#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mhg s LEU 4 N 0.00 4.30 1.07 -4.42 1.43 -1.26 -5.02 118.68 114.78 3mhg s LEU 4 Ca 0.00 2.69 -0.12 0.00 -1.03 0.00 0.00 54.13 55.67 3mhg s LEU 4 Cb 0.00 -3.79 0.23 0.00 0.03 0.00 0.00 46.19 42.66 3mhg s LEU 4 CO 0.00 -0.73 1.07 0.42 0.23 0.00 0.00 176.35 177.34 3mhg s THR 5 N -1.21 2.12 0.17 5.49 -4.23 -1.26 -4.77 115.64 111.95 3mhg s THR 5 Ca 0.54 0.04 -0.14 0.00 -1.18 0.00 0.00 61.69 60.94 3mhg s THR 5 Cb -0.39 -2.17 0.06 0.00 1.34 0.00 0.00 72.50 71.33 3mhg s THR 5 CO 0.51 -0.05 1.79 -0.08 -0.54 0.00 0.00 174.62 176.25 3mhg h GLU 6 N -2.29 0.47 -0.24 3.99 4.81 -1.99 -1.30 114.58 118.03 3mhg h GLU 6 Ca -0.56 -0.03 -0.14 0.00 -0.13 0.00 0.00 59.36 58.50 3mhg h GLU 6 Cb 1.31 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.58 3mhg h GLU 6 CO 0.50 0.31 -0.43 -0.91 -0.73 0.00 0.00 179.01 177.74 3mhg h ASN 7 N 0.48 0.63 -0.31 1.04 2.35 -1.92 -1.98 115.58 115.88 3mhg h ASN 7 Ca 0.20 -0.29 -0.13 0.00 -0.55 0.00 0.00 56.30 55.52 3mhg h ASN 7 Cb 0.09 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 3mhg h ASN 7 CO -0.13 0.98 -0.29 0.11 -1.65 0.00 0.00 177.43 176.46 3mhg h LYS 8 N 0.48 0.83 -0.49 0.81 1.57 -1.70 -1.87 116.57 116.20 3mhg h LYS 8 Ca 0.03 -0.38 -0.02 0.00 -1.87 0.00 0.00 60.65 58.42 3mhg h LYS 8 Cb 0.95 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.22 3mhg h LYS 8 CO 0.09 1.01 0.21 -0.09 -0.57 0.00 0.00 179.45 180.10 3mhg h ARG 9 N 0.70 0.72 -0.86 3.15 2.43 -1.10 0.40 114.38 119.82 3mhg h ARG 9 Ca 0.08 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.12 3mhg h ARG 9 Cb 0.83 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 30.22 3mhg h ARG 9 CO 0.07 0.62 0.49 -0.22 -1.51 0.00 0.00 179.97 179.42 3mhg h LYS 10 N 0.64 1.19 -0.48 0.20 1.63 -1.25 0.44 116.57 118.94 3mhg h LYS 10 Ca 0.16 -0.13 -0.08 0.00 -0.85 0.00 0.00 60.65 59.76 3mhg h LYS 10 Cb 0.16 -0.24 -0.02 0.00 -0.60 0.00 0.00 32.23 31.54 3mhg h LYS 10 CO -0.02 0.86 -0.02 0.77 -3.45 0.00 0.00 179.45 177.59 3mhg h SER 11 N 1.19 0.85 -0.98 4.20 0.02 -1.02 -2.11 113.55 115.71 3mhg h SER 11 Ca 0.30 -0.32 0.01 0.00 -0.84 0.00 0.00 61.79 60.94 3mhg h SER 11 Cb 0.00 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.26 3mhg h SER 11 CO -0.05 0.96 0.64 0.24 -1.14 0.00 0.00 176.83 177.48 3mhg h MET 12 N 0.72 1.30 -0.94 3.45 2.86 -0.41 -1.85 114.93 120.04 3mhg h MET 12 Ca 0.13 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 3mhg h MET 12 Cb 0.54 -0.29 -0.05 0.00 0.06 0.00 0.00 31.60 31.87 3mhg h MET 12 CO 0.03 0.87 0.56 0.93 1.06 0.00 0.00 176.91 180.35 3mhg h GLU 13 N 1.33 1.29 0.00 1.72 5.08 -0.68 -2.42 114.58 120.90 3mhg h GLU 13 Ca 0.36 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 3mhg h GLU 13 Cb -0.14 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 28.84 3mhg h GLU 13 CO -0.08 0.91 0.00 0.87 -1.00 0.00 0.00 179.01 179.71 3mhg h LYS 14 N 1.31 0.00 -0.01 2.33 1.57 -0.66 -2.67 116.57 118.44 3mhg h LYS 14 Ca 0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.12 3mhg h LYS 14 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.27 3mhg h LYS 14 CO -0.06 0.00 -0.48 1.28 -0.57 0.00 0.00 179.45 179.61 3mhg n LEU 15 N -3.01 1.52 -4.41 2.94 4.77 -0.93 -2.68 117.00 115.19 3mhg n LEU 15 Ca 0.00 -0.54 -0.20 0.00 -0.03 0.00 0.00 56.01 55.24 3mhg n LEU 15 Cb 0.26 -0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 41.20 3mhg n LEU 15 CO 0.25 0.29 -0.26 -0.44 -1.33 0.00 0.00 177.39 175.90 3mhg s SER 16 N -2.58 2.05 -0.09 -1.43 0.01 -1.01 -4.06 113.70 106.58 3mhg s SER 16 Ca 0.18 -1.39 -0.00 0.00 1.31 0.00 0.00 55.95 56.06 3mhg s SER 16 Cb 0.18 -0.01 0.02 0.00 0.21 0.00 0.00 66.02 66.43 3mhg s SER 16 CO 0.60 -0.65 -0.06 -0.69 0.41 0.00 0.00 173.24 172.86 3mhg s VAL 17 N -3.42 0.86 -1.56 3.43 1.01 -0.35 -4.85 120.40 115.52 3mhg s VAL 17 Ca 0.37 -0.20 -0.11 0.00 0.00 0.00 0.00 61.98 62.04 3mhg s VAL 17 Cb 0.08 -0.90 0.09 0.00 0.00 0.00 0.00 36.38 35.66 3mhg s VAL 17 CO 0.15 0.33 0.72 -0.67 0.00 0.00 0.00 175.10 175.63 3mhg n ASP 18 N 4.83 -2.67 0.00 3.32 2.03 -1.26 -1.50 116.55 121.31 3mhg n ASP 18 Ca -0.13 -0.95 0.00 0.00 0.52 0.00 0.00 54.79 54.23 3mhg n ASP 18 Cb 0.50 -3.17 0.00 0.00 -0.72 0.00 0.00 41.12 37.73 3mhg n ASP 18 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3mhg n GLY 19 N -1.65 0.84 3.37 0.27 0.00 -1.26 -4.72 105.19 102.05 3mhg n GLY 19 Ca -0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.63 3mhg n GLY 19 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mhg s VAL 20 N -3.35 3.01 -0.41 1.61 1.01 -0.56 -0.34 120.40 121.37 3mhg s VAL 20 Ca 0.00 -0.68 -0.19 0.00 0.00 0.00 0.00 61.98 61.10 3mhg s VAL 20 Cb 0.00 -2.25 0.02 0.00 0.00 0.00 0.00 36.38 34.14 3mhg s VAL 20 CO 0.00 0.53 0.57 -0.63 0.00 0.00 0.00 175.10 175.57 3mhg s ILE 21 N 0.26 4.93 -0.70 2.22 1.01 -0.25 -1.21 121.20 127.46 3mhg s ILE 21 Ca -0.10 0.07 0.04 0.00 0.00 0.00 0.00 60.65 60.67 3mhg s ILE 21 Cb -0.16 -4.11 0.29 0.00 0.01 0.00 0.00 42.46 38.49 3mhg s ILE 21 CO 0.05 -0.47 0.97 -1.54 0.00 0.00 0.00 174.94 173.96 3mhg n SER 22 N 5.99 4.55 -4.88 3.58 3.41 -1.26 -0.60 113.62 124.41 3mhg n SER 22 Ca -0.04 -3.53 -0.34 0.00 -0.26 0.00 0.00 58.87 54.71 3mhg n SER 22 Cb 0.48 -0.75 -0.05 0.00 -0.26 0.00 0.00 64.21 63.63 3mhg n SER 22 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3mhg s ALA 23 N -2.93 3.80 -0.17 7.33 0.00 -0.86 -1.38 121.76 127.56 3mhg s ALA 23 Ca 0.41 -0.52 -0.12 0.00 0.00 0.00 0.00 51.96 51.73 3mhg s ALA 23 Cb 0.18 -2.13 -0.05 0.00 0.00 0.00 0.00 23.12 21.11 3mhg s ALA 23 CO -0.04 0.64 0.23 -1.17 0.00 0.00 0.00 175.76 175.42 3mhg s LEU 24 N -2.09 4.25 -0.20 0.00 2.96 -0.27 -1.50 118.68 121.83 3mhg s LEU 24 Ca 0.33 0.42 -0.06 0.00 -0.22 0.00 0.00 54.13 54.61 3mhg s LEU 24 Cb -0.13 -2.26 -0.03 0.00 0.50 0.00 0.00 46.19 44.27 3mhg s LEU 24 CO 0.20 0.16 0.02 0.00 -1.32 0.00 0.00 176.35 175.40 3mhg s ALA 25 N 0.28 3.08 -0.37 5.97 0.00 -0.22 -0.53 121.76 129.97 3mhg s ALA 25 Ca 0.14 -0.98 0.13 0.00 0.00 0.00 0.00 51.96 51.24 3mhg s ALA 25 Cb -0.12 -1.83 0.40 0.00 0.00 0.00 0.00 23.12 21.57 3mhg s ALA 25 CO 0.02 -0.16 1.03 0.34 0.00 0.00 0.00 175.76 176.99 3mhg n PHE 26 N 4.26 -0.50 0.09 0.00 7.35 0.14 -4.07 117.46 124.73 3mhg n PHE 26 Ca -0.17 -2.71 0.12 0.00 -0.76 0.00 0.00 57.45 53.93 3mhg n PHE 26 Cb 0.52 0.38 0.24 0.00 0.35 0.00 0.00 39.48 40.97 3mhg n PHE 26 CO 0.00 0.00 0.00 -0.40 -0.76 0.00 0.00 176.76 175.60 3mhg n ASP 27 N -0.07 3.59 -4.73 -2.13 5.75 -1.21 -4.24 116.55 113.51 3mhg n ASP 27 Ca 0.09 -1.99 -0.42 0.00 -0.01 0.00 0.00 54.79 52.46 3mhg n ASP 27 Cb 0.78 -0.32 -0.02 0.00 -1.03 0.00 0.00 41.12 40.53 3mhg n ASP 27 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3mhg n GLN 28 N 1.51 2.64 0.00 0.11 3.00 -1.26 -4.54 117.38 118.83 3mhg n GLN 28 Ca 0.21 0.94 0.00 0.00 -0.01 0.00 0.00 57.00 58.13 3mhg n GLN 28 Cb 0.61 -2.72 0.00 0.00 0.00 0.00 0.00 30.24 28.13 3mhg n GLN 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 3mhg n ARG 29 N 2.37 0.00 -0.31 -1.09 1.74 -1.26 -4.56 116.66 113.55 3mhg n ARG 29 Ca 0.10 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.22 3mhg n ARG 29 Cb 0.36 0.00 0.19 0.00 -1.02 0.00 0.00 32.46 31.99 3mhg n ARG 29 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 3mhg h GLY 30 N 0.00 1.36 1.40 -0.13 0.00 -1.95 0.10 103.07 103.86 3mhg h GLY 30 Ca 0.00 -0.33 -0.09 0.00 0.00 0.00 0.00 47.33 46.91 3mhg h GLY 30 CO 0.00 0.11 -0.13 0.00 0.00 0.00 0.00 176.54 176.52 3mhg h ALA 31 N 1.49 1.03 -0.42 3.60 0.00 -1.98 -1.79 119.26 121.19 3mhg h ALA 31 Ca 0.43 -0.32 -0.15 0.00 0.00 0.00 0.00 54.91 54.87 3mhg h ALA 31 Cb 0.43 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3mhg h ALA 31 CO -0.27 0.58 -0.32 1.25 0.00 0.00 0.00 179.25 180.50 3mhg h LEU 32 N 0.64 0.99 -0.69 0.00 5.85 -1.51 -2.26 115.31 118.32 3mhg h LEU 32 Ca 0.11 -0.42 -0.06 0.00 0.84 0.00 0.00 57.88 58.35 3mhg h LEU 32 Cb 0.59 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.32 3mhg h LEU 32 CO 0.04 1.21 0.18 0.50 -0.34 0.00 0.00 178.44 180.03 3mhg h LYS 33 N 0.79 1.09 -0.64 1.25 3.64 -0.77 -1.19 116.57 120.74 3mhg h LYS 33 Ca 0.08 -0.26 -0.05 0.00 -1.27 0.00 0.00 60.65 59.15 3mhg h LYS 33 Cb 0.90 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 32.54 3mhg h LYS 33 CO 0.08 0.96 0.19 0.00 -2.27 0.00 0.00 179.45 178.42 3mhg h ARG 34 N 1.03 0.99 -0.12 1.90 3.08 -1.27 -1.10 114.38 118.89 3mhg h ARG 34 Ca 0.22 -0.20 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 3mhg h ARG 34 Cb 0.35 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3mhg h ARG 34 CO -0.00 0.85 0.07 0.52 -1.07 0.00 0.00 179.97 180.34 3mhg h MET 35 N 0.95 0.17 -0.71 0.04 2.86 -0.89 -2.95 114.93 114.40 3mhg h MET 35 Ca 0.21 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.82 3mhg h MET 35 Cb 0.29 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.88 3mhg h MET 35 CO -0.01 0.17 0.39 0.52 1.06 0.00 0.00 176.91 179.04 3mhg h MET 36 N 0.12 0.98 0.00 1.72 2.86 -0.98 -2.31 114.93 117.33 3mhg h MET 36 Ca 0.04 -0.10 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 3mhg h MET 36 Cb 0.05 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 31.51 3mhg h MET 36 CO -0.01 0.72 -0.07 0.00 1.06 0.00 0.00 176.91 178.61 3mhg h ALA 37 N 1.44 1.37 0.00 6.32 0.00 -1.04 -1.78 119.26 125.58 3mhg h ALA 37 Ca 0.25 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 3mhg h ALA 37 Cb 0.02 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3mhg h ALA 37 CO -0.04 0.09 -0.08 1.96 0.00 0.00 0.00 179.25 181.18 3mhg h GLN 38 N 0.00 0.00 -0.01 0.00 4.20 -1.28 -3.28 115.11 114.74 3mhg h GLN 38 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3mhg h GLN 38 Cb 0.20 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.98 3mhg h GLN 38 CO 0.01 0.08 -0.12 0.72 -0.67 0.00 0.00 178.83 178.84 3mhg n HIS 39 N -3.45 0.00 -4.05 2.96 8.25 -0.67 -5.00 115.22 113.26 3mhg n HIS 39 Ca -0.02 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.36 3mhg n HIS 39 Cb 0.22 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.24 3mhg n HIS 39 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 3mhg s GLN 40 N -1.10 0.84 -0.06 -0.41 -2.07 -1.22 -4.71 119.66 110.93 3mhg s GLN 40 Ca 0.08 -1.24 -0.24 0.00 -1.82 0.00 0.00 55.36 52.15 3mhg s GLN 40 Cb 0.07 0.27 -0.28 0.00 -1.09 0.00 0.00 33.01 31.99 3mhg s GLN 40 CO 0.19 -0.24 0.92 1.15 -1.32 0.00 0.00 175.29 175.99 3mhg h THR 41 N 2.89 1.58 -4.25 3.63 2.02 -1.93 -3.45 112.91 113.39 3mhg h THR 41 Ca -0.34 -2.32 -0.50 0.00 0.77 0.00 0.00 66.41 64.01 3mhg h THR 41 Cb 1.18 3.09 0.09 0.00 -1.74 0.00 0.00 68.15 70.78 3mhg h THR 41 CO 0.59 0.64 0.36 -1.59 0.37 0.00 0.00 175.52 175.90 3mhg s LYS 42 N -2.61 2.92 0.19 6.66 -2.85 -1.26 -4.98 119.74 117.81 3mhg s LYS 42 Ca -0.15 1.18 -0.31 0.00 -1.00 0.00 0.00 55.97 55.68 3mhg s LYS 42 Cb 0.00 -1.98 -0.10 0.00 -2.06 0.00 0.00 37.83 33.69 3mhg s LYS 42 CO 0.78 -1.13 1.52 -2.00 0.10 0.00 0.00 175.35 174.63 3mhg s GLU 43 N -4.47 4.23 0.25 1.78 2.12 -1.26 -4.90 118.70 116.45 3mhg s GLU 43 Ca 0.62 2.34 -0.31 0.00 0.36 0.00 0.00 54.97 57.98 3mhg s GLU 43 Cb -0.17 -3.14 -0.13 0.00 0.26 0.00 0.00 34.13 30.95 3mhg s GLU 43 CO 0.46 -0.55 1.49 -2.30 -0.54 0.00 0.00 175.26 173.82 3mhg n PRO 44 N 3.46 2.25 -2.98 4.30 -0.02 -1.26 -4.96 135.00 135.79 3mhg n PRO 44 Ca 0.12 0.80 -0.25 0.00 -2.02 0.00 0.00 63.50 62.15 3mhg n PRO 44 Cb 0.39 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 3mhg n PRO 44 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3mhg s THR 45 N 0.08 4.53 0.28 3.45 -4.23 -1.26 -4.96 115.64 113.52 3mhg s THR 45 Ca 0.68 -0.29 -0.01 0.00 -1.18 0.00 0.00 61.69 60.89 3mhg s THR 45 Cb -0.60 -3.69 0.28 0.00 1.34 0.00 0.00 72.50 69.83 3mhg s THR 45 CO 0.48 -0.53 1.88 0.58 -0.54 0.00 0.00 174.62 176.49 3mhg h VAL 46 N 0.42 1.06 -0.83 2.29 2.07 -2.00 -1.88 116.25 117.38 3mhg h VAL 46 Ca -0.47 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 66.65 3mhg h VAL 46 Cb 1.23 -0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 3mhg h VAL 46 CO 0.60 0.20 0.47 -0.33 0.02 0.00 0.00 177.57 178.53 3mhg h GLU 47 N 1.12 1.15 -0.43 1.57 3.07 -1.99 -0.47 114.58 118.61 3mhg h GLU 47 Ca 0.43 -0.13 -0.08 0.00 -0.50 0.00 0.00 59.36 59.09 3mhg h GLU 47 Cb 0.21 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 27.88 3mhg h GLU 47 CO -0.18 0.84 -0.03 1.96 -1.40 0.00 0.00 179.01 180.20 3mhg h GLN 48 N 1.15 0.79 -0.26 2.33 4.20 -1.77 -0.22 115.11 121.33 3mhg h GLN 48 Ca 0.29 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 3mhg h GLN 48 Cb 0.01 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 3mhg h GLN 48 CO -0.05 0.87 0.10 0.82 -0.67 0.00 0.00 178.83 179.91 3mhg h ILE 49 N 0.62 1.17 -0.66 2.54 2.04 -1.12 -1.37 117.51 120.73 3mhg h ILE 49 Ca 0.12 -0.52 -0.05 0.00 1.00 0.00 0.00 64.86 65.41 3mhg h ILE 49 Cb 0.54 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 3mhg h ILE 49 CO 0.03 0.18 0.23 -0.33 0.00 0.00 0.00 178.15 178.26 3mhg h GLU 50 N 0.26 0.99 -0.21 2.37 5.08 -1.02 -2.54 114.58 119.52 3mhg h GLU 50 Ca 0.09 -0.18 -0.09 0.00 -1.00 0.00 0.00 59.36 58.17 3mhg h GLU 50 Cb 0.18 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 3mhg h GLU 50 CO -0.01 0.83 -0.24 1.49 -1.00 0.00 0.00 179.01 180.09 3mhg h GLU 51 N 0.97 0.53 -0.78 2.33 4.81 -0.80 -2.01 114.58 119.62 3mhg h GLU 51 Ca 0.22 -0.29 -0.03 0.00 -0.13 0.00 0.00 59.36 59.13 3mhg h GLU 51 Cb 0.24 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.60 3mhg h GLU 51 CO -0.01 0.88 0.37 1.25 -0.73 0.00 0.00 179.01 180.76 3mhg h LEU 52 N 0.20 1.01 -0.67 1.64 5.85 -1.20 -0.68 115.31 121.45 3mhg h LEU 52 Ca 0.03 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.60 3mhg h LEU 52 Cb 0.80 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 3mhg h LEU 52 CO 0.06 0.85 0.32 0.11 -0.34 0.00 0.00 178.44 179.44 3mhg h LYS 53 N 1.10 0.98 -0.68 1.25 1.57 -1.39 -1.69 116.57 117.71 3mhg h LYS 53 Ca 0.27 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.85 3mhg h LYS 53 Cb 0.12 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 3mhg h LYS 53 CO -0.03 0.78 0.20 0.77 -0.57 0.00 0.00 179.45 180.59 3mhg h SER 54 N 0.94 0.97 -0.33 0.86 0.02 -0.78 -1.10 113.55 114.14 3mhg h SER 54 Ca 0.23 -0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 3mhg h SER 54 Cb 0.13 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 3mhg h SER 54 CO -0.03 0.91 0.12 -0.07 -1.14 0.00 0.00 176.83 176.62 3mhg h LEU 55 N 1.00 0.47 -0.49 5.07 3.38 -0.84 -0.17 115.31 123.74 3mhg h LEU 55 Ca 0.22 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 3mhg h LEU 55 Cb 0.30 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3mhg h LEU 55 CO -0.01 0.53 0.20 0.58 0.09 0.00 0.00 178.44 179.84 3mhg h VAL 56 N 0.38 1.21 0.14 1.22 2.07 -1.17 -1.01 116.25 119.09 3mhg h VAL 56 Ca 0.11 -0.63 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 3mhg h VAL 56 Cb 0.22 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 3mhg h VAL 56 CO -0.01 0.24 -0.07 -1.28 0.02 0.00 0.00 177.57 176.48 3mhg h SER 57 N 0.64 -0.15 -0.72 0.57 0.87 -1.07 -0.94 113.55 112.75 3mhg h SER 57 Ca 0.16 -0.08 -0.04 0.00 -1.23 0.00 0.00 61.79 60.60 3mhg h SER 57 Cb 0.18 0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.15 3mhg h SER 57 CO -0.01 -0.01 0.29 -0.08 -0.53 0.00 0.00 176.83 176.48 3mhg h GLU 58 N -0.29 1.07 0.12 2.24 4.81 -0.94 -2.36 114.58 119.24 3mhg h GLU 58 Ca -0.02 -0.19 -0.29 0.00 -0.13 0.00 0.00 59.36 58.73 3mhg h GLU 58 Cb 0.23 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.43 3mhg h GLU 58 CO 0.03 0.88 -1.39 0.93 -0.73 0.00 0.00 179.01 178.73 3mhg h GLU 59 N 1.03 0.25 0.00 1.92 4.39 -1.15 -3.40 114.58 117.62 3mhg h GLU 59 Ca 0.24 -0.43 0.00 0.00 0.34 0.00 0.00 59.36 59.51 3mhg h GLU 59 Cb 0.21 0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 3mhg h GLU 59 CO -0.02 1.15 -1.44 1.28 -1.16 0.00 0.00 179.01 178.82 3mhg n LEU 60 N -3.48 0.16 0.30 1.33 4.77 -0.36 -4.51 117.00 115.21 3mhg n LEU 60 Ca -0.12 -0.12 0.19 0.00 -0.03 0.00 0.00 56.01 55.92 3mhg n LEU 60 Cb 1.03 0.00 0.89 0.00 -2.33 0.00 0.00 43.42 43.01 3mhg n LEU 60 CO 0.52 0.04 1.06 0.71 -1.33 0.00 0.00 177.39 178.39 3mhg h THR 61 N 0.00 0.10 0.00 -5.08 1.35 -1.55 -0.83 112.91 106.89 3mhg h THR 61 Ca 0.00 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 3mhg h THR 61 Cb 0.60 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 3mhg h THR 61 CO 0.00 0.02 0.00 -2.65 -0.25 0.00 0.00 175.52 172.64 3mhg n PRO 62 N -3.17 0.12 -0.16 4.72 -0.02 -1.26 -2.07 135.00 133.16 3mhg n PRO 62 Ca -0.01 0.54 0.06 0.00 -2.02 0.00 0.00 63.50 62.07 3mhg n PRO 62 Cb 0.21 -1.84 0.14 0.00 -0.02 0.00 0.00 33.50 31.99 3mhg n PRO 62 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3mhg n PHE 63 N -2.09 0.42 -4.38 6.00 3.72 -0.32 -4.98 117.46 115.82 3mhg n PHE 63 Ca -0.00 -0.44 -0.24 0.00 -0.05 0.00 0.00 57.45 56.72 3mhg n PHE 63 Cb 0.09 -0.02 -0.13 0.00 -0.94 0.00 0.00 39.48 38.47 3mhg n PHE 63 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3mhg s ALA 64 N -0.99 1.79 -0.04 4.37 0.00 -0.88 -4.97 121.76 121.04 3mhg s ALA 64 Ca 0.22 -1.19 0.22 0.00 0.00 0.00 0.00 51.96 51.21 3mhg s ALA 64 Cb 0.12 -0.27 0.64 0.00 0.00 0.00 0.00 23.12 23.61 3mhg s ALA 64 CO 0.16 0.37 1.70 0.66 0.00 0.00 0.00 175.76 178.66 3mhg h SER 65 N 4.30 0.00 -5.13 0.00 4.64 -1.50 -3.42 113.55 112.44 3mhg h SER 65 Ca -0.45 0.00 0.13 0.00 -0.47 0.00 0.00 61.79 61.00 3mhg h SER 65 Cb 1.17 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.18 3mhg h SER 65 CO 0.41 0.24 0.42 -0.94 -0.87 0.00 0.00 176.83 176.09 3mhg s SER 66 N -6.22 -0.25 -0.02 4.97 1.04 -1.26 -1.65 113.70 110.32 3mhg s SER 66 Ca 0.03 -0.35 0.03 0.00 0.48 0.00 0.00 55.95 56.13 3mhg s SER 66 Cb 0.09 0.53 -0.00 0.00 0.10 0.00 0.00 66.02 66.73 3mhg s SER 66 CO 0.66 -0.95 -0.10 -0.51 0.98 0.00 0.00 173.24 173.32 3mhg s ILE 67 N -3.41 0.83 -0.25 -1.02 2.07 -0.44 -1.11 121.20 117.85 3mhg s ILE 67 Ca 0.10 -0.42 -0.11 0.00 -1.41 0.00 0.00 60.65 58.81 3mhg s ILE 67 Cb -0.02 -0.71 -0.05 0.00 0.13 0.00 0.00 42.46 41.81 3mhg s ILE 67 CO 0.00 0.24 0.21 -0.22 -1.91 0.00 0.00 174.94 173.26 3mhg s LEU 68 N -0.06 4.08 0.27 8.50 2.96 0.31 -0.99 118.68 133.75 3mhg s LEU 68 Ca 0.01 0.12 0.06 0.00 -0.22 0.00 0.00 54.13 54.09 3mhg s LEU 68 Cb -0.06 -2.17 -0.06 0.00 0.50 0.00 0.00 46.19 44.40 3mhg s LEU 68 CO 0.00 -0.00 -0.04 -0.76 -1.32 0.00 0.00 176.35 174.22 3mhg s LEU 69 N 1.39 2.41 0.15 -0.68 1.43 -0.44 -0.69 118.68 122.26 3mhg s LEU 69 Ca 0.09 -1.20 -0.04 0.00 -1.03 0.00 0.00 54.13 51.95 3mhg s LEU 69 Cb -0.15 -0.54 -0.05 0.00 0.03 0.00 0.00 46.19 45.48 3mhg s LEU 69 CO 0.07 -0.39 0.37 1.51 0.23 0.00 0.00 176.35 178.15 3mhg s ASP 70 N -3.41 6.47 0.03 2.29 -4.77 -1.26 -1.27 116.67 114.75 3mhg s ASP 70 Ca 0.29 0.55 0.27 0.00 -3.30 0.00 0.00 52.55 50.36 3mhg s ASP 70 Cb 0.04 -2.07 1.12 0.00 -1.09 0.00 0.00 42.92 40.92 3mhg s ASP 70 CO 0.11 0.04 1.86 -2.65 0.70 0.00 0.00 175.17 175.23 3mhg n PRO 71 N -0.03 0.04 0.03 2.11 -0.02 -1.26 -1.06 135.00 134.82 3mhg n PRO 71 Ca -0.03 0.06 -0.19 0.00 -2.02 0.00 0.00 63.50 61.32 3mhg n PRO 71 Cb 0.52 -1.55 -0.12 0.00 -0.02 0.00 0.00 33.50 32.33 3mhg n PRO 71 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3mhg h GLU 72 N 0.00 0.44 0.00 -0.52 5.08 -1.94 -3.40 114.58 114.24 3mhg h GLU 72 Ca 0.00 -0.54 0.00 0.00 -1.00 0.00 0.00 59.36 57.82 3mhg h GLU 72 Cb 0.51 0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.93 3mhg h GLU 72 CO 0.00 1.19 -0.23 0.66 -1.00 0.00 0.00 179.01 179.64 3mhg n TYR 73 N -4.11 0.00 1.06 4.33 4.01 -1.25 -4.85 117.16 116.35 3mhg n TYR 73 Ca -0.12 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.75 3mhg n TYR 73 Cb 0.77 0.00 0.24 0.00 -0.31 0.00 0.00 39.34 40.04 3mhg n TYR 73 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3mhg n GLY 74 N 1.22 0.79 0.24 2.72 0.00 -0.22 -4.41 105.19 105.52 3mhg n GLY 74 Ca 0.00 -0.62 -0.09 0.00 0.00 0.00 0.00 46.02 45.31 3mhg n GLY 74 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3mhg h LEU 75 N 3.93 0.76 -0.40 0.99 3.38 -1.79 0.71 115.31 122.88 3mhg h LEU 75 Ca 0.00 -0.26 0.03 0.00 0.09 0.00 0.00 57.88 57.74 3mhg h LEU 75 Cb 0.84 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 3mhg h LEU 75 CO 0.00 0.82 0.22 -0.65 0.09 0.00 0.00 178.44 178.92 3mhg h PRO 76 N 0.66 0.43 -0.90 1.13 0.11 -1.94 -2.32 132.00 129.16 3mhg h PRO 76 Ca 0.15 -0.03 0.08 0.00 0.11 0.00 0.00 66.00 66.31 3mhg h PRO 76 Cb 0.38 -0.10 -0.06 0.00 0.11 0.00 0.00 31.00 31.33 3mhg h PRO 76 CO 0.01 0.28 0.58 0.00 -0.21 0.00 0.00 178.00 178.66 3mhg h ALA 77 N 1.20 1.56 -0.11 -0.75 0.00 -1.72 -1.80 119.26 117.64 3mhg h ALA 77 Ca 0.17 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3mhg h ALA 77 Cb 0.05 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3mhg h ALA 77 CO -0.10 0.29 -0.12 0.66 0.00 0.00 0.00 179.25 179.98 3mhg h SER 78 N 0.97 0.15 1.23 0.00 4.64 -0.33 -2.11 113.55 118.12 3mhg h SER 78 Ca 0.40 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 3mhg h SER 78 Cb 0.28 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 3mhg h SER 78 CO -0.16 0.29 0.00 0.54 -0.87 0.00 0.00 176.83 176.63 3mhg n ARG 79 N -4.32 0.17 -0.26 4.77 1.74 -0.68 -3.15 116.66 114.92 3mhg n ARG 79 Ca -0.01 0.17 0.08 0.00 -0.77 0.00 0.00 57.85 57.31 3mhg n ARG 79 Cb 0.24 -1.71 0.22 0.00 -1.02 0.00 0.00 32.46 30.19 3mhg n ARG 79 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 3mhg n VAL 80 N -2.00 1.08 -1.37 1.55 0.24 -0.80 -5.01 118.33 112.01 3mhg n VAL 80 Ca 0.06 -1.04 -0.32 0.00 -2.04 0.00 0.00 64.34 60.99 3mhg n VAL 80 Cb 0.38 0.46 0.09 0.00 -1.47 0.00 0.00 33.84 33.29 3mhg n VAL 80 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3mhg s ARG 81 N -1.10 2.26 0.39 7.34 1.70 -1.14 -4.14 118.95 124.26 3mhg s ARG 81 Ca 0.33 1.36 -0.26 0.00 -0.47 0.00 0.00 55.73 56.69 3mhg s ARG 81 Cb 0.18 -1.88 -0.11 0.00 -0.57 0.00 0.00 34.95 32.56 3mhg s ARG 81 CO 0.21 -1.67 1.24 0.45 -1.08 0.00 0.00 175.30 174.45 3mhg n SER 82 N -3.15 2.43 0.23 -2.89 2.88 -1.26 -4.87 113.62 106.98 3mhg n SER 82 Ca 0.10 1.14 0.17 0.00 -1.33 0.00 0.00 58.87 58.95 3mhg n SER 82 Cb 0.52 -1.47 0.85 0.00 -0.75 0.00 0.00 64.21 63.37 3mhg n SER 82 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 3mhg h GLU 83 N 2.18 0.00 -0.00 -1.46 4.81 -1.94 -1.34 114.58 116.82 3mhg h GLU 83 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 3mhg h GLU 83 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 3mhg h GLU 83 CO 0.60 0.00 -0.37 0.39 -0.73 0.00 0.00 179.01 178.90 3mhg n GLU 84 N -3.76 0.37 -3.85 1.92 4.71 -1.26 -4.91 120.64 113.85 3mhg n GLU 84 Ca 0.01 -0.21 -0.36 0.00 -0.01 0.00 0.00 57.16 56.59 3mhg n GLU 84 Cb 0.28 -1.50 -0.07 0.00 -1.01 0.00 0.00 31.44 29.15 3mhg n GLU 84 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3mhg s ALA 85 N -2.78 3.77 0.91 0.62 0.00 -0.51 -4.88 121.76 118.90 3mhg s ALA 85 Ca 0.17 -0.67 -0.14 0.00 0.00 0.00 0.00 51.96 51.32 3mhg s ALA 85 Cb 0.18 -2.02 0.17 0.00 0.00 0.00 0.00 23.12 21.45 3mhg s ALA 85 CO 0.61 0.43 1.27 0.20 0.00 0.00 0.00 175.76 178.28 3mhg s GLY 86 N -0.45 1.73 -0.07 0.00 0.00 -0.66 -4.81 107.32 103.06 3mhg s GLY 86 Ca 0.12 -1.07 0.02 0.00 0.00 0.00 0.00 44.72 43.79 3mhg s GLY 86 CO 0.02 -0.39 -0.13 -2.27 0.00 0.00 0.00 173.10 170.33 3mhg s LEU 87 N -5.78 1.68 0.02 0.66 2.96 -1.26 -1.33 118.68 115.63 3mhg s LEU 87 Ca 0.71 -0.32 0.05 0.00 -0.22 0.00 0.00 54.13 54.34 3mhg s LEU 87 Cb -0.06 -0.88 -0.03 0.00 0.50 0.00 0.00 46.19 45.72 3mhg s LEU 87 CO 0.52 0.04 -0.10 -0.76 -1.32 0.00 0.00 176.35 174.73 3mhg s LEU 88 N 0.65 3.01 -0.06 -0.68 1.02 -0.16 0.12 118.68 122.58 3mhg s LEU 88 Ca -0.15 -0.24 0.05 0.00 0.02 0.00 0.00 54.13 53.82 3mhg s LEU 88 Cb -0.16 -1.75 -0.01 0.00 0.02 0.00 0.00 46.19 44.29 3mhg s LEU 88 CO 0.04 0.26 -0.24 -0.76 0.02 0.00 0.00 176.35 175.68 3mhg s LEU 89 N -1.51 2.04 0.46 1.79 1.43 -0.95 -1.32 118.68 120.62 3mhg s LEU 89 Ca 0.17 -0.50 -0.22 0.00 -1.03 0.00 0.00 54.13 52.55 3mhg s LEU 89 Cb -0.11 -1.32 -0.08 0.00 0.03 0.00 0.00 46.19 44.72 3mhg s LEU 89 CO 0.08 0.21 1.12 0.00 0.23 0.00 0.00 176.35 177.99 3mhg s ALA 90 N -0.02 2.94 -0.01 4.21 0.00 -0.40 -1.34 121.76 127.13 3mhg s ALA 90 Ca -0.07 0.83 0.01 0.00 0.00 0.00 0.00 51.96 52.74 3mhg s ALA 90 Cb -0.14 -3.34 -0.02 0.00 0.00 0.00 0.00 23.12 19.62 3mhg s ALA 90 CO 0.05 -0.55 0.03 0.98 0.00 0.00 0.00 175.76 176.26 3mhg n TYR 91 N -0.59 0.00 -3.36 0.00 9.36 0.47 -4.35 117.16 118.70 3mhg n TYR 91 Ca 0.08 0.00 -0.32 0.00 3.32 0.00 0.00 57.90 60.98 3mhg n TYR 91 Cb 0.49 -0.02 -0.06 0.00 -0.63 0.00 0.00 39.34 39.13 3mhg n TYR 91 CO 0.00 0.00 0.00 -1.83 0.22 0.00 0.00 176.86 175.25 3mhg s GLU 92 N -1.83 3.84 0.53 2.98 1.03 -1.26 -0.90 118.70 123.10 3mhg s GLU 92 Ca -0.00 0.36 -0.21 0.00 0.03 0.00 0.00 54.97 55.15 3mhg s GLU 92 Cb 0.01 -2.61 -0.05 0.00 -0.80 0.00 0.00 34.13 30.68 3mhg s GLU 92 CO 0.04 0.29 1.21 0.15 -1.33 0.00 0.00 175.26 175.62 3mhg s LYS 93 N -2.84 3.31 0.49 -4.83 1.02 0.08 -4.65 119.74 112.33 3mhg s LYS 93 Ca 0.49 1.85 -0.21 0.00 0.02 0.00 0.00 55.97 58.12 3mhg s LYS 93 Cb -0.11 -2.15 -0.08 0.00 -0.52 0.00 0.00 37.83 34.97 3mhg s LYS 93 CO 0.20 -0.94 1.08 -0.08 -0.92 0.00 0.00 175.35 174.70 3mhg s THR 94 N -1.55 3.50 0.00 2.17 -1.32 -1.26 -4.90 115.64 112.28 3mhg s THR 94 Ca 0.71 0.98 0.00 0.00 -1.21 0.00 0.00 61.69 62.18 3mhg s THR 94 Cb -0.31 -3.42 0.00 0.00 -1.51 0.00 0.00 72.50 67.26 3mhg s THR 94 CO 0.35 -0.16 0.00 0.61 -2.21 0.00 0.00 174.62 173.22 3mhg n GLY 95 N 0.04 -0.27 3.66 6.08 0.00 -1.26 -5.00 105.19 108.43 3mhg n GLY 95 Ca 0.09 -1.04 -0.09 0.00 0.00 0.00 0.00 46.02 44.99 3mhg n GLY 95 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3mhg s TYR 96 N 0.00 -0.18 -0.40 1.61 -0.85 -1.26 -5.07 117.35 111.20 3mhg s TYR 96 Ca 0.00 -0.19 -0.28 0.00 -0.52 0.00 0.00 57.07 56.07 3mhg s TYR 96 Cb 0.00 0.55 0.02 0.00 0.38 0.00 0.00 41.96 42.91 3mhg s TYR 96 CO 0.00 -1.06 1.07 0.34 -1.52 0.00 0.00 175.55 174.38 3mhg s ASP 97 N -2.89 6.76 0.06 -0.18 2.15 -1.26 -4.89 116.67 116.42 3mhg s ASP 97 Ca 0.10 0.71 0.23 0.00 0.43 0.00 0.00 52.55 54.01 3mhg s ASP 97 Cb -0.03 -2.53 0.93 0.00 -0.30 0.00 0.00 42.92 40.99 3mhg s ASP 97 CO 0.01 -1.03 1.72 0.00 -0.17 0.00 0.00 175.17 175.69 3mhg n ALA 98 N 7.26 2.00 0.17 3.66 0.00 -1.26 -3.28 120.51 129.06 3mhg n ALA 98 Ca 0.11 -0.05 0.02 0.00 0.00 0.00 0.00 53.44 53.52 3mhg n ALA 98 Cb 0.48 -1.38 0.34 0.00 0.00 0.00 0.00 19.45 18.89 3mhg n ALA 98 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3mhg h THR 99 N 0.00 1.28 -4.86 0.00 2.02 -2.08 -3.45 112.91 105.82 3mhg h THR 99 Ca 0.00 -1.32 -0.55 0.00 0.77 0.00 0.00 66.41 65.31 3mhg h THR 99 Cb 0.42 1.69 -0.11 0.00 -1.74 0.00 0.00 68.15 68.41 3mhg h THR 99 CO 0.00 0.38 -0.43 0.35 0.37 0.00 0.00 175.52 176.19 3mhg n THR 100 N -4.08 0.00 0.40 3.16 -2.24 -1.21 -5.07 114.28 105.24 3mhg n THR 100 Ca -0.02 -2.18 0.05 0.00 -2.27 0.00 0.00 64.05 59.64 3mhg n THR 100 Cb 0.42 0.61 0.06 0.00 -2.10 0.00 0.00 70.33 69.31 3mhg n THR 100 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3mhg n THR 101 N -0.99 0.10 0.06 4.28 -2.24 -1.26 -4.65 114.28 109.57 3mhg n THR 101 Ca -0.12 -0.55 -0.04 0.00 -2.27 0.00 0.00 64.05 61.07 3mhg n THR 101 Cb 0.57 1.16 -0.08 0.00 -2.10 0.00 0.00 70.33 69.88 3mhg n THR 101 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3mhg h SER 102 N 2.14 0.00 -7.00 3.42 4.64 -1.98 -3.45 113.55 111.32 3mhg h SER 102 Ca 0.00 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.73 3mhg h SER 102 Cb 0.48 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.52 3mhg h SER 102 CO 0.00 0.80 -0.97 0.54 -0.87 0.00 0.00 176.83 176.34 3mhg n ARG 103 N -3.18 -0.37 -2.42 4.77 1.74 -1.26 -4.86 116.66 111.09 3mhg n ARG 103 Ca -0.05 0.04 -0.41 0.00 -0.77 0.00 0.00 57.85 56.67 3mhg n ARG 103 Cb 0.89 -2.53 -0.04 0.00 -1.02 0.00 0.00 32.46 29.77 3mhg n ARG 103 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3mhg s LEU 104 N -7.38 4.52 0.48 0.55 1.43 -1.26 -4.54 118.68 112.48 3mhg s LEU 104 Ca 0.38 2.30 -0.21 0.00 -1.03 0.00 0.00 54.13 55.57 3mhg s LEU 104 Cb -0.21 -3.62 -0.08 0.00 0.03 0.00 0.00 46.19 42.31 3mhg s LEU 104 CO 0.94 -0.23 1.07 -2.16 0.23 0.00 0.00 176.35 176.20 3mhg s PRO 105 N -1.21 3.76 -0.23 1.29 0.04 -1.26 -5.00 135.00 132.39 3mhg s PRO 105 Ca 0.47 1.47 -0.06 0.00 0.04 0.00 0.00 61.00 62.92 3mhg s PRO 105 Cb -0.33 -2.17 0.11 0.00 0.04 0.00 0.00 34.50 32.15 3mhg s PRO 105 CO 0.41 -0.49 0.45 0.34 0.04 0.00 0.00 177.00 177.75 3mhg s ASP 106 N -1.82 -0.32 0.66 6.66 2.15 -1.26 -5.10 116.67 117.64 3mhg s ASP 106 Ca 0.67 0.88 -0.16 0.00 0.43 0.00 0.00 52.55 54.36 3mhg s ASP 106 Cb -0.20 1.46 -0.00 0.00 -0.30 0.00 0.00 42.92 43.88 3mhg s ASP 106 CO 0.24 -0.25 1.17 0.00 -0.17 0.00 0.00 175.17 176.16 3mhg n LEU 108 N -2.21 3.96 -0.28 0.00 4.77 -0.08 -4.59 117.00 118.57 3mhg n LEU 108 Ca 0.12 1.11 0.04 0.00 -0.03 0.00 0.00 56.01 57.26 3mhg n LEU 108 Cb 0.51 -1.55 0.26 0.00 -2.33 0.00 0.00 43.42 40.30 3mhg n LEU 108 CO 0.46 0.04 1.24 0.44 -1.33 0.00 0.00 177.39 178.24 3mhg h ASP 109 N 5.48 0.87 -0.53 -1.43 3.32 -1.92 -2.40 116.42 119.81 3mhg h ASP 109 Ca -0.45 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.44 3mhg h ASP 109 Cb 1.23 -0.18 -0.09 0.00 0.22 0.00 0.00 39.33 40.50 3mhg h ASP 109 CO 0.85 0.56 0.13 1.33 -1.72 0.00 0.00 179.24 180.40 3mhg n VAL 110 N -4.48 2.68 -4.41 -1.35 0.24 -1.26 -4.97 118.33 104.78 3mhg n VAL 110 Ca 0.13 -1.96 -0.24 0.00 -2.04 0.00 0.00 64.34 60.23 3mhg n VAL 110 Cb 0.19 -0.33 -0.09 0.00 -1.47 0.00 0.00 33.84 32.14 3mhg n VAL 110 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 3mhg s TRP 111 N -3.02 2.42 0.20 6.34 0.52 -0.90 -5.05 118.94 119.45 3mhg s TRP 111 Ca 0.49 -0.30 -0.12 0.00 0.02 0.00 0.00 56.10 56.19 3mhg s TRP 111 Cb 0.41 -1.07 0.00 0.00 -1.15 0.00 0.00 33.47 31.66 3mhg s TRP 111 CO 0.09 0.66 0.41 -1.54 0.02 0.00 0.00 176.95 176.60 3mhg s SER 112 N -3.45 -0.09 0.31 2.95 1.04 -1.26 -4.83 113.70 108.38 3mhg s SER 112 Ca 0.29 -0.78 0.02 0.00 0.48 0.00 0.00 55.95 55.96 3mhg s SER 112 Cb -0.06 0.52 0.59 0.00 0.10 0.00 0.00 66.02 67.17 3mhg s SER 112 CO 0.16 -1.02 1.91 0.00 0.98 0.00 0.00 173.24 175.28 3mhg h ALA 113 N 2.36 1.57 -0.38 5.32 0.00 -1.97 -1.41 119.26 124.74 3mhg h ALA 113 Ca -0.29 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 3mhg h ALA 113 Cb 1.24 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 3mhg h ALA 113 CO 0.41 0.29 0.19 -0.22 0.00 0.00 0.00 179.25 179.92 3mhg h LYS 114 N 0.96 0.55 -0.29 0.00 3.64 -1.96 -1.47 116.57 117.99 3mhg h LYS 114 Ca 0.39 -0.07 -0.09 0.00 -1.27 0.00 0.00 60.65 59.60 3mhg h LYS 114 Cb 0.26 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 3mhg h LYS 114 CO -0.15 0.47 -0.21 0.00 -2.27 0.00 0.00 179.45 177.29 3mhg h ARG 115 N 0.49 0.54 -0.36 1.90 3.08 -1.82 -0.37 114.38 117.85 3mhg h ARG 115 Ca 0.13 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 3mhg h ARG 115 Cb 0.10 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 3mhg h ARG 115 CO -0.02 0.72 0.17 0.82 -1.07 0.00 0.00 179.97 180.59 3mhg h ILE 116 N 0.49 1.17 -0.45 2.04 2.04 -1.03 0.11 117.51 121.88 3mhg h ILE 116 Ca 0.08 -0.49 0.03 0.00 1.00 0.00 0.00 64.86 65.47 3mhg h ILE 116 Cb 0.63 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 3mhg h ILE 116 CO 0.04 0.18 0.25 0.50 0.00 0.00 0.00 178.15 179.12 3mhg h LYS 117 N 0.44 0.48 0.00 2.37 3.64 -1.11 -2.19 116.57 120.19 3mhg h LYS 117 Ca 0.12 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 3mhg h LYS 117 Cb 0.13 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3mhg h LYS 117 CO -0.01 0.32 -0.07 0.93 -2.27 0.00 0.00 179.45 178.34 3mhg h GLU 118 N 0.49 0.00 -0.03 1.90 5.08 -0.66 -1.17 114.58 120.18 3mhg h GLU 118 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 3mhg h GLU 118 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3mhg h GLU 118 CO -0.11 0.07 0.00 0.00 -1.00 0.00 0.00 179.01 177.97 3mhg n ALA 119 N -2.25 2.61 -0.13 3.43 0.00 0.35 -4.90 120.51 119.62 3mhg n ALA 119 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.19 3mhg n ALA 119 Cb 0.19 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.35 3mhg n ALA 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mhg n GLY 120 N 0.92 0.85 3.78 0.00 0.00 -0.44 -5.07 105.19 105.24 3mhg n GLY 120 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 3mhg n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mhg s ALA 121 N -2.06 3.06 -2.81 4.61 0.00 -1.06 -4.76 121.76 118.74 3mhg s ALA 121 Ca 0.00 0.72 0.25 0.00 0.00 0.00 0.00 51.96 52.93 3mhg s ALA 121 Cb 0.00 -3.28 0.40 0.00 0.00 0.00 0.00 23.12 20.24 3mhg s ALA 121 CO 0.00 -0.27 1.38 0.39 0.00 0.00 0.00 175.76 177.26 3mhg n GLU 122 N -0.16 2.09 -3.55 0.00 4.71 0.12 -4.64 120.64 119.20 3mhg n GLU 122 Ca 0.05 -1.62 -0.16 0.00 -0.01 0.00 0.00 57.16 55.42 3mhg n GLU 122 Cb 0.50 -1.47 -0.06 0.00 -1.01 0.00 0.00 31.44 29.40 3mhg n GLU 122 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3mhg s ALA 123 N -2.03 -1.81 -0.22 0.62 0.00 -1.18 -4.02 121.76 113.12 3mhg s ALA 123 Ca 0.30 1.50 -0.10 0.00 0.00 0.00 0.00 51.96 53.66 3mhg s ALA 123 Cb 0.20 -0.36 -0.05 0.00 0.00 0.00 0.00 23.12 22.91 3mhg s ALA 123 CO 0.33 -0.35 0.14 0.08 0.00 0.00 0.00 175.76 175.96 3mhg s VAL 124 N -0.88 5.30 -0.09 0.00 1.01 -0.40 -2.24 120.40 123.11 3mhg s VAL 124 Ca -0.07 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.06 3mhg s VAL 124 Cb -0.01 -3.45 -0.03 0.00 0.00 0.00 0.00 36.38 32.89 3mhg s VAL 124 CO 0.07 0.38 -0.07 -0.75 0.00 0.00 0.00 175.10 174.73 3mhg s LYS 125 N 0.81 2.94 -0.02 2.72 2.36 -0.45 -0.58 119.74 127.52 3mhg s LYS 125 Ca 0.07 -0.56 0.00 0.00 -2.55 0.00 0.00 55.97 52.94 3mhg s LYS 125 Cb -0.13 -2.64 0.02 0.00 -1.05 0.00 0.00 37.83 34.03 3mhg s LYS 125 CO 0.02 0.56 0.02 0.12 1.55 0.00 0.00 175.35 177.62 3mhg s PHE 126 N -0.53 0.04 -0.22 4.03 2.19 -0.46 -0.40 117.98 122.64 3mhg s PHE 126 Ca 0.08 0.09 -0.10 0.00 0.33 0.00 0.00 56.93 57.33 3mhg s PHE 126 Cb -0.12 -0.19 -0.05 0.00 -1.31 0.00 0.00 43.02 41.35 3mhg s PHE 126 CO 0.02 -0.07 0.14 -1.17 1.83 0.00 0.00 175.22 175.97 3mhg s LEU 127 N 0.78 4.12 -0.10 6.12 2.96 -1.26 -0.50 118.68 130.81 3mhg s LEU 127 Ca -0.07 0.15 0.04 0.00 -0.22 0.00 0.00 54.13 54.03 3mhg s LEU 127 Cb -0.10 -2.09 0.00 0.00 0.50 0.00 0.00 46.19 44.51 3mhg s LEU 127 CO -0.02 0.12 -0.23 -0.22 -1.32 0.00 0.00 176.35 174.67 3mhg s LEU 128 N 0.73 2.06 -0.04 -0.68 2.96 0.29 -4.92 118.68 119.08 3mhg s LEU 128 Ca 0.07 -0.54 -0.22 0.00 -0.22 0.00 0.00 54.13 53.22 3mhg s LEU 128 Cb -0.12 -1.37 -0.04 0.00 0.50 0.00 0.00 46.19 45.15 3mhg s LEU 128 CO 0.02 0.15 0.66 -0.31 -1.32 0.00 0.00 176.35 175.55 3mhg s TYR 129 N 0.35 3.62 -0.05 5.38 1.51 -1.26 -1.63 117.35 125.27 3mhg s TYR 129 Ca -0.18 1.23 -0.02 0.00 -1.01 0.00 0.00 57.07 57.09 3mhg s TYR 129 Cb -0.18 -2.73 0.04 0.00 -0.11 0.00 0.00 41.96 38.98 3mhg s TYR 129 CO 0.09 0.19 0.10 -0.47 -1.11 0.00 0.00 175.55 174.34 3mhg s TYR 130 N 0.41 -0.06 -0.39 2.71 5.04 -0.57 -4.94 117.35 119.55 3mhg s TYR 130 Ca 0.35 0.36 -0.04 0.00 -2.44 0.00 0.00 57.07 55.30 3mhg s TYR 130 Cb -0.18 -0.27 0.09 0.00 0.35 0.00 0.00 41.96 41.96 3mhg s TYR 130 CO 0.18 -0.18 0.18 0.34 -1.34 0.00 0.00 175.55 174.73 3mhg s ASP 131 N 1.65 5.27 0.50 4.32 -1.08 -1.26 -3.05 116.67 123.01 3mhg s ASP 131 Ca -0.03 -1.79 0.23 0.00 -0.52 0.00 0.00 52.55 50.45 3mhg s ASP 131 Cb -0.12 -1.84 1.30 0.00 -1.46 0.00 0.00 42.92 40.80 3mhg s ASP 131 CO -0.04 -0.49 1.95 -0.29 0.52 0.00 0.00 175.17 176.81 3mhg h ILE 132 N 6.33 0.71 -0.27 4.11 6.09 -1.85 0.17 117.51 132.79 3mhg h ILE 132 Ca -0.16 -0.05 0.00 0.00 -1.37 0.00 0.00 64.86 63.28 3mhg h ILE 132 Cb 1.06 0.56 0.00 0.00 0.47 0.00 0.00 36.82 38.91 3mhg h ILE 132 CO 0.68 0.03 0.00 0.47 -3.07 0.00 0.00 178.15 176.26 3mhg n ASP 133 N -4.39 2.36 -2.78 2.19 8.00 -1.26 -4.96 116.55 115.70 3mhg n ASP 133 Ca 0.13 -1.84 -0.11 0.00 0.71 0.00 0.00 54.79 53.68 3mhg n ASP 133 Cb 0.66 -0.18 0.08 0.00 -0.02 0.00 0.00 41.12 41.66 3mhg n ASP 133 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mhg n GLY 134 N 1.27 -1.93 3.68 0.44 0.00 0.59 -4.94 105.19 104.30 3mhg n GLY 134 Ca 0.17 -1.57 -0.46 0.00 0.00 0.00 0.00 46.02 44.16 3mhg n GLY 134 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3mhg n ASP 135 N -3.49 3.32 0.04 1.61 -0.08 -1.26 -4.88 116.55 111.81 3mhg n ASP 135 Ca 0.06 1.04 -0.02 0.00 -1.51 0.00 0.00 54.79 54.36 3mhg n ASP 135 Cb 0.21 -1.43 0.26 0.00 2.34 0.00 0.00 41.12 42.50 3mhg n ASP 135 CO 0.00 0.00 0.00 0.06 0.12 0.00 0.00 177.20 177.38 3mhg h GLN 136 N 7.17 0.40 -0.21 -0.67 3.07 -1.96 -1.41 115.11 121.51 3mhg h GLN 136 Ca -0.46 -0.13 -0.15 0.00 0.09 0.00 0.00 58.65 58.00 3mhg h GLN 136 Cb 1.25 -0.03 -0.01 0.00 0.08 0.00 0.00 27.48 28.77 3mhg h GLN 136 CO 0.91 0.60 -0.50 -0.44 0.09 0.00 0.00 178.83 179.49 3mhg h ASP 137 N 0.37 0.61 -0.48 0.06 3.32 -1.99 -0.34 116.42 117.96 3mhg h ASP 137 Ca 0.06 -0.31 -0.02 0.00 0.02 0.00 0.00 57.03 56.78 3mhg h ASP 137 Cb 0.58 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 3mhg h ASP 137 CO 0.04 1.01 0.21 0.58 -1.72 0.00 0.00 179.24 179.36 3mhg h VAL 138 N 0.44 1.20 0.00 -1.35 2.07 -1.85 -2.17 116.25 114.59 3mhg h VAL 138 Ca 0.02 -0.61 -0.09 0.00 0.82 0.00 0.00 66.70 66.84 3mhg h VAL 138 Cb 1.03 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 3mhg h VAL 138 CO 0.10 0.23 -0.44 0.78 0.02 0.00 0.00 177.57 178.26 3mhg h ASN 139 N 0.64 0.00 -0.57 0.57 2.35 -1.08 -0.99 115.58 116.49 3mhg h ASN 139 Ca 0.16 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.86 3mhg h ASN 139 Cb 0.17 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 3mhg h ASN 139 CO -0.02 0.44 0.15 -0.08 -1.65 0.00 0.00 177.43 176.27 3mhg h GLU 140 N 0.00 0.91 -0.62 0.81 4.57 -0.89 0.16 114.58 119.53 3mhg h GLU 140 Ca -0.00 -0.22 -0.10 0.00 -1.18 0.00 0.00 59.36 57.86 3mhg h GLU 140 Cb 0.79 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.23 3mhg h GLU 140 CO 0.06 0.85 0.01 0.37 -1.18 0.00 0.00 179.01 179.11 3mhg h GLN 141 N 0.82 1.09 -0.51 1.92 4.15 -0.93 -1.54 115.11 120.12 3mhg h GLN 141 Ca 0.18 -0.34 -0.05 0.00 0.77 0.00 0.00 58.65 59.21 3mhg h GLN 141 Cb 0.34 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.91 3mhg h GLN 141 CO 0.00 1.05 0.12 0.87 -1.93 0.00 0.00 178.83 178.94 3mhg h LYS 142 N 1.00 0.82 -0.55 1.69 1.57 -0.90 -1.33 116.57 118.86 3mhg h LYS 142 Ca 0.18 -0.20 -0.07 0.00 -1.87 0.00 0.00 60.65 58.69 3mhg h LYS 142 Cb 0.55 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 3mhg h LYS 142 CO 0.03 0.79 0.08 0.87 -0.57 0.00 0.00 179.45 180.65 3mhg h LYS 143 N 0.71 0.92 -0.94 3.15 1.57 -0.83 -1.86 116.57 119.28 3mhg h LYS 143 Ca 0.16 -0.25 0.01 0.00 -1.87 0.00 0.00 60.65 58.69 3mhg h LYS 143 Cb 0.34 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.50 3mhg h LYS 143 CO 0.00 0.90 0.61 0.00 -0.57 0.00 0.00 179.45 180.39 3mhg h ALA 144 N 0.99 1.20 -0.61 3.86 0.00 -1.12 -1.46 119.26 122.12 3mhg h ALA 144 Ca 0.17 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3mhg h ALA 144 Cb 0.43 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 3mhg h ALA 144 CO 0.01 0.61 0.21 -0.92 0.00 0.00 0.00 179.25 179.17 3mhg h TYR 145 N 1.28 0.95 -0.30 0.00 3.20 -0.74 -2.38 116.97 118.98 3mhg h TYR 145 Ca 0.34 -0.08 -0.13 0.00 3.14 0.00 0.00 58.73 62.00 3mhg h TYR 145 Cb -0.13 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 37.85 3mhg h TYR 145 CO -0.00 0.77 -0.33 0.82 -1.64 0.00 0.00 178.16 177.78 3mhg h ILE 146 N 0.85 1.28 -0.60 1.81 1.08 -1.09 -2.75 117.51 118.10 3mhg h ILE 146 Ca 0.20 -1.47 0.08 0.00 -0.39 0.00 0.00 64.86 63.28 3mhg h ILE 146 Cb 0.25 1.41 -0.07 0.00 -3.07 0.00 0.00 36.82 35.35 3mhg h ILE 146 CO -0.01 0.48 0.24 -0.33 -0.69 0.00 0.00 178.15 177.84 3mhg h GLU 147 N 0.56 0.43 -0.39 2.37 5.08 -0.95 0.12 114.58 121.79 3mhg h GLU 147 Ca 0.06 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3mhg h GLU 147 Cb 0.84 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 3mhg h GLU 147 CO 0.07 0.28 0.26 0.00 -1.00 0.00 0.00 179.01 178.62 3mhg h ARG 148 N 0.44 0.51 -0.41 2.33 3.08 -1.16 -1.09 114.38 118.08 3mhg h ARG 148 Ca 0.30 -0.03 -0.09 0.00 0.07 0.00 0.00 59.98 60.22 3mhg h ARG 148 Cb 0.33 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 3mhg h ARG 148 CO -0.28 0.34 -0.09 0.82 -1.07 0.00 0.00 179.97 179.69 3mhg h ILE 149 N 0.53 1.27 -0.78 2.04 2.04 -1.16 -0.58 117.51 120.87 3mhg h ILE 149 Ca 0.14 -1.19 0.10 0.00 1.00 0.00 0.00 64.86 64.91 3mhg h ILE 149 Cb -0.06 1.19 -0.07 0.00 -0.74 0.00 0.00 36.82 37.14 3mhg h ILE 149 CO -0.03 0.40 0.42 1.23 0.00 0.00 0.00 178.15 180.17 3mhg h GLY 150 N 0.61 1.20 1.01 5.37 0.00 -0.65 -1.43 103.07 109.18 3mhg h GLY 150 Ca 0.11 -0.27 -0.11 0.00 0.00 0.00 0.00 47.33 47.05 3mhg h GLY 150 CO 0.04 0.09 -0.22 1.76 0.00 0.00 0.00 176.54 178.21 3mhg h SER 151 N 0.70 0.82 -0.59 0.19 0.02 -0.81 -2.01 113.55 111.87 3mhg h SER 151 Ca 0.38 -0.42 0.10 0.00 -0.84 0.00 0.00 61.79 61.01 3mhg h SER 151 Cb 0.39 -0.23 -0.08 0.00 0.14 0.00 0.00 62.40 62.62 3mhg h SER 151 CO -0.26 1.06 0.16 -0.33 -1.14 0.00 0.00 176.83 176.32 3mhg h GLU 152 N 0.58 0.30 -0.09 3.45 5.08 -0.64 -0.75 114.58 122.51 3mhg h GLU 152 Ca 0.08 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.29 3mhg h GLU 152 Cb 0.77 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 3mhg h GLU 152 CO 0.06 0.20 -0.52 0.00 -1.00 0.00 0.00 179.01 177.75 3mhg h ARG 154 N 0.20 0.46 -0.27 0.00 2.43 -0.86 0.21 114.38 116.55 3mhg h ARG 154 Ca 0.01 -0.09 -0.02 0.00 -0.81 0.00 0.00 59.98 59.06 3mhg h ARG 154 Cb 0.98 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.45 3mhg h ARG 154 CO 0.08 0.50 0.09 0.00 -1.51 0.00 0.00 179.97 179.13 3mhg h ALA 155 N 0.94 0.36 0.00 2.80 0.00 -0.87 -2.58 119.26 119.91 3mhg h ALA 155 Ca 0.10 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3mhg h ALA 155 Cb 0.22 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3mhg h ALA 155 CO -0.01 -0.02 0.00 0.39 0.00 0.00 0.00 179.25 179.61 3mhg n GLU 156 N -4.74 0.01 -3.23 0.00 -0.58 -0.24 -4.93 120.64 106.94 3mhg n GLU 156 Ca -0.03 0.03 -0.15 0.00 -0.42 0.00 0.00 57.16 56.60 3mhg n GLU 156 Cb 0.15 -1.52 0.08 0.00 -0.57 0.00 0.00 31.44 29.58 3mhg n GLU 156 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 3mhg n ASP 157 N -1.54 -2.07 -4.03 1.62 2.03 0.60 -5.02 116.55 108.14 3mhg n ASP 157 Ca 0.07 -0.53 -0.21 0.00 0.52 0.00 0.00 54.79 54.64 3mhg n ASP 157 Cb 0.33 -4.49 -0.15 0.00 -0.72 0.00 0.00 41.12 36.09 3mhg n ASP 157 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 3mhg s ILE 158 N -3.31 0.85 0.34 5.18 2.07 -0.43 -4.28 121.20 121.62 3mhg s ILE 158 Ca 0.00 -0.41 -0.28 0.00 -1.41 0.00 0.00 60.65 58.55 3mhg s ILE 158 Cb -0.00 -0.74 -0.12 0.00 0.13 0.00 0.00 42.46 41.73 3mhg s ILE 158 CO 0.63 0.26 1.36 -2.65 -1.91 0.00 0.00 174.94 172.62 3mhg n PRO 159 N 3.14 2.28 -3.59 3.50 -0.02 -1.26 -4.56 135.00 134.49 3mhg n PRO 159 Ca -0.17 0.80 -0.41 0.00 -2.02 0.00 0.00 63.50 61.71 3mhg n PRO 159 Cb 0.55 -2.43 -0.11 0.00 -0.02 0.00 0.00 33.50 31.48 3mhg n PRO 159 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3mhg s PHE 160 N -0.98 3.25 -0.34 6.00 5.36 -1.26 -1.27 117.98 128.74 3mhg s PHE 160 Ca 0.56 -1.01 -0.15 0.00 -0.96 0.00 0.00 56.93 55.37 3mhg s PHE 160 Cb -0.55 -2.48 -0.01 0.00 -0.34 0.00 0.00 43.02 39.64 3mhg s PHE 160 CO 0.61 -0.67 0.35 0.71 -1.46 0.00 0.00 175.22 174.76 3mhg s TYR 161 N 1.54 3.21 -0.27 10.12 1.51 0.25 -0.88 117.35 132.84 3mhg s TYR 161 Ca 0.02 -0.05 -0.09 0.00 -1.01 0.00 0.00 57.07 55.94 3mhg s TYR 161 Cb -0.20 -2.65 -0.03 0.00 -0.11 0.00 0.00 41.96 38.98 3mhg s TYR 161 CO 0.06 -0.42 0.12 -1.17 -1.11 0.00 0.00 175.55 173.03 3mhg s LEU 162 N 1.98 3.73 -0.08 -1.29 2.96 -0.50 -1.35 118.68 124.13 3mhg s LEU 162 Ca 0.11 -0.21 -0.16 0.00 -0.22 0.00 0.00 54.13 53.66 3mhg s LEU 162 Cb -0.17 -2.00 -0.05 0.00 0.50 0.00 0.00 46.19 44.48 3mhg s LEU 162 CO 0.11 -0.07 0.41 -0.70 -1.32 0.00 0.00 176.35 174.78 3mhg s GLU 163 N 1.66 4.14 -0.18 1.98 2.12 0.35 -0.64 118.70 128.13 3mhg s GLU 163 Ca 0.06 0.35 0.01 0.00 0.36 0.00 0.00 54.97 55.75 3mhg s GLU 163 Cb -0.16 -3.35 0.02 0.00 0.26 0.00 0.00 34.13 30.90 3mhg s GLU 163 CO 0.06 0.39 -0.19 0.42 -0.54 0.00 0.00 175.26 175.41 3mhg s ILE 164 N -0.11 2.17 -0.19 -3.70 1.01 -0.69 -0.54 121.20 119.15 3mhg s ILE 164 Ca 0.23 -0.90 -0.04 0.00 0.00 0.00 0.00 60.65 59.93 3mhg s ILE 164 Cb -0.15 -1.91 -0.02 0.00 0.01 0.00 0.00 42.46 40.38 3mhg s ILE 164 CO 0.10 0.53 -0.03 -0.76 0.00 0.00 0.00 174.94 174.78 3mhg s LEU 165 N 1.28 3.10 0.42 2.97 1.43 -0.65 -4.26 118.68 122.98 3mhg s LEU 165 Ca 0.04 -0.26 -0.04 0.00 -1.03 0.00 0.00 54.13 52.85 3mhg s LEU 165 Cb -0.13 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 3mhg s LEU 165 CO -0.12 0.07 0.70 0.42 0.23 0.00 0.00 176.35 177.65 3mhg s THR 166 N 0.98 4.97 0.33 5.49 -4.23 -1.26 -1.50 115.64 120.41 3mhg s THR 166 Ca 0.01 0.03 -0.18 0.00 -1.18 0.00 0.00 61.69 60.36 3mhg s THR 166 Cb -0.15 -3.84 0.04 0.00 1.34 0.00 0.00 72.50 69.89 3mhg s THR 166 CO 0.01 -0.69 0.78 -0.72 -0.54 0.00 0.00 174.62 173.45 3mhg s TYR 167 N -2.53 -0.01 -0.10 3.99 -0.85 -1.17 -4.87 117.35 111.81 3mhg s TYR 167 Ca 0.45 -0.56 0.02 0.00 -0.52 0.00 0.00 57.07 56.46 3mhg s TYR 167 Cb -0.10 0.78 0.01 0.00 0.38 0.00 0.00 41.96 43.03 3mhg s TYR 167 CO 0.40 -1.40 -0.15 0.34 -1.52 0.00 0.00 175.55 173.22 3mhg s ASP 168 N -3.02 2.36 0.47 -0.18 -1.08 -1.26 -4.22 116.67 109.73 3mhg s ASP 168 Ca 0.14 -0.41 0.26 0.00 -0.52 0.00 0.00 52.55 52.02 3mhg s ASP 168 Cb -0.05 -1.06 1.30 0.00 -1.46 0.00 0.00 42.92 41.64 3mhg s ASP 168 CO 0.09 0.03 1.82 -0.33 0.52 0.00 0.00 175.17 177.30 3mhg h GLU 169 N 7.25 0.20 -0.01 4.34 5.08 -1.96 -1.55 114.58 127.93 3mhg h GLU 169 Ca -0.30 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 3mhg h GLU 169 Cb 1.18 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.39 3mhg h GLU 169 CO 0.48 0.14 -0.55 1.63 -1.00 0.00 0.00 179.01 179.71 3mhg n LYS 170 N -4.42 1.03 -3.89 2.33 4.76 -1.26 -4.86 118.16 111.85 3mhg n LYS 170 Ca 0.23 -0.85 -0.35 0.00 -2.87 0.00 0.00 58.31 54.47 3mhg n LYS 170 Cb 0.97 -1.48 -0.14 0.00 -1.84 0.00 0.00 35.03 32.54 3mhg n LYS 170 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3mhg s ILE 171 N -2.56 3.29 0.15 -0.18 1.01 -0.58 -5.00 121.20 117.33 3mhg s ILE 171 Ca 0.17 -0.83 -0.11 0.00 0.00 0.00 0.00 60.65 59.88 3mhg s ILE 171 Cb 0.18 -2.65 -0.00 0.00 0.01 0.00 0.00 42.46 40.00 3mhg s ILE 171 CO 0.62 0.20 1.54 0.00 0.00 0.00 0.00 174.94 177.30 3mhg h ALA 172 N 8.10 0.66 -3.41 9.38 0.00 -1.89 -3.40 119.26 128.70 3mhg h ALA 172 Ca -0.34 -0.39 -0.67 0.00 0.00 0.00 0.00 54.91 53.51 3mhg h ALA 172 Cb 1.12 -0.16 -0.35 0.00 0.00 0.00 0.00 17.79 18.41 3mhg h ALA 172 CO 0.59 0.65 -0.80 0.34 0.00 0.00 0.00 179.25 180.03 3mhg s ASP 173 N -6.70 4.00 0.14 0.00 2.15 -1.26 -4.98 116.67 110.02 3mhg s ASP 173 Ca -0.11 -0.98 0.17 0.00 0.43 0.00 0.00 52.55 52.05 3mhg s ASP 173 Cb 0.12 -1.57 0.75 0.00 -0.30 0.00 0.00 42.92 41.92 3mhg s ASP 173 CO 0.87 -0.11 1.52 0.59 -0.17 0.00 0.00 175.17 177.87 3mhg n ASN 174 N 4.57 0.32 -0.15 -0.34 3.02 -1.26 -1.98 115.26 119.45 3mhg n ASN 174 Ca -0.17 0.60 0.13 0.00 -0.03 0.00 0.00 54.58 55.10 3mhg n ASN 174 Cb 0.46 -0.66 0.37 0.00 -0.61 0.00 0.00 39.78 39.34 3mhg n ASN 174 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3mhg n ALA 175 N -1.64 3.17 -1.57 5.41 0.00 -1.26 -4.57 120.51 120.04 3mhg n ALA 175 Ca 0.02 -0.36 -0.32 0.00 0.00 0.00 0.00 53.44 52.78 3mhg n ALA 175 Cb 0.15 -1.16 0.04 0.00 0.00 0.00 0.00 19.45 18.48 3mhg n ALA 175 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3mhg s SER 176 N -2.67 5.44 0.43 0.00 1.04 -0.84 -4.90 113.70 112.20 3mhg s SER 176 Ca 0.20 1.75 0.09 0.00 0.48 0.00 0.00 55.95 58.48 3mhg s SER 176 Cb 0.19 -2.52 0.95 0.00 0.10 0.00 0.00 66.02 64.74 3mhg s SER 176 CO 0.57 -1.40 2.07 -0.65 0.98 0.00 0.00 173.24 174.81 3mhg h PRO 177 N -0.22 0.40 -0.31 4.02 0.11 -1.92 -1.66 132.00 132.41 3mhg h PRO 177 Ca -0.45 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 3mhg h PRO 177 Cb 1.22 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3mhg h PRO 177 CO 0.56 0.28 0.16 1.49 -0.21 0.00 0.00 178.00 180.28 3mhg h GLU 178 N 0.41 0.44 -0.39 1.05 4.81 -1.92 -2.47 114.58 116.51 3mhg h GLU 178 Ca 0.11 -0.06 -0.13 0.00 -0.13 0.00 0.00 59.36 59.15 3mhg h GLU 178 Cb -0.02 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 3mhg h GLU 178 CO -0.02 0.39 -0.30 0.35 -0.73 0.00 0.00 179.01 178.71 3mhg h PHE 179 N 0.38 0.98 -0.84 0.92 3.57 -1.74 -3.05 116.94 117.16 3mhg h PHE 179 Ca 0.11 -0.26 0.14 0.00 3.53 0.00 0.00 57.97 61.50 3mhg h PHE 179 Cb 0.09 -0.22 -0.06 0.00 2.79 0.00 0.00 35.95 38.54 3mhg h PHE 179 CO -0.02 1.03 0.55 0.00 -2.23 0.00 0.00 178.31 177.63 3mhg h ALA 180 N 0.95 1.94 0.00 2.41 0.00 -1.02 -0.37 119.26 123.16 3mhg h ALA 180 Ca 0.08 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 3mhg h ALA 180 Cb 0.85 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 3mhg h ALA 180 CO 0.07 -0.16 -0.13 0.87 0.00 0.00 0.00 179.25 179.90 3mhg h LYS 181 N 0.59 0.00 -0.01 0.00 1.57 -1.33 -3.08 116.57 114.30 3mhg h LYS 181 Ca 0.42 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.20 3mhg h LYS 181 Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.07 3mhg h LYS 181 CO -0.17 0.13 -0.01 1.33 -0.57 0.00 0.00 179.45 180.16 3mhg n VAL 182 N -3.41 0.00 -0.11 0.50 0.24 -0.29 -4.76 118.33 110.50 3mhg n VAL 182 Ca -0.01 -0.50 -0.07 0.00 -2.04 0.00 0.00 64.34 61.72 3mhg n VAL 182 Cb 0.31 1.20 0.01 0.00 -1.47 0.00 0.00 33.84 33.88 3mhg n VAL 182 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 3mhg h LYS 183 N 1.88 0.40 -0.52 7.34 3.64 -1.08 -1.68 116.57 126.55 3mhg h LYS 183 Ca 0.00 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.42 3mhg h LYS 183 Cb 0.40 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.08 3mhg h LYS 183 CO 0.00 0.26 0.22 0.00 -2.27 0.00 0.00 179.45 177.66 3mhg h ALA 184 N 1.17 0.66 -0.16 5.00 0.00 -1.77 0.21 119.26 124.37 3mhg h ALA 184 Ca 0.15 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.14 3mhg h ALA 184 Cb 0.03 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3mhg h ALA 184 CO -0.08 -0.16 -0.02 1.25 0.00 0.00 0.00 179.25 180.24 3mhg h HIS 185 N 0.42 -0.04 -0.40 0.00 -0.00 -1.78 -0.25 115.15 113.10 3mhg h HIS 185 Ca 0.25 0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.64 3mhg h HIS 185 Cb 0.23 0.04 -0.02 0.00 -0.00 0.00 0.00 27.41 27.66 3mhg h HIS 185 CO -0.14 -0.04 0.25 0.87 -0.00 0.00 0.00 177.93 178.87 3mhg h LYS 186 N 0.03 0.49 0.06 5.26 1.79 -0.58 -1.87 116.57 121.75 3mhg h LYS 186 Ca 0.08 -0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 58.51 3mhg h LYS 186 Cb 0.10 -0.11 0.00 0.00 -1.58 0.00 0.00 32.23 30.64 3mhg h LYS 186 CO -0.14 0.32 -0.03 0.28 -1.08 0.00 0.00 179.45 178.80 3mhg h VAL 187 N 0.50 1.25 -0.37 0.50 2.07 -0.84 -2.74 116.25 116.62 3mhg h VAL 187 Ca 0.15 -1.14 -0.16 0.00 0.82 0.00 0.00 66.70 66.38 3mhg h VAL 187 Cb -0.03 1.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 3mhg h VAL 187 CO -0.05 0.28 -0.38 0.78 0.02 0.00 0.00 177.57 178.21 3mhg h ASN 188 N -0.59 0.96 0.20 0.57 2.35 -1.06 -1.61 115.58 116.40 3mhg h ASN 188 Ca -0.01 -0.44 -0.15 0.00 -0.55 0.00 0.00 56.30 55.16 3mhg h ASN 188 Cb 0.52 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 3mhg h ASN 188 CO 0.01 1.23 -0.56 -0.33 -1.65 0.00 0.00 177.43 176.13 3mhg h GLU 189 N 0.74 0.38 -0.55 0.81 4.39 -1.46 -2.08 114.58 116.82 3mhg h GLU 189 Ca 0.06 -0.24 -0.09 0.00 0.34 0.00 0.00 59.36 59.43 3mhg h GLU 189 Cb 0.97 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.63 3mhg h GLU 189 CO 0.09 0.84 -0.02 0.00 -1.16 0.00 0.00 179.01 178.76 3mhg h ALA 190 N 1.11 0.93 -0.62 3.43 0.00 -1.35 -1.80 119.26 120.96 3mhg h ALA 190 Ca 0.00 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.56 3mhg h ALA 190 Cb 1.07 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 3mhg h ALA 190 CO 0.09 0.64 0.20 0.52 0.00 0.00 0.00 179.25 180.71 3mhg h MET 191 N 0.88 0.93 -0.42 0.00 2.86 -1.13 -1.71 114.93 116.34 3mhg h MET 191 Ca 0.16 -0.17 -0.05 0.00 -2.06 0.00 0.00 59.70 57.57 3mhg h MET 191 Cb 0.54 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 3mhg h MET 191 CO 0.03 0.80 0.07 -0.22 1.06 0.00 0.00 176.91 178.64 3mhg h LYS 192 N 0.91 0.70 0.16 1.72 3.64 -1.05 -1.39 116.57 121.26 3mhg h LYS 192 Ca 0.21 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3mhg h LYS 192 Cb 0.25 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 3mhg h LYS 192 CO -0.01 0.74 -0.14 0.28 -2.27 0.00 0.00 179.45 178.05 3mhg h VAL 193 N 0.55 0.69 -0.02 2.00 2.07 -1.10 -3.08 116.25 117.36 3mhg h VAL 193 Ca 0.13 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.65 3mhg h VAL 193 Cb 0.38 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 3mhg h VAL 193 CO 0.01 0.00 0.00 0.49 0.02 0.00 0.00 177.57 178.09 3mhg n PHE 194 N -5.26 0.02 1.23 1.57 3.72 -0.66 -1.90 117.46 116.18 3mhg n PHE 194 Ca -0.08 -0.01 0.14 0.00 -0.05 0.00 0.00 57.45 57.45 3mhg n PHE 194 Cb 0.18 0.00 0.55 0.00 -0.94 0.00 0.00 39.48 39.27 3mhg n PHE 194 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3mhg n SER 195 N -0.50 0.35 -4.77 4.37 7.64 -0.53 -4.66 113.62 115.51 3mhg n SER 195 Ca 0.20 -0.24 -0.41 0.00 1.01 0.00 0.00 58.87 59.43 3mhg n SER 195 Cb 0.19 -0.12 -0.00 0.00 -1.01 0.00 0.00 64.21 63.26 3mhg n SER 195 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3mhg n LYS 196 N -1.20 2.71 -0.23 1.43 5.02 -0.80 -4.88 118.16 120.20 3mhg n LYS 196 Ca 0.11 0.95 0.19 0.00 -2.02 0.00 0.00 58.31 57.55 3mhg n LYS 196 Cb 0.30 -2.71 0.52 0.00 -0.02 0.00 0.00 35.03 33.13 3mhg n LYS 196 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 3mhg h GLU 197 N 3.53 0.37 0.00 1.97 4.81 -1.90 -2.39 114.58 120.97 3mhg h GLU 197 Ca -0.50 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 3mhg h GLU 197 Cb 1.24 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.53 3mhg h GLU 197 CO 0.69 0.24 0.00 0.07 -0.73 0.00 0.00 179.01 179.28 3mhg h ARG 198 N 0.38 0.00 0.00 1.92 0.11 -1.96 -2.38 114.38 112.45 3mhg h ARG 198 Ca 0.46 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.54 3mhg h ARG 198 Cb 1.18 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.26 3mhg h ARG 198 CO -0.16 0.00 -0.51 1.19 0.10 0.00 0.00 179.97 180.59 3mhg n PHE 199 N -2.89 0.14 -1.79 4.08 3.72 -0.90 -4.71 117.46 115.12 3mhg n PHE 199 Ca -0.02 0.04 -0.16 0.00 -0.05 0.00 0.00 57.45 57.26 3mhg n PHE 199 Cb 0.12 -0.37 -0.04 0.00 -0.94 0.00 0.00 39.48 38.24 3mhg n PHE 199 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3mhg n GLY 200 N 1.46 0.86 3.74 1.37 0.00 -0.90 -4.05 105.19 107.67 3mhg n GLY 200 Ca 0.05 -0.25 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 3mhg n GLY 200 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mhg s VAL 201 N -2.67 3.82 -0.23 1.61 1.01 -1.26 -4.63 120.40 118.06 3mhg s VAL 201 Ca 0.00 1.59 0.04 0.00 0.00 0.00 0.00 61.98 63.61 3mhg s VAL 201 Cb 0.00 -4.02 -0.19 0.00 0.00 0.00 0.00 36.38 32.17 3mhg s VAL 201 CO 0.00 0.28 -0.10 0.47 0.00 0.00 0.00 175.10 175.75 3mhg n ASP 202 N 2.28 1.69 -3.81 3.32 8.00 -0.06 -4.97 116.55 123.00 3mhg n ASP 202 Ca 0.02 -0.07 -0.13 0.00 0.71 0.00 0.00 54.79 55.33 3mhg n ASP 202 Cb 0.46 -0.25 -0.14 0.00 -0.02 0.00 0.00 41.12 41.17 3mhg n ASP 202 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3mhg s VAL 203 N -2.52 -0.02 -0.19 2.53 1.01 -1.00 -4.24 120.40 115.97 3mhg s VAL 203 Ca -0.29 0.07 -0.13 0.00 0.00 0.00 0.00 61.98 61.63 3mhg s VAL 203 Cb 0.08 -0.15 -0.05 0.00 0.00 0.00 0.00 36.38 36.27 3mhg s VAL 203 CO 0.66 0.03 0.26 -0.76 0.00 0.00 0.00 175.10 175.29 3mhg s LEU 204 N 0.44 4.19 -0.34 3.92 1.43 -0.61 -1.41 118.68 126.30 3mhg s LEU 204 Ca -0.03 0.38 -0.12 0.00 -1.03 0.00 0.00 54.13 53.33 3mhg s LEU 204 Cb -0.05 -2.30 -0.00 0.00 0.03 0.00 0.00 46.19 43.87 3mhg s LEU 204 CO -0.02 0.07 0.21 -0.75 0.23 0.00 0.00 176.35 176.09 3mhg s LYS 205 N 0.74 3.26 0.15 1.70 2.20 0.19 -0.52 119.74 127.46 3mhg s LYS 205 Ca 0.14 -0.79 0.02 0.00 -0.36 0.00 0.00 55.97 54.97 3mhg s LYS 205 Cb -0.13 -3.72 -0.04 0.00 -1.51 0.00 0.00 37.83 32.42 3mhg s LYS 205 CO 0.04 -0.51 -0.03 0.14 -0.36 0.00 0.00 175.35 174.63 3mhg s VAL 206 N 1.65 0.72 0.56 4.02 -7.23 0.06 -1.70 120.40 118.48 3mhg s VAL 206 Ca 0.05 -1.97 -0.16 0.00 -1.81 0.00 0.00 61.98 58.08 3mhg s VAL 206 Cb -0.18 -1.97 -0.05 0.00 0.56 0.00 0.00 36.38 34.74 3mhg s VAL 206 CO 0.08 -0.61 1.03 -1.61 -0.31 0.00 0.00 175.10 173.68 3mhg s GLU 207 N -3.88 3.58 0.48 4.82 2.02 -1.26 -1.96 118.70 122.50 3mhg s GLU 207 Ca 0.20 1.11 -0.24 0.00 0.02 0.00 0.00 54.97 56.06 3mhg s GLU 207 Cb 0.06 -2.07 -0.07 0.00 0.10 0.00 0.00 34.13 32.14 3mhg s GLU 207 CO 0.01 -0.59 1.35 0.14 0.02 0.00 0.00 175.26 176.19 3mhg s VAL 208 N -2.51 2.27 -0.54 2.63 -7.23 -1.26 -4.88 120.40 108.88 3mhg s VAL 208 Ca 0.62 0.22 0.01 0.00 -1.81 0.00 0.00 61.98 61.02 3mhg s VAL 208 Cb -0.14 -3.12 0.08 0.00 0.56 0.00 0.00 36.38 33.76 3mhg s VAL 208 CO 0.34 0.01 0.83 -0.81 -0.31 0.00 0.00 175.10 175.17 3mhg n PRO 209 N -0.52 1.28 -3.75 4.82 -0.04 -1.26 -4.76 135.00 130.77 3mhg n PRO 209 Ca 0.07 -0.31 -0.13 0.00 -0.04 0.00 0.00 63.50 63.08 3mhg n PRO 209 Cb 0.44 -1.38 -0.09 0.00 -0.04 0.00 0.00 33.50 32.43 3mhg n PRO 209 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3mhg s VAL 210 N -0.81 0.05 -0.55 0.52 1.01 -1.26 -3.01 120.40 116.34 3mhg s VAL 210 Ca 0.06 -0.38 -0.21 0.00 0.00 0.00 0.00 61.98 61.44 3mhg s VAL 210 Cb 0.05 -0.61 0.06 0.00 0.00 0.00 0.00 36.38 35.88 3mhg s VAL 210 CO 0.01 -0.21 0.77 0.21 0.00 0.00 0.00 175.10 175.88 3mhg s ASN 211 N -1.08 6.25 0.63 3.32 3.84 -1.26 -4.92 114.94 121.71 3mhg s ASN 211 Ca -0.11 -0.82 0.39 0.00 0.21 0.00 0.00 52.86 52.53 3mhg s ASN 211 Cb -0.05 -2.35 2.14 0.00 -0.55 0.00 0.00 41.25 40.45 3mhg s ASN 211 CO 0.04 -1.09 2.30 0.24 -2.79 0.00 0.00 177.10 175.80 3mhg h MET 212 N 9.18 0.00 0.00 0.43 2.86 -1.96 -1.49 114.93 123.95 3mhg h MET 212 Ca -0.27 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 3mhg h MET 212 Cb 1.08 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.74 3mhg h MET 212 CO 1.04 0.01 0.00 1.63 1.06 0.00 0.00 176.91 180.65 3mhg n LYS 213 N -3.30 0.04 -0.12 1.72 4.76 -1.26 -1.61 118.16 118.39 3mhg n LYS 213 Ca -0.03 0.45 0.04 0.00 -2.87 0.00 0.00 58.31 55.91 3mhg n LYS 213 Cb 0.11 -1.62 0.10 0.00 -1.84 0.00 0.00 35.03 31.78 3mhg n LYS 213 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 3mhg n PHE 214 N -1.71 0.26 -3.90 2.13 3.01 -0.56 -4.09 117.46 112.60 3mhg n PHE 214 Ca 0.01 -0.63 -0.36 0.00 1.01 0.00 0.00 57.45 57.48 3mhg n PHE 214 Cb 0.07 -0.09 -0.08 0.00 -0.01 0.00 0.00 39.48 39.37 3mhg n PHE 214 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 3mhg s VAL 215 N -1.54 5.24 0.03 -4.37 1.01 -0.64 -0.76 120.40 119.38 3mhg s VAL 215 Ca 0.17 0.12 -0.37 0.00 0.00 0.00 0.00 61.98 61.91 3mhg s VAL 215 Cb 0.12 -3.33 -0.16 0.00 0.00 0.00 0.00 36.38 33.02 3mhg s VAL 215 CO 0.06 0.53 1.47 1.21 0.00 0.00 0.00 175.10 178.37 3mhg n GLU 216 N 2.78 1.34 0.00 2.72 4.07 -0.08 -0.56 120.64 130.91 3mhg n GLU 216 Ca -0.18 0.49 0.00 0.00 -0.06 0.00 0.00 57.16 57.41 3mhg n GLU 216 Cb 0.53 -2.16 0.00 0.00 -0.06 0.00 0.00 31.44 29.75 3mhg n GLU 216 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3mhg n GLY 217 N 3.01 3.44 0.01 8.31 0.00 -1.26 -4.56 105.19 114.13 3mhg n GLY 217 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 3mhg n GLY 217 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3mhg n PHE 218 N -1.86 0.00 -2.47 1.61 3.01 0.27 -5.04 117.46 112.99 3mhg n PHE 218 Ca 0.00 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.05 3mhg n PHE 218 Cb 0.00 -0.09 -0.04 0.00 -0.01 0.00 0.00 39.48 39.34 3mhg n PHE 218 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3mhg s ALA 219 N -2.14 3.39 -1.73 4.37 0.00 0.16 -4.77 121.76 121.04 3mhg s ALA 219 Ca -0.01 0.85 0.20 0.00 0.00 0.00 0.00 51.96 52.99 3mhg s ALA 219 Cb 0.01 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.73 3mhg s ALA 219 CO 0.12 -0.29 0.97 -0.40 0.00 0.00 0.00 175.76 176.16 3mhg n ASP 220 N 2.68 1.79 0.00 0.00 5.68 -1.26 -4.98 116.55 120.47 3mhg n ASP 220 Ca 0.04 -1.40 0.00 0.00 -0.50 0.00 0.00 54.79 52.94 3mhg n ASP 220 Cb 0.46 0.51 0.00 0.00 -1.14 0.00 0.00 41.12 40.94 3mhg n ASP 220 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3mhg n GLY 221 N 1.30 4.13 3.70 6.12 0.00 -1.26 -5.10 105.19 114.08 3mhg n GLY 221 Ca 0.08 -0.53 -0.44 0.00 0.00 0.00 0.00 46.02 45.13 3mhg n GLY 221 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3mhg n GLU 222 N 0.00 2.25 -3.67 1.61 2.13 -1.26 -4.98 120.64 116.72 3mhg n GLU 222 Ca 0.00 0.80 -0.38 0.00 0.66 0.00 0.00 57.16 58.24 3mhg n GLU 222 Cb 0.00 -2.49 -0.12 0.00 0.27 0.00 0.00 31.44 29.10 3mhg n GLU 222 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 3mhg s VAL 223 N -0.11 4.67 -0.15 6.31 1.01 -1.26 -4.61 120.40 126.26 3mhg s VAL 223 Ca 0.66 -0.20 0.19 0.00 0.00 0.00 0.00 61.98 62.63 3mhg s VAL 223 Cb -0.60 -3.28 -0.27 0.00 0.00 0.00 0.00 36.38 32.23 3mhg s VAL 223 CO 0.50 0.20 0.23 0.18 0.00 0.00 0.00 175.10 176.21 3mhg n LEU 224 N 4.98 0.04 -3.96 3.92 4.77 0.06 -4.98 117.00 121.83 3mhg n LEU 224 Ca -0.15 0.02 -0.18 0.00 -0.03 0.00 0.00 56.01 55.67 3mhg n LEU 224 Cb 0.51 0.33 -0.15 0.00 -2.33 0.00 0.00 43.42 41.78 3mhg n LEU 224 CO 0.33 0.34 -0.42 -0.36 -1.33 0.00 0.00 177.39 175.95 3mhg s PHE 225 N -2.81 0.69 0.97 -1.77 0.08 -0.91 -5.05 117.98 109.18 3mhg s PHE 225 Ca -0.09 -0.15 -0.12 0.00 0.12 0.00 0.00 56.93 56.69 3mhg s PHE 225 Cb 0.08 -0.51 0.17 0.00 -0.57 0.00 0.00 43.02 42.20 3mhg s PHE 225 CO 0.85 -0.07 1.09 0.95 -0.10 0.00 0.00 175.22 177.94 3mhg s THR 226 N 0.21 2.27 0.28 0.64 -4.23 -1.26 -0.90 115.64 112.65 3mhg s THR 226 Ca -0.03 0.09 -0.01 0.00 -1.18 0.00 0.00 61.69 60.56 3mhg s THR 226 Cb -0.07 -2.55 0.15 0.00 1.34 0.00 0.00 72.50 71.36 3mhg s THR 226 CO -0.00 -0.12 1.81 0.11 -0.54 0.00 0.00 174.62 175.89 3mhg h LYS 227 N -1.81 0.82 -0.35 3.99 1.57 -1.96 -1.86 116.57 116.97 3mhg h LYS 227 Ca -0.53 -0.18 -0.10 0.00 -1.87 0.00 0.00 60.65 57.97 3mhg h LYS 227 Cb 1.31 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 3mhg h LYS 227 CO 0.56 0.75 -0.21 1.49 -0.57 0.00 0.00 179.45 181.48 3mhg h GLU 228 N 0.78 0.66 -0.45 3.15 4.57 -1.97 0.52 114.58 121.84 3mhg h GLU 228 Ca 0.17 -0.25 -0.10 0.00 -1.18 0.00 0.00 59.36 58.00 3mhg h GLU 228 Cb 0.32 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 3mhg h GLU 228 CO 0.00 0.82 -0.09 0.93 -1.18 0.00 0.00 179.01 179.49 3mhg h GLU 229 N 0.59 0.86 -0.52 1.92 5.08 -1.85 -1.49 114.58 119.17 3mhg h GLU 229 Ca 0.09 -0.32 -0.07 0.00 -1.00 0.00 0.00 59.36 58.06 3mhg h GLU 229 Cb 0.67 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 3mhg h GLU 229 CO 0.05 0.96 0.06 0.00 -1.00 0.00 0.00 179.01 179.08 3mhg h ALA 230 N 0.88 0.69 -0.93 3.43 0.00 -1.14 -2.65 119.26 119.55 3mhg h ALA 230 Ca 0.12 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.80 3mhg h ALA 230 Cb 0.63 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 3mhg h ALA 230 CO 0.04 0.45 0.60 0.00 0.00 0.00 0.00 179.25 180.35 3mhg h ALA 231 N 0.97 1.22 -0.27 0.00 0.00 -0.78 -1.77 119.26 118.62 3mhg h ALA 231 Ca 0.16 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 3mhg h ALA 231 Cb 0.43 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3mhg h ALA 231 CO 0.01 0.48 0.06 0.37 0.00 0.00 0.00 179.25 180.17 3mhg h GLN 232 N 1.18 0.39 -0.57 0.00 5.75 -1.02 -1.70 115.11 119.14 3mhg h GLN 232 Ca 0.37 -0.05 -0.07 0.00 -0.15 0.00 0.00 58.65 58.74 3mhg h GLN 232 Cb -0.02 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.44 3mhg h GLN 232 CO -0.11 0.37 0.07 0.00 -2.65 0.00 0.00 178.83 176.51 3mhg h ALA 233 N 1.68 1.06 -0.56 3.38 0.00 -0.98 0.13 119.26 123.98 3mhg h ALA 233 Ca 0.09 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 3mhg h ALA 233 Cb 0.17 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3mhg h ALA 233 CO -0.00 0.60 0.02 0.74 0.00 0.00 0.00 179.25 180.61 3mhg h PHE 234 N 0.87 1.05 -0.40 0.00 0.04 -1.15 -0.57 116.94 116.77 3mhg h PHE 234 Ca 0.18 -0.18 -0.09 0.00 2.80 0.00 0.00 57.97 60.68 3mhg h PHE 234 Cb 0.41 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.26 3mhg h PHE 234 CO 0.03 0.95 -0.11 0.00 -0.60 0.00 0.00 178.31 178.57 3mhg h ARG 235 N 0.85 0.71 -0.85 1.51 3.08 -1.00 -0.77 114.38 117.91 3mhg h ARG 235 Ca 0.16 -0.23 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 3mhg h ARG 235 Cb 0.51 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.46 3mhg h ARG 235 CO 0.02 0.80 0.42 -0.44 -1.07 0.00 0.00 179.97 179.70 3mhg h ASP 236 N 0.65 1.11 -0.35 7.04 3.32 -0.53 -1.07 116.42 126.59 3mhg h ASP 236 Ca 0.11 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 3mhg h ASP 236 Cb 0.56 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 3mhg h ASP 236 CO 0.04 0.93 0.17 -0.61 -1.72 0.00 0.00 179.24 178.05 3mhg h GLN 237 N 1.22 0.51 -0.49 3.56 4.15 -0.67 -2.46 115.11 120.92 3mhg h GLN 237 Ca 0.29 -0.07 0.01 0.00 0.77 0.00 0.00 58.65 59.65 3mhg h GLN 237 Cb 0.11 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.68 3mhg h GLN 237 CO -0.04 0.46 0.32 1.49 -1.93 0.00 0.00 178.83 179.14 3mhg h GLU 238 N 0.43 0.63 -0.00 1.69 4.57 -0.77 -1.41 114.58 119.72 3mhg h GLU 238 Ca 0.12 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.26 3mhg h GLU 238 Cb 0.12 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.57 3mhg h GLU 238 CO -0.02 0.41 0.00 0.00 -1.18 0.00 0.00 179.01 178.23 3mhg n ALA 239 N -2.47 2.66 0.55 2.92 0.00 -0.44 -3.67 120.51 120.07 3mhg n ALA 239 Ca 0.04 -0.23 0.12 0.00 0.00 0.00 0.00 53.44 53.37 3mhg n ALA 239 Cb 0.07 -1.45 0.12 0.00 0.00 0.00 0.00 19.45 18.20 3mhg n ALA 239 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3mhg n SER 240 N -0.81 0.68 -3.60 0.00 3.41 -0.53 -4.96 113.62 107.81 3mhg n SER 240 Ca 0.22 0.04 -0.15 0.00 -0.26 0.00 0.00 58.87 58.72 3mhg n SER 240 Cb 0.14 0.35 -0.06 0.00 -0.26 0.00 0.00 64.21 64.38 3mhg n SER 240 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3mhg s THR 241 N -3.18 0.03 -1.04 6.66 -1.32 -1.24 -3.88 115.64 111.66 3mhg s THR 241 Ca 0.05 -0.24 0.10 0.00 -1.21 0.00 0.00 61.69 60.39 3mhg s THR 241 Cb 0.14 -0.92 0.21 0.00 -1.51 0.00 0.00 72.50 70.41 3mhg s THR 241 CO 0.75 -0.13 1.08 -0.67 -2.21 0.00 0.00 174.62 173.43 3mhg n ASP 242 N 0.67 2.47 -4.84 8.08 2.03 -1.26 -4.93 116.55 118.77 3mhg n ASP 242 Ca -0.19 -1.77 -0.32 0.00 0.52 0.00 0.00 54.79 53.03 3mhg n ASP 242 Cb 0.59 -0.13 -0.02 0.00 -0.72 0.00 0.00 41.12 40.84 3mhg n ASP 242 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3mhg s LEU 243 N -0.95 3.55 0.39 -2.67 1.43 -1.26 -4.96 118.68 114.20 3mhg s LEU 243 Ca 0.18 1.61 -0.28 0.00 -1.03 0.00 0.00 54.13 54.62 3mhg s LEU 243 Cb 0.10 -4.51 -0.11 0.00 0.03 0.00 0.00 46.19 41.71 3mhg s LEU 243 CO 0.14 -0.77 1.49 -2.84 0.23 0.00 0.00 176.35 174.60 3mhg s PRO 244 N -4.20 4.05 0.01 1.29 0.02 -1.26 -4.91 135.00 130.00 3mhg s PRO 244 Ca 0.60 2.57 -0.02 0.00 0.02 0.00 0.00 61.00 64.17 3mhg s PRO 244 Cb -0.12 -2.93 -0.01 0.00 0.02 0.00 0.00 34.50 31.46 3mhg s PRO 244 CO 0.35 -0.58 0.02 1.52 -0.33 0.00 0.00 177.00 177.98 3mhg s TYR 245 N -1.13 0.15 0.08 6.54 -0.85 -1.26 -1.57 117.35 119.32 3mhg s TYR 245 Ca 0.54 -0.32 0.03 0.00 -0.52 0.00 0.00 57.07 56.80 3mhg s TYR 245 Cb -0.46 -0.12 -0.03 0.00 0.38 0.00 0.00 41.96 41.72 3mhg s TYR 245 CO 0.63 -0.18 -0.10 0.96 -1.52 0.00 0.00 175.55 175.34 3mhg s ILE 246 N -1.16 0.85 -0.03 -3.49 -4.36 0.32 -0.73 121.20 112.61 3mhg s ILE 246 Ca -0.13 -1.48 -0.11 0.00 -0.26 0.00 0.00 60.65 58.67 3mhg s ILE 246 Cb -0.08 -1.16 -0.05 0.00 1.25 0.00 0.00 42.46 42.42 3mhg s ILE 246 CO -0.00 -0.49 0.31 -0.31 0.24 0.00 0.00 174.94 174.69 3mhg s TYR 247 N -2.11 3.66 0.29 1.37 2.02 -0.77 -0.76 117.35 121.05 3mhg s TYR 247 Ca 0.01 0.79 -0.06 0.00 -0.37 0.00 0.00 57.07 57.44 3mhg s TYR 247 Cb -0.05 -2.14 -0.05 0.00 -0.40 0.00 0.00 41.96 39.32 3mhg s TYR 247 CO 0.00 0.66 0.56 -0.48 -1.57 0.00 0.00 175.55 174.73 3mhg s LEU 248 N -1.20 4.06 0.18 -1.29 0.05 -0.83 -1.60 118.68 118.05 3mhg s LEU 248 Ca 0.22 0.76 0.12 0.00 0.05 0.00 0.00 54.13 55.29 3mhg s LEU 248 Cb -0.15 -3.58 -0.07 0.00 -2.05 0.00 0.00 46.19 40.35 3mhg s LEU 248 CO 0.11 -0.19 1.28 0.77 -0.55 0.00 0.00 176.35 177.77 3mhg h SER 249 N 1.77 0.00 -0.49 1.48 4.64 -1.92 -3.43 113.55 115.60 3mhg h SER 249 Ca -0.47 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 60.64 3mhg h SER 249 Cb 1.19 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.19 3mhg h SER 249 CO 0.66 0.70 -0.19 0.00 -0.87 0.00 0.00 176.83 177.14 3mhg n ALA 250 N -2.30 -0.16 -1.15 5.18 0.00 -1.26 -2.82 120.51 118.00 3mhg n ALA 250 Ca -0.01 0.17 -0.05 0.00 0.00 0.00 0.00 53.44 53.54 3mhg n ALA 250 Cb 0.83 -1.45 -0.02 0.00 0.00 0.00 0.00 19.45 18.81 3mhg n ALA 250 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mhg n GLY 251 N -0.80 0.76 3.61 0.00 0.00 -1.26 -5.04 105.19 102.46 3mhg n GLY 251 Ca -0.10 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.15 3mhg n GLY 251 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3mhg s VAL 252 N -2.07 1.65 0.63 1.61 -7.23 -1.13 -4.76 120.40 109.10 3mhg s VAL 252 Ca 0.00 0.00 -0.16 0.00 -1.81 0.00 0.00 61.98 60.01 3mhg s VAL 252 Cb 0.00 -2.50 -0.02 0.00 0.56 0.00 0.00 36.38 34.42 3mhg s VAL 252 CO 0.00 0.00 1.12 -0.94 -0.31 0.00 0.00 175.10 174.97 3mhg s SER 253 N -3.88 5.27 0.23 4.85 1.04 -1.26 -4.16 113.70 115.79 3mhg s SER 253 Ca 0.70 2.06 -0.07 0.00 0.48 0.00 0.00 55.95 59.13 3mhg s SER 253 Cb -0.10 -2.56 0.38 0.00 0.10 0.00 0.00 66.02 63.84 3mhg s SER 253 CO 0.56 -1.52 1.72 0.00 0.98 0.00 0.00 173.24 174.98 3mhg h ALA 254 N 0.37 0.92 -0.39 5.32 0.00 -1.93 -1.11 119.26 122.44 3mhg h ALA 254 Ca -0.48 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 3mhg h ALA 254 Cb 1.25 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.13 3mhg h ALA 254 CO 0.55 -0.23 0.20 -0.22 0.00 0.00 0.00 179.25 179.55 3mhg h LYS 255 N 0.39 0.56 -0.67 0.00 1.63 -1.91 -1.38 116.57 115.18 3mhg h LYS 255 Ca 0.37 -0.07 -0.08 0.00 -0.85 0.00 0.00 60.65 60.01 3mhg h LYS 255 Cb 0.54 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 32.04 3mhg h LYS 255 CO -0.39 0.47 0.10 1.25 -3.45 0.00 0.00 179.45 177.43 3mhg h LEU 256 N 0.50 1.07 -0.37 5.20 5.85 -1.81 -1.54 115.31 124.20 3mhg h LEU 256 Ca 0.14 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 3mhg h LEU 256 Cb 0.09 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.82 3mhg h LEU 256 CO -0.02 1.06 0.18 0.15 -0.34 0.00 0.00 178.44 179.47 3mhg h PHE 257 N 1.04 0.54 -0.13 1.25 3.57 -1.05 0.09 116.94 122.24 3mhg h PHE 257 Ca 0.20 -0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.71 3mhg h PHE 257 Cb 0.45 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 38.99 3mhg h PHE 257 CO 0.03 0.45 -0.09 1.96 -2.23 0.00 0.00 178.31 178.43 3mhg h GLN 258 N 0.46 -0.10 -0.10 1.11 4.20 -1.06 -1.53 115.11 118.09 3mhg h GLN 258 Ca 0.13 0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.80 3mhg h GLN 258 Cb 0.12 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 3mhg h GLN 258 CO -0.02 -0.07 -0.14 -0.44 -0.67 0.00 0.00 178.83 177.49 3mhg h ASP 259 N -0.10 0.15 -0.64 1.46 3.32 -1.06 -2.25 116.42 117.31 3mhg h ASP 259 Ca 0.08 -0.03 -0.08 0.00 0.02 0.00 0.00 57.03 57.02 3mhg h ASP 259 Cb 0.22 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 3mhg h ASP 259 CO -0.19 0.32 0.09 0.74 -1.72 0.00 0.00 179.24 178.47 3mhg h THR 260 N 0.15 1.26 -0.52 0.35 2.02 -0.43 -0.82 112.91 114.93 3mhg h THR 260 Ca 0.03 -1.04 -0.12 0.00 0.77 0.00 0.00 66.41 66.05 3mhg h THR 260 Cb 0.36 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.44 3mhg h THR 260 CO 0.02 0.39 -0.15 -0.07 0.37 0.00 0.00 175.52 176.08 3mhg h LEU 261 N 0.98 1.01 -0.63 2.58 3.38 -0.75 0.19 115.31 122.08 3mhg h LEU 261 Ca 0.19 -0.35 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 3mhg h LEU 261 Cb 0.45 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 3mhg h LEU 261 CO 0.02 1.14 0.38 0.58 0.09 0.00 0.00 178.44 180.65 3mhg h VAL 262 N 0.88 1.18 -0.51 1.22 2.07 -1.32 -1.46 116.25 118.32 3mhg h VAL 262 Ca 0.13 -0.41 -0.06 0.00 0.82 0.00 0.00 66.70 67.18 3mhg h VAL 262 Cb 0.71 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 3mhg h VAL 262 CO 0.05 0.19 0.08 0.15 0.02 0.00 0.00 177.57 178.07 3mhg h PHE 263 N 0.85 0.90 -0.44 1.57 3.57 -0.61 -1.75 116.94 121.04 3mhg h PHE 263 Ca 0.23 -0.13 0.04 0.00 3.53 0.00 0.00 57.97 61.64 3mhg h PHE 263 Cb -0.03 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 38.43 3mhg h PHE 263 CO -0.02 0.82 0.20 0.00 -2.23 0.00 0.00 178.31 177.08 3mhg h ALA 264 N 0.98 0.54 -0.21 2.41 0.00 -0.40 -0.81 119.26 121.77 3mhg h ALA 264 Ca 0.16 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 3mhg h ALA 264 Cb 0.40 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3mhg h ALA 264 CO 0.01 -0.17 0.07 0.00 0.00 0.00 0.00 179.25 179.17 3mhg h ALA 265 N 1.25 0.28 -0.37 0.00 0.00 -1.05 -1.24 119.26 118.13 3mhg h ALA 265 Ca 0.19 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 3mhg h ALA 265 Cb 0.13 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3mhg h ALA 265 CO -0.16 -0.10 0.11 0.93 0.00 0.00 0.00 179.25 180.03 3mhg h GLU 266 N 0.18 0.53 0.00 0.00 5.08 -1.13 -2.43 114.58 116.81 3mhg h GLU 266 Ca 0.07 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 3mhg h GLU 266 Cb 0.22 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3mhg h GLU 266 CO -0.00 0.48 -0.34 0.77 -1.00 0.00 0.00 179.01 178.91 3mhg h SER 267 N 0.53 0.00 0.00 1.42 0.02 -0.78 -3.47 113.55 111.27 3mhg h SER 267 Ca 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 3mhg h SER 267 Cb 0.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.71 3mhg h SER 267 CO -0.01 0.34 0.00 0.61 -1.14 0.00 0.00 176.83 176.63 3mhg n GLY 268 N -0.01 0.95 3.68 -3.77 0.00 -0.87 -4.62 105.19 100.54 3mhg n GLY 268 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 3mhg n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mhg s ALA 269 N -1.79 3.64 -0.99 4.61 0.00 -0.52 -4.88 121.76 121.83 3mhg s ALA 269 Ca 0.00 1.04 -0.02 0.00 0.00 0.00 0.00 51.96 52.99 3mhg s ALA 269 Cb 0.00 -3.69 0.31 0.00 0.00 0.00 0.00 23.12 19.74 3mhg s ALA 269 CO 0.00 -1.17 1.92 1.63 0.00 0.00 0.00 175.76 178.14 3mhg n LYS 270 N 6.11 4.75 -1.79 0.00 4.76 -1.26 -4.37 118.16 126.35 3mhg n LYS 270 Ca 0.16 -4.31 -0.33 0.00 -2.87 0.00 0.00 58.31 50.97 3mhg n LYS 270 Cb 0.42 -2.43 0.04 0.00 -1.84 0.00 0.00 35.03 31.22 3mhg n LYS 270 CO 0.00 0.00 0.00 -0.59 -1.37 0.00 0.00 177.40 175.44 3mhg s PHE 271 N -4.07 2.78 -0.68 2.13 -0.12 -1.26 -4.67 117.98 112.09 3mhg s PHE 271 Ca 0.43 1.53 0.14 0.00 -0.05 0.00 0.00 56.93 58.98 3mhg s PHE 271 Cb 0.25 -3.08 0.46 0.00 -0.63 0.00 0.00 43.02 40.02 3mhg s PHE 271 CO -0.20 -1.47 1.39 0.09 -0.05 0.00 0.00 175.22 174.98 3mhg n ASN 272 N -2.44 3.62 0.00 1.98 4.13 0.09 -0.42 115.26 122.22 3mhg n ASN 272 Ca 0.09 -2.46 0.00 0.00 1.68 0.00 0.00 54.58 53.89 3mhg n ASN 272 Cb 0.52 -0.41 0.00 0.00 -1.54 0.00 0.00 39.78 38.35 3mhg n ASN 272 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3mhg n GLY 273 N 0.24 0.79 3.12 7.41 0.00 -1.26 -1.09 105.19 114.40 3mhg n GLY 273 Ca 0.18 -1.82 -0.09 0.00 0.00 0.00 0.00 46.02 44.29 3mhg n GLY 273 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3mhg s VAL 274 N -2.88 0.14 -0.50 1.61 -7.23 0.23 -1.85 120.40 109.93 3mhg s VAL 274 Ca 0.00 -1.19 0.02 0.00 -1.81 0.00 0.00 61.98 59.00 3mhg s VAL 274 Cb 0.00 -1.00 0.13 0.00 0.56 0.00 0.00 36.38 36.07 3mhg s VAL 274 CO 0.00 -0.66 0.25 -0.76 -0.31 0.00 0.00 175.10 173.62 3mhg s LEU 275 N -2.28 4.65 -0.24 1.32 1.43 -0.63 -2.03 118.68 120.91 3mhg s LEU 275 Ca -0.03 -2.74 -0.08 0.00 -1.03 0.00 0.00 54.13 50.24 3mhg s LEU 275 Cb 0.00 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.49 3mhg s LEU 275 CO -0.06 -0.31 0.10 0.00 0.23 0.00 0.00 176.35 176.31 3mhg n GLY 277 N 4.59 0.32 0.35 0.00 0.00 -1.26 -1.06 105.19 108.13 3mhg n GLY 277 Ca -0.16 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.94 3mhg n GLY 277 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3mhg h ARG 278 N 0.00 0.86 -0.32 1.61 3.08 -1.95 -0.50 114.38 117.16 3mhg h ARG 278 Ca 0.00 -0.05 0.09 0.00 0.07 0.00 0.00 59.98 60.09 3mhg h ARG 278 Cb 0.00 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.84 3mhg h ARG 278 CO 0.00 0.57 0.30 0.00 -1.07 0.00 0.00 179.97 179.77 3mhg h ALA 279 N 1.55 2.08 0.00 0.04 0.00 -1.86 -0.63 119.26 120.45 3mhg h ALA 279 Ca 0.50 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 55.15 3mhg h ALA 279 Cb 0.57 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 3mhg h ALA 279 CO -0.30 -0.46 -1.36 2.41 0.00 0.00 0.00 179.25 179.54 3mhg n THR 280 N -3.98 1.54 0.61 0.00 -1.04 -0.23 -3.83 114.28 107.35 3mhg n THR 280 Ca 0.05 -0.07 0.07 0.00 -2.04 0.00 0.00 64.05 62.06 3mhg n THR 280 Cb 0.46 -2.02 0.02 0.00 -1.82 0.00 0.00 70.33 66.97 3mhg n THR 280 CO 0.00 0.00 0.00 -2.67 -0.64 0.00 0.00 175.07 171.76 3mhg n TRP 281 N -4.39 0.00 -0.24 -1.42 4.27 -1.00 -4.68 117.44 109.98 3mhg n TRP 281 Ca -0.33 0.00 0.02 0.00 -3.89 0.00 0.00 57.50 53.29 3mhg n TRP 281 Cb 0.71 0.00 0.10 0.00 -1.36 0.00 0.00 31.31 30.75 3mhg n TRP 281 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 3mhg h ALA 282 N 2.56 0.55 0.00 -1.67 0.00 -1.35 -0.84 119.26 118.51 3mhg h ALA 282 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3mhg h ALA 282 Cb 0.52 0.50 0.00 0.00 0.00 0.00 0.00 17.79 18.80 3mhg h ALA 282 CO 0.00 -0.42 0.00 0.41 0.00 0.00 0.00 179.25 179.24 3mhg n GLY 283 N -1.45 -1.00 0.20 0.00 0.00 -1.26 -2.58 105.19 99.10 3mhg n GLY 283 Ca 0.10 0.11 0.08 0.00 0.00 0.00 0.00 46.02 46.31 3mhg n GLY 283 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3mhg h SER 284 N 0.00 0.00 0.04 1.61 4.64 -1.51 -3.30 113.55 115.04 3mhg h SER 284 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3mhg h SER 284 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 3mhg h SER 284 CO 0.00 0.30 -0.02 0.58 -0.87 0.00 0.00 176.83 176.82 3mhg h VAL 285 N 0.00 1.16 -0.33 0.95 2.07 -1.66 0.12 116.25 118.57 3mhg h VAL 285 Ca -0.00 -0.64 0.03 0.00 0.82 0.00 0.00 66.70 66.91 3mhg h VAL 285 Cb 0.84 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 32.16 3mhg h VAL 285 CO 0.04 0.16 0.13 0.50 0.02 0.00 0.00 177.57 178.42 3mhg h LYS 286 N -0.33 0.27 -0.53 1.57 3.64 -1.79 -1.62 116.57 117.79 3mhg h LYS 286 Ca -0.01 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3mhg h LYS 286 Cb 0.31 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.04 3mhg h LYS 286 CO 0.01 0.18 0.33 0.28 -2.27 0.00 0.00 179.45 177.98 3mhg h VAL 287 N 0.28 1.15 -0.21 2.00 2.07 -1.60 -0.09 116.25 119.84 3mhg h VAL 287 Ca 0.15 -0.31 0.01 0.00 0.82 0.00 0.00 66.70 67.36 3mhg h VAL 287 Cb 0.10 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 3mhg h VAL 287 CO -0.14 0.15 0.12 0.22 0.02 0.00 0.00 177.57 177.94 3mhg h TYR 288 N 0.71 0.22 -0.25 1.57 3.20 -0.50 0.79 116.97 122.71 3mhg h TYR 288 Ca 0.19 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.96 3mhg h TYR 288 Cb -0.04 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.16 3mhg h TYR 288 CO -0.03 0.13 -0.28 0.82 -1.64 0.00 0.00 178.16 177.16 3mhg h ILE 289 N 0.25 1.32 0.08 1.81 1.08 -1.11 -0.38 117.51 120.55 3mhg h ILE 289 Ca 0.08 -1.46 -0.25 0.00 -0.39 0.00 0.00 64.86 62.85 3mhg h ILE 289 Cb -0.00 1.69 -0.01 0.00 -3.07 0.00 0.00 36.82 35.43 3mhg h ILE 289 CO -0.04 0.46 -1.14 -0.33 -0.69 0.00 0.00 178.15 176.40 3mhg h GLU 290 N 0.33 0.17 0.00 2.37 5.08 -1.00 -3.40 114.58 118.14 3mhg h GLU 290 Ca 0.03 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 3mhg h GLU 290 Cb 0.85 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.21 3mhg h GLU 290 CO 0.07 1.13 -0.10 0.39 -1.00 0.00 0.00 179.01 179.50 3mhg n GLU 291 N -3.47 5.77 0.00 2.33 -0.58 0.26 -5.08 120.64 119.86 3mhg n GLU 291 Ca -0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.69 3mhg n GLU 291 Cb 0.99 -0.51 0.00 0.00 -0.57 0.00 0.00 31.44 31.34 3mhg n GLU 291 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3mhg n GLY 292 N 1.07 0.69 0.11 0.62 0.00 -0.15 -4.45 105.19 103.08 3mhg n GLY 292 Ca 0.00 -2.05 -0.09 0.00 0.00 0.00 0.00 46.02 43.87 3mhg n GLY 292 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3mhg h PRO 293 N 0.00 0.26 -0.60 1.61 0.13 -1.90 -1.84 132.00 129.66 3mhg h PRO 293 Ca 0.00 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 65.09 3mhg h PRO 293 Cb 0.00 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 31.04 3mhg h PRO 293 CO 0.00 0.17 0.27 0.37 -0.23 0.00 0.00 178.00 178.58 3mhg h GLN 294 N 0.26 0.89 -0.60 0.86 5.75 -1.96 -0.37 115.11 119.93 3mhg h GLN 294 Ca 0.09 -0.14 -0.02 0.00 -0.15 0.00 0.00 58.65 58.42 3mhg h GLN 294 Cb -0.00 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 28.37 3mhg h GLN 294 CO -0.04 0.73 0.27 0.00 -2.65 0.00 0.00 178.83 177.14 3mhg h ALA 295 N 1.11 1.35 -0.46 3.38 0.00 -1.74 -1.74 119.26 121.16 3mhg h ALA 295 Ca 0.21 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3mhg h ALA 295 Cb 0.15 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3mhg h ALA 295 CO -0.02 0.50 0.12 0.00 0.00 0.00 0.00 179.25 179.85 3mhg h ALA 296 N 1.45 0.61 -0.65 0.00 0.00 -0.66 -1.32 119.26 118.69 3mhg h ALA 296 Ca 0.21 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 55.00 3mhg h ALA 296 Cb 0.11 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 17.66 3mhg h ALA 296 CO -0.03 0.29 0.33 0.00 0.00 0.00 0.00 179.25 179.84 3mhg h ARG 297 N 0.62 0.57 -0.14 0.00 3.08 -0.55 -0.08 114.38 117.88 3mhg h ARG 297 Ca 0.15 -0.03 -0.11 0.00 0.07 0.00 0.00 59.98 60.05 3mhg h ARG 297 Cb 0.31 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 3mhg h ARG 297 CO -0.00 0.37 -0.39 0.93 -1.07 0.00 0.00 179.97 179.81 3mhg h GLU 298 N 0.58 0.30 -0.38 0.04 5.08 -1.11 -0.66 114.58 118.43 3mhg h GLU 298 Ca 0.31 -0.14 -0.03 0.00 -1.00 0.00 0.00 59.36 58.50 3mhg h GLU 298 Cb 0.28 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 3mhg h GLU 298 CO -0.23 0.65 0.12 2.35 -1.00 0.00 0.00 179.01 180.89 3mhg h TRP 299 N 0.25 0.62 -0.15 4.33 7.01 -0.60 -2.90 115.95 124.50 3mhg h TRP 299 Ca 0.02 -0.06 -0.07 0.00 2.11 0.00 0.00 58.89 60.89 3mhg h TRP 299 Cb 0.81 -0.18 -0.01 0.00 -2.10 0.00 0.00 29.16 27.68 3mhg h TRP 299 CO 0.02 0.59 -0.21 -0.07 -2.79 0.00 0.00 178.44 175.97 3mhg h LEU 300 N 0.47 0.26 0.00 0.65 3.38 -0.51 0.43 115.31 119.99 3mhg h LEU 300 Ca 0.12 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3mhg h LEU 300 Cb 0.26 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3mhg h LEU 300 CO -0.00 0.49 -0.00 0.54 0.09 0.00 0.00 178.44 179.55 3mhg n ARG 301 N -4.19 0.18 0.00 1.13 1.74 -0.30 -0.55 116.66 114.67 3mhg n ARG 301 Ca -0.01 0.14 0.00 0.00 -0.77 0.00 0.00 57.85 57.22 3mhg n ARG 301 Cb 0.34 -1.71 0.00 0.00 -1.02 0.00 0.00 32.46 30.07 3mhg n ARG 301 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3mhg n THR 302 N -2.01 0.00 -0.11 0.55 -2.24 -0.93 -4.54 114.28 104.99 3mhg n THR 302 Ca 0.06 0.04 -0.11 0.00 -2.27 0.00 0.00 64.05 61.77 3mhg n THR 302 Cb 0.40 -0.84 -0.03 0.00 -2.10 0.00 0.00 70.33 67.76 3mhg n THR 302 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3mhg h GLU 303 N 0.00 0.64 -0.38 -0.78 4.39 -1.22 -1.23 114.58 116.00 3mhg h GLU 303 Ca 0.00 -0.25 -0.02 0.00 0.34 0.00 0.00 59.36 59.43 3mhg h GLU 303 Cb 0.00 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 3mhg h GLU 303 CO 0.00 0.82 0.15 0.78 -1.16 0.00 0.00 179.01 179.60 3mhg h GLY 304 N 0.42 0.61 1.00 -3.84 0.00 -1.19 -1.41 103.07 98.67 3mhg h GLY 304 Ca 0.08 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.07 3mhg h GLY 304 CO 0.03 0.32 0.34 -2.75 0.00 0.00 0.00 176.54 174.48 3mhg h PHE 305 N 0.47 0.87 -0.68 5.60 3.57 -0.81 -1.95 116.94 124.02 3mhg h PHE 305 Ca 0.13 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.64 3mhg h PHE 305 Cb 0.19 -0.28 -0.04 0.00 2.79 0.00 0.00 35.95 38.61 3mhg h PHE 305 CO -0.00 0.63 0.42 -0.22 -2.23 0.00 0.00 178.31 176.90 3mhg h LYS 306 N 0.86 0.78 -0.17 1.11 3.64 -0.93 0.33 116.57 122.19 3mhg h LYS 306 Ca 0.22 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 3mhg h LYS 306 Cb 0.05 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 3mhg h LYS 306 CO -0.03 0.52 0.11 -0.91 -2.27 0.00 0.00 179.45 176.86 3mhg h ASN 307 N 0.81 0.20 0.71 4.20 2.35 -0.84 -1.65 115.58 121.36 3mhg h ASN 307 Ca 0.28 -0.02 -0.21 0.00 -0.55 0.00 0.00 56.30 55.79 3mhg h ASN 307 Cb 0.04 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 3mhg h ASN 307 CO -0.12 0.16 -0.97 -0.29 -1.65 0.00 0.00 177.43 174.57 3mhg h ILE 308 N 0.22 1.56 -0.22 2.81 2.10 -1.05 -2.33 117.51 120.59 3mhg h ILE 308 Ca 0.06 -2.91 -0.03 0.00 1.08 0.00 0.00 64.86 63.07 3mhg h ILE 308 Cb -0.01 2.65 -0.01 0.00 -1.09 0.00 0.00 36.82 38.36 3mhg h ILE 308 CO -0.01 0.84 0.02 -0.78 -1.08 0.00 0.00 178.15 177.14 3mhg h ASP 309 N 0.06 0.36 -0.18 2.19 3.58 -0.33 -0.04 116.42 122.07 3mhg h ASP 309 Ca -0.05 -0.28 -0.09 0.00 0.42 0.00 0.00 57.03 57.03 3mhg h ASP 309 Cb 1.64 -0.10 -0.02 0.00 1.72 0.00 0.00 39.33 42.58 3mhg h ASP 309 CO 0.14 0.55 -0.18 -0.33 -2.88 0.00 0.00 179.24 176.54 3mhg h GLU 310 N 0.16 0.61 -0.38 0.28 4.39 -1.34 -1.70 114.58 116.60 3mhg h GLU 310 Ca 0.07 -0.21 -0.00 0.00 0.34 0.00 0.00 59.36 59.55 3mhg h GLU 310 Cb 0.35 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.94 3mhg h GLU 310 CO 0.01 0.76 0.24 1.25 -1.16 0.00 0.00 179.01 180.10 3mhg h LEU 311 N 0.54 0.45 -0.83 1.33 5.85 -1.27 -1.97 115.31 119.41 3mhg h LEU 311 Ca 0.09 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 3mhg h LEU 311 Cb 0.62 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.50 3mhg h LEU 311 CO 0.04 0.36 0.45 0.78 -0.34 0.00 0.00 178.44 179.73 3mhg h ASN 312 N 0.51 1.04 -0.85 1.25 2.35 -0.58 0.82 115.58 120.11 3mhg h ASN 312 Ca 0.14 -0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 3mhg h ASN 312 Cb -0.02 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.05 3mhg h ASN 312 CO -0.03 0.84 0.49 0.11 -1.65 0.00 0.00 177.43 177.19 3mhg h LYS 313 N 1.15 1.18 -0.29 0.81 1.57 -1.16 -0.96 116.57 118.88 3mhg h LYS 313 Ca 0.29 -0.12 -0.11 0.00 -1.87 0.00 0.00 60.65 58.84 3mhg h LYS 313 Cb 0.03 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 3mhg h LYS 313 CO -0.05 0.85 -0.25 0.28 -0.57 0.00 0.00 179.45 179.72 3mhg h VAL 314 N 1.19 1.30 -0.90 0.50 2.07 -0.57 -3.00 116.25 116.84 3mhg h VAL 314 Ca 0.30 -1.40 0.09 0.00 0.82 0.00 0.00 66.70 66.51 3mhg h VAL 314 Cb -0.00 1.55 -0.07 0.00 -1.52 0.00 0.00 31.29 31.25 3mhg h VAL 314 CO -0.05 0.45 0.55 -0.07 0.02 0.00 0.00 177.57 178.47 3mhg h LEU 315 N 0.43 0.84 -2.01 2.57 3.38 -0.59 -1.27 115.31 118.65 3mhg h LEU 315 Ca 0.05 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.13 3mhg h LEU 315 Cb 0.81 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 3mhg h LEU 315 CO 0.06 0.50 0.20 0.44 0.09 0.00 0.00 178.44 179.73 3mhg h ASP 316 N 0.95 0.00 -0.21 -0.43 5.19 -1.04 -1.16 116.42 119.72 3mhg h ASP 316 Ca 0.42 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.83 3mhg h ASP 316 Cb 0.30 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.81 3mhg h ASP 316 CO -0.22 0.00 0.00 2.29 -3.12 0.00 0.00 179.24 178.19 3mhg n LYS 317 N -4.44 1.86 0.00 3.56 2.85 -0.57 -4.73 118.16 116.69 3mhg n LYS 317 Ca 0.04 -1.70 0.00 0.00 -1.05 0.00 0.00 58.31 55.60 3mhg n LYS 317 Cb 0.36 -1.27 0.00 0.00 -0.65 0.00 0.00 35.03 33.47 3mhg n LYS 317 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 3mhg n THR 318 N 0.65 0.00 -2.31 0.58 -2.24 -0.65 -5.06 114.28 105.24 3mhg n THR 318 Ca 0.10 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.55 3mhg n THR 318 Cb 0.38 -0.38 -0.02 0.00 -2.10 0.00 0.00 70.33 68.21 3mhg n THR 318 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3mhg s ALA 319 N -1.64 2.85 0.02 6.98 0.00 -0.48 -4.79 121.76 124.71 3mhg s ALA 319 Ca 0.00 0.44 0.05 0.00 0.00 0.00 0.00 51.96 52.45 3mhg s ALA 319 Cb 0.00 -3.22 -0.03 0.00 0.00 0.00 0.00 23.12 19.87 3mhg s ALA 319 CO 0.00 -0.51 -0.13 -1.12 0.00 0.00 0.00 175.76 174.00 3mhg s SER 320 N -2.52 4.14 0.25 0.00 0.01 0.44 -4.97 113.70 111.04 3mhg s SER 320 Ca 0.64 -0.30 -0.30 0.00 1.31 0.00 0.00 55.95 57.31 3mhg s SER 320 Cb -0.15 -0.81 -0.09 0.00 0.21 0.00 0.00 66.02 65.18 3mhg s SER 320 CO 0.29 0.27 1.07 -2.16 0.41 0.00 0.00 173.24 173.12 3mhg s PRO 321 N -1.37 4.67 0.34 12.44 0.04 -1.26 -4.02 135.00 145.85 3mhg s PRO 321 Ca 0.15 1.72 0.27 0.00 0.04 0.00 0.00 61.00 63.18 3mhg s PRO 321 Cb -0.11 -3.23 0.96 0.00 0.04 0.00 0.00 34.50 32.17 3mhg s PRO 321 CO 0.06 0.24 1.78 0.11 0.04 0.00 0.00 177.00 179.23 3mhg h TRP 322 N 4.19 0.00 0.00 0.56 5.08 -1.00 -3.25 115.95 121.54 3mhg h TRP 322 Ca -0.46 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.51 3mhg h TRP 322 Cb 1.21 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.37 3mhg h TRP 322 CO 0.60 0.00 0.00 0.25 -1.28 0.00 0.00 178.44 178.01 3mhg n THR 323 N -2.56 0.25 -0.02 0.12 -2.24 -1.26 -1.63 114.28 106.94 3mhg n THR 323 Ca 0.03 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.77 3mhg n THR 323 Cb 0.33 -0.50 -0.02 0.00 -2.10 0.00 0.00 70.33 68.03 3mhg n THR 323 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 3mhg n GLU 324 N 0.46 0.12 0.00 -0.78 0.00 -1.23 -5.11 120.64 114.10 3mhg n GLU 324 Ca 0.00 0.03 0.06 0.00 0.00 0.00 0.00 57.16 57.25 3mhg n GLU 324 Cb 0.20 -1.01 0.35 0.00 0.00 0.00 0.00 31.44 30.98 3mhg n GLU 324 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76