 -0.91 0.90 118.94 117.66 2dtg s TRP 489 Ca 0.21 0.55 0.00 0.00 -1.06 0.00 0.00 56.10 55.80 2dtg s TRP 489 Cb -0.05 0.34 0.00 0.00 -1.16 0.00 0.00 33.47 32.60 2dtg s TRP 489 CO 0.09 -0.63 0.00 0.39 -4.06 0.00 0.00 176.95 172.74 2dtg n GLU 490 N 0.52 1.85 -3.60 3.25 1.02 -0.28 -3.69 120.64 119.71 2dtg n GLU 490 Ca -0.19 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.73 2dtg n GLU 490 Cb 0.60 -0.92 -0.01 0.00 -0.02 0.00 0.00 31.44 31.08 2dtg n GLU 490 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 2dtg s PRO 491 N -1.84 2.41 0.00 3.49 0.02 -1.26 -4.52 135.00 133.30 2dtg s PRO 491 Ca 0.00 -1.71 0.00 0.00 0.02 0.00 0.00 61.00 59.31 2dtg s PRO 491 Cb 0.00 -2.32 0.00 0.00 0.02 0.00 0.00 34.50 32.20 2dtg s PRO 491 CO 0.00 -0.42 0.00 2.48 -0.33 0.00 0.00 177.00 178.73 2dtg n TYR 492 N -1.71 0.00 0.00 6.54 4.11 -1.26 -5.02 117.16 119.82 2dtg n TYR 492 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.93 2dtg n TYR 492 Cb 0.63 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.97 2dtg n TYR 492 CO 0.00 0.00 0.00 1.87 -0.00 0.00 0.00 176.86 178.73 2dtg n TRP 493 N 0.00 0.00 -1.03 -3.48 -0.00 -1.26 -5.01 117.44 106.66 2dtg n TRP 493 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.50 57.20 2dtg n TRP 493 Cb 0.00 0.00 0.16 0.00 -0.00 0.00 0.00 31.31 31.47 2dtg n TRP 493 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 2dtg s PRO 494 N 0.00 0.97 0.00 5.87 0.04 -1.26 -5.00 135.00 135.61 2dtg s PRO 494 Ca 0.00 0.97 0.00 0.00 0.04 0.00 0.00 61.00 62.01 2dtg s PRO 494 Cb 0.00 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.78 2dtg s PRO 494 CO 0.00 -2.48 0.00 -2.30 0.04 0.00 0.00 177.00 172.26 2dtg n PRO 495 N -4.07 0.00 -3.78 0.56 -0.02 -1.26 -4.62 135.00 121.82 2dtg n PRO 495 Ca 0.07 0.00 -0.28 0.00 -2.02 0.00 0.00 63.50 61.27 2dtg n PRO 495 Cb 0.54 0.00 -0.16 0.00 -0.02 0.00 0.00 33.50 33.86 2dtg n PRO 495 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2dtg s ASP 496 N -1.09 3.16 0.00 2.55 1.11 -1.26 -5.12 116.67 116.03 2dtg s ASP 496 Ca 0.00 -0.93 0.00 0.00 0.18 0.00 0.00 52.55 51.80 2dtg s ASP 496 Cb 0.00 -0.73 0.00 0.00 1.07 0.00 0.00 42.92 43.26 2dtg s ASP 496 CO 0.00 -0.30 0.00 0.33 1.18 0.00 0.00 175.17 176.38 2dtg n PHE 497 N 4.96 0.00 0.00 4.23 -0.00 -1.26 -5.09 117.46 120.30 2dtg n PHE 497 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.36 2dtg n PHE 497 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.94 2dtg n PHE 497 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.76 174.63 2dtg n ARG 498 N 0.00 0.00 -3.60 -4.13 0.63 -1.26 -5.06 116.66 103.24 2dtg n ARG 498 Ca 0.00 0.00 -0.21 0.00 -0.92 0.00 0.00 57.85 56.72 2dtg n ARG 498 Cb 0.00 0.00 -0.16 0.00 0.45 0.00 0.00 32.46 32.75 2dtg n ARG 498 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2dtg s ASP 499 N 0.00 1.59 0.02 6.15 -0.00 -1.26 -4.47 116.67 118.70 2dtg s ASP 499 Ca 0.00 -0.22 0.01 0.00 -0.00 0.00 0.00 52.55 52.35 2dtg s ASP 499 Cb 0.00 0.05 -0.01 0.00 -0.00 0.00 0.00 42.92 42.95 2dtg s ASP 499 CO 0.00 -0.31 -0.05 -0.76 -0.00 0.00 0.00 175.17 174.05 2dtg s LEU 500 N 2.23 2.15 -0.20 1.23 1.43 -1.12 0.84 118.68 125.23 2dtg s LEU 500 Ca 0.04 -0.33 -0.14 0.00 -1.03 0.00 0.00 54.13 52.67 2dtg s LEU 500 Cb -0.15 -0.14 0.06 0.00 0.03 0.00 0.00 46.19 46.00 2dtg s LEU 500 CO -0.08 -0.11 0.51 -1.48 0.23 0.00 0.00 176.35 175.42 2dtg s LEU 501 N -0.91 -0.26 0.00 1.79 0.05 0.70 -1.46 118.68 118.59 2dtg s LEU 501 Ca -0.06 1.09 0.04 0.00 0.05 0.00 0.00 54.13 55.25 2dtg s LEU 501 Cb -0.06 1.74 0.04 0.00 -2.05 0.00 0.00 46.19 45.86 2dtg s LEU 501 CO -0.00 -0.20 0.33 0.61 -0.55 0.00 0.00 176.35 176.54 2dtg n GLY 502 N 3.76 2.66 3.17 -3.48 0.00 0.23 0.20 105.19 111.72 2dtg n GLY 502 Ca -0.19 -2.25 -0.11 0.00 0.00 0.00 0.00 46.02 43.47 2dtg n GLY 502 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dtg s PHE 503 N -1.76 -0.51 0.43 1.61 0.08 0.34 -1.23 117.98 116.94 2dtg s PHE 503 Ca 0.25 1.10 0.08 0.00 0.12 0.00 0.00 56.93 58.48 2dtg s PHE 503 Cb -0.02 0.16 -0.00 0.00 -0.57 0.00 0.00 43.02 42.59 2dtg s PHE 503 CO 0.16 -0.32 0.45 -1.64 -0.10 0.00 0.00 175.22 173.77 2dtg s MET 504 N 1.59 2.57 0.00 0.44 -1.94 -0.70 -2.23 119.30 119.03 2dtg s MET 504 Ca -0.08 -1.51 0.00 0.00 -1.71 0.00 0.00 55.69 52.40 2dtg s MET 504 Cb -0.10 -2.46 0.00 0.00 2.01 0.00 0.00 34.83 34.28 2dtg s MET 504 CO -0.11 -0.28 0.00 -0.11 -0.01 0.00 0.00 175.02 174.52 2dtg n LEU 505 N -1.67 0.00 -3.85 -0.03 7.94 -0.91 -3.12 117.00 115.37 2dtg n LEU 505 Ca 0.05 0.00 -0.03 0.00 -1.11 0.00 0.00 56.01 54.91 2dtg n LEU 505 Cb 0.61 0.00 0.01 0.00 0.53 0.00 0.00 43.42 44.58 2dtg n LEU 505 CO 0.41 0.00 0.78 0.72 -1.11 0.00 0.00 177.39 178.19 2dtg s PHE 506 N -3.00 0.04 0.39 1.96 -0.00 -1.26 -1.23 117.98 114.88 2dtg s PHE 506 Ca 0.00 -0.44 0.00 0.00 -0.00 0.00 0.00 56.93 56.49 2dtg s PHE 506 Cb 0.00 0.70 0.00 0.00 -0.00 0.00 0.00 43.02 43.72 2dtg s PHE 506 CO 0.00 -0.94 0.00 0.66 -0.00 0.00 0.00 175.22 174.94 2dtg n TYR 507 N -0.64 -3.27 -2.57 3.49 4.01 0.29 -4.78 117.16 113.67 2dtg n TYR 507 Ca -0.04 1.74 -0.01 0.00 -0.16 0.00 0.00 57.90 59.43 2dtg n TYR 507 Cb 0.60 -2.72 -0.01 0.00 -0.31 0.00 0.00 39.34 36.90 2dtg n TYR 507 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2dtg n LYS 508 N -0.90 -2.13 -1.66 -0.72 5.02 -1.26 -4.79 118.16 111.73 2dtg n LYS 508 Ca 0.00 1.68 -0.51 0.00 -2.02 0.00 0.00 58.31 57.45 2dtg n LYS 508 Cb 0.00 -2.10 -0.06 0.00 -0.02 0.00 0.00 35.03 32.85 2dtg n LYS 508 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2dtg n GLU 509 N 2.13 1.70 0.00 1.97 4.07 -1.26 -4.93 120.64 124.32 2dtg n GLU 509 Ca -0.08 0.61 0.00 0.00 -0.06 0.00 0.00 57.16 57.62 2dtg n GLU 509 Cb 0.13 -2.47 0.00 0.00 -0.06 0.00 0.00 31.44 29.04 2dtg n GLU 509 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2dtg n ALA 510 N 6.84 0.00 -3.88 4.31 0.00 -1.26 -5.08 120.51 121.44 2dtg n ALA 510 Ca 0.27 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.42 2dtg n ALA 510 Cb 0.24 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.53 2dtg n ALA 510 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2dtg s PRO 511 N -2.00 1.35 0.00 0.00 0.04 -1.20 -4.95 135.00 128.24 2dtg s PRO 511 Ca 0.00 -0.66 0.00 0.00 0.04 0.00 0.00 61.00 60.38 2dtg s PRO 511 Cb 0.00 -2.22 0.00 0.00 0.04 0.00 0.00 34.50 32.32 2dtg s PRO 511 CO 0.00 -0.53 0.57 0.98 0.04 0.00 0.00 177.00 178.06 2dtg n TYR 512 N 4.84 0.00 -0.22 0.56 9.36 -1.23 0.13 117.16 130.60 2dtg n TYR 512 Ca -0.11 0.00 0.08 0.00 3.32 0.00 0.00 57.90 61.18 2dtg n TYR 512 Cb 0.46 -0.16 0.34 0.00 -0.63 0.00 0.00 39.34 39.36 2dtg n TYR 512 CO 0.00 0.00 0.00 1.96 0.22 0.00 0.00 176.86 179.04 2dtg h GLN 513 N 0.00 0.75 0.00 2.98 1.08 -2.04 -3.32 115.11 114.56 2dtg h GLN 513 Ca 0.00 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 2dtg h GLN 513 Cb 0.17 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 2dtg h GLN 513 CO 0.00 0.50 -0.50 0.09 -0.95 0.00 0.00 178.83 177.97 2dtg n ASN 514 N -4.50 1.30 -3.59 1.46 3.02 0.35 -5.07 115.26 108.23 2dtg n ASN 514 Ca 0.13 0.21 -0.05 0.00 -0.03 0.00 0.00 54.58 54.83 2dtg n ASN 514 Cb 0.29 -0.54 -0.03 0.00 -0.61 0.00 0.00 39.78 38.90 2dtg n ASN 514 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2dtg s VAL 515 N -2.25 0.00 0.00 2.41 0.11 -0.44 -5.07 120.40 115.16 2dtg s VAL 515 Ca -0.15 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 58.90 2dtg s VAL 515 Cb 0.02 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.87 2dtg s VAL 515 CO 0.22 0.00 0.00 1.07 -3.33 0.00 0.00 175.10 173.06 2dtg n THR 516 N 0.11 0.00 -3.44 5.04 5.66 -1.26 -3.20 114.28 117.18 2dtg n THR 516 Ca -0.02 0.00 0.01 0.00 -3.05 0.00 0.00 64.05 60.99 2dtg n THR 516 Cb 0.59 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.33 2dtg n THR 516 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 2dtg s GLU 517 N 1.07 0.36 0.08 1.09 1.03 -1.26 -5.06 118.70 116.00 2dtg s GLU 517 Ca 0.00 0.88 0.00 0.00 0.03 0.00 0.00 54.97 55.88 2dtg s GLU 517 Cb 0.00 0.53 0.00 0.00 -0.80 0.00 0.00 34.13 33.86 2dtg s GLU 517 CO 0.00 -0.14 0.00 1.19 -1.33 0.00 0.00 175.26 174.98 2dtg n PHE 518 N 5.10 -0.54 -3.11 4.83 3.01 -1.26 -5.11 117.46 120.39 2dtg n PHE 518 Ca -0.09 0.30 0.00 0.00 1.01 0.00 0.00 57.45 58.66 2dtg n PHE 518 Cb 0.52 -0.88 0.00 0.00 -0.01 0.00 0.00 39.48 39.10 2dtg n PHE 518 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 2dtg n ASP 519 N -1.66 0.00 -4.70 4.37 2.03 -1.26 -5.13 116.55 110.20 2dtg n ASP 519 Ca -0.00 0.00 -0.36 0.00 0.52 0.00 0.00 54.79 54.95 2dtg n ASP 519 Cb 0.06 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.38 2dtg n ASP 519 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2dtg s GLY 520 N 0.00 2.08 0.00 0.27 0.00 -1.26 -5.06 107.32 103.35 2dtg s GLY 520 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 44.72 44.07 2dtg s GLY 520 CO 0.00 0.42 0.00 -0.18 0.00 0.00 0.00 173.10 173.34 2dtg n GLN 521 N 3.92 0.00 0.00 2.90 0.00 -1.26 -4.85 117.38 118.09 2dtg n GLN 521 Ca -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.87 2dtg n GLN 521 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.76 2dtg n GLN 521 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 2dtg n ASP 522 N 0.00 0.00 -1.41 1.69 4.64 -1.26 -5.12 116.55 115.09 2dtg n ASP 522 Ca 0.00 0.00 0.18 0.00 -1.38 0.00 0.00 54.79 53.59 2dtg n ASP 522 Cb 0.00 0.00 -0.06 0.00 -1.04 0.00 0.00 41.12 40.02 2dtg n ASP 522 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2dtg n ALA 523 N -3.00 -3.73 -3.05 -1.67 0.00 -1.26 -4.79 120.51 103.01 2dtg n ALA 523 Ca 0.00 0.66 -0.37 0.00 0.00 0.00 0.00 53.44 53.74 2dtg n ALA 523 Cb 0.00 -1.41 -0.13 0.00 0.00 0.00 0.00 19.45 17.92 2dtg n ALA 523 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dtg n GLY 525 N 4.93 2.65 0.00 0.00 0.00 -1.26 -5.19 105.19 106.31 2dtg n GLY 525 Ca -0.16 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.13 2dtg n GLY 525 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dtg n SER 526 N 0.00 0.00 0.00 1.61 2.88 -1.26 -5.05 113.62 111.80 2dtg n SER 526 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2dtg n SER 526 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2dtg n SER 526 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2dtg n ASN 527 N 0.88 0.00 -3.90 -3.46 2.85 -1.26 -5.14 115.26 105.23 2dtg n ASN 527 Ca 0.00 -0.67 0.00 0.00 -0.11 0.00 0.00 54.58 53.80 2dtg n ASN 527 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 2dtg n ASN 527 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 2dtg n SER 528 N 0.00 0.00 -3.61 1.20 7.64 -1.26 -5.10 113.62 112.49 2dtg n SER 528 Ca 0.00 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.84 2dtg n SER 528 Cb 0.17 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.35 2dtg n SER 528 CO 0.00 0.00 0.00 0.86 -3.01 0.00 0.00 175.04 172.89 2dtg s TRP 529 N 0.00 -0.10 -0.00 1.43 -0.11 -1.26 -5.14 118.94 113.76 2dtg s TRP 529 Ca 0.00 0.06 -0.00 0.00 1.22 0.00 0.00 56.10 57.38 2dtg s TRP 529 Cb 0.00 0.51 0.00 0.00 -1.50 0.00 0.00 33.47 32.48 2dtg s TRP 529 CO 0.00 -0.17 0.00 0.25 -4.62 0.00 0.00 176.95 172.41 2dtg n THR 530 N -0.10 -3.11 -4.36 5.86 -2.24 -1.26 -5.11 114.28 103.96 2dtg n THR 530 Ca 0.01 0.28 -0.19 0.00 -2.27 0.00 0.00 64.05 61.87 2dtg n THR 530 Cb 0.58 -3.33 -0.10 0.00 -2.10 0.00 0.00 70.33 65.38 2dtg n THR 530 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2dtg s VAL 531 N -0.05 1.83 0.00 2.28 0.11 -1.26 -5.11 120.40 118.20 2dtg s VAL 531 Ca -0.00 -2.24 0.00 0.00 -2.93 0.00 0.00 61.98 56.81 2dtg s VAL 531 Cb 0.00 -2.09 0.00 0.00 -1.53 0.00 0.00 36.38 32.76 2dtg s VAL 531 CO 0.01 -0.56 0.00 0.52 -3.33 0.00 0.00 175.10 171.73 2dtg n VAL 532 N -0.42 0.00 0.00 2.04 0.31 -1.26 -5.03 118.33 113.97 2dtg n VAL 532 Ca -0.08 0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 2dtg n VAL 532 Cb 0.60 -0.98 0.00 0.00 -0.91 0.00 0.00 33.84 32.55 2dtg n VAL 532 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2dtg n ASP 533 N -1.59 0.00 -4.85 4.52 8.00 -1.26 -4.82 116.55 116.55 2dtg n ASP 533 Ca 0.00 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.27 2dtg n ASP 533 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 2dtg n ASP 533 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2dtg s ILE 534 N 0.00 4.65 0.31 0.53 2.07 -1.26 -5.08 121.20 122.41 2dtg s ILE 534 Ca 0.00 -1.22 -0.30 0.00 -1.41 0.00 0.00 60.65 57.73 2dtg s ILE 534 Cb 0.00 -3.47 -0.12 0.00 0.13 0.00 0.00 42.46 39.00 2dtg s ILE 534 CO 0.00 -0.28 1.57 0.47 -1.91 0.00 0.00 174.94 174.79 2dtg n ASP 535 N -0.99 3.81 -4.80 4.50 9.92 -1.26 -4.97 116.55 122.76 2dtg n ASP 535 Ca -0.08 1.16 -0.39 0.00 -0.53 0.00 0.00 54.79 54.96 2dtg n ASP 535 Cb 0.57 -1.59 -0.06 0.00 -0.64 0.00 0.00 41.12 39.39 2dtg n ASP 535 CO 0.00 0.00 0.00 -2.84 0.13 0.00 0.00 177.20 174.49 2dtg s PRO 536 N -0.81 4.20 -0.13 -0.24 0.02 -1.18 -4.91 135.00 131.95 2dtg s PRO 536 Ca 0.62 0.68 -0.05 0.00 0.02 0.00 0.00 61.00 62.27 2dtg s PRO 536 Cb -0.50 -3.27 -0.04 0.00 0.02 0.00 0.00 34.50 30.72 2dtg s PRO 536 CO 0.52 0.56 0.06 -1.25 -0.33 0.00 0.00 177.00 176.56 2dtg s PRO 537 N -0.81 3.50 -0.31 5.54 0.04 -1.26 -1.72 135.00 139.98 2dtg s PRO 537 Ca 0.29 -0.31 -0.12 0.00 0.04 0.00 0.00 61.00 60.89 2dtg s PRO 537 Cb -0.19 -3.06 -0.03 0.00 0.04 0.00 0.00 34.50 31.26 2dtg s PRO 537 CO 0.17 0.55 0.23 -0.48 0.04 0.00 0.00 177.00 177.52 2dtg s LEU 538 N -0.42 4.27 -0.89 -3.56 2.34 -0.37 -4.93 118.68 115.12 2dtg s LEU 538 Ca 0.09 -0.19 -0.06 0.00 0.06 0.00 0.00 54.13 54.04 2dtg s LEU 538 Cb -0.12 -2.16 0.22 0.00 -0.56 0.00 0.00 46.19 43.58 2dtg s LEU 538 CO 0.02 -0.16 0.80 0.00 -1.06 0.00 0.00 176.35 175.95 2dtg s ARG 539 N 1.78 3.43 -0.26 1.48 3.03 -1.26 -0.60 118.95 126.55 2dtg s ARG 539 Ca 0.07 -3.02 -0.13 0.00 2.03 0.00 0.00 55.73 54.68 2dtg s ARG 539 Cb -0.17 -4.14 -0.04 0.00 -1.03 0.00 0.00 34.95 29.58 2dtg s ARG 539 CO 0.11 -1.25 0.30 -1.54 -1.13 0.00 0.00 175.30 171.79 2dtg s SER 540 N 0.69 6.20 0.00 -2.89 1.04 -0.54 -5.00 113.70 113.21 2dtg s SER 540 Ca 0.25 0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.90 2dtg s SER 540 Cb -0.11 -2.18 0.00 0.00 0.10 0.00 0.00 66.02 63.84 2dtg s SER 540 CO -0.09 -0.11 0.00 -0.46 0.98 0.00 0.00 173.24 173.56 2dtg n ASN 541 N 5.02 0.00 -2.85 7.02 0.23 -1.26 -2.78 115.26 120.64 2dtg n ASN 541 Ca -0.11 0.00 -0.15 0.00 -0.53 0.00 0.00 54.58 53.79 2dtg n ASN 541 Cb 0.51 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 38.16 2dtg n ASN 541 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 2dtg n ASP 542 N 0.00 0.52 0.00 0.53 5.75 -1.26 -3.37 116.55 118.71 2dtg n ASP 542 Ca 0.00 -2.46 0.00 0.00 -0.01 0.00 0.00 54.79 52.32 2dtg n ASP 542 Cb 0.00 0.86 0.00 0.00 -1.03 0.00 0.00 41.12 40.95 2dtg n ASP 542 CO 0.00 0.00 0.00 -0.81 -0.11 0.00 0.00 177.20 176.28 2dtg n PRO 543 N -0.54 0.00 0.00 0.11 -0.04 -1.26 -5.07 135.00 128.20 2dtg n PRO 543 Ca -0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2dtg n PRO 543 Cb 0.41 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.87 2dtg n PRO 543 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2dtg n LYS 544 N 0.00 0.00 0.00 0.54 4.76 -1.26 -5.14 118.16 117.06 2dtg n LYS 544 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2dtg n LYS 544 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2dtg n LYS 544 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 2dtg n SER 545 N -0.20 0.00 -3.91 4.39 3.41 -1.26 -5.06 113.62 111.00 2dtg n SER 545 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 2dtg n SER 545 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 2dtg n SER 545 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dtg n GLN 546 N 0.00 4.57 -3.65 4.33 10.64 -1.26 -4.93 117.38 127.08 2dtg n GLN 546 Ca 0.00 -4.59 -0.04 0.00 -1.83 0.00 0.00 57.00 50.55 2dtg n GLN 546 Cb 0.00 -2.49 -0.06 0.00 -0.86 0.00 0.00 30.24 26.83 2dtg n GLN 546 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.06 176.44 2dtg s ASN 547 N -1.78 -0.94 0.16 2.61 2.47 -1.26 -5.15 114.94 111.05 2dtg s ASN 547 Ca 0.33 1.44 -0.33 0.00 0.42 0.00 0.00 52.86 54.72 2dtg s ASN 547 Cb 0.08 1.89 -0.16 0.00 -1.45 0.00 0.00 41.25 41.61 2dtg s ASN 547 CO 0.06 -0.22 1.20 1.41 -3.72 0.00 0.00 177.10 175.83 2dtg n HIS 548 N 5.14 1.36 -3.56 0.43 8.25 -1.26 -4.80 115.22 120.78 2dtg n HIS 548 Ca -0.14 0.66 -0.31 0.00 -0.26 0.00 0.00 57.72 57.68 2dtg n HIS 548 Cb 0.51 -2.29 -0.05 0.00 1.12 0.00 0.00 29.99 29.29 2dtg n HIS 548 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2dtg s PRO 549 N -0.23 3.66 0.02 -0.41 0.04 -1.24 -4.94 135.00 131.90 2dtg s PRO 549 Ca 0.75 0.01 -0.29 0.00 0.04 0.00 0.00 61.00 61.51 2dtg s PRO 549 Cb -0.86 -2.76 0.10 0.00 0.04 0.00 0.00 34.50 31.01 2dtg s PRO 549 CO 0.51 0.39 1.14 0.20 0.04 0.00 0.00 177.00 179.28 2dtg s GLY 550 N -2.55 -0.34 0.45 0.56 0.00 -1.26 -2.14 107.32 102.03 2dtg s GLY 550 Ca 0.43 0.62 0.00 0.00 0.00 0.00 0.00 44.72 45.77 2dtg s GLY 550 CO 0.25 0.14 0.00 1.87 0.00 0.00 0.00 173.10 175.36 2dtg n TRP 551 N -0.42 1.03 -3.51 1.90 -0.00 -0.91 -4.99 117.44 110.53 2dtg n TRP 551 Ca -0.07 -2.25 -0.29 0.00 -0.00 0.00 0.00 57.50 54.89 2dtg n TRP 551 Cb 0.62 -0.29 -0.13 0.00 -0.00 0.00 0.00 31.31 31.51 2dtg n TRP 551 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 177.69 176.52 2dtg s LEU 552 N 0.00 1.09 0.21 5.87 0.20 -1.26 -2.38 118.68 122.41 2dtg s LEU 552 Ca 0.01 -2.05 -0.32 0.00 0.69 0.00 0.00 54.13 52.46 2dtg s LEU 552 Cb 0.00 -0.46 -0.14 0.00 -0.43 0.00 0.00 46.19 45.16 2dtg s LEU 552 CO 0.00 -0.33 1.37 0.23 -0.29 0.00 0.00 176.35 177.33 2dtg n MET 553 N 4.24 1.83 -4.23 1.98 2.81 -0.61 -4.90 117.12 118.23 2dtg n MET 553 Ca 0.08 0.65 -0.20 0.00 -1.81 0.00 0.00 57.70 56.42 2dtg n MET 553 Cb 0.38 -2.28 -0.12 0.00 -0.71 0.00 0.00 33.22 30.48 2dtg n MET 553 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 2dtg s ARG 554 N -0.25 0.92 -0.69 0.03 6.06 -1.26 -2.53 118.95 121.22 2dtg s ARG 554 Ca 0.71 -0.98 -0.07 0.00 -2.50 0.00 0.00 55.73 52.89 2dtg s ARG 554 Cb -0.71 -0.99 0.01 0.00 0.06 0.00 0.00 34.95 33.33 2dtg s ARG 554 CO 0.49 0.23 0.65 0.41 -2.50 0.00 0.00 175.30 174.58 2dtg n GLY 555 N 1.33 -1.11 3.29 8.12 0.00 -0.55 -4.91 105.19 111.35 2dtg n GLY 555 Ca -0.20 0.72 -0.22 0.00 0.00 0.00 0.00 46.02 46.32 2dtg n GLY 555 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2dtg s LEU 556 N -3.92 2.36 0.17 0.99 2.34 1.43 -4.98 118.68 117.07 2dtg s LEU 556 Ca 0.08 -0.76 -0.34 0.00 0.06 0.00 0.00 54.13 53.17 2dtg s LEU 556 Cb -0.02 -0.78 -0.14 0.00 -0.56 0.00 0.00 46.19 44.70 2dtg s LEU 556 CO 0.82 -0.02 1.57 1.17 -1.06 0.00 0.00 176.35 178.83 2dtg n LYS 557 N 0.73 2.18 -1.14 1.48 4.81 -1.26 -4.08 118.16 120.88 2dtg n LYS 557 Ca -0.17 0.79 -0.29 0.00 -0.87 0.00 0.00 58.31 57.77 2dtg n LYS 557 Cb 0.55 -2.55 0.19 0.00 0.02 0.00 0.00 35.03 33.24 2dtg n LYS 557 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 2dtg s PRO 558 N 0.81 0.05 -1.56 1.64 0.02 -1.14 -3.90 135.00 130.91 2dtg s PRO 558 Ca 0.78 0.40 -0.05 0.00 0.02 0.00 0.00 61.00 62.15 2dtg s PRO 558 Cb -0.67 -1.70 0.05 0.00 0.02 0.00 0.00 34.50 32.20 2dtg s PRO 558 CO 0.39 -2.96 0.31 1.87 -0.33 0.00 0.00 177.00 176.28 2dtg n TRP 559 N -4.32 -1.45 -4.67 6.54 -0.00 0.39 -4.87 117.44 109.07 2dtg n TRP 559 Ca 0.06 0.69 -0.25 0.00 -0.00 0.00 0.00 57.50 58.00 2dtg n TRP 559 Cb 0.58 -3.05 -0.14 0.00 -0.00 0.00 0.00 31.31 28.69 2dtg n TRP 559 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 177.69 178.68 2dtg s THR 560 N -3.97 1.55 -1.04 5.87 2.01 -1.23 -4.80 115.64 114.03 2dtg s THR 560 Ca 0.19 -1.08 -0.15 0.00 0.31 0.00 0.00 61.69 60.96 2dtg s THR 560 Cb -0.11 -1.34 0.18 0.00 0.01 0.00 0.00 72.50 71.24 2dtg s THR 560 CO 0.95 0.23 1.17 -1.58 -0.69 0.00 0.00 174.62 174.71 2dtg s GLN 561 N -1.00 3.87 -0.13 4.92 0.74 -1.22 -0.51 119.66 126.32 2dtg s GLN 561 Ca 0.07 -2.39 -0.29 0.00 0.05 0.00 0.00 55.36 52.79 2dtg s GLN 561 Cb -0.08 -4.83 -0.02 0.00 1.10 0.00 0.00 33.01 29.18 2dtg s GLN 561 CO 0.01 -1.61 1.16 0.71 -0.55 0.00 0.00 175.29 175.01 2dtg s TYR 562 N 1.26 3.17 -0.13 1.67 2.02 0.58 0.11 117.35 126.04 2dtg s TYR 562 Ca 0.33 1.27 -0.19 0.00 -0.37 0.00 0.00 57.07 58.12 2dtg s TYR 562 Cb -0.06 -3.38 -0.04 0.00 -0.40 0.00 0.00 41.96 38.09 2dtg s TYR 562 CO -0.06 -1.08 0.50 0.00 -1.57 0.00 0.00 175.55 173.34 2dtg s ALA 563 N 2.72 3.47 0.16 3.71 0.00 -0.36 -2.30 121.76 129.16 2dtg s ALA 563 Ca 0.52 -0.19 -0.00 0.00 0.00 0.00 0.00 51.96 52.29 2dtg s ALA 563 Cb -0.21 -2.70 -0.04 0.00 0.00 0.00 0.00 23.12 20.17 2dtg s ALA 563 CO 0.16 -0.07 0.05 0.96 0.00 0.00 0.00 175.76 176.86 2dtg s ILE 564 N 0.79 0.30 0.00 0.00 -4.36 -0.86 -2.13 121.20 114.94 2dtg s ILE 564 Ca 0.27 -1.94 -0.29 0.00 -0.26 0.00 0.00 60.65 58.42 2dtg s ILE 564 Cb -0.15 -2.13 0.10 0.00 1.25 0.00 0.00 42.46 41.53 2dtg s ILE 564 CO 0.11 -0.42 1.12 0.72 0.24 0.00 0.00 174.94 176.71 2dtg s PHE 565 N -3.91 -0.13 0.03 1.37 -0.12 -0.95 0.14 117.98 114.41 2dtg s PHE 565 Ca 0.26 -0.03 0.01 0.00 -0.05 0.00 0.00 56.93 57.12 2dtg s PHE 565 Cb 0.07 0.57 -0.02 0.00 -0.63 0.00 0.00 43.02 43.01 2dtg s PHE 565 CO 0.04 -0.47 -0.05 0.54 -0.05 0.00 0.00 175.22 175.23 2dtg s VAL 566 N -2.78 0.33 0.13 -2.49 0.11 -1.26 0.13 120.40 114.56 2dtg s VAL 566 Ca 0.11 -0.98 -0.03 0.00 -2.93 0.00 0.00 61.98 58.15 2dtg s VAL 566 Cb 0.01 -0.44 -0.03 0.00 -1.53 0.00 0.00 36.38 34.39 2dtg s VAL 566 CO -0.03 -0.43 0.11 -0.75 -3.33 0.00 0.00 175.10 170.67 2dtg s LYS 567 N -1.49 0.95 -0.11 1.54 2.20 0.52 0.83 119.74 124.18 2dtg s LYS 567 Ca -0.13 -1.32 -0.04 0.00 -0.36 0.00 0.00 55.97 54.13 2dtg s LYS 567 Cb -0.10 0.28 -0.04 0.00 -1.51 0.00 0.00 37.83 36.47 2dtg s LYS 567 CO -0.00 -0.29 0.05 0.95 -0.36 0.00 0.00 175.35 175.70 2dtg s THR 568 N -4.00 4.73 -0.04 3.43 -4.23 -1.09 0.25 115.64 114.69 2dtg s THR 568 Ca 0.19 -0.08 -0.01 0.00 -1.18 0.00 0.00 61.69 60.61 2dtg s THR 568 Cb 0.06 -3.03 -0.02 0.00 1.34 0.00 0.00 72.50 70.85 2dtg s THR 568 CO -0.01 0.60 2.27 -0.11 -0.54 0.00 0.00 174.62 176.83 2dtg n LEU 569 N 2.23 5.45 -2.76 4.79 7.94 0.25 -4.89 117.00 130.00 2dtg n LEU 569 Ca -0.19 -2.64 -0.28 0.00 -1.11 0.00 0.00 56.01 51.79 2dtg n LEU 569 Cb 0.54 -1.17 -0.01 0.00 0.53 0.00 0.00 43.42 43.31 2dtg n LEU 569 CO 0.30 1.15 -0.20 0.52 -1.11 0.00 0.00 177.39 178.05 2dtg n VAL 570 N 1.55 0.67 -3.22 1.96 0.31 -1.26 -4.80 118.33 113.53 2dtg n VAL 570 Ca 0.10 -0.32 -0.24 0.00 -0.01 0.00 0.00 64.34 63.88 2dtg n VAL 570 Cb 0.57 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.44 2dtg n VAL 570 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2dtg n THR 571 N -0.46 0.59 -2.34 2.52 -1.04 -1.26 -5.11 114.28 107.19 2dtg n THR 571 Ca 0.08 -4.60 -0.39 0.00 -2.04 0.00 0.00 64.05 57.11 2dtg n THR 571 Cb 0.23 -1.60 -0.03 0.00 -1.82 0.00 0.00 70.33 67.11 2dtg n THR 571 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 2dtg s PHE 572 N -2.01 3.17 0.00 -1.42 2.99 -1.26 -5.06 117.98 114.39 2dtg s PHE 572 Ca 0.39 1.58 0.00 0.00 0.00 0.00 0.00 56.93 58.89 2dtg s PHE 572 Cb 0.21 -3.37 0.00 0.00 0.00 0.00 0.00 43.02 39.86 2dtg s PHE 572 CO -0.08 -1.16 0.00 -1.13 -0.00 0.00 0.00 175.22 172.84 2dtg n SER 573 N 0.29 0.00 -0.33 1.36 3.41 -1.26 -4.97 113.62 112.12 2dtg n SER 573 Ca 0.03 -0.17 0.20 0.00 -0.26 0.00 0.00 58.87 58.68 2dtg n SER 573 Cb 0.46 0.00 0.42 0.00 -0.26 0.00 0.00 64.21 64.83 2dtg n SER 573 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2dtg h ASP 574 N 0.00 0.42 -1.93 4.04 3.45 -2.06 -3.43 116.42 116.90 2dtg h ASP 574 Ca 0.00 0.18 -0.27 0.00 0.43 0.00 0.00 57.03 57.38 2dtg h ASP 574 Cb 0.00 0.15 0.15 0.00 -0.56 0.00 0.00 39.33 39.07 2dtg h ASP 574 CO 0.00 -0.11 -0.55 -0.62 -1.57 0.00 0.00 179.24 176.39 2dtg n GLU 575 N -5.07 -1.97 -1.82 3.56 4.71 -1.26 -4.74 120.64 114.04 2dtg n GLU 575 Ca 0.29 -0.58 -0.37 0.00 -0.01 0.00 0.00 57.16 56.49 2dtg n GLU 575 Cb 0.88 -1.47 -0.03 0.00 -1.01 0.00 0.00 31.44 29.81 2dtg n GLU 575 CO 0.00 0.00 0.00 0.50 0.09 0.00 0.00 177.13 177.72 2dtg s ARG 576 N -3.34 2.37 -0.36 3.49 3.52 -1.26 -4.89 118.95 118.49 2dtg s ARG 576 Ca 0.38 0.92 -0.37 0.00 -0.13 0.00 0.00 55.73 56.53 2dtg s ARG 576 Cb -0.06 -4.50 -0.13 0.00 -1.56 0.00 0.00 34.95 28.70 2dtg s ARG 576 CO 0.40 -3.03 2.14 2.89 -0.81 0.00 0.00 175.30 176.88 2dtg n ARG 577 N 9.10 0.97 -3.85 5.12 0.00 -1.26 -4.90 116.66 121.82 2dtg n ARG 577 Ca 0.28 0.28 -0.36 0.00 -0.00 0.00 0.00 57.85 58.05 2dtg n ARG 577 Cb 0.53 -2.31 -0.13 0.00 -0.00 0.00 0.00 32.46 30.55 2dtg n ARG 577 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.63 177.55 2dtg s THR 578 N 6.74 3.52 0.00 8.89 -1.32 -1.26 -4.91 115.64 127.30 2dtg s THR 578 Ca 1.10 -0.73 0.00 0.00 -1.21 0.00 0.00 61.69 60.84 2dtg s THR 578 Cb -0.96 -2.76 0.00 0.00 -1.51 0.00 0.00 72.50 67.27 2dtg s THR 578 CO 0.53 0.20 0.00 -1.22 -2.21 0.00 0.00 174.62 171.91 2dtg n TYR 579 N 4.79 0.00 0.00 9.09 4.02 -1.26 -4.82 117.16 128.99 2dtg n TYR 579 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.73 2dtg n TYR 579 Cb 0.48 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.79 2dtg n TYR 579 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2dtg n GLY 580 N -0.03 4.07 0.00 2.72 0.00 -1.26 -2.99 105.19 107.70 2dtg n GLY 580 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2dtg n GLY 580 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dtg n ALA 581 N 12.51 0.00 -3.11 4.61 0.00 -1.26 -4.85 120.51 128.41 2dtg n ALA 581 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 2dtg n ALA 581 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.31 2dtg n ALA 581 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2dtg s LYS 582 N 0.00 0.04 0.00 0.00 2.20 0.33 -2.68 119.74 119.63 2dtg s LYS 582 Ca 0.00 0.11 0.00 0.00 -0.36 0.00 0.00 55.97 55.72 2dtg s LYS 582 Cb 0.00 -0.03 0.00 0.00 -1.51 0.00 0.00 37.83 36.29 2dtg s LYS 582 CO 0.00 -0.04 0.00 0.45 -0.36 0.00 0.00 175.35 175.40 2dtg n SER 583 N 3.32 0.00 -4.08 1.43 2.88 0.24 -2.35 113.62 115.07 2dtg n SER 583 Ca -0.16 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.28 2dtg n SER 583 Cb 0.58 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.96 2dtg n SER 583 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2dtg s ASP 584 N -1.53 0.02 0.36 -3.46 3.68 -1.26 -4.51 116.67 109.97 2dtg s ASP 584 Ca 0.00 -1.11 -0.07 0.00 2.13 0.00 0.00 52.55 53.50 2dtg s ASP 584 Cb 0.00 0.48 -0.06 0.00 -1.45 0.00 0.00 42.92 41.90 2dtg s ASP 584 CO 0.00 -0.99 0.67 0.27 0.13 0.00 0.00 175.17 175.25 2dtg s ILE 585 N -4.07 4.91 0.04 4.11 -0.00 -1.25 -4.11 121.20 120.83 2dtg s ILE 585 Ca 0.28 0.30 -0.11 0.00 -0.00 0.00 0.00 60.65 61.13 2dtg s ILE 585 Cb 0.03 -3.75 0.01 0.00 -0.00 0.00 0.00 42.46 38.75 2dtg s ILE 585 CO 0.09 -0.46 0.22 0.27 -0.00 0.00 0.00 174.94 175.07 2dtg s ILE 586 N -2.27 0.10 0.33 8.37 -4.36 0.12 -4.93 121.20 118.57 2dtg s ILE 586 Ca 0.47 -0.84 -0.26 0.00 -0.26 0.00 0.00 60.65 59.76 2dtg s ILE 586 Cb -0.10 -0.92 -0.10 0.00 1.25 0.00 0.00 42.46 42.59 2dtg s ILE 586 CO 0.32 -0.46 0.98 -0.47 0.24 0.00 0.00 174.94 175.55 2dtg s TYR 587 N -2.57 3.61 -0.27 1.37 5.04 -1.26 -2.02 117.35 121.25 2dtg s TYR 587 Ca -0.05 1.76 -0.05 0.00 -2.44 0.00 0.00 57.07 56.29 2dtg s TYR 587 Cb -0.01 -3.01 0.14 0.00 0.35 0.00 0.00 41.96 39.44 2dtg s TYR 587 CO -0.04 -0.03 0.53 0.08 -1.34 0.00 0.00 175.55 174.75 2dtg s VAL 588 N -1.55 -0.84 -0.18 3.14 1.01 -0.97 -4.95 120.40 116.05 2dtg s VAL 588 Ca 0.51 0.02 -0.08 0.00 0.00 0.00 0.00 61.98 62.43 2dtg s VAL 588 Cb -0.21 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 2dtg s VAL 588 CO 0.27 -0.02 0.06 -1.58 0.00 0.00 0.00 175.10 173.84 2dtg s GLN 589 N 2.75 3.98 -0.05 2.72 0.74 -1.22 0.22 119.66 128.80 2dtg s GLN 589 Ca 0.08 -0.34 -0.14 0.00 0.05 0.00 0.00 55.36 55.02 2dtg s GLN 589 Cb -0.14 -3.22 -0.05 0.00 1.10 0.00 0.00 33.01 30.70 2dtg s GLN 589 CO -0.18 0.28 0.37 -0.08 -0.55 0.00 0.00 175.29 175.14 2dtg s THR 590 N 0.35 5.14 1.00 -0.34 -1.32 0.33 -4.85 115.64 115.94 2dtg s THR 590 Ca 0.03 0.75 -0.19 0.00 -1.21 0.00 0.00 61.69 61.08 2dtg s THR 590 Cb -0.12 -3.69 -0.11 0.00 -1.51 0.00 0.00 72.50 67.07 2dtg s THR 590 CO -0.00 0.52 -0.70 0.47 -2.21 0.00 0.00 174.62 172.69 2dtg n ASP 591 N 2.36 -4.41 -3.93 8.08 9.92 0.28 0.15 116.55 129.00 2dtg n ASP 591 Ca -0.13 0.14 -0.30 0.00 -0.53 0.00 0.00 54.79 53.97 2dtg n ASP 591 Cb 0.52 -0.79 -0.16 0.00 -0.64 0.00 0.00 41.12 40.05 2dtg n ASP 591 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dtg s ALA 592 N -2.09 1.87 -0.06 2.24 0.00 -1.26 -0.94 121.76 121.52 2dtg s ALA 592 Ca 0.43 -1.26 -0.04 0.00 0.00 0.00 0.00 51.96 51.10 2dtg s ALA 592 Cb -0.12 -1.38 -0.04 0.00 0.00 0.00 0.00 23.12 21.59 2dtg s ALA 592 CO 0.75 -1.12 0.11 0.95 0.00 0.00 0.00 175.76 176.45 2dtg s THR 593 N 1.44 5.08 0.00 0.00 -4.23 -1.26 -4.90 115.64 111.76 2dtg s THR 593 Ca -0.05 -0.10 0.00 0.00 -1.18 0.00 0.00 61.69 60.36 2dtg s THR 593 Cb -0.18 -3.26 0.00 0.00 1.34 0.00 0.00 72.50 70.40 2dtg s THR 593 CO -0.07 0.49 0.00 -0.46 -0.54 0.00 0.00 174.62 174.05 2dtg n ASN 594 N 1.61 0.00 -4.97 3.99 6.94 -1.26 -4.57 115.26 116.99 2dtg n ASN 594 Ca -0.16 0.00 -0.21 0.00 -0.02 0.00 0.00 54.58 54.18 2dtg n ASN 594 Cb 0.54 0.00 0.02 0.00 -2.36 0.00 0.00 39.78 37.98 2dtg n ASN 594 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 2dtg s PRO 595 N 0.00 2.77 0.76 -0.53 0.04 -1.26 -4.54 135.00 132.23 2dtg s PRO 595 Ca 0.00 -0.71 -0.11 0.00 0.04 0.00 0.00 61.00 60.21 2dtg s PRO 595 Cb 0.00 -2.54 0.05 0.00 0.04 0.00 0.00 34.50 32.04 2dtg s PRO 595 CO 0.00 -0.50 1.09 0.45 0.04 0.00 0.00 177.00 178.08 2dtg s SER 596 N -4.34 4.89 0.62 6.66 0.15 -1.26 -4.40 113.70 116.02 2dtg s SER 596 Ca 0.53 1.28 -0.18 0.00 0.70 0.00 0.00 55.95 58.29 2dtg s SER 596 Cb -0.10 -2.05 -0.07 0.00 -1.71 0.00 0.00 66.02 62.09 2dtg s SER 596 CO 0.38 -1.71 0.62 0.55 1.20 0.00 0.00 173.24 174.27 2dtg n VAL 597 N -3.26 2.48 -1.21 4.45 3.14 -1.26 -4.62 118.33 118.06 2dtg n VAL 597 Ca 0.07 -0.48 -0.32 0.00 -2.96 0.00 0.00 64.34 60.66 2dtg n VAL 597 Cb 0.56 -0.79 0.11 0.00 -1.06 0.00 0.00 33.84 32.65 2dtg n VAL 597 CO 0.00 0.00 0.00 -2.84 -6.46 0.00 0.00 176.83 167.53 2dtg s PRO 598 N -2.40 1.97 0.22 1.45 0.02 -1.26 -4.49 135.00 130.51 2dtg s PRO 598 Ca 0.70 1.41 0.09 0.00 0.02 0.00 0.00 61.00 63.21 2dtg s PRO 598 Cb -0.41 -1.85 -0.04 0.00 0.02 0.00 0.00 34.50 32.22 2dtg s PRO 598 CO 0.53 -1.90 -0.04 -0.51 -0.33 0.00 0.00 177.00 174.76 2dtg s LEU 599 N -5.83 3.13 -1.49 -5.54 2.01 -0.51 -4.76 118.68 105.69 2dtg s LEU 599 Ca 0.66 -0.58 -0.04 0.00 0.01 0.00 0.00 54.13 54.18 2dtg s LEU 599 Cb -0.21 -1.73 0.03 0.00 0.01 0.00 0.00 46.19 44.29 2dtg s LEU 599 CO 0.52 0.05 0.41 0.47 1.01 0.00 0.00 176.35 178.82 2dtg n ASP 600 N -0.42 -0.62 -4.73 2.29 9.92 -1.26 0.51 116.55 122.24 2dtg n ASP 600 Ca -0.09 -1.06 -0.41 0.00 -0.53 0.00 0.00 54.79 52.70 2dtg n ASP 600 Cb 0.57 -2.72 -0.04 0.00 -0.64 0.00 0.00 41.12 38.29 2dtg n ASP 600 CO 0.00 0.00 0.00 -2.84 0.13 0.00 0.00 177.20 174.49 2dtg s PRO 601 N -6.78 4.65 -0.21 -0.24 0.02 -1.26 -4.20 135.00 126.99 2dtg s PRO 601 Ca 0.14 1.56 -0.04 0.00 0.02 0.00 0.00 61.00 62.69 2dtg s PRO 601 Cb -0.08 -3.34 0.11 0.00 0.02 0.00 0.00 34.50 31.21 2dtg s PRO 601 CO 0.92 0.15 0.33 0.96 -0.33 0.00 0.00 177.00 179.02 2dtg s ILE 602 N -0.07 -0.51 -0.31 2.83 -0.00 0.49 -4.97 121.20 118.67 2dtg s ILE 602 Ca 0.48 0.02 -0.08 0.00 -0.00 0.00 0.00 60.65 61.07 2dtg s ILE 602 Cb -0.26 -0.69 0.00 0.00 -0.00 0.00 0.00 42.46 41.51 2dtg s ILE 602 CO 0.32 -0.07 0.12 -0.94 -0.00 0.00 0.00 174.94 174.38 2dtg s SER 603 N 2.48 5.38 0.03 4.36 1.04 -1.26 -1.60 113.70 124.13 2dtg s SER 603 Ca 0.07 -0.64 0.08 0.00 0.48 0.00 0.00 55.95 55.95 2dtg s SER 603 Cb -0.14 -1.95 -0.02 0.00 0.10 0.00 0.00 66.02 64.00 2dtg s SER 603 CO -0.13 -0.21 -0.25 0.54 0.98 0.00 0.00 173.24 174.18 2dtg s VAL 604 N 1.56 1.97 0.11 5.02 0.11 -0.32 -4.76 120.40 124.08 2dtg s VAL 604 Ca 0.04 -1.24 -0.30 0.00 -2.93 0.00 0.00 61.98 57.54 2dtg s VAL 604 Cb -0.17 -1.68 -0.06 0.00 -1.53 0.00 0.00 36.38 32.94 2dtg s VAL 604 CO 0.05 0.39 1.08 -0.55 -3.33 0.00 0.00 175.10 172.73 2dtg s SER 605 N -1.02 7.28 -0.17 3.54 0.15 -1.26 -1.05 113.70 121.16 2dtg s SER 605 Ca 0.10 1.95 -0.14 0.00 0.70 0.00 0.00 55.95 58.56 2dtg s SER 605 Cb -0.10 -2.59 -0.09 0.00 -1.71 0.00 0.00 66.02 61.53 2dtg s SER 605 CO 0.01 -0.26 -0.04 -3.20 1.20 0.00 0.00 173.24 170.95 2dtg n ASN 606 N 3.07 1.83 0.00 5.45 4.05 -1.11 -4.89 115.26 123.66 2dtg n ASN 606 Ca 0.05 0.54 0.00 0.00 0.45 0.00 0.00 54.58 55.62 2dtg n ASN 606 Cb 0.47 -0.90 0.00 0.00 1.23 0.00 0.00 39.78 40.58 2dtg n ASN 606 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 2dtg n SER 607 N -4.53 0.59 -0.08 1.20 3.41 -1.20 -5.01 113.62 108.01 2dtg n SER 607 Ca -0.18 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.31 2dtg n SER 607 Cb 0.44 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.34 2dtg n SER 607 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2dtg h SER 608 N 0.00 0.42 0.00 4.04 0.02 -1.87 -3.02 113.55 113.14 2dtg h SER 608 Ca 0.00 -0.35 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 2dtg h SER 608 Cb 0.00 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.42 2dtg h SER 608 CO 0.00 0.68 -0.13 -0.24 -1.14 0.00 0.00 176.83 176.00 2dtg n SER 609 N -4.61 1.45 -4.65 3.07 2.88 -1.26 -3.74 113.62 106.76 2dtg n SER 609 Ca -0.04 -2.40 -0.31 0.00 -1.33 0.00 0.00 58.87 54.79 2dtg n SER 609 Cb 0.28 -0.25 -0.09 0.00 -0.75 0.00 0.00 64.21 63.40 2dtg n SER 609 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2dtg s GLN 610 N -1.51 2.51 -0.15 -1.46 -0.21 -1.26 -2.74 119.66 114.84 2dtg s GLN 610 Ca 0.15 -0.82 -0.05 0.00 0.02 0.00 0.00 55.36 54.66 2dtg s GLN 610 Cb 0.13 -2.51 0.07 0.00 1.00 0.00 0.00 33.01 31.70 2dtg s GLN 610 CO 0.01 0.56 0.29 -1.50 -2.12 0.00 0.00 175.29 172.53 2dtg s ILE 611 N -1.20 -0.46 -0.04 1.08 1.10 -1.03 -2.76 121.20 117.90 2dtg s ILE 611 Ca 0.22 0.22 -0.16 0.00 -0.51 0.00 0.00 60.65 60.43 2dtg s ILE 611 Cb -0.11 -0.51 -0.05 0.00 0.15 0.00 0.00 42.46 41.93 2dtg s ILE 611 CO 0.14 0.08 0.43 0.27 -2.11 0.00 0.00 174.94 173.75 2dtg s ILE 612 N 2.45 5.07 -0.12 2.00 -5.25 -0.22 -1.05 121.20 124.10 2dtg s ILE 612 Ca 0.02 0.87 0.03 0.00 -0.99 0.00 0.00 60.65 60.57 2dtg s ILE 612 Cb -0.12 -3.75 -0.00 0.00 2.95 0.00 0.00 42.46 41.54 2dtg s ILE 612 CO -0.10 0.49 -0.21 -0.22 -1.79 0.00 0.00 174.94 173.12 2dtg s LEU 613 N -0.49 2.25 0.14 0.37 0.20 0.93 -1.18 118.68 120.90 2dtg s LEU 613 Ca 0.24 -0.51 0.10 0.00 0.69 0.00 0.00 54.13 54.65 2dtg s LEU 613 Cb -0.16 -1.47 -0.04 0.00 -0.43 0.00 0.00 46.19 44.09 2dtg s LEU 613 CO 0.12 0.14 -0.25 -0.54 -0.29 0.00 0.00 176.35 175.54 2dtg s LYS 614 N 0.45 1.35 -0.13 1.98 -0.14 -0.62 -2.03 119.74 120.60 2dtg s LYS 614 Ca -0.14 -1.34 -0.30 0.00 -1.36 0.00 0.00 55.97 52.82 2dtg s LYS 614 Cb -0.17 -1.75 0.12 0.00 -1.68 0.00 0.00 37.83 34.36 2dtg s LYS 614 CO 0.06 0.40 1.00 1.67 -0.76 0.00 0.00 175.35 177.72 2dtg s TRP 615 N -1.24 -0.34 0.21 3.18 -2.14 -1.21 -0.38 118.94 117.02 2dtg s TRP 615 Ca 0.14 0.48 0.06 0.00 2.66 0.00 0.00 56.10 59.44 2dtg s TRP 615 Cb -0.09 0.47 -0.04 0.00 -3.10 0.00 0.00 33.47 30.71 2dtg s TRP 615 CO 0.06 -0.37 0.20 0.15 -2.66 0.00 0.00 176.95 174.33 2dtg s LYS 616 N -1.63 3.01 0.26 3.25 -0.14 0.18 -4.73 119.74 119.93 2dtg s LYS 616 Ca 0.01 -0.91 -0.30 0.00 -1.36 0.00 0.00 55.97 53.41 2dtg s LYS 616 Cb -0.01 -2.66 -0.10 0.00 -1.68 0.00 0.00 37.83 33.38 2dtg s LYS 616 CO -0.01 0.45 1.50 -2.14 -0.76 0.00 0.00 175.35 174.38 2dtg s PRO 617 N -3.51 4.22 0.60 -1.68 0.02 -1.26 -1.42 135.00 131.96 2dtg s PRO 617 Ca 0.32 2.39 0.31 0.00 0.02 0.00 0.00 61.00 64.05 2dtg s PRO 617 Cb -0.09 -3.08 1.88 0.00 0.02 0.00 0.00 34.50 33.22 2dtg s PRO 617 CO 0.25 -0.50 2.27 -1.00 -0.33 0.00 0.00 177.00 177.69 2dtg h PRO 618 N 5.09 0.00 -4.64 5.54 0.13 -1.82 -3.41 132.00 132.90 2dtg h PRO 618 Ca -0.46 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.43 2dtg h PRO 618 Cb 1.22 0.00 0.12 0.00 0.13 0.00 0.00 31.00 32.47 2dtg h PRO 618 CO 0.79 0.00 -0.56 -1.13 -0.23 0.00 0.00 178.00 176.87 2dtg n SER 619 N -3.78 -2.15 -3.97 1.44 3.41 -1.26 -4.71 113.62 102.59 2dtg n SER 619 Ca -0.03 -0.45 -0.09 0.00 -0.26 0.00 0.00 58.87 58.04 2dtg n SER 619 Cb 0.08 -3.84 -0.06 0.00 -0.26 0.00 0.00 64.21 60.13 2dtg n SER 619 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2dtg s ASP 620 N -3.96 -0.08 0.00 4.04 1.01 -1.26 -4.91 116.67 111.51 2dtg s ASP 620 Ca 0.01 -0.89 0.00 0.00 0.71 0.00 0.00 52.55 52.39 2dtg s ASP 620 Cb -0.00 0.55 0.00 0.00 1.01 0.00 0.00 42.92 44.48 2dtg s ASP 620 CO 0.53 -1.07 0.00 -2.65 0.21 0.00 0.00 175.17 172.19 2dtg n PRO 621 N -0.34 0.00 0.00 8.23 -0.02 -1.26 -3.73 135.00 137.88 2dtg n PRO 621 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 2dtg n PRO 621 Cb 0.62 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.10 2dtg n PRO 621 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2dtg n ASN 622 N 0.00 0.00 0.00 2.55 2.85 -1.26 -4.20 115.26 115.20 2dtg n ASN 622 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 2dtg n ASN 622 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 2dtg n ASN 622 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2dtg n GLY 623 N -1.75 1.78 1.95 8.20 0.00 -1.24 -3.66 105.19 110.46 2dtg n GLY 623 Ca 0.00 -0.17 -0.20 0.00 0.00 0.00 0.00 46.02 45.65 2dtg n GLY 623 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2dtg n ASN 624 N 8.99 5.10 0.00 1.61 5.03 -1.26 -4.66 115.26 130.07 2dtg n ASN 624 Ca 0.00 -3.22 0.00 0.00 0.87 0.00 0.00 54.58 52.23 2dtg n ASN 624 Cb 0.00 -0.87 0.00 0.00 -1.02 0.00 0.00 39.78 37.89 2dtg n ASN 624 CO 0.00 0.00 0.00 2.30 -1.83 0.00 0.00 177.26 177.73 2dtg n ILE 625 N -0.42 0.00 0.04 2.41 -6.64 -1.24 -4.73 119.36 108.77 2dtg n ILE 625 Ca 0.42 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 61.40 2dtg n ILE 625 Cb 0.99 0.00 0.00 0.00 -1.44 0.00 0.00 39.64 39.19 2dtg n ILE 625 CO 0.00 0.00 0.00 1.07 -1.77 0.00 0.00 176.55 175.85 2dtg n THR 626 N 0.00 0.00 -3.82 7.28 5.66 -0.54 -4.78 114.28 118.09 2dtg n THR 626 Ca 0.00 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.92 2dtg n THR 626 Cb 0.00 -0.11 -0.02 0.00 -1.55 0.00 0.00 70.33 68.64 2dtg n THR 626 CO 0.00 0.00 0.00 -1.38 -3.05 0.00 0.00 175.07 170.64 2dtg s HIS 627 N -2.00 -0.16 0.02 1.09 -3.43 -1.20 -4.31 115.29 105.30 2dtg s HIS 627 Ca 0.00 -0.25 0.05 0.00 -0.80 0.00 0.00 55.06 54.06 2dtg s HIS 627 Cb 0.00 0.62 -0.03 0.00 -1.43 0.00 0.00 32.58 31.73 2dtg s HIS 627 CO 0.00 -1.15 -0.14 0.71 -2.00 0.00 0.00 174.74 172.16 2dtg s TYR 628 N -3.91 2.67 -0.84 0.38 4.12 -0.33 -0.48 117.35 118.97 2dtg s TYR 628 Ca 0.11 -0.18 -0.07 0.00 0.02 0.00 0.00 57.07 56.95 2dtg s TYR 628 Cb -0.05 -1.53 0.21 0.00 -1.52 0.00 0.00 41.96 39.08 2dtg s TYR 628 CO 0.04 0.27 0.74 -1.17 0.02 0.00 0.00 175.55 175.46 2dtg s LEU 629 N -1.32 5.99 -0.43 -1.29 2.96 0.91 -1.31 118.68 124.19 2dtg s LEU 629 Ca 0.15 -3.13 -0.26 0.00 -0.22 0.00 0.00 54.13 50.67 2dtg s LEU 629 Cb -0.11 -2.04 0.02 0.00 0.50 0.00 0.00 46.19 44.56 2dtg s LEU 629 CO 0.05 -0.38 0.93 -0.69 -1.32 0.00 0.00 176.35 174.95 2dtg s VAL 630 N -0.50 4.50 0.52 1.68 1.01 -0.95 -2.20 120.40 124.46 2dtg s VAL 630 Ca 0.22 0.91 0.06 0.00 0.00 0.00 0.00 61.98 63.17 2dtg s VAL 630 Cb -0.12 -4.40 0.05 0.00 0.00 0.00 0.00 36.38 31.90 2dtg s VAL 630 CO -0.08 -0.74 0.71 -0.36 0.00 0.00 0.00 175.10 174.63 2dtg s PHE 631 N 3.68 2.32 -0.29 5.22 0.40 -1.26 -3.94 117.98 124.10 2dtg s PHE 631 Ca 0.38 -0.40 -0.17 0.00 -0.60 0.00 0.00 56.93 56.13 2dtg s PHE 631 Cb -0.11 -2.46 0.17 0.00 0.51 0.00 0.00 43.02 41.13 2dtg s PHE 631 CO 0.24 -0.83 1.14 1.67 0.70 0.00 0.00 175.22 178.13 2dtg s TRP 632 N -2.59 -0.31 0.05 0.36 -2.14 -1.26 -2.69 118.94 110.36 2dtg s TRP 632 Ca 0.58 0.65 0.06 0.00 2.66 0.00 0.00 56.10 60.05 2dtg s TRP 632 Cb -0.08 0.23 -0.03 0.00 -3.10 0.00 0.00 33.47 30.49 2dtg s TRP 632 CO 0.37 -0.16 -0.16 -2.00 -2.66 0.00 0.00 176.95 172.34 2dtg s GLU 633 N 1.03 0.98 -0.30 3.25 2.12 -0.74 -4.93 118.70 120.12 2dtg s GLU 633 Ca -0.06 -0.87 -0.25 0.00 0.36 0.00 0.00 54.97 54.14 2dtg s GLU 633 Cb -0.03 -1.03 0.00 0.00 0.26 0.00 0.00 34.13 33.33 2dtg s GLU 633 CO -0.12 0.25 0.86 0.50 -0.54 0.00 0.00 175.26 176.21 2dtg s ARG 634 N -1.38 4.02 -0.36 4.30 3.52 -1.26 -0.67 118.95 127.12 2dtg s ARG 634 Ca 0.02 0.77 -0.17 0.00 -0.13 0.00 0.00 55.73 56.22 2dtg s ARG 634 Cb -0.09 -3.72 -0.00 0.00 -1.56 0.00 0.00 34.95 29.58 2dtg s ARG 634 CO 0.02 -0.70 0.45 -0.65 -0.81 0.00 0.00 175.30 173.60 2dtg s GLN 635 N 3.10 3.51 1.08 5.12 -0.21 0.56 -4.97 119.66 127.85 2dtg s GLN 635 Ca 0.36 -0.35 -0.13 0.00 0.02 0.00 0.00 55.36 55.26 2dtg s GLN 635 Cb -0.14 -3.83 0.24 0.00 1.00 0.00 0.00 33.01 30.27 2dtg s GLN 635 CO 0.12 -0.64 1.06 0.00 -2.12 0.00 0.00 175.29 173.71 2dtg s ALA 636 N 2.22 0.24 0.63 6.09 0.00 -1.26 -4.17 121.76 125.51 2dtg s ALA 636 Ca 0.15 -0.21 -0.08 0.00 0.00 0.00 0.00 51.96 51.82 2dtg s ALA 636 Cb -0.16 -3.19 0.01 0.00 0.00 0.00 0.00 23.12 19.78 2dtg s ALA 636 CO 0.13 -3.35 0.97 -1.21 0.00 0.00 0.00 175.76 172.30 2dtg s GLU 637 N -4.70 2.89 -0.19 0.00 0.41 -1.26 -5.03 118.70 110.83 2dtg s GLU 637 Ca 0.67 0.15 -0.17 0.00 -0.41 0.00 0.00 54.97 55.21 2dtg s GLU 637 Cb -0.22 -2.19 -0.06 0.00 -1.78 0.00 0.00 34.13 29.88 2dtg s GLU 637 CO 0.61 -0.81 -0.33 -0.40 -0.49 0.00 0.00 175.26 173.84 2dtg n ASP 638 N -2.73 1.93 0.00 -0.19 3.85 -1.26 -5.15 116.55 113.01 2dtg n ASP 638 Ca 0.05 0.36 0.00 0.00 -0.71 0.00 0.00 54.79 54.49 2dtg n ASP 638 Cb 0.57 -0.76 0.00 0.00 -1.35 0.00 0.00 41.12 39.58 2dtg n ASP 638 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 2dtg n SER 639 N -4.45 0.00 -0.08 -1.12 3.41 -1.26 -5.00 113.62 105.11 2dtg n SER 639 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.43 2dtg n SER 639 Cb 0.54 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 2dtg n SER 639 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2dtg n GLU 640 N 0.00 0.00 -4.34 4.33 0.28 -1.26 -4.65 120.64 115.00 2dtg n GLU 640 Ca 0.00 0.00 -0.34 0.00 -0.16 0.00 0.00 57.16 56.66 2dtg n GLU 640 Cb 0.00 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 32.77 2dtg n GLU 640 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 2dtg s LEU 641 N 0.00 3.51 0.00 -1.84 0.20 -1.26 -4.14 118.68 115.15 2dtg s LEU 641 Ca 0.00 0.06 0.00 0.00 0.69 0.00 0.00 54.13 54.88 2dtg s LEU 641 Cb 0.00 -1.82 0.00 0.00 -0.43 0.00 0.00 46.19 43.94 2dtg s LEU 641 CO 0.00 0.29 0.64 0.33 -0.29 0.00 0.00 176.35 177.32 2dtg n PHE 642 N 2.71 0.00 -0.03 5.38 -0.00 -1.26 -3.56 117.46 120.71 2dtg n PHE 642 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.27 2dtg n PHE 642 Cb 0.53 -0.38 0.00 0.00 -0.00 0.00 0.00 39.48 39.64 2dtg n PHE 642 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.76 175.91 2dtg n GLU 643 N -1.63 0.29 -1.59 -4.13 -0.00 -1.26 -4.82 120.64 107.50 2dtg n GLU 643 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.16 2dtg n GLU 643 Cb 0.00 -1.36 0.00 0.00 -0.00 0.00 0.00 31.44 30.08 2dtg n GLU 643 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2dtg n LEU 644 N 1.59 -2.56 0.00 -1.84 7.99 -1.23 -5.01 117.00 115.94 2dtg n LEU 644 Ca 0.00 2.13 0.00 0.00 -0.01 0.00 0.00 56.01 58.13 2dtg n LEU 644 Cb 0.14 -2.55 0.00 0.00 -0.11 0.00 0.00 43.42 40.91 2dtg n LEU 644 CO 0.00 -0.05 0.00 -0.67 -1.51 0.00 0.00 177.39 175.16 2dtg n ASP 645 N -0.19 0.00 -3.22 -1.43 4.64 -1.26 -4.85 116.55 110.23 2dtg n ASP 645 Ca 0.00 0.00 -0.23 0.00 -1.38 0.00 0.00 54.79 53.18 2dtg n ASP 645 Cb 0.00 0.00 0.02 0.00 -1.04 0.00 0.00 41.12 40.10 2dtg n ASP 645 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2dtg n TYR 646 N 0.00 -2.71 -1.17 -0.67 9.36 -1.26 -4.60 117.16 116.11 2dtg n TYR 646 Ca 0.00 1.13 -0.25 0.00 3.32 0.00 0.00 57.90 62.09 2dtg n TYR 646 Cb 0.00 -2.53 -0.12 0.00 -0.63 0.00 0.00 39.34 36.06 2dtg n TYR 646 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2dtg n LEU 648 N 15.70 0.00 0.00 0.00 0.00 -1.26 -5.10 117.00 126.34 2dtg n LEU 648 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.44 2dtg n LEU 648 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.87 2dtg n LEU 648 CO 0.81 0.00 0.00 1.17 0.00 0.00 0.00 177.39 179.37 2dtg n LYS 649 N 0.00 1.00 0.00 1.96 0.00 -1.26 -5.11 118.16 114.75 2dtg n LYS 649 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.31 2dtg n LYS 649 Cb 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 35.03 34.87 2dtg n LYS 649 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2dtg n GLY 650 N -0.08 3.47 0.02 3.14 0.00 -1.26 -5.16 105.19 105.32 2dtg n GLY 650 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.65 2dtg n GLY 650 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dtg n LEU 651 N 0.00 0.00 0.00 0.99 4.32 -1.26 -5.15 117.00 115.90 2dtg n LEU 651 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 2dtg n LEU 651 Cb 0.00 0.01 0.00 0.00 -1.62 0.00 0.00 43.42 41.81 2dtg n LEU 651 CO 0.00 -0.01 0.00 1.17 -1.22 0.00 0.00 177.39 177.33 2dtg n LYS 652 N -0.85 0.00 0.00 3.23 4.81 -1.26 -5.12 118.16 118.97 2dtg n LYS 652 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2dtg n LYS 652 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2dtg n LYS 652 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2dtg n LEU 653 N 0.00 0.00 -0.40 3.14 7.99 -1.26 -5.07 117.00 121.40 2dtg n LEU 653 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.00 2dtg n LEU 653 Cb 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.31 2dtg n LEU 653 CO 0.00 0.00 0.00 -2.65 -1.51 0.00 0.00 177.39 173.23 2dtg n PRO 654 N 0.00 0.00 0.00 3.23 -0.02 -1.26 -5.12 135.00 131.83 2dtg n PRO 654 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2dtg n PRO 654 Cb 0.00 -0.40 0.00 0.00 -0.02 0.00 0.00 33.50 33.08 2dtg n PRO 654 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2dtg n SER 655 N -2.99 0.00 0.00 2.55 7.64 -1.26 -5.23 113.62 114.33 2dtg n SER 655 Ca 0.00 -1.00 0.00 0.00 1.01 0.00 0.00 58.87 58.88 2dtg n SER 655 Cb 0.28 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.48 2dtg n SER 655 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2dtg n GLU 755 N 0.00 0.00 -0.49 1.43 -0.58 -1.26 -5.28 120.64 114.46 2dtg n GLU 755 Ca 0.00 0.00 0.07 0.00 -0.42 0.00 0.00 57.16 56.81 2dtg n GLU 755 Cb 0.42 0.00 0.27 0.00 -0.57 0.00 0.00 31.44 31.56 2dtg n GLU 755 CO 0.00 0.00 0.00 1.58 -0.48 0.00 0.00 177.13 178.23 2dtg n HIS 756 N 0.00 1.17 0.00 -0.32 -0.00 -1.26 -5.02 115.22 109.79 2dtg n HIS 756 Ca 0.00 -0.45 0.00 0.00 0.46 0.00 0.00 57.72 57.73 2dtg n HIS 756 Cb 0.00 -0.23 0.00 0.00 -0.12 0.00 0.00 29.99 29.64 2dtg n HIS 756 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 2dtg n ARG 757 N 0.73 0.00 -3.60 1.57 1.74 -1.26 -5.10 116.66 110.74 2dtg n ARG 757 Ca 0.19 0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 57.07 2dtg n ARG 757 Cb 0.73 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 32.15 2dtg n ARG 757 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2dtg s PRO 758 N -0.73 2.79 0.00 5.56 0.04 -1.26 -5.00 135.00 136.39 2dtg s PRO 758 Ca 0.00 -1.27 0.03 0.00 0.04 0.00 0.00 61.00 59.80 2dtg s PRO 758 Cb 0.00 -2.56 -0.01 0.00 0.04 0.00 0.00 34.50 31.97 2dtg s PRO 758 CO 0.00 -0.01 0.30 0.34 0.04 0.00 0.00 177.00 177.67 2dtg n PHE 759 N -1.52 0.00 0.00 0.56 -0.00 -1.26 -4.99 117.46 110.26 2dtg n PHE 759 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.46 2dtg n PHE 759 Cb 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.08 2dtg n PHE 759 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.76 174.85 2dtg n GLU 760 N -0.59 0.00 -3.44 -4.13 4.07 -1.25 -4.86 120.64 110.43 2dtg n GLU 760 Ca 0.01 0.00 -0.44 0.00 -0.06 0.00 0.00 57.16 56.67 2dtg n GLU 760 Cb 0.05 0.00 -0.05 0.00 -0.06 0.00 0.00 31.44 31.38 2dtg n GLU 760 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 2dtg s LYS 761 N -0.25 3.05 -0.10 5.31 1.02 -1.26 -2.23 119.74 125.28 2dtg s LYS 761 Ca 0.00 -2.17 -0.30 0.00 0.02 0.00 0.00 55.97 53.53 2dtg s LYS 761 Cb 0.00 -4.17 -0.04 0.00 -0.52 0.00 0.00 37.83 33.10 2dtg s LYS 761 CO 0.00 -1.26 1.44 0.08 -0.92 0.00 0.00 175.35 174.70 2dtg s VAL 762 N 0.68 3.92 -0.05 3.17 1.01 -0.43 -4.82 120.40 123.88 2dtg s VAL 762 Ca 0.12 1.14 0.04 0.00 0.00 0.00 0.00 61.98 63.28 2dtg s VAL 762 Cb -0.20 -3.73 -0.00 0.00 0.00 0.00 0.00 36.38 32.45 2dtg s VAL 762 CO -0.04 -0.09 -0.17 0.68 0.00 0.00 0.00 175.10 175.49 2dtg s VAL 763 N 3.59 1.41 0.00 2.92 -7.23 -1.26 -1.18 120.40 118.65 2dtg s VAL 763 Ca 0.64 -0.69 0.00 0.00 -1.81 0.00 0.00 61.98 60.12 2dtg s VAL 763 Cb -0.28 -1.23 0.00 0.00 0.56 0.00 0.00 36.38 35.44 2dtg s VAL 763 CO 0.22 0.41 0.00 0.59 -0.31 0.00 0.00 175.10 176.01 2dtg n ASN 764 N 3.29 -0.15 -3.83 4.85 3.02 -1.26 -4.96 115.26 116.21 2dtg n ASN 764 Ca -0.19 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.21 2dtg n ASN 764 Cb 0.53 -0.78 -0.15 0.00 -0.61 0.00 0.00 39.78 38.76 2dtg n ASN 764 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2dtg s LYS 765 N -0.31 0.09 -0.65 3.52 1.02 -1.26 -5.04 119.74 117.11 2dtg s LYS 765 Ca 0.00 0.08 -0.02 0.00 0.02 0.00 0.00 55.97 56.05 2dtg s LYS 765 Cb 0.00 -0.25 0.38 0.00 -0.52 0.00 0.00 37.83 37.45 2dtg s LYS 765 CO 0.00 -0.09 2.07 -0.85 -0.92 0.00 0.00 175.35 175.56 2dtg n GLU 766 N 3.75 2.57 -3.63 1.68 0.00 -1.26 -4.86 120.64 118.90 2dtg n GLU 766 Ca -0.22 -3.07 -0.03 0.00 0.00 0.00 0.00 57.16 53.84 2dtg n GLU 766 Cb 0.54 -2.19 -0.06 0.00 0.00 0.00 0.00 31.44 29.72 2dtg n GLU 766 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 2dtg s SER 767 N -1.33 -0.66 0.01 -1.84 0.15 -1.26 -3.28 113.70 105.49 2dtg s SER 767 Ca 0.58 1.04 0.07 0.00 0.70 0.00 0.00 55.95 58.34 2dtg s SER 767 Cb 0.46 1.32 -0.02 0.00 -1.71 0.00 0.00 66.02 66.06 2dtg s SER 767 CO -0.10 -0.16 -0.21 -0.22 1.20 0.00 0.00 173.24 173.75 2dtg s LEU 768 N 1.53 2.10 -0.49 3.45 0.20 -0.86 -5.00 118.68 119.61 2dtg s LEU 768 Ca -0.09 -0.45 -0.00 0.00 0.69 0.00 0.00 54.13 54.28 2dtg s LEU 768 Cb -0.04 -1.05 0.13 0.00 -0.43 0.00 0.00 46.19 44.80 2dtg s LEU 768 CO -0.17 0.22 0.26 0.68 -0.29 0.00 0.00 176.35 177.05 2dtg s VAL 769 N -0.64 3.10 -0.65 1.68 -7.23 -1.26 -0.05 120.40 115.35 2dtg s VAL 769 Ca 0.08 -2.64 -0.26 0.00 -1.81 0.00 0.00 61.98 57.35 2dtg s VAL 769 Cb -0.08 -3.12 -0.12 0.00 0.56 0.00 0.00 36.38 33.62 2dtg s VAL 769 CO 0.00 -0.76 2.42 -0.38 -0.31 0.00 0.00 175.10 176.08 2dtg n ILE 770 N 3.89 -0.05 -0.62 -0.62 5.41 -0.21 -4.88 119.36 122.28 2dtg n ILE 770 Ca 0.03 -0.63 -0.26 0.00 1.00 0.00 0.00 62.75 62.89 2dtg n ILE 770 Cb 0.38 -2.27 0.15 0.00 -0.71 0.00 0.00 39.64 37.20 2dtg n ILE 770 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 2dtg n SER 771 N 16.37 -2.76 -4.23 4.38 7.64 -1.26 -2.45 113.62 131.31 2dtg n SER 771 Ca 0.44 -0.26 -0.37 0.00 1.01 0.00 0.00 58.87 59.69 2dtg n SER 771 Cb 0.46 -0.82 0.04 0.00 -1.01 0.00 0.00 64.21 62.88 2dtg n SER 771 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dtg n GLY 772 N 2.36 -3.21 1.43 0.23 0.00 -1.11 -4.69 105.19 100.21 2dtg n GLY 772 Ca 0.03 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.56 2dtg n GLY 772 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2dtg n LEU 773 N 1.87 -0.21 -3.74 0.99 7.94 -1.16 -4.98 117.00 117.70 2dtg n LEU 773 Ca 0.05 0.05 -0.12 0.00 -1.11 0.00 0.00 56.01 54.88 2dtg n LEU 773 Cb 0.51 0.54 -0.11 0.00 0.53 0.00 0.00 43.42 44.89 2dtg n LEU 773 CO 0.52 -0.32 -0.00 -0.60 -1.11 0.00 0.00 177.39 175.89 2dtg s ARG 774 N -1.07 0.37 0.62 1.96 6.06 -1.26 -5.09 118.95 120.55 2dtg s ARG 774 Ca 0.00 0.52 -0.08 0.00 -2.50 0.00 0.00 55.73 53.68 2dtg s ARG 774 Cb 0.00 0.13 0.01 0.00 0.06 0.00 0.00 34.95 35.14 2dtg s ARG 774 CO 0.00 -0.08 0.96 -3.38 -2.50 0.00 0.00 175.30 170.30 2dtg s HIS 775 N 0.48 3.31 -0.67 5.12 -3.43 -1.26 -4.48 115.29 114.36 2dtg s HIS 775 Ca -0.02 0.80 -0.15 0.00 -0.80 0.00 0.00 55.06 54.89 2dtg s HIS 775 Cb -0.04 -2.82 0.02 0.00 -1.43 0.00 0.00 32.58 28.31 2dtg s HIS 775 CO -0.03 -0.90 0.40 0.34 -2.00 0.00 0.00 174.74 172.56 2dtg n PHE 776 N -2.71 -0.98 -3.73 0.38 7.35 0.83 -4.76 117.46 113.85 2dtg n PHE 776 Ca 0.05 0.19 -0.14 0.00 -0.76 0.00 0.00 57.45 56.80 2dtg n PHE 776 Cb 0.57 -1.69 -0.09 0.00 0.35 0.00 0.00 39.48 38.62 2dtg n PHE 776 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 2dtg s THR 777 N -3.58 0.03 -0.02 -2.13 2.01 -1.26 -3.81 115.64 106.88 2dtg s THR 777 Ca 0.20 -0.27 -0.17 0.00 0.31 0.00 0.00 61.69 61.75 2dtg s THR 777 Cb -0.11 -0.63 -0.05 0.00 0.01 0.00 0.00 72.50 71.71 2dtg s THR 777 CO 0.59 -0.15 0.49 -0.83 -0.69 0.00 0.00 174.62 174.02 2dtg s GLY 778 N -0.82 2.51 -0.03 4.40 0.00 -1.26 -0.92 107.32 111.21 2dtg s GLY 778 Ca -0.09 -0.12 0.07 0.00 0.00 0.00 0.00 44.72 44.57 2dtg s GLY 778 CO 0.04 0.48 -0.23 -0.19 0.00 0.00 0.00 173.10 173.20 2dtg s TYR 779 N -0.47 2.09 -0.39 1.90 1.51 0.30 -0.32 117.35 121.97 2dtg s TYR 779 Ca 0.26 -0.47 -0.14 0.00 -1.01 0.00 0.00 57.07 55.71 2dtg s TYR 779 Cb -0.17 -1.36 0.01 0.00 -0.11 0.00 0.00 41.96 40.33 2dtg s TYR 779 CO 0.14 -0.09 0.28 1.03 -1.11 0.00 0.00 175.55 175.81 2dtg s ARG 780 N -0.39 3.08 0.02 -0.62 1.81 0.15 -1.66 118.95 121.34 2dtg s ARG 780 Ca 0.05 -0.94 -0.04 0.00 -1.72 0.00 0.00 55.73 53.08 2dtg s ARG 780 Cb -0.10 -3.93 -0.04 0.00 -0.45 0.00 0.00 34.95 30.42 2dtg s ARG 780 CO 0.00 -0.68 0.23 0.96 -0.68 0.00 0.00 175.30 175.13 2dtg s ILE 781 N 1.68 5.37 -0.15 1.52 -0.00 0.13 -1.78 121.20 127.96 2dtg s ILE 781 Ca 0.05 -0.07 -0.14 0.00 -0.00 0.00 0.00 60.65 60.49 2dtg s ILE 781 Cb -0.19 -3.57 -0.05 0.00 -0.00 0.00 0.00 42.46 38.66 2dtg s ILE 781 CO 0.10 0.29 -0.27 1.21 -0.00 0.00 0.00 174.94 176.27 2dtg n GLU 782 N 0.84 0.45 -2.78 0.37 2.13 -1.10 -1.82 120.64 118.74 2dtg n GLU 782 Ca -0.09 0.28 -0.04 0.00 0.66 0.00 0.00 57.16 57.96 2dtg n GLU 782 Cb 0.52 -1.41 0.00 0.00 0.27 0.00 0.00 31.44 30.83 2dtg n GLU 782 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 2dtg n LEU 783 N -4.29 -8.00 -4.91 4.31 7.94 -1.20 -2.53 117.00 108.33 2dtg n LEU 783 Ca -0.11 1.05 -0.20 0.00 -1.11 0.00 0.00 56.01 55.64 2dtg n LEU 783 Cb 0.40 -3.38 -0.02 0.00 0.53 0.00 0.00 43.42 40.95 2dtg n LEU 783 CO 0.16 -2.85 -0.01 -1.10 -1.11 0.00 0.00 177.39 172.47 2dtg s GLN 784 N -2.06 2.83 -0.03 1.96 -0.21 -0.93 -2.85 119.66 118.37 2dtg s GLN 784 Ca 0.11 -1.23 0.07 0.00 0.02 0.00 0.00 55.36 54.33 2dtg s GLN 784 Cb -0.03 -2.59 -0.02 0.00 1.00 0.00 0.00 33.01 31.37 2dtg s GLN 784 CO 0.78 0.03 -0.24 0.00 -2.12 0.00 0.00 175.29 173.74 2dtg s ALA 785 N -2.29 2.26 0.04 6.09 0.00 -1.26 -0.06 121.76 126.55 2dtg s ALA 785 Ca 0.44 -1.09 0.06 0.00 0.00 0.00 0.00 51.96 51.37 2dtg s ALA 785 Cb -0.07 -0.64 -0.02 0.00 0.00 0.00 0.00 23.12 22.38 2dtg s ALA 785 CO 0.28 0.53 -0.17 0.00 0.00 0.00 0.00 175.76 176.40 2dtg n ASN 787 N 1.84 4.23 0.00 0.00 6.94 -0.88 -1.46 115.26 125.93 2dtg n ASN 787 Ca -0.18 -2.49 0.00 0.00 -0.02 0.00 0.00 54.58 51.90 2dtg n ASN 787 Cb 0.54 -0.50 0.00 0.00 -2.36 0.00 0.00 39.78 37.46 2dtg n ASN 787 CO 0.00 0.00 0.00 1.67 -1.03 0.00 0.00 177.26 177.90 2dtg n GLN 788 N 0.64 0.00 0.00 -3.83 7.27 -1.26 -4.73 117.38 115.47 2dtg n GLN 788 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.29 2dtg n GLN 788 Cb 0.80 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.45 2dtg n GLN 788 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 2dtg n ASP 789 N 0.00 1.66 0.00 1.69 2.03 -1.26 -3.19 116.55 117.48 2dtg n ASP 789 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2dtg n ASP 789 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2dtg n ASP 789 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2dtg n THR 790 N -2.49 0.00 -1.04 5.18 -2.24 -1.26 -3.46 114.28 108.97 2dtg n THR 790 Ca 0.00 0.52 -0.31 0.00 -2.27 0.00 0.00 64.05 61.98 2dtg n THR 790 Cb 0.36 -1.26 -0.12 0.00 -2.10 0.00 0.00 70.33 67.22 2dtg n THR 790 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2dtg n PRO 791 N -0.02 0.15 -1.40 -0.78 -0.04 -1.26 -4.64 135.00 127.01 2dtg n PRO 791 Ca 0.00 -1.38 0.17 0.00 -0.04 0.00 0.00 63.50 62.24 2dtg n PRO 791 Cb 0.00 -3.18 -0.08 0.00 -0.04 0.00 0.00 33.50 30.19 2dtg n PRO 791 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2dtg n GLU 792 N 8.03 -3.08 -2.44 0.54 1.02 -1.22 -4.84 120.64 118.65 2dtg n GLU 792 Ca 0.44 2.48 -0.35 0.00 -0.02 0.00 0.00 57.16 59.72 2dtg n GLU 792 Cb 0.44 -3.67 -0.02 0.00 -0.02 0.00 0.00 31.44 28.17 2dtg n GLU 792 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2dtg s GLU 793 N -4.17 3.73 -0.40 3.49 2.02 -1.25 -4.30 118.70 117.81 2dtg s GLU 793 Ca 0.00 1.50 0.06 0.00 0.02 0.00 0.00 54.97 56.54 2dtg s GLU 793 Cb 0.00 -2.17 0.20 0.00 0.10 0.00 0.00 34.13 32.26 2dtg s GLU 793 CO 0.00 -0.51 0.42 -2.13 0.02 0.00 0.00 175.26 173.06 2dtg n ARG 794 N -0.87 0.41 -0.59 1.61 0.63 -1.19 -5.02 116.66 111.63 2dtg n ARG 794 Ca 0.09 -3.16 0.00 0.00 -0.92 0.00 0.00 57.85 53.86 2dtg n ARG 794 Cb 0.51 -1.48 0.00 0.00 0.45 0.00 0.00 32.46 31.94 2dtg n ARG 794 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2dtg s SER 796 N -1.00 3.87 -0.06 0.00 1.04 0.14 -4.55 113.70 113.14 2dtg s SER 796 Ca 0.00 -1.48 -0.29 0.00 0.48 0.00 0.00 55.95 54.66 2dtg s SER 796 Cb 0.00 -0.03 -0.07 0.00 0.10 0.00 0.00 66.02 66.02 2dtg s SER 796 CO 0.00 -0.62 1.94 0.54 0.98 0.00 0.00 173.24 176.09 2dtg s VAL 797 N -2.81 3.17 0.54 5.02 0.11 -1.26 -4.47 120.40 120.69 2dtg s VAL 797 Ca 0.24 0.20 -0.21 0.00 -2.93 0.00 0.00 61.98 59.28 2dtg s VAL 797 Cb 0.07 -3.15 -0.07 0.00 -1.53 0.00 0.00 36.38 31.70 2dtg s VAL 797 CO 0.12 -0.05 1.08 0.00 -3.33 0.00 0.00 175.10 172.92 2dtg n ALA 798 N 8.55 0.55 -3.93 1.54 0.00 -1.26 -4.00 120.51 121.95 2dtg n ALA 798 Ca 0.22 0.10 -0.33 0.00 0.00 0.00 0.00 53.44 53.43 2dtg n ALA 798 Cb 0.43 -2.16 -0.14 0.00 0.00 0.00 0.00 19.45 17.57 2dtg n ALA 798 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dtg s ALA 799 N -1.39 2.73 0.31 0.00 0.00 -1.05 -4.99 121.76 117.36 2dtg s ALA 799 Ca 0.71 -1.95 -0.18 0.00 0.00 0.00 0.00 51.96 50.54 2dtg s ALA 799 Cb -0.46 -1.80 -0.09 0.00 0.00 0.00 0.00 23.12 20.77 2dtg s ALA 799 CO 0.51 -1.34 0.77 0.71 0.00 0.00 0.00 175.76 176.40 2dtg s TYR 800 N 1.11 3.47 0.10 0.00 1.51 -1.24 -4.22 117.35 118.07 2dtg s TYR 800 Ca -0.03 1.35 -0.25 0.00 -1.01 0.00 0.00 57.07 57.13 2dtg s TYR 800 Cb -0.20 -2.62 0.08 0.00 -0.11 0.00 0.00 41.96 39.11 2dtg s TYR 800 CO -0.04 0.15 0.69 0.54 -1.11 0.00 0.00 175.55 175.78 2dtg s VAL 801 N -1.85 0.00 0.40 0.71 0.11 -0.75 -5.04 120.40 113.98 2dtg s VAL 801 Ca 0.51 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.61 2dtg s VAL 801 Cb -0.12 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.70 2dtg s VAL 801 CO 0.18 0.00 0.16 -0.94 -3.33 0.00 0.00 175.10 171.17 2dtg s SER 802 N -2.56 2.61 -0.28 3.54 1.04 -1.26 0.19 113.70 116.98 2dtg s SER 802 Ca 0.01 -1.70 -0.29 0.00 0.48 0.00 0.00 55.95 54.45 2dtg s SER 802 Cb -0.01 0.54 0.19 0.00 0.10 0.00 0.00 66.02 66.84 2dtg s SER 802 CO -0.10 -0.97 1.34 0.00 0.98 0.00 0.00 173.24 174.49 2dtg s ALA 803 N -3.25 -2.12 -0.11 5.32 0.00 -0.66 -4.75 121.76 116.20 2dtg s ALA 803 Ca 0.26 1.84 0.02 0.00 0.00 0.00 0.00 51.96 54.09 2dtg s ALA 803 Cb 0.02 -1.50 -0.01 0.00 0.00 0.00 0.00 23.12 21.64 2dtg s ALA 803 CO 0.17 -0.23 -0.19 0.50 0.00 0.00 0.00 175.76 176.01 2dtg s ARG 804 N -0.88 3.16 0.76 0.00 6.06 -1.26 0.11 118.95 126.91 2dtg s ARG 804 Ca 0.08 -0.80 -0.11 0.00 -2.50 0.00 0.00 55.73 52.40 2dtg s ARG 804 Cb -0.01 -2.43 0.05 0.00 0.06 0.00 0.00 34.95 32.62 2dtg s ARG 804 CO -0.08 0.21 1.09 0.95 -2.50 0.00 0.00 175.30 174.97 2dtg s THR 805 N 0.31 3.36 1.15 4.11 -4.23 -0.10 -4.71 115.64 115.53 2dtg s THR 805 Ca -0.15 0.45 -0.18 0.00 -1.18 0.00 0.00 61.69 60.64 2dtg s THR 805 Cb -0.17 -2.95 0.26 0.00 1.34 0.00 0.00 72.50 70.98 2dtg s THR 805 CO 0.07 -0.57 1.13 -0.04 -0.54 0.00 0.00 174.62 174.67 2dtg s MET 806 N -4.87 -0.78 0.51 3.99 1.00 -1.14 -3.17 119.30 114.84 2dtg s MET 806 Ca 0.61 -0.02 0.03 0.00 0.00 0.00 0.00 55.69 56.31 2dtg s MET 806 Cb -0.17 -1.64 -0.01 0.00 0.00 0.00 0.00 34.83 33.01 2dtg s MET 806 CO 0.55 -3.43 0.13 -1.25 0.00 0.00 0.00 175.02 171.02 2dtg s PRO 807 N -5.39 2.20 0.01 2.03 0.04 -1.26 -0.12 135.00 132.50 2dtg s PRO 807 Ca 0.70 -2.24 -0.02 0.00 0.04 0.00 0.00 61.00 59.49 2dtg s PRO 807 Cb -0.10 -1.73 -0.01 0.00 0.04 0.00 0.00 34.50 32.70 2dtg s PRO 807 CO 0.56 -0.40 0.02 -1.21 0.04 0.00 0.00 177.00 176.01 2dtg s GLU 808 N -3.98 0.25 -0.14 4.56 2.02 -1.26 -4.81 118.70 115.33 2dtg s GLU 808 Ca 0.18 -0.36 -0.40 0.00 0.02 0.00 0.00 54.97 54.41 2dtg s GLU 808 Cb 0.01 0.09 -0.18 0.00 0.10 0.00 0.00 34.13 34.16 2dtg s GLU 808 CO 0.10 -0.04 1.45 0.00 0.02 0.00 0.00 175.26 176.79 2dtg n ALA 809 N 2.07 -1.34 -3.10 5.21 0.00 -1.26 -4.84 120.51 117.25 2dtg n ALA 809 Ca -0.20 0.49 -0.12 0.00 0.00 0.00 0.00 53.44 53.61 2dtg n ALA 809 Cb 0.57 -2.03 -0.11 0.00 0.00 0.00 0.00 19.45 17.87 2dtg n ALA 809 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2dtg s LYS 810 N 1.71 0.31 0.00 0.00 -0.14 -1.26 -5.10 119.74 115.27 2dtg s LYS 810 Ca 0.93 0.11 0.00 0.00 -1.36 0.00 0.00 55.97 55.65 2dtg s LYS 810 Cb -1.14 0.14 0.00 0.00 -1.68 0.00 0.00 37.83 35.15 2dtg s LYS 810 CO 0.60 -0.05 0.00 0.00 -0.76 0.00 0.00 175.35 175.14 2dtg n ALA 811 N 2.56 0.00 -3.33 5.17 0.00 -1.26 -3.18 120.51 120.46 2dtg n ALA 811 Ca -0.15 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.24 2dtg n ALA 811 Cb 0.58 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.01 2dtg n ALA 811 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2dtg n ASP 812 N 0.00 -0.33 -3.22 0.00 10.43 -1.26 -4.59 116.55 117.58 2dtg n ASP 812 Ca 0.00 -1.60 0.03 0.00 2.57 0.00 0.00 54.79 55.80 2dtg n ASP 812 Cb 0.00 0.65 -0.01 0.00 1.84 0.00 0.00 41.12 43.60 2dtg n ASP 812 CO 0.00 0.00 0.00 1.51 -1.07 0.00 0.00 177.20 177.64 2dtg s ASP 813 N -1.66 -1.27 0.41 -2.24 -4.77 -1.26 -5.08 116.67 100.80 2dtg s ASP 813 Ca 0.10 0.92 0.00 0.00 -3.30 0.00 0.00 52.55 50.26 2dtg s ASP 813 Cb 0.00 2.11 0.00 0.00 -1.09 0.00 0.00 42.92 43.94 2dtg s ASP 813 CO 0.07 -0.24 0.00 2.30 0.70 0.00 0.00 175.17 178.00 2dtg n ILE 814 N 5.43 -0.99 0.00 2.11 -5.35 -1.26 -4.55 119.36 114.75 2dtg n ILE 814 Ca -0.03 0.73 0.00 0.00 -0.27 0.00 0.00 62.75 63.18 2dtg n ILE 814 Cb 0.51 -1.14 0.00 0.00 -1.74 0.00 0.00 39.64 37.27 2dtg n ILE 814 CO 0.00 0.00 0.00 0.52 -1.76 0.00 0.00 176.55 175.31 2dtg n VAL 815 N -3.21 0.00 0.00 7.28 0.31 -1.26 -4.33 118.33 117.12 2dtg n VAL 815 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 2dtg n VAL 815 Cb 0.42 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.35 2dtg n VAL 815 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2dtg n GLY 816 N 5.00 -0.31 3.51 2.92 0.00 -1.19 -4.45 105.19 110.67 2dtg n GLY 816 Ca 0.00 0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2dtg n GLY 816 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dtg s PRO 817 N 0.00 3.51 0.25 1.61 0.04 -1.26 -2.85 135.00 136.30 2dtg s PRO 817 Ca 0.00 -1.24 0.16 0.00 0.04 0.00 0.00 61.00 59.96 2dtg s PRO 817 Cb 0.00 -4.99 0.87 0.00 0.04 0.00 0.00 34.50 30.42 2dtg s PRO 817 CO 0.00 -2.02 1.48 1.55 0.04 0.00 0.00 177.00 178.05 2dtg n VAL 818 N 6.27 1.18 -3.80 -0.36 3.14 -0.79 -4.85 118.33 119.13 2dtg n VAL 818 Ca 0.24 0.69 -0.22 0.00 -2.96 0.00 0.00 64.34 62.08 2dtg n VAL 818 Cb 0.50 -1.69 -0.07 0.00 -1.06 0.00 0.00 33.84 31.52 2dtg n VAL 818 CO 0.00 0.00 0.00 1.07 -6.46 0.00 0.00 176.83 171.44 2dtg n THR 819 N -2.07 -0.76 -0.01 1.55 5.66 -1.26 -4.72 114.28 112.67 2dtg n THR 819 Ca -0.01 -0.36 -0.00 0.00 -3.05 0.00 0.00 64.05 60.63 2dtg n THR 819 Cb 0.06 -0.75 0.00 0.00 -1.55 0.00 0.00 70.33 68.09 2dtg n THR 819 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 175.07 173.59 2dtg n HIS 820 N -3.55 -0.05 -3.07 1.09 -0.00 -1.23 -4.84 115.22 103.57 2dtg n HIS 820 Ca -0.23 0.00 -0.38 0.00 0.46 0.00 0.00 57.72 57.58 2dtg n HIS 820 Cb 0.49 -0.02 -0.02 0.00 -0.12 0.00 0.00 29.99 30.32 2dtg n HIS 820 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 2dtg n GLU 821 N 0.03 4.01 -0.81 1.57 -0.58 -1.25 -4.51 120.64 119.09 2dtg n GLU 821 Ca 0.00 -4.62 -0.44 0.00 -0.42 0.00 0.00 57.16 51.69 2dtg n GLU 821 Cb 0.01 -2.43 -0.09 0.00 -0.57 0.00 0.00 31.44 28.36 2dtg n GLU 821 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 2dtg n ILE 822 N 0.96 0.80 -1.90 -3.67 2.08 -0.28 -3.26 119.36 114.09 2dtg n ILE 822 Ca 0.29 -0.70 -0.07 0.00 0.56 0.00 0.00 62.75 62.83 2dtg n ILE 822 Cb 0.35 -2.14 -0.02 0.00 -0.75 0.00 0.00 39.64 37.08 2dtg n ILE 822 CO 0.00 0.00 0.00 0.49 0.56 0.00 0.00 176.55 177.60 2dtg n PHE 823 N 8.59 -1.20 0.00 1.39 3.72 -1.26 -3.87 117.46 124.82 2dtg n PHE 823 Ca 0.48 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.88 2dtg n PHE 823 Cb 0.41 -1.96 0.00 0.00 -0.94 0.00 0.00 39.48 36.99 2dtg n PHE 823 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 2dtg n GLU 824 N -2.14 0.00 0.00 -1.08 4.07 -1.20 -5.12 120.64 115.16 2dtg n GLU 824 Ca -0.08 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.02 2dtg n GLU 824 Cb 0.42 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.80 2dtg n GLU 824 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 2dtg n ASN 825 N 0.00 0.00 0.00 4.31 4.05 -1.25 -3.74 115.26 118.63 2dtg n ASN 825 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 2dtg n ASN 825 Cb 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.01 2dtg n ASN 825 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 2dtg n ASN 826 N 0.00 0.00 -4.26 1.20 5.03 -1.26 -1.12 115.26 114.84 2dtg n ASN 826 Ca 0.00 0.00 -0.34 0.00 0.87 0.00 0.00 54.58 55.11 2dtg n ASN 826 Cb 0.00 0.00 0.12 0.00 -1.02 0.00 0.00 39.78 38.88 2dtg n ASN 826 CO 0.00 0.00 0.00 0.55 -1.83 0.00 0.00 177.26 175.98 2dtg n VAL 827 N 0.00 0.00 -2.82 2.41 3.14 -1.26 -4.15 118.33 115.65 2dtg n VAL 827 Ca 0.00 -0.25 -0.11 0.00 -2.96 0.00 0.00 64.34 61.02 2dtg n VAL 827 Cb 0.00 -0.47 0.05 0.00 -1.06 0.00 0.00 33.84 32.36 2dtg n VAL 827 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 2dtg n VAL 828 N -3.75 0.23 -1.45 1.55 0.31 -0.85 -3.48 118.33 110.88 2dtg n VAL 828 Ca 0.02 -2.71 -0.62 0.00 -0.01 0.00 0.00 64.34 61.03 2dtg n VAL 828 Cb 0.60 0.70 -0.11 0.00 -0.91 0.00 0.00 33.84 34.12 2dtg n VAL 828 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 2dtg n HIS 829 N -0.01 1.43 -2.48 3.52 -0.00 -1.26 -4.09 115.22 112.33 2dtg n HIS 829 Ca 0.09 0.84 -0.24 0.00 -0.00 0.00 0.00 57.72 58.42 2dtg n HIS 829 Cb 0.76 -2.30 0.09 0.00 -0.00 0.00 0.00 29.99 28.54 2dtg n HIS 829 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2dtg s LEU 830 N 5.02 3.01 -0.11 0.27 1.02 0.65 -1.88 118.68 126.67 2dtg s LEU 830 Ca 1.13 -0.06 -0.29 0.00 0.02 0.00 0.00 54.13 54.94 2dtg s LEU 830 Cb -1.43 -2.47 0.07 0.00 0.02 0.00 0.00 46.19 42.37 2dtg s LEU 830 CO 0.70 -1.67 0.67 -0.04 0.02 0.00 0.00 176.35 176.03 2dtg s MET 831 N -5.11 0.98 0.16 1.70 -1.94 -1.13 -3.68 119.30 110.27 2dtg s MET 831 Ca 0.63 0.44 -0.24 0.00 -1.71 0.00 0.00 55.69 54.81 2dtg s MET 831 Cb -0.08 0.47 0.07 0.00 2.01 0.00 0.00 34.83 37.30 2dtg s MET 831 CO 0.43 -0.26 0.99 1.67 -0.01 0.00 0.00 175.02 177.84 2dtg s TRP 832 N -0.77 -0.08 -0.34 -0.03 -2.14 -1.26 -3.17 118.94 111.16 2dtg s TRP 832 Ca -0.08 -0.25 -0.28 0.00 2.66 0.00 0.00 56.10 58.15 2dtg s TRP 832 Cb -0.01 0.65 0.02 0.00 -3.10 0.00 0.00 33.47 31.03 2dtg s TRP 832 CO 0.07 -0.84 1.04 -0.65 -2.66 0.00 0.00 176.95 173.91 2dtg s GLN 833 N -2.99 4.00 -0.49 3.25 -0.21 -1.26 -4.97 119.66 117.00 2dtg s GLN 833 Ca 0.14 0.94 -0.26 0.00 0.02 0.00 0.00 55.36 56.20 2dtg s GLN 833 Cb -0.01 -3.76 -0.07 0.00 1.00 0.00 0.00 33.01 30.17 2dtg s GLN 833 CO 0.03 -0.93 2.42 -1.91 -2.12 0.00 0.00 175.29 172.78 2dtg n GLU 834 N 6.89 1.05 0.02 2.91 0.00 -1.26 -4.73 120.64 125.52 2dtg n GLU 834 Ca 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.27 2dtg n GLU 834 Cb 0.47 -3.46 0.00 0.00 0.00 0.00 0.00 31.44 28.46 2dtg n GLU 834 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.13 174.83 2dtg n PRO 835 N 9.01 0.00 0.00 5.31 -0.02 -1.26 -4.73 135.00 143.31 2dtg n PRO 835 Ca 0.37 0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 2dtg n PRO 835 Cb 0.55 -1.01 0.00 0.00 -0.02 0.00 0.00 33.50 33.02 2dtg n PRO 835 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2dtg n LYS 836 N -0.59 0.00 0.00 -0.52 4.76 -1.26 -4.53 118.16 116.02 2dtg n LYS 836 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2dtg n LYS 836 Cb 0.27 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.46 2dtg n LYS 836 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 2dtg n GLU 837 N 0.00 0.00 -4.08 1.97 -0.00 -1.26 -5.13 120.64 112.14 2dtg n GLU 837 Ca 0.00 0.00 -0.27 0.00 -0.00 0.00 0.00 57.16 56.89 2dtg n GLU 837 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 31.44 31.38 2dtg n GLU 837 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.13 175.88 2dtg s PRO 838 N 0.00 2.90 -1.42 3.44 0.04 -1.26 -4.67 135.00 134.02 2dtg s PRO 838 Ca 0.00 -0.84 -0.00 0.00 0.04 0.00 0.00 61.00 60.19 2dtg s PRO 838 Cb 0.00 -2.66 0.00 0.00 0.04 0.00 0.00 34.50 31.88 2dtg s PRO 838 CO 0.00 0.50 0.01 0.09 0.04 0.00 0.00 177.00 177.63 2dtg n ASN 839 N -0.24 0.82 0.00 6.66 5.03 -1.26 -3.07 115.26 123.20 2dtg n ASN 839 Ca -0.08 -1.18 0.00 0.00 0.87 0.00 0.00 54.58 54.19 2dtg n ASN 839 Cb 0.54 -1.47 0.00 0.00 -1.02 0.00 0.00 39.78 37.84 2dtg n ASN 839 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2dtg n GLY 840 N -2.46 0.82 3.18 7.41 0.00 -1.25 -3.60 105.19 109.29 2dtg n GLY 840 Ca -0.30 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.59 2dtg n GLY 840 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dtg s LEU 841 N 0.00 0.23 -0.22 0.99 2.96 -1.18 -4.99 118.68 116.48 2dtg s LEU 841 Ca 0.00 0.72 -0.15 0.00 -0.22 0.00 0.00 54.13 54.48 2dtg s LEU 841 Cb 0.00 1.09 -0.04 0.00 0.50 0.00 0.00 46.19 47.74 2dtg s LEU 841 CO 0.00 -0.17 0.37 -0.51 -1.32 0.00 0.00 176.35 174.72 2dtg s ILE 842 N 1.14 5.21 -0.22 6.68 -1.16 -1.26 0.42 121.20 132.00 2dtg s ILE 842 Ca -0.08 0.64 0.11 0.00 -0.51 0.00 0.00 60.65 60.81 2dtg s ILE 842 Cb -0.08 -3.70 -0.22 0.00 0.61 0.00 0.00 42.46 39.07 2dtg s ILE 842 CO -0.09 0.24 -0.05 0.55 -2.81 0.00 0.00 174.94 172.78 2dtg n VAL 843 N 4.50 1.41 -3.51 4.00 3.14 -0.92 -4.26 118.33 122.69 2dtg n VAL 843 Ca -0.09 -0.73 -0.16 0.00 -2.96 0.00 0.00 64.34 60.40 2dtg n VAL 843 Cb 0.51 -0.84 -0.05 0.00 -1.06 0.00 0.00 33.84 32.40 2dtg n VAL 843 CO 0.00 0.00 0.00 -1.48 -6.46 0.00 0.00 176.83 168.89 2dtg s LEU 844 N -5.88 -0.59 0.16 6.55 -0.00 -1.13 -3.98 118.68 113.80 2dtg s LEU 844 Ca -0.20 0.53 0.10 0.00 -0.00 0.00 0.00 54.13 54.56 2dtg s LEU 844 Cb 0.07 2.43 -0.04 0.00 -0.00 0.00 0.00 46.19 48.65 2dtg s LEU 844 CO 0.73 -0.63 -0.17 -0.31 -0.00 0.00 0.00 176.35 175.97 2dtg s TYR 845 N -1.68 2.50 -0.46 3.48 2.02 -1.26 0.92 117.35 122.87 2dtg s TYR 845 Ca -0.07 -0.28 0.01 0.00 -0.37 0.00 0.00 57.07 56.36 2dtg s TYR 845 Cb -0.00 -1.27 0.12 0.00 -0.40 0.00 0.00 41.96 40.41 2dtg s TYR 845 CO 0.04 0.46 0.23 -1.21 -1.57 0.00 0.00 175.55 173.49 2dtg s GLU 846 N -2.50 1.98 0.11 -0.62 8.01 0.32 -3.50 118.70 122.49 2dtg s GLU 846 Ca 0.21 -2.17 -0.31 0.00 0.01 0.00 0.00 54.97 52.71 2dtg s GLU 846 Cb -0.09 -3.46 -0.08 0.00 -4.31 0.00 0.00 34.13 26.19 2dtg s GLU 846 CO 0.12 -1.07 1.47 0.08 0.01 0.00 0.00 175.26 175.87 2dtg s VAL 847 N 0.50 3.12 0.00 2.63 1.01 -1.26 -3.37 120.40 123.04 2dtg s VAL 847 Ca 0.13 0.77 0.00 0.00 0.00 0.00 0.00 61.98 62.87 2dtg s VAL 847 Cb -0.22 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.67 2dtg s VAL 847 CO -0.04 0.05 0.00 -0.24 0.00 0.00 0.00 175.10 174.87 2dtg n SER 848 N 4.27 0.00 -0.08 3.32 2.88 -1.15 -4.01 113.62 118.85 2dtg n SER 848 Ca 0.13 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.67 2dtg n SER 848 Cb 0.41 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.87 2dtg n SER 848 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dtg n TYR 849 N 0.00 -0.22 0.00 0.66 -0.00 -1.19 -4.25 117.16 112.16 2dtg n TYR 849 Ca 0.00 0.12 0.00 0.00 -0.00 0.00 0.00 57.90 58.02 2dtg n TYR 849 Cb 0.00 -0.47 0.00 0.00 -0.00 0.00 0.00 39.34 38.87 2dtg n TYR 849 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 176.86 179.75 2dtg n ARG 850 N -1.79 -3.13 0.08 -3.48 1.85 -1.24 -2.80 116.66 106.14 2dtg n ARG 850 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 2dtg n ARG 850 Cb 0.03 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.44 2dtg n ARG 850 CO 0.00 0.00 0.00 -2.13 -0.01 0.00 0.00 177.63 175.49 2dtg n ARG 851 N -0.29 0.00 -3.91 2.89 0.00 -1.26 -2.20 116.66 111.90 2dtg n ARG 851 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 57.85 57.56 2dtg n ARG 851 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 32.46 32.33 2dtg n ARG 851 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.63 179.15 2dtg s TYR 852 N -1.58 3.42 0.00 -0.14 -0.85 -1.26 -5.01 117.35 111.93 2dtg s TYR 852 Ca 0.00 -3.25 0.00 0.00 -0.52 0.00 0.00 57.07 53.30 2dtg s TYR 852 Cb 0.00 -2.79 0.00 0.00 0.38 0.00 0.00 41.96 39.55 2dtg s TYR 852 CO 0.00 -0.64 0.00 0.41 -1.52 0.00 0.00 175.55 173.80 2dtg n GLY 853 N 2.49 -2.74 2.76 5.49 0.00 -1.26 -5.02 105.19 106.90 2dtg n GLY 853 Ca 0.13 -2.18 -0.24 0.00 0.00 0.00 0.00 46.02 43.73 2dtg n GLY 853 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2dtg s ASP 854 N -0.17 1.96 -0.26 1.61 3.84 -1.26 -4.66 116.67 117.73 2dtg s ASP 854 Ca 0.00 -0.29 -0.07 0.00 -0.00 0.00 0.00 52.55 52.18 2dtg s ASP 854 Cb 0.00 -0.48 -0.02 0.00 -1.38 0.00 0.00 42.92 41.04 2dtg s ASP 854 CO 0.00 -0.23 0.07 -1.61 -0.00 0.00 0.00 175.17 173.41 2dtg s GLU 855 N 1.94 3.53 0.00 2.11 8.01 -1.12 -5.04 118.70 128.13 2dtg s GLU 855 Ca 0.03 -0.56 0.00 0.00 0.01 0.00 0.00 54.97 54.45 2dtg s GLU 855 Cb -0.14 -3.34 0.00 0.00 -4.31 0.00 0.00 34.13 26.35 2dtg s GLU 855 CO -0.06 -0.25 0.00 0.39 0.01 0.00 0.00 175.26 175.35 2dtg n GLU 856 N 4.91 0.00 -1.69 1.61 -0.58 -1.26 -4.10 120.64 119.53 2dtg n GLU 856 Ca -0.16 0.00 -0.00 0.00 -0.42 0.00 0.00 57.16 56.58 2dtg n GLU 856 Cb 0.51 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.38 2dtg n GLU 856 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2dtg n LEU 857 N 0.00 -2.63 0.00 -4.62 4.32 -1.26 -4.28 117.00 108.53 2dtg n LEU 857 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 2dtg n LEU 857 Cb 0.00 -1.30 0.00 0.00 -1.62 0.00 0.00 43.42 40.50 2dtg n LEU 857 CO 0.00 -0.17 0.00 0.00 -1.22 0.00 0.00 177.39 176.00 2dtg n HIS 858 N -0.99 0.00 -4.16 -1.77 1.44 -1.26 -4.18 115.22 104.30 2dtg n HIS 858 Ca 0.00 0.00 -0.11 0.00 -2.01 0.00 0.00 57.72 55.60 2dtg n HIS 858 Cb 0.43 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.44 2dtg n HIS 858 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2dtg s LEU 859 N 0.00 1.09 0.00 2.39 1.43 -1.23 -4.95 118.68 117.41 2dtg s LEU 859 Ca 0.00 -1.29 0.00 0.00 -1.03 0.00 0.00 54.13 51.81 2dtg s LEU 859 Cb 0.00 0.59 0.00 0.00 0.03 0.00 0.00 46.19 46.81 2dtg s LEU 859 CO 0.00 -0.87 0.00 0.00 0.23 0.00 0.00 176.35 175.71 2dtg n ASP 861 N 0.00 0.00 -4.05 0.00 5.68 -1.26 -4.90 116.55 112.02 2dtg n ASP 861 Ca 0.00 0.00 -0.10 0.00 -0.50 0.00 0.00 54.79 54.19 2dtg n ASP 861 Cb 0.00 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 39.90 2dtg n ASP 861 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 2dtg s THR 862 N 0.00 0.06 0.00 2.12 -4.23 -1.26 -4.31 115.64 108.02 2dtg s THR 862 Ca 0.00 -1.62 0.00 0.00 -1.18 0.00 0.00 61.69 58.89 2dtg s THR 862 Cb 0.00 -2.01 0.00 0.00 1.34 0.00 0.00 72.50 71.83 2dtg s THR 862 CO 0.00 -0.29 0.00 -1.14 -0.54 0.00 0.00 174.62 172.65 2dtg n ARG 863 N -0.20 0.00 -0.68 3.99 3.00 -1.26 -4.95 116.66 116.56 2dtg n ARG 863 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.80 2dtg n ARG 863 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.09 2dtg n ARG 863 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 2dtg n LYS 864 N 0.00 0.00 0.00 -0.14 4.81 -1.26 -4.47 118.16 117.10 2dtg n LYS 864 Ca 0.00 0.23 0.00 0.00 -0.87 0.00 0.00 58.31 57.67 2dtg n LYS 864 Cb 0.00 -0.45 0.00 0.00 0.02 0.00 0.00 35.03 34.60 2dtg n LYS 864 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 2dtg n HIS 865 N 0.29 0.00 -0.78 5.64 8.25 -1.26 -4.93 115.22 122.43 2dtg n HIS 865 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2dtg n HIS 865 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2dtg n HIS 865 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2dtg n PHE 866 N 0.00 -0.26 -1.84 4.41 -0.00 -1.26 -4.53 117.46 113.99 2dtg n PHE 866 Ca 0.00 0.16 -0.33 0.00 -0.00 0.00 0.00 57.45 57.28 2dtg n PHE 866 Cb 0.00 -2.09 -0.04 0.00 -0.00 0.00 0.00 39.48 37.35 2dtg n PHE 866 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2dtg s ALA 867 N -0.03 1.75 -0.39 3.13 0.00 -1.26 -4.73 121.76 120.24 2dtg s ALA 867 Ca 0.00 -0.60 0.04 0.00 0.00 0.00 0.00 51.96 51.40 2dtg s ALA 867 Cb 0.00 -4.39 0.13 0.00 0.00 0.00 0.00 23.12 18.86 2dtg s ALA 867 CO 0.00 -4.45 1.10 1.47 0.00 0.00 0.00 175.76 173.88 2dtg n LEU 868 N 14.60 2.37 -4.60 0.00 -0.00 -1.26 -5.06 117.00 123.04 2dtg n LEU 868 Ca 0.31 -1.98 -0.60 0.00 -0.00 0.00 0.00 56.01 53.74 2dtg n LEU 868 Cb 0.51 -0.09 -0.08 0.00 -0.00 0.00 0.00 43.42 43.76 2dtg n LEU 868 CO 0.67 0.59 0.86 -1.84 -0.00 0.00 0.00 177.39 177.68 2dtg n GLU 869 N -0.07 0.32 0.00 1.47 0.00 -1.26 0.25 120.64 121.34 2dtg n GLU 869 Ca 0.05 0.12 0.00 0.00 0.00 0.00 0.00 57.16 57.32 2dtg n GLU 869 Cb 0.32 -1.66 0.00 0.00 0.00 0.00 0.00 31.44 30.10 2dtg n GLU 869 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 2dtg n ARG 870 N 2.74 0.00 0.00 3.44 0.63 -1.26 -4.92 116.66 117.29 2dtg n ARG 870 Ca 0.23 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.16 2dtg n ARG 870 Cb 0.07 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.98 2dtg n ARG 870 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2dtg n GLY 871 N 0.00 1.12 3.78 5.14 0.00 0.14 -4.85 105.19 110.52 2dtg n GLY 871 Ca 0.00 -2.20 -0.33 0.00 0.00 0.00 0.00 46.02 43.49 2dtg n GLY 871 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dtg s ARG 873 N -4.12 0.28 -0.35 0.00 3.52 -1.26 0.24 118.95 117.26 2dtg s ARG 873 Ca 0.66 0.51 -0.06 0.00 -0.13 0.00 0.00 55.73 56.70 2dtg s ARG 873 Cb -0.19 -0.57 0.05 0.00 -1.56 0.00 0.00 34.95 32.68 2dtg s ARG 873 CO 0.40 -0.57 0.11 -0.48 -0.81 0.00 0.00 175.30 173.95 2dtg s LEU 874 N 2.48 4.40 0.59 -0.88 2.34 -1.26 -4.92 118.68 121.43 2dtg s LEU 874 Ca 0.09 -1.25 -0.01 0.00 0.06 0.00 0.00 54.13 53.01 2dtg s LEU 874 Cb -0.15 -1.86 0.04 0.00 -0.56 0.00 0.00 46.19 43.67 2dtg s LEU 874 CO -0.14 -0.35 0.84 0.00 -1.06 0.00 0.00 176.35 175.65 2dtg s ARG 875 N 1.37 2.46 -0.39 1.48 3.03 -1.26 -2.01 118.95 123.63 2dtg s ARG 875 Ca -0.01 -0.61 0.00 0.00 2.03 0.00 0.00 55.73 57.14 2dtg s ARG 875 Cb -0.20 -2.39 0.00 0.00 -1.03 0.00 0.00 34.95 31.33 2dtg s ARG 875 CO 0.02 -0.86 0.00 0.41 -1.13 0.00 0.00 175.30 173.74 2dtg n GLY 876 N -2.51 0.35 3.67 3.88 0.00 -1.26 -4.84 105.19 104.48 2dtg n GLY 876 Ca 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.66 2dtg n GLY 876 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2dtg n LEU 877 N -0.68 3.17 -4.75 0.99 -0.00 -1.26 -4.91 117.00 109.56 2dtg n LEU 877 Ca -0.04 1.18 -0.40 0.00 -0.00 0.00 0.00 56.01 56.75 2dtg n LEU 877 Cb 0.23 -1.44 -0.06 0.00 -0.00 0.00 0.00 43.42 42.16 2dtg n LEU 877 CO 0.06 -0.58 0.68 -0.44 -0.00 0.00 0.00 177.39 177.10 2dtg s SER 878 N -0.08 7.57 0.22 1.96 0.01 -1.26 -4.73 113.70 117.40 2dtg s SER 878 Ca 0.61 2.00 -0.25 0.00 1.31 0.00 0.00 55.95 59.63 2dtg s SER 878 Cb -0.62 -2.61 -0.16 0.00 0.21 0.00 0.00 66.02 62.84 2dtg s SER 878 CO 0.57 0.09 0.41 -2.65 0.41 0.00 0.00 173.24 172.06 2dtg n PRO 879 N 1.51 0.00 -0.24 12.44 -0.02 -1.26 -4.91 135.00 142.52 2dtg n PRO 879 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 2dtg n PRO 879 Cb 0.47 -0.93 0.00 0.00 -0.02 0.00 0.00 33.50 33.02 2dtg n PRO 879 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dtg n GLY 880 N 1.92 0.89 3.04 -1.23 0.00 -1.25 -4.98 105.19 103.58 2dtg n GLY 880 Ca 0.16 -1.84 -0.30 0.00 0.00 0.00 0.00 46.02 44.04 2dtg n GLY 880 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2dtg s ASN 881 N -4.00 2.69 0.26 1.61 3.84 -1.26 0.39 114.94 118.47 2dtg s ASN 881 Ca 0.00 -0.49 0.10 0.00 0.21 0.00 0.00 52.86 52.68 2dtg s ASN 881 Cb 0.00 -1.20 -0.04 0.00 -0.55 0.00 0.00 41.25 39.46 2dtg s ASN 881 CO 0.00 -0.03 -0.05 -0.31 -2.79 0.00 0.00 177.10 173.92 2dtg s TYR 882 N 1.34 2.60 -0.57 0.43 4.12 1.34 -4.60 117.35 122.01 2dtg s TYR 882 Ca 0.02 -0.24 0.01 0.00 0.02 0.00 0.00 57.07 56.88 2dtg s TYR 882 Cb -0.13 -1.16 0.15 0.00 -1.52 0.00 0.00 41.96 39.30 2dtg s TYR 882 CO -0.09 0.63 0.35 -1.12 0.02 0.00 0.00 175.55 175.34 2dtg s SER 883 N -3.58 4.69 0.72 2.29 0.01 -0.93 0.22 113.70 117.12 2dtg s SER 883 Ca 0.31 -3.02 -0.11 0.00 1.31 0.00 0.00 55.95 54.44 2dtg s SER 883 Cb -0.06 -1.72 0.02 0.00 0.21 0.00 0.00 66.02 64.47 2dtg s SER 883 CO 0.19 -0.27 1.07 0.68 0.41 0.00 0.00 173.24 175.32 2dtg s VAL 884 N -0.30 3.78 -0.32 3.43 -7.23 -0.89 -3.20 120.40 115.68 2dtg s VAL 884 Ca 0.18 0.58 0.03 0.00 -1.81 0.00 0.00 61.98 60.95 2dtg s VAL 884 Cb -0.23 -3.23 0.19 0.00 0.56 0.00 0.00 36.38 33.68 2dtg s VAL 884 CO -0.02 -0.75 0.70 0.00 -0.31 0.00 0.00 175.10 174.72 2dtg s ARG 885 N -4.98 0.52 0.44 4.82 3.03 -1.26 -3.48 118.95 118.03 2dtg s ARG 885 Ca 0.59 0.28 -0.20 0.00 2.03 0.00 0.00 55.73 58.42 2dtg s ARG 885 Cb -0.15 0.17 -0.11 0.00 -1.03 0.00 0.00 34.95 33.84 2dtg s ARG 885 CO 0.55 -0.91 0.95 0.42 -1.13 0.00 0.00 175.30 175.18 2dtg s ILE 886 N 2.59 4.42 -0.21 4.99 1.01 -1.26 -2.95 121.20 129.79 2dtg s ILE 886 Ca 0.14 1.44 -0.07 0.00 0.00 0.00 0.00 60.65 62.16 2dtg s ILE 886 Cb -0.07 -3.62 0.09 0.00 0.01 0.00 0.00 42.46 38.88 2dtg s ILE 886 CO -0.21 -0.36 0.45 0.00 0.00 0.00 0.00 174.94 174.82 2dtg s ARG 887 N -3.29 0.36 0.52 2.79 1.04 -1.22 -3.81 118.95 115.35 2dtg s ARG 887 Ca 0.61 1.08 -0.11 0.00 -1.04 0.00 0.00 55.73 56.28 2dtg s ARG 887 Cb -0.09 0.39 -0.05 0.00 -2.04 0.00 0.00 34.95 33.15 2dtg s ARG 887 CO 0.15 -0.24 0.91 0.00 -0.04 0.00 0.00 175.30 176.09 2dtg s ALA 888 N 2.59 3.21 -0.28 7.88 0.00 -1.26 -0.53 121.76 133.37 2dtg s ALA 888 Ca -0.03 -0.13 -0.01 0.00 0.00 0.00 0.00 51.96 51.79 2dtg s ALA 888 Cb -0.12 -2.91 0.09 0.00 0.00 0.00 0.00 23.12 20.19 2dtg s ALA 888 CO -0.14 -0.36 0.08 0.99 0.00 0.00 0.00 175.76 176.33 2dtg s THR 889 N -2.77 0.88 0.69 0.00 2.01 0.26 -4.08 115.64 112.63 2dtg s THR 889 Ca 0.54 -1.25 0.03 0.00 0.31 0.00 0.00 61.69 61.31 2dtg s THR 889 Cb -0.10 -1.58 0.12 0.00 0.01 0.00 0.00 72.50 70.95 2dtg s THR 889 CO 0.41 -0.55 0.95 -0.94 -0.69 0.00 0.00 174.62 173.80 2dtg s SER 890 N 1.63 4.51 -0.87 3.53 1.04 -0.34 -2.16 113.70 121.04 2dtg s SER 890 Ca 0.07 -0.60 -0.25 0.00 0.48 0.00 0.00 55.95 55.65 2dtg s SER 890 Cb -0.17 0.22 -0.20 0.00 0.10 0.00 0.00 66.02 65.97 2dtg s SER 890 CO -0.21 -1.76 2.51 -0.11 0.98 0.00 0.00 173.24 174.65 2dtg n LEU 891 N -2.67 0.50 -2.26 2.42 -0.00 1.42 -1.89 117.00 114.52 2dtg n LEU 891 Ca 0.16 -0.26 -0.00 0.00 -0.00 0.00 0.00 56.01 55.91 2dtg n LEU 891 Cb 0.61 -1.05 0.00 0.00 -0.00 0.00 0.00 43.42 42.98 2dtg n LEU 891 CO 0.41 -1.22 0.16 0.00 -0.00 0.00 0.00 177.39 176.75 2dtg n ALA 892 N 11.40 -2.03 0.00 1.96 0.00 -1.26 -4.82 120.51 125.76 2dtg n ALA 892 Ca 0.59 0.02 0.00 0.00 0.00 0.00 0.00 53.44 54.05 2dtg n ALA 892 Cb 0.20 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 18.87 2dtg n ALA 892 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dtg n GLY 893 N -1.34 3.86 0.08 0.00 0.00 -0.79 -5.01 105.19 102.00 2dtg n GLY 893 Ca 0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 46.02 45.79 2dtg n GLY 893 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2dtg n ASN 894 N 0.00 0.56 0.00 1.61 3.02 -1.26 -1.20 115.26 117.99 2dtg n ASN 894 Ca 0.00 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.80 2dtg n ASN 894 Cb 0.00 0.50 0.00 0.00 -0.61 0.00 0.00 39.78 39.67 2dtg n ASN 894 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dtg n GLY 895 N 1.51 0.19 0.88 7.41 0.00 -1.26 -4.25 105.19 109.67 2dtg n GLY 895 Ca -0.17 -0.92 -0.05 0.00 0.00 0.00 0.00 46.02 44.88 2dtg n GLY 895 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dtg n SER 896 N -0.21 1.00 0.00 1.61 7.64 -1.19 -5.01 113.62 117.46 2dtg n SER 896 Ca 0.00 -1.40 0.00 0.00 1.01 0.00 0.00 58.87 58.48 2dtg n SER 896 Cb 0.00 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.15 2dtg n SER 896 CO 0.00 0.00 0.00 1.87 -3.01 0.00 0.00 175.04 173.90 2dtg n TRP 897 N -1.01 0.00 -3.64 1.43 -0.00 -1.26 -4.38 117.44 108.58 2dtg n TRP 897 Ca 0.01 0.00 -0.04 0.00 -0.00 0.00 0.00 57.50 57.48 2dtg n TRP 897 Cb 0.14 0.00 0.02 0.00 -0.00 0.00 0.00 31.31 31.47 2dtg n TRP 897 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 177.69 180.10 2dtg n THR 898 N 0.00 0.00 -1.46 5.87 -1.04 -1.25 -4.66 114.28 111.74 2dtg n THR 898 Ca 0.00 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.51 2dtg n THR 898 Cb 0.00 0.58 0.00 0.00 -1.82 0.00 0.00 70.33 69.09 2dtg n THR 898 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2dtg n GLU 899 N -0.42 0.00 -1.69 -2.82 4.71 -1.26 -4.82 120.64 114.34 2dtg n GLU 899 Ca -0.03 -0.10 -0.39 0.00 -0.01 0.00 0.00 57.16 56.62 2dtg n GLU 899 Cb 0.39 -0.27 0.04 0.00 -1.01 0.00 0.00 31.44 30.59 2dtg n GLU 899 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 2dtg n PRO 900 N 0.00 1.48 -3.74 3.49 -0.04 -1.23 -4.87 135.00 130.09 2dtg n PRO 900 Ca 0.00 0.54 -0.22 0.00 -0.04 0.00 0.00 63.50 63.78 2dtg n PRO 900 Cb 0.35 -2.37 -0.04 0.00 -0.04 0.00 0.00 33.50 31.39 2dtg n PRO 900 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2dtg s THR 901 N -1.33 2.65 -0.10 0.52 2.01 -1.26 -2.10 115.64 116.03 2dtg s THR 901 Ca 0.70 -1.45 -0.32 0.00 0.31 0.00 0.00 61.69 60.93 2dtg s THR 901 Cb -0.45 -3.01 0.12 0.00 0.01 0.00 0.00 72.50 69.17 2dtg s THR 901 CO 0.51 -0.02 1.05 -0.72 -0.69 0.00 0.00 174.62 174.75 2dtg s TYR 902 N -2.49 -0.24 0.16 4.92 -0.85 0.59 -4.87 117.35 114.58 2dtg s TYR 902 Ca 0.45 0.16 0.06 0.00 -0.52 0.00 0.00 57.07 57.22 2dtg s TYR 902 Cb -0.02 0.52 -0.04 0.00 0.38 0.00 0.00 41.96 42.80 2dtg s TYR 902 CO 0.26 -0.37 -0.13 0.12 -1.52 0.00 0.00 175.55 173.91 2dtg s PHE 903 N -2.70 1.47 -0.25 -3.49 5.36 -1.26 0.41 117.98 117.52 2dtg s PHE 903 Ca 0.07 -0.63 -0.04 0.00 -0.96 0.00 0.00 56.93 55.37 2dtg s PHE 903 Cb -0.01 -0.73 0.00 0.00 -0.34 0.00 0.00 43.02 41.94 2dtg s PHE 903 CO -0.07 0.20 -0.01 0.71 -1.46 0.00 0.00 175.22 174.60 2dtg s TYR 904 N -2.83 3.04 -0.79 10.12 2.02 1.25 -4.91 117.35 125.24 2dtg s TYR 904 Ca 0.16 -1.06 -0.26 0.00 -0.37 0.00 0.00 57.07 55.54 2dtg s TYR 904 Cb -0.01 -2.14 -0.26 0.00 -0.40 0.00 0.00 41.96 39.15 2dtg s TYR 904 CO 0.04 -0.59 1.94 1.33 -1.57 0.00 0.00 175.55 176.70 2dtg n VAL 905 N 4.79 0.00 0.00 0.71 0.24 -1.26 -3.86 118.33 118.95 2dtg n VAL 905 Ca -0.17 -0.03 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 2dtg n VAL 905 Cb 0.49 -1.89 0.00 0.00 -1.47 0.00 0.00 33.84 30.97 2dtg n VAL 905 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 2dtg n THR 906 N 8.40 0.00 -3.37 3.34 5.66 -1.26 -4.51 114.28 122.55 2dtg n THR 906 Ca 0.40 0.00 -0.17 0.00 -3.05 0.00 0.00 64.05 61.23 2dtg n THR 906 Cb 0.46 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.16 2dtg n THR 906 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2dtg s ASP 907 N -2.01 1.28 1.20 1.09 1.11 -1.26 -5.01 116.67 113.08 2dtg s ASP 907 Ca 0.00 -1.50 -0.19 0.00 0.18 0.00 0.00 52.55 51.04 2dtg s ASP 907 Cb 0.00 0.53 0.29 0.00 1.07 0.00 0.00 42.92 44.80 2dtg s ASP 907 CO 0.00 -0.28 1.10 -0.72 1.18 0.00 0.00 175.17 176.46 2dtg s TYR 908 N 1.53 0.51 -0.63 4.23 -0.85 -1.26 -5.25 117.35 115.63 2dtg s TYR 908 Ca 0.16 0.52 0.05 0.00 -0.52 0.00 0.00 57.07 57.28 2dtg s TYR 908 Cb -0.15 -3.42 0.04 0.00 0.38 0.00 0.00 41.96 38.80 2dtg s TYR 908 CO -0.07 -3.89 0.66 -0.11 -1.52 0.00 0.00 175.55 170.62