#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s4m s VAL 2 N 0.00 5.03 -0.15 2.03 0.11 -0.56 -3.59 120.40 123.27 1s4m s VAL 2 Ca 0.00 1.15 0.02 0.00 -2.93 0.00 0.00 61.98 60.21 1s4m s VAL 2 Cb 0.00 -3.93 0.01 0.00 -1.53 0.00 0.00 36.38 30.93 1s4m s VAL 2 CO 0.00 0.11 -0.20 -0.69 -3.33 0.00 0.00 175.10 170.99 1s4m s VAL 3 N 1.97 2.22 0.09 2.04 1.01 -0.53 -2.19 120.40 124.99 1s4m s VAL 3 Ca 0.28 -0.92 -0.25 0.00 0.00 0.00 0.00 61.98 61.09 1s4m s VAL 3 Cb -0.16 -1.90 -0.06 0.00 0.00 0.00 0.00 36.38 34.26 1s4m s VAL 3 CO 0.10 0.54 0.77 -0.44 0.00 0.00 0.00 175.10 176.06 1s4m s SER 4 N 0.88 7.27 -0.06 3.32 0.01 0.56 -0.90 113.70 124.78 1s4m s SER 4 Ca -0.05 1.51 0.03 0.00 1.31 0.00 0.00 55.95 58.75 1s4m s SER 4 Cb -0.15 -2.48 0.01 0.00 0.21 0.00 0.00 66.02 63.61 1s4m s SER 4 CO -0.03 0.08 -0.14 -0.63 0.41 0.00 0.00 173.24 172.94 1s4m s ILE 5 N -0.43 1.23 -1.30 1.44 1.01 -0.33 0.35 121.20 123.16 1s4m s ILE 5 Ca 0.37 -0.56 0.00 0.00 0.00 0.00 0.00 60.65 60.46 1s4m s ILE 5 Cb -0.21 -1.10 0.00 0.00 0.01 0.00 0.00 42.46 41.16 1s4m s ILE 5 CO 0.24 0.37 0.00 0.61 0.00 0.00 0.00 174.94 176.16 1s4m n GLY 6 N 3.56 -1.50 0.09 6.18 0.00 -0.92 -4.49 105.19 108.11 1s4m n GLY 6 Ca -0.21 -1.05 -0.18 0.00 0.00 0.00 0.00 46.02 44.59 1s4m n GLY 6 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1s4m h VAL 7 N 0.00 1.41 -3.89 1.61 2.07 -1.85 -1.21 116.25 114.38 1s4m h VAL 7 Ca 0.00 -2.29 -0.37 0.00 0.82 0.00 0.00 66.70 64.86 1s4m h VAL 7 Cb 0.00 2.90 0.05 0.00 -1.52 0.00 0.00 31.29 32.72 1s4m h VAL 7 CO 0.00 0.50 -0.55 0.49 0.02 0.00 0.00 177.57 178.03 1s4m n PHE 8 N -4.50 -1.66 -1.87 1.57 3.72 -1.26 -4.49 117.46 108.97 1s4m n PHE 8 Ca -0.19 0.40 -0.42 0.00 -0.05 0.00 0.00 57.45 57.19 1s4m n PHE 8 Cb 0.59 -4.14 -0.03 0.00 -0.94 0.00 0.00 39.48 34.96 1s4m n PHE 8 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1s4m s ASP 9 N -2.64 6.35 0.00 4.37 3.68 -1.26 -1.64 116.67 125.53 1s4m s ASP 9 Ca 0.23 2.17 0.00 0.00 2.13 0.00 0.00 52.55 57.08 1s4m s ASP 9 Cb -0.10 -2.53 0.00 0.00 -1.45 0.00 0.00 42.92 38.84 1s4m s ASP 9 CO 0.29 -1.20 0.00 0.61 0.13 0.00 0.00 175.17 175.00 1s4m n GLY 10 N 4.62 3.34 3.88 2.66 0.00 -1.26 -4.52 105.19 113.91 1s4m n GLY 10 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 1s4m n GLY 10 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1s4m n VAL 11 N -1.69 -4.25 -1.26 1.61 0.31 -0.65 -4.97 118.33 107.43 1s4m n VAL 11 Ca 0.00 -0.76 -0.17 0.00 -0.01 0.00 0.00 64.34 63.39 1s4m n VAL 11 Cb 0.00 -3.30 0.13 0.00 -0.91 0.00 0.00 33.84 29.76 1s4m n VAL 11 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1s4m n HIS 12 N -4.51 -3.81 0.24 3.52 1.44 -1.26 -4.64 115.22 106.19 1s4m n HIS 12 Ca -0.14 -0.64 0.08 0.00 -2.01 0.00 0.00 57.72 55.01 1s4m n HIS 12 Cb 0.60 -0.62 0.58 0.00 0.12 0.00 0.00 29.99 30.67 1s4m n HIS 12 CO 0.00 0.00 0.00 -0.84 -2.81 0.00 0.00 176.34 172.69 1s4m h ILE 13 N -1.75 0.90 -0.53 0.61 3.07 -1.55 0.31 117.51 118.56 1s4m h ILE 13 Ca -0.25 -0.69 -0.11 0.00 1.55 0.00 0.00 64.86 65.36 1s4m h ILE 13 Cb 0.71 1.40 -0.02 0.00 -0.27 0.00 0.00 36.82 38.64 1s4m h ILE 13 CO 0.17 0.18 -0.10 1.23 -1.05 0.00 0.00 178.15 178.58 1s4m h GLY 14 N 0.78 1.09 1.13 0.16 0.00 -1.87 -1.83 103.07 102.54 1s4m h GLY 14 Ca -0.00 -0.88 -0.09 0.00 0.00 0.00 0.00 47.33 46.35 1s4m h GLY 14 CO 0.02 0.81 -0.00 0.45 0.00 0.00 0.00 176.54 177.82 1s4m h HIS 15 N 0.88 1.13 -0.29 5.60 3.86 -1.60 -2.18 115.15 122.56 1s4m h HIS 15 Ca 0.14 -0.19 -0.03 0.00 -1.16 0.00 0.00 60.37 59.12 1s4m h HIS 15 Cb 0.67 -0.30 -0.02 0.00 1.06 0.00 0.00 27.41 28.83 1s4m h HIS 15 CO 0.05 1.00 0.04 1.96 0.86 0.00 0.00 177.93 181.83 1s4m h GLN 16 N 0.95 0.42 -0.39 2.45 4.20 -0.72 -0.46 115.11 121.57 1s4m h GLN 16 Ca 0.17 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.77 1s4m h GLN 16 Cb 0.55 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.24 1s4m h GLN 16 CO 0.03 0.43 0.10 -0.22 -0.67 0.00 0.00 178.83 178.49 1s4m h LYS 17 N 0.42 0.62 -0.17 1.46 3.64 -0.73 -0.30 116.57 121.52 1s4m h LYS 17 Ca 0.10 -0.15 0.03 0.00 -1.27 0.00 0.00 60.65 59.35 1s4m h LYS 17 Cb 0.22 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.93 1s4m h LYS 17 CO 0.00 0.65 0.00 0.28 -2.27 0.00 0.00 179.45 178.12 1s4m h VAL 18 N 0.49 0.89 -0.36 2.00 2.07 -0.81 -1.56 116.25 118.96 1s4m h VAL 18 Ca 0.12 -0.02 -0.05 0.00 0.82 0.00 0.00 66.70 67.57 1s4m h VAL 18 Cb 0.31 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 1s4m h VAL 18 CO 0.00 0.01 0.02 -0.07 0.02 0.00 0.00 177.57 177.55 1s4m h LEU 19 N 0.06 0.61 -0.57 2.57 3.38 -0.91 -0.11 115.31 120.33 1s4m h LEU 19 Ca 0.08 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 1s4m h LEU 19 Cb 0.09 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 1s4m h LEU 19 CO -0.13 0.75 0.26 0.03 0.09 0.00 0.00 178.44 179.44 1s4m h ARG 20 N 0.44 0.83 -0.80 1.13 3.08 -1.04 -1.75 114.38 116.27 1s4m h ARG 20 Ca 0.10 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1s4m h ARG 20 Cb 0.43 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.29 1s4m h ARG 20 CO 0.01 0.69 0.45 1.15 -1.07 0.00 0.00 179.97 181.21 1s4m h THR 21 N 0.78 1.23 -0.56 2.04 2.02 -1.00 -2.09 112.91 115.33 1s4m h THR 21 Ca 0.19 -0.56 0.04 0.00 0.77 0.00 0.00 66.41 66.85 1s4m h THR 21 Cb 0.15 0.15 -0.04 0.00 -1.74 0.00 0.00 68.15 66.67 1s4m h THR 21 CO -0.02 0.26 0.32 -0.03 0.37 0.00 0.00 175.52 176.41 1s4m h MET 22 N 1.11 0.60 -0.72 6.66 1.85 -0.64 0.61 114.93 124.40 1s4m h MET 22 Ca 0.28 -0.04 -0.03 0.00 -0.61 0.00 0.00 59.70 59.31 1s4m h MET 22 Cb 0.01 -0.14 -0.03 0.00 0.43 0.00 0.00 31.60 31.87 1s4m h MET 22 CO -0.05 0.40 0.34 0.87 -0.40 0.00 0.00 176.91 178.07 1s4m h LYS 23 N 0.62 1.04 -0.24 0.39 1.57 -0.82 0.24 116.57 119.37 1s4m h LYS 23 Ca 0.23 -0.15 -0.11 0.00 -1.87 0.00 0.00 60.65 58.76 1s4m h LYS 23 Cb 0.08 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.19 1s4m h LYS 23 CO -0.13 0.81 -0.28 1.49 -0.57 0.00 0.00 179.45 180.77 1s4m h GLU 24 N 1.03 0.61 -0.63 3.15 4.81 -0.89 -0.99 114.58 121.66 1s4m h GLU 24 Ca 0.25 -0.34 -0.02 0.00 -0.13 0.00 0.00 59.36 59.12 1s4m h GLU 24 Cb 0.12 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 1s4m h GLU 24 CO -0.03 0.94 0.32 0.82 -0.73 0.00 0.00 179.01 180.33 1s4m h ILE 25 N 0.31 1.21 -0.97 2.32 2.04 -0.46 -1.23 117.51 120.73 1s4m h ILE 25 Ca 0.03 -0.58 0.01 0.00 1.00 0.00 0.00 64.86 65.31 1s4m h ILE 25 Cb 0.85 0.43 -0.05 0.00 -0.74 0.00 0.00 36.82 37.32 1s4m h ILE 25 CO 0.07 0.24 0.63 0.00 0.00 0.00 0.00 178.15 179.10 1s4m h ALA 26 N 1.14 1.23 -0.13 1.87 0.00 -0.41 -0.42 119.26 122.55 1s4m h ALA 26 Ca 0.22 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1s4m h ALA 26 Cb 0.10 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1s4m h ALA 26 CO -0.03 0.64 0.05 0.35 0.00 0.00 0.00 179.25 180.25 1s4m h PHE 27 N 1.32 0.20 0.00 0.00 3.57 -0.45 0.19 116.94 121.77 1s4m h PHE 27 Ca 0.35 -0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.76 1s4m h PHE 27 Cb -0.14 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 1s4m h PHE 27 CO -0.00 0.30 -0.38 0.27 -2.23 0.00 0.00 178.31 176.27 1s4m h PHE 28 N 0.04 0.00 -0.00 0.41 -5.15 -0.92 -2.40 116.94 108.92 1s4m h PHE 28 Ca 0.04 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.81 1s4m h PHE 28 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.36 1s4m h PHE 28 CO -0.01 0.38 -0.28 0.54 -2.00 0.00 0.00 178.31 176.94 1s4m n ARG 29 N -3.28 0.01 -3.16 6.09 1.74 -0.20 -4.93 116.66 112.94 1s4m n ARG 29 Ca 0.02 -0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.86 1s4m n ARG 29 Cb 0.63 -1.50 0.03 0.00 -1.02 0.00 0.00 32.46 30.60 1s4m n ARG 29 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1s4m n LYS 30 N -1.49 -5.05 -3.42 5.56 5.02 0.46 -5.00 118.16 114.23 1s4m n LYS 30 Ca 0.06 0.83 -0.20 0.00 -2.02 0.00 0.00 58.31 56.98 1s4m n LYS 30 Cb 0.34 -5.70 -0.01 0.00 -0.02 0.00 0.00 35.03 29.64 1s4m n LYS 30 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1s4m s ASP 31 N -2.79 5.15 0.69 4.39 1.11 -0.06 -5.02 116.67 120.14 1s4m s ASP 31 Ca 0.36 -0.74 -0.05 0.00 0.18 0.00 0.00 52.55 52.30 1s4m s ASP 31 Cb -0.16 -0.40 0.07 0.00 1.07 0.00 0.00 42.92 43.49 1s4m s ASP 31 CO 0.44 -0.79 0.98 -1.81 1.18 0.00 0.00 175.17 175.17 1s4m s ASP 32 N -4.25 4.77 -0.05 0.27 1.11 -1.26 -4.58 116.67 112.69 1s4m s ASP 32 Ca 0.50 0.28 0.04 0.00 0.18 0.00 0.00 52.55 53.54 1s4m s ASP 32 Cb -0.05 -0.92 -0.03 0.00 1.07 0.00 0.00 42.92 43.00 1s4m s ASP 32 CO 0.29 -1.59 -0.14 -0.44 1.18 0.00 0.00 175.17 174.47 1s4m s SER 33 N -4.54 4.03 -0.11 0.27 0.01 -1.26 -1.49 113.70 110.60 1s4m s SER 33 Ca 0.61 -0.20 -0.07 0.00 1.31 0.00 0.00 55.95 57.60 1s4m s SER 33 Cb -0.10 -0.86 0.04 0.00 0.21 0.00 0.00 66.02 65.32 1s4m s SER 33 CO 0.44 0.34 0.27 -0.22 0.41 0.00 0.00 173.24 174.49 1s4m s LEU 34 N -0.72 0.46 -0.19 2.44 2.96 -0.93 -4.23 118.68 118.48 1s4m s LEU 34 Ca 0.11 0.58 -0.05 0.00 -0.22 0.00 0.00 54.13 54.54 1s4m s LEU 34 Cb -0.11 0.86 -0.03 0.00 0.50 0.00 0.00 46.19 47.41 1s4m s LEU 34 CO 0.01 -0.15 0.01 -0.63 -1.32 0.00 0.00 176.35 174.26 1s4m s ILE 35 N 1.04 4.15 -0.33 6.68 1.01 0.01 -0.32 121.20 133.44 1s4m s ILE 35 Ca -0.07 -0.25 -0.11 0.00 0.00 0.00 0.00 60.65 60.22 1s4m s ILE 35 Cb -0.08 -2.87 -0.00 0.00 0.01 0.00 0.00 42.46 39.51 1s4m s ILE 35 CO -0.07 0.44 0.18 -0.31 0.00 0.00 0.00 174.94 175.18 1s4m s TYR 36 N 0.77 3.20 -0.26 3.97 2.02 0.15 -0.52 117.35 126.67 1s4m s TYR 36 Ca 0.01 -0.55 -0.06 0.00 -0.37 0.00 0.00 57.07 56.10 1s4m s TYR 36 Cb -0.14 -2.39 -0.00 0.00 -0.40 0.00 0.00 41.96 39.02 1s4m s TYR 36 CO 0.02 -0.46 0.04 -0.08 -1.57 0.00 0.00 175.55 173.50 1s4m s THR 37 N 1.63 3.86 0.01 -0.71 -1.32 -0.09 -2.17 115.64 116.85 1s4m s THR 37 Ca 0.05 -0.52 -0.30 0.00 -1.21 0.00 0.00 61.69 59.70 1s4m s THR 37 Cb -0.17 -2.88 -0.06 0.00 -1.51 0.00 0.00 72.50 67.88 1s4m s THR 37 CO 0.07 0.24 1.37 -0.63 -2.21 0.00 0.00 174.62 173.46 1s4m s ILE 38 N 1.52 3.73 0.16 5.08 1.01 -0.46 0.10 121.20 132.34 1s4m s ILE 38 Ca 0.04 1.14 -0.21 0.00 0.00 0.00 0.00 60.65 61.62 1s4m s ILE 38 Cb -0.16 -3.73 0.07 0.00 0.01 0.00 0.00 42.46 38.65 1s4m s ILE 38 CO 0.01 0.01 1.63 0.77 0.00 0.00 0.00 174.94 177.36 1s4m h SER 39 N 7.61 -0.79 -4.26 3.58 4.64 -1.02 -3.43 113.55 119.89 1s4m h SER 39 Ca -0.38 0.16 -0.27 0.00 -0.47 0.00 0.00 61.79 60.83 1s4m h SER 39 Cb 1.18 0.39 -0.25 0.00 -0.31 0.00 0.00 62.40 63.41 1s4m h SER 39 CO 0.89 -0.26 -0.73 -0.31 -0.87 0.00 0.00 176.83 175.54 1s4m s TYR 40 N -6.09 0.39 0.66 4.77 2.02 -1.26 -4.93 117.35 112.90 1s4m s TYR 40 Ca -0.15 -0.25 -0.11 0.00 -0.37 0.00 0.00 57.07 56.20 1s4m s TYR 40 Cb 0.14 -0.25 -0.02 0.00 -0.40 0.00 0.00 41.96 41.43 1s4m s TYR 40 CO 0.69 -0.05 1.05 -1.25 -1.57 0.00 0.00 175.55 174.41 1s4m s PRO 41 N -0.69 3.26 0.36 -1.71 0.04 -1.26 -4.83 135.00 130.17 1s4m s PRO 41 Ca -0.04 0.83 0.04 0.00 0.04 0.00 0.00 61.00 61.86 1s4m s PRO 41 Cb -0.05 -2.04 0.69 0.00 0.04 0.00 0.00 34.50 33.14 1s4m s PRO 41 CO -0.00 -0.83 2.01 -1.35 0.04 0.00 0.00 177.00 176.87 1s4m h PRO 42 N -0.52 0.77 -0.15 0.56 0.11 -2.01 -1.61 132.00 129.16 1s4m h PRO 42 Ca -0.44 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 65.67 1s4m h PRO 42 Cb 1.20 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1s4m h PRO 42 CO 0.60 0.51 0.11 0.93 -0.21 0.00 0.00 178.00 179.94 1s4m h GLU 43 N 0.80 0.00 -0.99 1.05 3.07 -1.97 -2.39 114.58 114.15 1s4m h GLU 43 Ca 0.24 0.00 0.25 0.00 -0.50 0.00 0.00 59.36 59.35 1s4m h GLU 43 Cb -0.03 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 27.81 1s4m h GLU 43 CO -0.06 0.00 0.66 -0.92 -1.40 0.00 0.00 179.01 177.29 1s4m h TYR 44 N 0.00 0.50 -0.00 4.33 3.20 -1.65 0.04 116.97 123.38 1s4m h TYR 44 Ca 0.07 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.96 1s4m h TYR 44 Cb 0.29 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.41 1s4m h TYR 44 CO 0.00 0.08 -0.32 1.19 -1.64 0.00 0.00 178.16 177.47 1s4m n PHE 45 N -4.51 0.00 -2.73 -3.82 3.72 -0.90 -4.82 117.46 104.40 1s4m n PHE 45 Ca 0.23 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.29 1s4m n PHE 45 Cb 0.86 -0.26 -0.06 0.00 -0.94 0.00 0.00 39.48 39.08 1s4m n PHE 45 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1s4m s LEU 46 N -2.84 3.94 0.41 4.37 1.43 0.00 -4.98 118.68 121.02 1s4m s LEU 46 Ca 0.16 1.78 0.18 0.00 -1.03 0.00 0.00 54.13 55.22 1s4m s LEU 46 Cb 0.18 -4.50 1.09 0.00 0.03 0.00 0.00 46.19 42.99 1s4m s LEU 46 CO 0.61 -0.46 1.82 1.55 0.23 0.00 0.00 176.35 180.09 1s4m h PRO 47 N 1.90 0.39 -0.47 1.29 0.13 -1.89 -2.84 132.00 130.51 1s4m h PRO 47 Ca -0.49 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1s4m h PRO 47 Cb 1.19 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1s4m h PRO 47 CO 0.61 0.26 0.00 -0.40 -0.23 0.00 0.00 178.00 178.24 1s4m n ASP 48 N -4.55 2.90 -4.71 1.44 5.75 -1.26 -4.95 116.55 111.17 1s4m n ASP 48 Ca 0.22 -1.96 -0.42 0.00 -0.01 0.00 0.00 54.79 52.62 1s4m n ASP 48 Cb 0.78 -0.31 -0.03 0.00 -1.03 0.00 0.00 41.12 40.53 1s4m n ASP 48 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 1s4m n PHE 49 N 1.10 2.70 0.24 2.11 7.35 -1.07 -4.84 117.46 125.04 1s4m n PHE 49 Ca 0.19 -0.05 0.07 0.00 -0.76 0.00 0.00 57.45 56.89 1s4m n PHE 49 Cb 0.48 -2.70 0.58 0.00 0.35 0.00 0.00 39.48 38.19 1s4m n PHE 49 CO 0.00 0.00 0.00 -1.35 -0.76 0.00 0.00 176.76 174.65 1s4m h PRO 50 N 7.61 0.00 0.00 -7.13 0.11 -1.92 -3.49 132.00 127.18 1s4m h PRO 50 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1s4m h PRO 50 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1s4m h PRO 50 CO 0.95 0.10 0.00 0.41 -0.21 0.00 0.00 178.00 179.25 1s4m n GLY 51 N -1.23 3.01 3.79 -0.55 0.00 -1.26 -3.40 105.19 105.54 1s4m n GLY 51 Ca -0.03 -1.94 -0.33 0.00 0.00 0.00 0.00 46.02 43.72 1s4m n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s4m s LEU 52 N 0.00 3.44 0.51 0.99 1.43 -0.26 -3.77 118.68 121.03 1s4m s LEU 52 Ca 0.00 1.87 0.30 0.00 -1.03 0.00 0.00 54.13 55.27 1s4m s LEU 52 Cb 0.00 -4.54 1.05 0.00 0.03 0.00 0.00 46.19 42.73 1s4m s LEU 52 CO 0.00 -1.33 1.87 -0.07 0.23 0.00 0.00 176.35 177.04 1s4m h LEU 53 N 0.25 0.00 -7.46 1.79 3.38 -1.90 0.65 115.31 112.02 1s4m h LEU 53 Ca -0.47 0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.60 1s4m h LEU 53 Cb 1.23 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.88 1s4m h LEU 53 CO 0.56 0.03 0.37 0.00 0.09 0.00 0.00 178.44 179.49 1s4m s MET 54 N -3.54 1.27 0.74 1.13 0.23 -1.26 -4.85 119.30 113.02 1s4m s MET 54 Ca 0.03 -0.62 -0.11 0.00 -1.03 0.00 0.00 55.69 53.95 1s4m s MET 54 Cb 0.08 0.49 0.04 0.00 -1.53 0.00 0.00 34.83 33.91 1s4m s MET 54 CO 0.59 -0.57 1.09 0.95 -2.03 0.00 0.00 175.02 175.04 1s4m s THR 55 N -3.49 3.45 0.29 3.16 -4.23 -1.26 -4.85 115.64 108.70 1s4m s THR 55 Ca 0.08 0.50 -0.02 0.00 -1.18 0.00 0.00 61.69 61.07 1s4m s THR 55 Cb -0.02 -3.03 0.27 0.00 1.34 0.00 0.00 72.50 71.05 1s4m s THR 55 CO -0.02 -0.59 1.95 0.58 -0.54 0.00 0.00 174.62 176.00 1s4m h VAL 56 N -0.89 1.18 -0.13 2.29 2.07 -1.99 -0.74 116.25 118.05 1s4m h VAL 56 Ca -0.44 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 66.68 1s4m h VAL 56 Cb 1.23 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 1s4m h VAL 56 CO 0.53 0.21 0.05 -0.08 0.02 0.00 0.00 177.57 178.30 1s4m h GLU 57 N 1.15 0.20 -0.95 1.57 4.81 -1.99 0.13 114.58 119.50 1s4m h GLU 57 Ca 0.34 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.53 1s4m h GLU 57 Cb -0.05 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.25 1s4m h GLU 57 CO -0.09 0.30 0.59 0.77 -0.73 0.00 0.00 179.01 179.85 1s4m h SER 58 N 0.06 1.13 -0.15 1.04 0.02 -1.77 -1.70 113.55 112.17 1s4m h SER 58 Ca 0.04 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1s4m h SER 58 Cb 0.17 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 1s4m h SER 58 CO -0.00 0.85 0.10 -0.09 -1.14 0.00 0.00 176.83 176.54 1s4m h ARG 59 N 1.30 0.20 -0.60 3.45 2.43 -0.66 -2.12 114.38 118.39 1s4m h ARG 59 Ca 0.34 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.47 1s4m h ARG 59 Cb -0.08 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.39 1s4m h ARG 59 CO -0.07 0.16 0.27 0.28 -1.51 0.00 0.00 179.97 179.10 1s4m h VAL 60 N 0.19 1.22 -0.99 0.20 2.07 -0.51 0.14 116.25 118.57 1s4m h VAL 60 Ca 0.06 -0.65 0.08 0.00 0.82 0.00 0.00 66.70 67.00 1s4m h VAL 60 Cb 0.01 0.53 -0.07 0.00 -1.52 0.00 0.00 31.29 30.24 1s4m h VAL 60 CO -0.01 0.26 0.64 -0.08 0.02 0.00 0.00 177.57 178.39 1s4m h GLU 61 N 0.83 1.09 -0.13 1.57 4.81 -1.08 0.19 114.58 121.86 1s4m h GLU 61 Ca 0.20 -0.07 -0.13 0.00 -0.13 0.00 0.00 59.36 59.24 1s4m h GLU 61 Cb 0.15 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.29 1s4m h GLU 61 CO -0.02 0.72 -0.41 0.52 -0.73 0.00 0.00 179.01 179.09 1s4m h MET 62 N 1.13 0.51 -0.74 1.92 2.86 -0.65 -3.18 114.93 116.77 1s4m h MET 62 Ca 0.44 -0.37 0.04 0.00 -2.06 0.00 0.00 59.70 57.75 1s4m h MET 62 Cb 0.23 0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.91 1s4m h MET 62 CO -0.19 0.99 0.49 -0.07 1.06 0.00 0.00 176.91 179.19 1s4m h LEU 63 N 0.12 0.76 -2.31 1.22 3.38 -0.14 -1.95 115.31 116.39 1s4m h LEU 63 Ca -0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1s4m h LEU 63 Cb 1.03 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1s4m h LEU 63 CO 0.09 0.52 0.00 0.28 0.09 0.00 0.00 178.44 179.42 1s4m h SER 64 N 0.88 0.00 1.13 -0.43 0.02 -0.62 0.03 113.55 114.56 1s4m h SER 64 Ca 0.30 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 1s4m h SER 64 Cb 0.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.61 1s4m h SER 64 CO -0.09 0.00 0.00 0.03 -1.14 0.00 0.00 176.83 175.63 1s4m h ARG 65 N 0.00 0.00 0.02 3.45 3.08 -1.42 -3.27 114.38 116.24 1s4m h ARG 65 Ca 0.00 0.00 -0.40 0.00 0.07 0.00 0.00 59.98 59.65 1s4m h ARG 65 Cb 0.10 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.09 1s4m h ARG 65 CO 0.00 0.00 -2.36 0.66 -1.07 0.00 0.00 179.97 177.20 1s4m n TYR 66 N -2.39 0.24 -3.66 3.04 4.01 -0.03 -5.08 117.16 113.28 1s4m n TYR 66 Ca 0.03 0.06 -0.01 0.00 -0.16 0.00 0.00 57.90 57.82 1s4m n TYR 66 Cb 0.33 -1.03 -0.01 0.00 -0.31 0.00 0.00 39.34 38.33 1s4m n TYR 66 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1s4m s ALA 67 N -2.51 -1.98 0.13 -0.72 0.00 -1.04 -5.03 121.76 110.61 1s4m s ALA 67 Ca -0.34 0.57 -0.35 0.00 0.00 0.00 0.00 51.96 51.84 1s4m s ALA 67 Cb 0.10 0.43 -0.16 0.00 0.00 0.00 0.00 23.12 23.50 1s4m s ALA 67 CO 0.59 -0.99 1.38 -2.13 0.00 0.00 0.00 175.76 174.61 1s4m n ARG 68 N -0.43 1.47 -4.87 0.00 0.63 -1.26 -4.08 116.66 108.11 1s4m n ARG 68 Ca -0.07 0.53 -0.31 0.00 -0.92 0.00 0.00 57.85 57.08 1s4m n ARG 68 Cb 0.62 -2.18 -0.17 0.00 0.45 0.00 0.00 32.46 31.18 1s4m n ARG 68 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 1s4m s THR 69 N 0.46 1.90 -0.12 5.15 2.01 -1.26 -0.81 115.64 122.97 1s4m s THR 69 Ca 0.80 -0.91 0.03 0.00 0.31 0.00 0.00 61.69 61.93 1s4m s THR 69 Cb -0.85 -1.67 0.00 0.00 0.01 0.00 0.00 72.50 69.99 1s4m s THR 69 CO 0.45 0.52 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.99 1s4m s VAL 70 N 0.62 2.04 0.01 3.82 1.01 0.32 -4.98 120.40 123.24 1s4m s VAL 70 Ca -0.13 -0.99 -0.28 0.00 0.00 0.00 0.00 61.98 60.59 1s4m s VAL 70 Cb -0.17 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 1s4m s VAL 70 CO 0.03 0.55 0.89 -0.69 0.00 0.00 0.00 175.10 175.88 1s4m s VAL 71 N 0.57 4.82 -0.26 2.92 1.01 -1.26 -0.91 120.40 127.29 1s4m s VAL 71 Ca -0.13 1.87 -0.11 0.00 0.00 0.00 0.00 61.98 63.60 1s4m s VAL 71 Cb -0.17 -4.23 -0.05 0.00 0.00 0.00 0.00 36.38 31.93 1s4m s VAL 71 CO 0.04 0.24 0.21 -0.76 0.00 0.00 0.00 175.10 174.82 1s4m s LEU 72 N 0.64 4.07 -0.39 3.92 1.43 0.11 -4.88 118.68 123.58 1s4m s LEU 72 Ca 0.46 0.09 -0.29 0.00 -1.03 0.00 0.00 54.13 53.37 1s4m s LEU 72 Cb -0.21 -2.16 0.01 0.00 0.03 0.00 0.00 46.19 43.86 1s4m s LEU 72 CO 0.26 -0.02 1.34 -0.62 0.23 0.00 0.00 176.35 177.53 1s4m s ASP 73 N 1.43 6.48 0.27 2.29 3.68 -1.26 -0.32 116.67 129.24 1s4m s ASP 73 Ca 0.09 0.89 -0.04 0.00 2.13 0.00 0.00 52.55 55.61 1s4m s ASP 73 Cb -0.15 -2.54 0.54 0.00 -1.45 0.00 0.00 42.92 39.32 1s4m s ASP 73 CO 0.08 -1.30 1.60 0.15 0.13 0.00 0.00 175.17 175.84 1s4m h PHE 74 N 10.05 -0.12 0.00 -5.34 3.57 -1.93 0.12 116.94 123.28 1s4m h PHE 74 Ca -0.26 0.07 -0.03 0.00 3.53 0.00 0.00 57.97 61.27 1s4m h PHE 74 Cb 1.10 0.19 -0.00 0.00 2.79 0.00 0.00 35.95 40.02 1s4m h PHE 74 CO 0.94 -0.33 -0.16 0.74 -2.23 0.00 0.00 178.31 177.27 1s4m h PHE 75 N 0.06 0.00 0.00 0.41 0.04 -1.97 -1.02 116.94 114.46 1s4m h PHE 75 Ca 0.48 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.23 1s4m h PHE 75 Cb 0.89 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.04 1s4m h PHE 75 CO -0.50 0.16 -0.43 0.00 -0.60 0.00 0.00 178.31 176.94 1s4m h ARG 76 N 0.00 0.00 0.00 1.51 3.08 -1.20 -3.39 114.38 114.38 1s4m h ARG 76 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1s4m h ARG 76 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1s4m h ARG 76 CO 0.02 0.08 -0.76 0.44 -1.07 0.00 0.00 179.97 178.68 1s4m n ILE 77 N -2.98 0.00 -0.10 2.04 -5.35 -0.70 -4.70 119.36 107.57 1s4m n ILE 77 Ca 0.02 -0.24 0.09 0.00 -0.27 0.00 0.00 62.75 62.35 1s4m n ILE 77 Cb 0.58 0.67 0.45 0.00 -1.74 0.00 0.00 39.64 39.60 1s4m n ILE 77 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 1s4m h LYS 78 N 0.00 0.51 0.00 6.28 2.10 -1.39 -2.69 116.57 121.38 1s4m h LYS 78 Ca 0.00 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.62 1s4m h LYS 78 Cb 0.17 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 31.39 1s4m h LYS 78 CO 0.00 0.34 -0.71 -0.44 -2.00 0.00 0.00 179.45 176.64 1s4m h ASP 79 N 0.53 0.00 -3.58 7.07 3.32 -1.84 -3.18 116.42 118.75 1s4m h ASP 79 Ca 0.27 -0.09 -0.57 0.00 0.02 0.00 0.00 57.03 56.67 1s4m h ASP 79 Cb 0.39 0.00 0.16 0.00 0.22 0.00 0.00 39.33 40.10 1s4m h ASP 79 CO -0.08 0.05 0.18 0.18 -1.72 0.00 0.00 179.24 177.84 1s4m n LEU 80 N -2.48 3.80 -4.90 1.55 4.77 -1.02 -4.37 117.00 114.36 1s4m n LEU 80 Ca 0.02 0.84 -0.29 0.00 -0.03 0.00 0.00 56.01 56.56 1s4m n LEU 80 Cb 0.50 -1.41 0.03 0.00 -2.33 0.00 0.00 43.42 40.22 1s4m n LEU 80 CO 0.38 -1.69 0.65 0.42 -1.33 0.00 0.00 177.39 175.81 1s4m s THR 81 N -1.47 3.76 0.31 -5.08 -4.23 -1.26 0.40 115.64 108.07 1s4m s THR 81 Ca 0.74 0.32 0.05 0.00 -1.18 0.00 0.00 61.69 61.62 1s4m s THR 81 Cb -0.43 -3.53 0.30 0.00 1.34 0.00 0.00 72.50 70.18 1s4m s THR 81 CO 0.48 -0.63 1.84 -0.65 -0.54 0.00 0.00 174.62 175.12 1s4m h PRO 82 N -0.38 0.83 0.05 3.99 0.11 -1.90 -0.75 132.00 133.95 1s4m h PRO 82 Ca -0.45 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 1s4m h PRO 82 Cb 1.25 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1s4m h PRO 82 CO 0.62 0.55 -0.02 0.93 -0.21 0.00 0.00 178.00 179.87 1s4m h GLU 83 N 0.86 -0.06 -0.07 1.05 3.07 -1.99 -2.09 114.58 115.35 1s4m h GLU 83 Ca 0.49 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 59.29 1s4m h GLU 83 Cb 0.63 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.54 1s4m h GLU 83 CO -0.26 0.01 -0.28 0.78 -1.40 0.00 0.00 179.01 177.86 1s4m h GLY 84 N -0.11 0.13 0.80 -3.84 0.00 -1.65 -0.94 103.07 97.46 1s4m h GLY 84 Ca -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.22 1s4m h GLY 84 CO 0.01 0.09 0.02 -2.75 0.00 0.00 0.00 176.54 173.90 1s4m h PHE 85 N 0.11 0.11 -0.16 5.60 3.57 -0.88 -0.18 116.94 125.11 1s4m h PHE 85 Ca 0.02 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 1s4m h PHE 85 Cb 0.56 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.26 1s4m h PHE 85 CO 0.00 0.30 0.09 0.28 -2.23 0.00 0.00 178.31 176.75 1s4m h VAL 86 N -0.10 1.08 -0.51 1.41 2.07 -1.12 0.28 116.25 119.36 1s4m h VAL 86 Ca 0.02 -0.22 0.03 0.00 0.82 0.00 0.00 66.70 67.36 1s4m h VAL 86 Cb 0.24 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 1s4m h VAL 86 CO 0.00 0.08 0.28 -0.08 0.02 0.00 0.00 177.57 177.87 1s4m h GLU 87 N 0.17 0.54 0.02 1.57 4.81 -1.15 0.35 114.58 120.89 1s4m h GLU 87 Ca 0.06 -0.03 -0.23 0.00 -0.13 0.00 0.00 59.36 59.02 1s4m h GLU 87 Cb 0.05 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.27 1s4m h GLU 87 CO -0.01 0.36 -1.16 -0.09 -0.73 0.00 0.00 179.01 177.38 1s4m h ARG 88 N 0.56 0.04 0.00 1.92 2.43 -0.79 -3.37 114.38 115.16 1s4m h ARG 88 Ca 0.21 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 1s4m h ARG 88 Cb 0.07 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 1s4m h ARG 88 CO -0.12 0.95 -0.89 0.66 -1.51 0.00 0.00 179.97 179.06 1s4m n TYR 89 N -3.32 0.00 -1.66 2.20 4.01 0.97 -4.72 117.16 114.64 1s4m n TYR 89 Ca -0.04 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.75 1s4m n TYR 89 Cb 0.97 -0.08 0.20 0.00 -0.31 0.00 0.00 39.34 40.11 1s4m n TYR 89 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1s4m n LEU 90 N -1.49 2.65 -4.69 7.72 4.77 0.10 -4.98 117.00 121.08 1s4m n LEU 90 Ca -0.00 -3.82 -0.42 0.00 -0.03 0.00 0.00 56.01 51.73 1s4m n LEU 90 Cb 0.13 -0.50 -0.03 0.00 -2.33 0.00 0.00 43.42 40.70 1s4m n LEU 90 CO 0.12 1.37 1.00 -0.44 -1.33 0.00 0.00 177.39 178.12 1s4m s SER 91 N -3.18 6.98 -0.29 -1.43 0.01 -1.18 -2.25 113.70 112.37 1s4m s SER 91 Ca 0.38 1.97 0.00 0.00 1.31 0.00 0.00 55.95 59.61 1s4m s SER 91 Cb 0.37 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 64.04 1s4m s SER 91 CO -0.07 -0.61 0.00 0.61 0.41 0.00 0.00 173.24 173.58 1s4m n GLY 92 N 3.44 0.59 3.55 3.44 0.00 -1.26 -4.92 105.19 110.02 1s4m n GLY 92 Ca 0.11 -0.50 -0.36 0.00 0.00 0.00 0.00 46.02 45.27 1s4m n GLY 92 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s4m s VAL 93 N -2.01 4.62 -0.43 1.61 1.01 -0.95 -2.38 120.40 121.86 1s4m s VAL 93 Ca 0.00 -0.08 0.22 0.00 0.00 0.00 0.00 61.98 62.12 1s4m s VAL 93 Cb 0.00 -3.12 -0.29 0.00 0.00 0.00 0.00 36.38 32.97 1s4m s VAL 93 CO 0.00 0.39 0.66 -1.54 0.00 0.00 0.00 175.10 174.61 1s4m n SER 94 N 4.28 0.42 -3.80 3.32 3.41 -1.24 -4.78 113.62 115.22 1s4m n SER 94 Ca -0.16 -0.40 -0.13 0.00 -0.26 0.00 0.00 58.87 57.92 1s4m n SER 94 Cb 0.52 1.57 -0.12 0.00 -0.26 0.00 0.00 64.21 65.91 1s4m n SER 94 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1s4m s ALA 95 N -3.30 -0.48 0.06 7.33 0.00 -1.24 0.24 121.76 124.38 1s4m s ALA 95 Ca -0.01 0.57 0.06 0.00 0.00 0.00 0.00 51.96 52.58 1s4m s ALA 95 Cb 0.15 -0.33 -0.03 0.00 0.00 0.00 0.00 23.12 22.91 1s4m s ALA 95 CO 0.89 -0.10 -0.17 0.14 0.00 0.00 0.00 175.76 176.52 1s4m s VAL 96 N 0.18 1.37 -0.20 0.00 -7.23 0.09 -1.46 120.40 113.15 1s4m s VAL 96 Ca -0.01 -1.25 -0.01 0.00 -1.81 0.00 0.00 61.98 58.90 1s4m s VAL 96 Cb -0.02 -1.25 0.01 0.00 0.56 0.00 0.00 36.38 35.68 1s4m s VAL 96 CO -0.00 -0.03 -0.13 -0.69 -0.31 0.00 0.00 175.10 173.94 1s4m s VAL 97 N -1.02 2.59 0.12 1.32 1.01 -0.08 -0.85 120.40 123.49 1s4m s VAL 97 Ca 0.03 -0.80 -0.04 0.00 0.00 0.00 0.00 61.98 61.17 1s4m s VAL 97 Cb -0.09 -2.15 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 1s4m s VAL 97 CO 0.02 0.47 0.11 0.68 0.00 0.00 0.00 175.10 176.38 1s4m s VAL 98 N 1.36 0.12 0.96 2.92 -7.23 -0.68 -1.19 120.40 116.66 1s4m s VAL 98 Ca 0.05 -1.68 -0.15 0.00 -1.81 0.00 0.00 61.98 58.39 1s4m s VAL 98 Cb -0.14 -1.83 0.18 0.00 0.56 0.00 0.00 36.38 35.15 1s4m s VAL 98 CO -0.09 -0.53 1.21 -0.83 -0.31 0.00 0.00 175.10 174.55 1s4m s GLY 99 N -2.99 1.65 0.61 2.32 0.00 -1.26 -0.75 107.32 106.90 1s4m s GLY 99 Ca 0.17 -0.87 -0.18 0.00 0.00 0.00 0.00 44.72 43.85 1s4m s GLY 99 CO -0.02 -0.19 1.19 0.50 0.00 0.00 0.00 173.10 174.58 1s4m s ARG 100 N -5.58 2.90 -1.65 2.90 1.81 -1.18 -3.17 118.95 114.99 1s4m s ARG 100 Ca 0.68 1.75 0.00 0.00 -1.72 0.00 0.00 55.73 56.44 1s4m s ARG 100 Cb -0.09 -1.93 0.00 0.00 -0.45 0.00 0.00 34.95 32.48 1s4m s ARG 100 CO 0.53 -1.24 0.00 -0.25 -0.68 0.00 0.00 175.30 173.66 1s4m n ASP 101 N -1.77 -5.15 -4.75 0.23 10.43 -1.26 -4.93 116.55 109.34 1s4m n ASP 101 Ca 0.13 0.16 -0.41 0.00 2.57 0.00 0.00 54.79 57.24 1s4m n ASP 101 Cb 0.50 -4.22 -0.02 0.00 1.84 0.00 0.00 41.12 39.22 1s4m n ASP 101 CO 0.00 0.00 0.00 0.12 -1.07 0.00 0.00 177.20 176.25 1s4m s PHE 102 N -2.79 3.09 0.10 1.24 5.36 -1.19 -5.01 117.98 118.79 1s4m s PHE 102 Ca 0.00 1.22 0.03 0.00 -0.96 0.00 0.00 56.93 57.22 1s4m s PHE 102 Cb 0.00 -3.71 -0.04 0.00 -0.34 0.00 0.00 43.02 38.93 1s4m s PHE 102 CO 0.00 -2.17 -0.08 1.03 -1.46 0.00 0.00 175.22 172.53 1s4m s ARG 103 N -0.85 0.87 0.21 10.12 1.81 -1.26 -4.24 118.95 125.60 1s4m s ARG 103 Ca 0.55 -1.27 -0.23 0.00 -1.72 0.00 0.00 55.73 53.06 1s4m s ARG 103 Cb -0.40 -0.40 0.04 0.00 -0.45 0.00 0.00 34.95 33.75 1s4m s ARG 103 CO 0.46 0.04 0.77 -0.59 -0.68 0.00 0.00 175.30 175.29 1s4m s PHE 104 N -3.07 -0.25 0.00 -0.53 -0.12 -0.84 -4.98 117.98 108.19 1s4m s PHE 104 Ca 0.10 -0.11 0.00 0.00 -0.05 0.00 0.00 56.93 56.86 1s4m s PHE 104 Cb 0.01 0.66 0.00 0.00 -0.63 0.00 0.00 43.02 43.06 1s4m s PHE 104 CO -0.02 -1.03 0.00 0.41 -0.05 0.00 0.00 175.22 174.53 1s4m n GLY 105 N -0.43 -1.50 3.76 1.99 0.00 -1.26 -0.42 105.19 107.33 1s4m n GLY 105 Ca -0.07 -1.57 -0.39 0.00 0.00 0.00 0.00 46.02 43.99 1s4m n GLY 105 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1s4m s LYS 106 N -2.29 3.57 -1.94 1.61 2.20 0.16 -1.89 119.74 121.16 1s4m s LYS 106 Ca 0.00 2.20 0.00 0.00 -0.36 0.00 0.00 55.97 57.81 1s4m s LYS 106 Cb 0.00 -2.50 0.00 0.00 -1.51 0.00 0.00 37.83 33.82 1s4m s LYS 106 CO 0.00 -0.83 0.00 0.09 -0.36 0.00 0.00 175.35 174.25 1s4m n ASN 107 N -0.45 -5.26 -3.67 1.43 3.02 -1.26 -2.45 115.26 106.62 1s4m n ASN 107 Ca 0.07 0.34 -0.27 0.00 -0.03 0.00 0.00 54.58 54.69 1s4m n ASN 107 Cb 0.44 -4.59 -0.02 0.00 -0.61 0.00 0.00 39.78 35.00 1s4m n ASN 107 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1s4m n ALA 108 N 0.21 -1.12 0.34 5.41 0.00 -0.79 -4.84 120.51 119.72 1s4m n ALA 108 Ca -0.21 0.01 0.14 0.00 0.00 0.00 0.00 53.44 53.38 1s4m n ALA 108 Cb 0.65 -2.66 0.51 0.00 0.00 0.00 0.00 19.45 17.95 1s4m n ALA 108 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1s4m h SER 109 N -0.97 0.00 -3.43 0.00 4.64 -1.42 -3.41 113.55 108.96 1s4m h SER 109 Ca -0.45 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.33 1s4m h SER 109 Cb 1.30 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.35 1s4m h SER 109 CO 0.59 0.00 -0.04 -0.83 -0.87 0.00 0.00 176.83 175.68 1s4m s GLY 110 N -3.96 2.44 0.17 -0.77 0.00 0.44 -4.95 107.32 100.69 1s4m s GLY 110 Ca 0.04 -0.09 -0.02 0.00 0.00 0.00 0.00 44.72 44.65 1s4m s GLY 110 CO 0.54 0.17 0.26 1.16 0.00 0.00 0.00 173.10 175.22 1s4m n ASN 111 N 0.49 -0.73 -0.11 1.64 0.23 -1.26 -1.98 115.26 113.54 1s4m n ASN 111 Ca -0.03 -1.85 0.02 0.00 -0.53 0.00 0.00 54.58 52.18 1s4m n ASN 111 Cb 0.52 1.32 0.32 0.00 -2.08 0.00 0.00 39.78 39.85 1s4m n ASN 111 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1s4m h ALA 112 N 1.78 1.54 0.03 -2.53 0.00 -1.98 -2.31 119.26 115.78 1s4m h ALA 112 Ca -0.13 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1s4m h ALA 112 Cb 0.56 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1s4m h ALA 112 CO 0.18 0.41 -0.05 1.03 0.00 0.00 0.00 179.25 180.82 1s4m h SER 113 N 0.79 -0.12 -0.97 0.00 0.87 -1.95 -1.39 113.55 110.77 1s4m h SER 113 Ca 0.21 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.78 1s4m h SER 113 Cb -0.04 0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 61.92 1s4m h SER 113 CO -0.04 -0.07 0.60 0.15 -0.53 0.00 0.00 176.83 176.93 1s4m h PHE 114 N -0.10 1.26 -0.78 2.24 3.57 -1.82 -2.25 116.94 119.05 1s4m h PHE 114 Ca 0.01 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 1s4m h PHE 114 Cb 0.10 -0.42 -0.04 0.00 2.79 0.00 0.00 35.95 38.39 1s4m h PHE 114 CO -0.10 0.82 0.34 -0.07 -2.23 0.00 0.00 178.31 177.07 1s4m h LEU 115 N 1.33 1.05 -1.00 0.59 3.38 -0.93 -2.42 115.31 117.30 1s4m h LEU 115 Ca 0.35 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 58.10 1s4m h LEU 115 Cb -0.08 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.38 1s4m h LEU 115 CO -0.07 0.91 -0.11 0.03 0.09 0.00 0.00 178.44 179.29 1s4m h ARG 116 N 1.13 0.59 0.00 1.13 3.08 -0.83 0.19 114.38 119.67 1s4m h ARG 116 Ca 0.27 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 60.13 1s4m h ARG 116 Cb 0.16 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 1s4m h ARG 116 CO -0.03 0.69 -0.04 0.87 -1.07 0.00 0.00 179.97 180.39 1s4m h LYS 117 N 0.54 0.00 -0.63 0.04 1.57 -0.95 -1.70 116.57 115.46 1s4m h LYS 117 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1s4m h LYS 117 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1s4m h LYS 117 CO 0.03 0.04 0.00 1.63 -0.57 0.00 0.00 179.45 180.58 1s4m n LYS 118 N -3.16 3.16 -0.93 3.15 4.76 -0.82 -4.89 118.16 119.43 1s4m n LYS 118 Ca 0.00 -2.25 0.00 0.00 -2.87 0.00 0.00 58.31 53.19 1s4m n LYS 118 Cb 0.31 -1.76 0.00 0.00 -1.84 0.00 0.00 35.03 31.74 1s4m n LYS 118 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1s4m n GLY 119 N 0.96 0.53 3.80 0.72 0.00 -0.64 -5.03 105.19 105.53 1s4m n GLY 119 Ca 0.20 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 1s4m n GLY 119 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s4m s VAL 120 N -2.00 5.13 0.08 1.61 1.01 0.62 -4.89 120.40 121.95 1s4m s VAL 120 Ca 0.00 0.79 -0.23 0.00 0.00 0.00 0.00 61.98 62.54 1s4m s VAL 120 Cb 0.00 -3.71 -0.06 0.00 0.00 0.00 0.00 36.38 32.61 1s4m s VAL 120 CO 0.00 0.50 0.69 -1.61 0.00 0.00 0.00 175.10 174.68 1s4m s GLU 121 N -0.49 4.42 -0.19 2.72 2.02 0.14 -3.37 118.70 123.96 1s4m s GLU 121 Ca 0.23 0.95 0.01 0.00 0.02 0.00 0.00 54.97 56.17 1s4m s GLU 121 Cb -0.16 -3.30 0.02 0.00 0.10 0.00 0.00 34.13 30.79 1s4m s GLU 121 CO 0.11 0.46 -0.18 0.08 0.02 0.00 0.00 175.26 175.75 1s4m s VAL 122 N -0.63 2.18 -0.43 2.63 1.01 -1.26 -0.73 120.40 123.17 1s4m s VAL 122 Ca 0.34 -0.92 -0.15 0.00 0.00 0.00 0.00 61.98 61.25 1s4m s VAL 122 Cb -0.21 -1.93 0.03 0.00 0.00 0.00 0.00 36.38 34.27 1s4m s VAL 122 CO 0.22 0.51 0.35 -0.31 0.00 0.00 0.00 175.10 175.87 1s4m s TYR 123 N 1.30 3.23 -0.22 5.22 2.02 -0.03 -4.99 117.35 123.88 1s4m s TYR 123 Ca 0.05 -0.64 -0.19 0.00 -0.37 0.00 0.00 57.07 55.92 1s4m s TYR 123 Cb -0.13 -2.79 -0.03 0.00 -0.40 0.00 0.00 41.96 38.61 1s4m s TYR 123 CO -0.12 -0.66 0.53 -1.21 -1.57 0.00 0.00 175.55 172.52 1s4m s GLU 124 N 1.75 4.15 -0.22 -0.62 2.02 -1.26 -1.68 118.70 122.85 1s4m s GLU 124 Ca 0.06 0.41 -0.15 0.00 0.02 0.00 0.00 54.97 55.31 1s4m s GLU 124 Cb -0.20 -3.59 -0.04 0.00 0.10 0.00 0.00 34.13 30.40 1s4m s GLU 124 CO 0.10 -0.23 0.37 0.42 0.02 0.00 0.00 175.26 175.94 1s4m s ILE 125 N 1.89 5.21 0.54 -1.63 -1.09 0.07 -4.89 121.20 121.30 1s4m s ILE 125 Ca 0.24 0.64 -0.20 0.00 -2.23 0.00 0.00 60.65 59.09 1s4m s ILE 125 Cb -0.15 -3.70 -0.05 0.00 -1.58 0.00 0.00 42.46 36.97 1s4m s ILE 125 CO 0.09 0.25 1.18 -1.61 -1.23 0.00 0.00 174.94 173.62 1s4m s GLU 126 N 1.40 3.28 0.61 2.79 0.41 -1.26 -3.09 118.70 122.86 1s4m s GLU 126 Ca 0.17 1.76 -0.18 0.00 -0.41 0.00 0.00 54.97 56.31 1s4m s GLU 126 Cb -0.15 -2.07 -0.03 0.00 -1.78 0.00 0.00 34.13 30.11 1s4m s GLU 126 CO 0.08 -0.94 1.23 -0.51 -0.49 0.00 0.00 175.26 174.63 1s4m s ASP 127 N -1.58 4.98 0.02 -0.19 -0.00 -1.26 -4.98 116.67 113.67 1s4m s ASP 127 Ca 0.73 2.45 -0.23 0.00 -0.00 0.00 0.00 52.55 55.50 1s4m s ASP 127 Cb -0.28 -2.60 -0.05 0.00 -0.00 0.00 0.00 42.92 39.98 1s4m s ASP 127 CO 0.32 -1.74 0.68 -0.69 -0.00 0.00 0.00 175.17 173.74 1s4m s VAL 128 N -1.56 4.82 -0.12 -1.27 1.01 -1.26 -4.96 120.40 117.04 1s4m s VAL 128 Ca 0.79 1.44 -0.04 0.00 0.00 0.00 0.00 61.98 64.17 1s4m s VAL 128 Cb -0.32 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.00 1s4m s VAL 128 CO 0.35 0.39 0.03 -0.69 0.00 0.00 0.00 175.10 175.19 1s4m s VAL 129 N -0.13 4.56 -0.06 2.92 1.01 -1.26 -0.77 120.40 126.68 1s4m s VAL 129 Ca 0.35 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.19 1s4m s VAL 129 Cb -0.19 -2.97 0.02 0.00 0.00 0.00 0.00 36.38 33.24 1s4m s VAL 129 CO 0.20 0.56 -0.03 -0.69 0.00 0.00 0.00 175.10 175.14 1s4m s VAL 130 N -0.45 0.52 -0.95 2.92 1.01 0.12 -4.87 120.40 118.71 1s4m s VAL 130 Ca 0.09 -0.06 -0.27 0.00 0.00 0.00 0.00 61.98 61.74 1s4m s VAL 130 Cb -0.12 -0.59 0.04 0.00 0.00 0.00 0.00 36.38 35.71 1s4m s VAL 130 CO 0.02 0.25 0.54 0.00 0.00 0.00 0.00 175.10 175.90 1s4m n GLN 131 N 4.43 -0.42 -0.31 2.72 10.64 -1.26 0.02 117.38 133.20 1s4m n GLN 131 Ca -0.19 -0.02 0.00 0.00 -1.83 0.00 0.00 57.00 54.96 1s4m n GLN 131 Cb 0.51 -1.74 0.00 0.00 -0.86 0.00 0.00 30.24 28.15 1s4m n GLN 131 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1s4m n GLY 132 N -1.84 1.38 3.48 2.61 0.00 -1.26 -4.99 105.19 104.57 1s4m n GLY 132 Ca -0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 1s4m n GLY 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s4m s LYS 133 N -0.15 2.35 -0.01 1.61 1.02 0.10 -5.10 119.74 119.57 1s4m s LYS 133 Ca 0.00 -0.80 -0.30 0.00 0.02 0.00 0.00 55.97 54.89 1s4m s LYS 133 Cb 0.00 -2.32 -0.04 0.00 -0.52 0.00 0.00 37.83 34.95 1s4m s LYS 133 CO 0.00 0.59 1.13 1.03 -0.92 0.00 0.00 175.35 177.18 1s4m s ARG 134 N -1.07 4.43 0.04 1.68 0.52 -1.26 0.14 118.95 123.44 1s4m s ARG 134 Ca 0.13 1.61 -0.30 0.00 -0.52 0.00 0.00 55.73 56.65 1s4m s ARG 134 Cb -0.11 -3.47 -0.07 0.00 0.52 0.00 0.00 34.95 31.82 1s4m s ARG 134 CO 0.03 -0.28 1.56 0.08 0.02 0.00 0.00 175.30 176.70 1s4m s VAL 135 N 1.56 3.29 0.14 3.52 1.01 0.05 -4.89 120.40 125.08 1s4m s VAL 135 Ca 0.55 0.72 -0.13 0.00 0.00 0.00 0.00 61.98 63.12 1s4m s VAL 135 Cb -0.25 -3.46 0.02 0.00 0.00 0.00 0.00 36.38 32.69 1s4m s VAL 135 CO 0.25 -0.00 0.35 -0.94 0.00 0.00 0.00 175.10 174.76 1s4m s SER 136 N 2.20 -0.10 0.28 3.32 1.04 -1.26 -4.69 113.70 114.50 1s4m s SER 136 Ca 0.70 -0.54 -0.02 0.00 0.48 0.00 0.00 55.95 56.57 1s4m s SER 136 Cb -0.37 0.45 0.39 0.00 0.10 0.00 0.00 66.02 66.60 1s4m s SER 136 CO 0.30 -0.87 1.88 0.28 0.98 0.00 0.00 173.24 175.82 1s4m h SER 137 N 2.46 0.89 -0.70 7.02 0.02 -1.94 -2.36 113.55 118.94 1s4m h SER 137 Ca -0.33 -0.10 0.01 0.00 -0.84 0.00 0.00 61.79 60.54 1s4m h SER 137 Cb 1.24 -0.23 -0.04 0.00 0.14 0.00 0.00 62.40 63.51 1s4m h SER 137 CO 0.48 0.75 0.46 0.28 -1.14 0.00 0.00 176.83 177.66 1s4m h SER 138 N 0.98 0.79 -0.54 3.07 0.02 -1.96 0.27 113.55 116.18 1s4m h SER 138 Ca 0.24 -0.02 -0.07 0.00 -0.84 0.00 0.00 61.79 61.10 1s4m h SER 138 Cb 0.10 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 1s4m h SER 138 CO -0.03 0.57 0.05 0.25 -1.14 0.00 0.00 176.83 176.53 1s4m h LEU 139 N 0.93 0.89 -0.59 5.07 6.46 -1.84 -1.48 115.31 124.75 1s4m h LEU 139 Ca 0.26 -0.28 -0.12 0.00 -0.12 0.00 0.00 57.88 57.62 1s4m h LEU 139 Cb -0.09 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 39.59 1s4m h LEU 139 CO -0.06 0.94 -0.20 0.40 -0.62 0.00 0.00 178.44 178.90 1s4m h ILE 140 N 0.80 1.27 -0.79 4.05 2.04 -0.89 -2.11 117.51 121.88 1s4m h ILE 140 Ca 0.16 -1.34 0.00 0.00 1.00 0.00 0.00 64.86 64.68 1s4m h ILE 140 Cb 0.46 1.12 -0.04 0.00 -0.74 0.00 0.00 36.82 37.62 1s4m h ILE 140 CO 0.02 0.46 0.51 0.03 0.00 0.00 0.00 178.15 179.17 1s4m h ARG 141 N 0.80 1.05 -0.30 2.37 3.08 -0.28 -1.63 114.38 119.46 1s4m h ARG 141 Ca 0.11 -0.07 -0.12 0.00 0.07 0.00 0.00 59.98 59.96 1s4m h ARG 141 Cb 0.75 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 1s4m h ARG 141 CO 0.06 0.71 -0.32 -0.91 -1.07 0.00 0.00 179.97 178.43 1s4m h ASN 142 N 1.08 0.68 -0.68 7.04 2.35 -0.98 -2.17 115.58 122.91 1s4m h ASN 142 Ca 0.29 -0.27 -0.05 0.00 -0.55 0.00 0.00 56.30 55.72 1s4m h ASN 142 Cb -0.10 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.05 1s4m h ASN 142 CO -0.06 0.95 0.26 -0.07 -1.65 0.00 0.00 177.43 176.86 1s4m h LEU 143 N 0.55 0.96 -0.34 1.61 3.38 -0.85 -1.21 115.31 119.41 1s4m h LEU 143 Ca 0.06 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1s4m h LEU 143 Cb 0.82 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1s4m h LEU 143 CO 0.07 0.87 0.14 0.58 0.09 0.00 0.00 178.44 180.19 1s4m h VAL 144 N 1.02 1.18 0.00 1.22 2.07 -1.02 0.15 116.25 120.87 1s4m h VAL 144 Ca 0.23 -0.55 -0.03 0.00 0.82 0.00 0.00 66.70 67.17 1s4m h VAL 144 Cb 0.23 0.91 -0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1s4m h VAL 144 CO -0.02 0.19 -0.14 1.56 0.02 0.00 0.00 177.57 179.19 1s4m h GLN 145 N 0.40 0.00 -0.53 1.57 4.20 -1.03 -0.89 115.11 118.83 1s4m h GLN 145 Ca 0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.82 1s4m h GLN 145 Cb 0.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1s4m h GLN 145 CO -0.01 0.14 0.00 0.39 -0.67 0.00 0.00 178.83 178.68 1s4m n GLU 146 N -3.52 2.26 -1.11 1.46 1.02 -0.49 -3.56 120.64 116.71 1s4m n GLU 146 Ca -0.01 -1.96 -0.07 0.00 -0.02 0.00 0.00 57.16 55.10 1s4m n GLU 146 Cb 0.29 -1.43 -0.03 0.00 -0.02 0.00 0.00 31.44 30.25 1s4m n GLU 146 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1s4m n GLY 147 N 1.37 0.65 2.61 0.62 0.00 -0.40 -4.86 105.19 105.20 1s4m n GLY 147 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1s4m n GLY 147 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s4m n ARG 148 N -0.30 3.01 0.23 1.61 1.74 0.43 -4.49 116.66 118.88 1s4m n ARG 148 Ca -0.07 -2.37 0.11 0.00 -0.77 0.00 0.00 57.85 54.75 1s4m n ARG 148 Cb 0.49 -3.07 0.42 0.00 -1.02 0.00 0.00 32.46 29.28 1s4m n ARG 148 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 1s4m h VAL 149 N 3.68 0.38 0.00 1.55 -1.51 -1.89 -3.13 116.25 115.33 1s4m h VAL 149 Ca 0.66 -1.09 -0.04 0.00 -1.23 0.00 0.00 66.70 65.00 1s4m h VAL 149 Cb 0.50 1.82 -0.01 0.00 -2.13 0.00 0.00 31.29 31.48 1s4m h VAL 149 CO 1.84 0.17 -0.20 -0.33 -1.23 0.00 0.00 177.57 177.82 1s4m h GLU 150 N 0.00 0.00 0.00 5.19 5.08 -1.85 -3.00 114.58 120.01 1s4m h GLU 150 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1s4m h GLU 150 Cb 0.80 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1s4m h GLU 150 CO 0.02 0.20 -0.43 0.39 -1.00 0.00 0.00 179.01 178.20 1s4m n GLU 151 N -3.18 0.20 -0.17 2.33 1.02 -1.18 -4.34 120.64 115.31 1s4m n GLU 151 Ca 0.03 0.08 -0.08 0.00 -0.02 0.00 0.00 57.16 57.17 1s4m n GLU 151 Cb 0.57 -1.65 0.01 0.00 -0.02 0.00 0.00 31.44 30.35 1s4m n GLU 151 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1s4m h ILE 152 N 0.00 1.22 -0.79 -3.67 2.04 -1.55 -3.14 117.51 111.62 1s4m h ILE 152 Ca 0.00 -0.68 0.23 0.00 1.00 0.00 0.00 64.86 65.41 1s4m h ILE 152 Cb 0.67 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 1s4m h ILE 152 CO 0.00 0.25 0.57 -0.65 0.00 0.00 0.00 178.15 178.33 1s4m h PRO 153 N 0.66 0.00 0.00 2.37 0.11 -1.75 0.19 132.00 133.59 1s4m h PRO 153 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1s4m h PRO 153 Cb 0.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.32 1s4m h PRO 153 CO -0.01 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.78 1s4m n ALA 154 N -2.69 1.65 -0.04 -0.75 0.00 -1.19 -1.09 120.51 116.41 1s4m n ALA 154 Ca 0.16 0.06 -0.07 0.00 0.00 0.00 0.00 53.44 53.60 1s4m n ALA 154 Cb 0.86 -1.36 -0.03 0.00 0.00 0.00 0.00 19.45 18.92 1s4m n ALA 154 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1s4m n TYR 155 N -2.12 0.00 0.15 0.00 4.01 0.47 -4.72 117.16 114.96 1s4m n TYR 155 Ca 0.02 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.83 1s4m n TYR 155 Cb 0.22 -0.30 0.06 0.00 -0.31 0.00 0.00 39.34 39.01 1s4m n TYR 155 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 1s4m h LEU 156 N -0.10 0.00 0.00 7.72 5.85 -1.06 -2.37 115.31 125.35 1s4m h LEU 156 Ca -0.19 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.53 1s4m h LEU 156 Cb 1.24 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.27 1s4m h LEU 156 CO -0.06 0.27 0.00 0.61 -0.34 0.00 0.00 178.44 178.92 1s4m n GLY 157 N 1.19 0.84 3.82 3.75 0.00 -0.25 -4.00 105.19 110.54 1s4m n GLY 157 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.00 1s4m n GLY 157 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1s4m s ARG 158 N -0.51 1.21 0.54 1.61 1.70 -1.25 -5.02 118.95 117.24 1s4m s ARG 158 Ca 0.00 -0.74 -0.19 0.00 -0.47 0.00 0.00 55.73 54.33 1s4m s ARG 158 Cb 0.00 0.37 -0.06 0.00 -0.57 0.00 0.00 34.95 34.69 1s4m s ARG 158 CO 0.00 -0.56 1.10 0.71 -1.08 0.00 0.00 175.30 175.46 1s4m s TYR 159 N -2.56 2.78 0.44 5.89 2.02 -1.26 -3.48 117.35 121.18 1s4m s TYR 159 Ca 0.18 1.55 -0.25 0.00 -0.37 0.00 0.00 57.07 58.19 1s4m s TYR 159 Cb -0.02 -3.19 -0.08 0.00 -0.40 0.00 0.00 41.96 38.27 1s4m s TYR 159 CO 0.04 -1.35 1.29 0.12 -1.57 0.00 0.00 175.55 174.08 1s4m s PHE 160 N -1.94 2.72 -0.00 2.71 5.36 -1.26 -4.79 117.98 120.77 1s4m s PHE 160 Ca 0.70 1.42 0.08 0.00 -0.96 0.00 0.00 56.93 58.17 1s4m s PHE 160 Cb -0.21 -3.64 -0.02 0.00 -0.34 0.00 0.00 43.02 38.81 1s4m s PHE 160 CO 0.27 -2.14 -0.25 -1.21 -1.46 0.00 0.00 175.22 170.43 1s4m s GLU 161 N -2.46 1.92 -0.11 10.12 2.02 -1.26 -0.50 118.70 128.43 1s4m s GLU 161 Ca 0.61 -0.93 -0.01 0.00 0.02 0.00 0.00 54.97 54.66 1s4m s GLU 161 Cb -0.37 -1.91 -0.03 0.00 0.10 0.00 0.00 34.13 31.92 1s4m s GLU 161 CO 0.46 0.52 -0.04 0.42 0.02 0.00 0.00 175.26 176.63 1s4m s ILE 162 N -0.63 3.88 0.01 -1.63 -1.09 -0.29 -4.95 121.20 116.50 1s4m s ILE 162 Ca 0.10 -0.39 -0.01 0.00 -2.23 0.00 0.00 60.65 58.11 1s4m s ILE 162 Cb -0.10 -2.64 -0.01 0.00 -1.58 0.00 0.00 42.46 38.13 1s4m s ILE 162 CO -0.00 0.56 0.01 -0.70 -1.23 0.00 0.00 174.94 173.57 1s4m s GLU 163 N -0.33 0.27 0.00 2.79 -6.30 -1.26 -0.10 118.70 113.78 1s4m s GLU 163 Ca 0.05 -0.42 0.00 0.00 -2.50 0.00 0.00 54.97 52.10 1s4m s GLU 163 Cb -0.12 0.10 0.00 0.00 0.00 0.00 0.00 34.13 34.11 1s4m s GLU 163 CO 0.02 -0.05 0.00 0.41 0.02 0.00 0.00 175.26 175.66 1s4m n GLY 164 N 1.93 -0.98 3.63 -1.50 0.00 -0.93 -4.22 105.19 103.11 1s4m n GLY 164 Ca -0.21 -0.93 -0.28 0.00 0.00 0.00 0.00 46.02 44.60 1s4m n GLY 164 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s4m s ILE 165 N -3.00 3.59 0.16 -0.61 1.09 -0.26 -0.58 121.20 121.59 1s4m s ILE 165 Ca 0.00 -1.34 -0.30 0.00 -1.10 0.00 0.00 60.65 57.91 1s4m s ILE 165 Cb 0.00 -2.75 -0.07 0.00 -1.06 0.00 0.00 42.46 38.58 1s4m s ILE 165 CO 0.00 -0.01 0.98 -0.69 -0.10 0.00 0.00 174.94 175.12 1s4m s VAL 166 N -1.50 4.25 0.00 2.92 1.01 -0.57 0.30 120.40 126.81 1s4m s VAL 166 Ca 0.25 1.99 0.00 0.00 0.00 0.00 0.00 61.98 64.22 1s4m s VAL 166 Cb -0.10 -4.27 0.00 0.00 0.00 0.00 0.00 36.38 32.01 1s4m s VAL 166 CO 0.17 0.36 0.00 1.57 0.00 0.00 0.00 175.10 177.20 1s4m n HIS 167 N 2.33 0.00 -0.75 5.22 -0.00 -0.09 -2.18 115.22 119.74 1s4m n HIS 167 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.73 1s4m n HIS 167 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.47 1s4m n HIS 167 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.34 177.51 1s4m n LYS 168 N 0.00 -0.80 -3.92 1.57 4.81 -1.26 -4.72 118.16 113.84 1s4m n LYS 168 Ca 0.00 0.20 -0.32 0.00 -0.87 0.00 0.00 58.31 57.32 1s4m n LYS 168 Cb 0.00 -4.51 0.00 0.00 0.02 0.00 0.00 35.03 30.54 1s4m n LYS 168 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 1s4m n PHE 178 N -2.05 -1.65 -2.86 5.64 3.01 -1.26 -5.20 117.46 113.09 1s4m n PHE 178 Ca 0.00 0.52 -0.43 0.00 1.01 0.00 0.00 57.45 58.55 1s4m n PHE 178 Cb 0.20 -3.39 -0.04 0.00 -0.01 0.00 0.00 39.48 36.24 1s4m n PHE 178 CO 0.00 0.00 0.00 -2.14 1.01 0.00 0.00 176.76 175.63 1s4m s PRO 179 N -6.60 3.66 0.06 -1.08 0.02 -1.26 -5.01 135.00 124.80 1s4m s PRO 179 Ca 0.24 0.29 -0.06 0.00 0.02 0.00 0.00 61.00 61.50 1s4m s PRO 179 Cb -0.10 -3.86 -0.01 0.00 0.02 0.00 0.00 34.50 30.54 1s4m s PRO 179 CO 0.91 -1.04 0.11 0.95 -0.33 0.00 0.00 177.00 177.59 1s4m s THR 180 N 3.46 0.16 -0.26 0.99 -4.23 -1.26 -4.72 115.64 109.78 1s4m s THR 180 Ca 0.35 -1.34 -0.08 0.00 -1.18 0.00 0.00 61.69 59.45 1s4m s THR 180 Cb -0.12 -1.28 -0.03 0.00 1.34 0.00 0.00 72.50 72.41 1s4m s THR 180 CO 0.21 -0.74 0.10 0.00 -0.54 0.00 0.00 174.62 173.65 1s4m s ALA 181 N -3.57 3.22 -0.20 3.99 0.00 0.18 -4.84 121.76 120.53 1s4m s ALA 181 Ca 0.03 -1.16 -0.22 0.00 0.00 0.00 0.00 51.96 50.62 1s4m s ALA 181 Cb 0.04 -2.17 -0.02 0.00 0.00 0.00 0.00 23.12 20.98 1s4m s ALA 181 CO -0.09 -0.55 0.68 -0.80 0.00 0.00 0.00 175.76 175.00 1s4m s ASN 182 N 1.63 6.73 -0.29 0.00 -0.87 -1.26 -0.22 114.94 120.66 1s4m s ASN 182 Ca 0.06 0.89 -0.16 0.00 -1.57 0.00 0.00 52.86 52.07 1s4m s ASN 182 Cb -0.15 -2.37 -0.02 0.00 -0.02 0.00 0.00 41.25 38.68 1s4m s ASN 182 CO 0.05 -0.33 0.44 -0.63 -2.57 0.00 0.00 177.10 174.06 1s4m s ILE 183 N 2.11 5.11 -0.33 0.60 -1.09 0.13 -0.92 121.20 126.82 1s4m s ILE 183 Ca 0.30 0.55 -0.21 0.00 -2.23 0.00 0.00 60.65 59.07 1s4m s ILE 183 Cb -0.16 -3.80 -0.00 0.00 -1.58 0.00 0.00 42.46 36.92 1s4m s ILE 183 CO 0.10 0.03 0.66 -0.62 -1.23 0.00 0.00 174.94 173.89 1s4m s ASP 184 N 1.65 6.49 0.00 3.58 3.68 0.15 -4.44 116.67 127.78 1s4m s ASP 184 Ca 0.17 0.34 0.21 0.00 2.13 0.00 0.00 52.55 55.41 1s4m s ASP 184 Cb -0.16 -2.34 1.02 0.00 -1.45 0.00 0.00 42.92 39.99 1s4m s ASP 184 CO 0.11 -0.56 1.69 0.54 0.13 0.00 0.00 175.17 177.07 1s4m n ARG 185 N 6.03 1.33 0.00 4.34 1.74 -1.26 -1.10 116.66 127.73 1s4m n ARG 185 Ca -0.00 -0.49 0.00 0.00 -0.77 0.00 0.00 57.85 56.59 1s4m n ARG 185 Cb 0.49 -1.36 0.00 0.00 -1.02 0.00 0.00 32.46 30.57 1s4m n ARG 185 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1s4m n GLY 186 N 0.96 -2.66 1.18 -0.13 0.00 -1.26 -4.70 105.19 98.59 1s4m n GLY 186 Ca 0.16 -2.10 0.12 0.00 0.00 0.00 0.00 46.02 44.19 1s4m n GLY 186 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1s4m n ASN 187 N 0.00 3.53 -4.87 1.61 5.03 -1.26 -4.96 115.26 114.34 1s4m n ASN 187 Ca 0.00 -2.00 -0.30 0.00 0.87 0.00 0.00 54.58 53.15 1s4m n ASN 187 Cb 0.00 -0.27 -0.03 0.00 -1.02 0.00 0.00 39.78 38.46 1s4m n ASN 187 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1s4m s GLU 188 N -1.44 3.78 -0.59 3.52 2.12 -1.26 -4.98 118.70 119.85 1s4m s GLU 188 Ca 0.40 0.52 -0.28 0.00 0.36 0.00 0.00 54.97 55.97 1s4m s GLU 188 Cb 0.23 -2.36 0.02 0.00 0.26 0.00 0.00 34.13 32.28 1s4m s GLU 188 CO 0.32 -0.08 1.37 0.15 -0.54 0.00 0.00 175.26 176.48 1s4m s LYS 189 N -3.93 3.30 0.08 4.30 1.02 -1.26 -4.99 119.74 118.26 1s4m s LYS 189 Ca 0.52 0.33 0.06 0.00 0.02 0.00 0.00 55.97 56.90 1s4m s LYS 189 Cb -0.10 -4.12 -0.04 0.00 -0.52 0.00 0.00 37.83 33.05 1s4m s LYS 189 CO 0.32 -1.94 -0.06 -0.51 -0.92 0.00 0.00 175.35 172.24 1s4m s LEU 190 N 5.92 3.22 0.46 3.17 1.43 -1.26 -1.10 118.68 130.51 1s4m s LEU 190 Ca 0.49 -0.27 -0.24 0.00 -1.03 0.00 0.00 54.13 53.08 1s4m s LEU 190 Cb -0.10 -1.96 -0.07 0.00 0.03 0.00 0.00 46.19 44.09 1s4m s LEU 190 CO 0.24 0.19 1.34 0.54 0.23 0.00 0.00 176.35 178.89 1s4m s VAL 191 N -1.21 2.35 -0.08 -1.59 0.11 0.22 -4.63 120.40 115.57 1s4m s VAL 191 Ca 0.22 0.29 -0.02 0.00 -2.93 0.00 0.00 61.98 59.55 1s4m s VAL 191 Cb -0.11 -3.16 -0.03 0.00 -1.53 0.00 0.00 36.38 31.54 1s4m s VAL 191 CO 0.14 0.03 0.02 -1.81 -3.33 0.00 0.00 175.10 170.15 1s4m s ASP 192 N -0.78 5.36 0.52 3.54 1.01 -1.26 -4.96 116.67 120.10 1s4m s ASP 192 Ca 0.63 0.16 -0.20 0.00 0.71 0.00 0.00 52.55 53.85 1s4m s ASP 192 Cb -0.39 -1.53 -0.07 0.00 1.01 0.00 0.00 42.92 41.94 1s4m s ASP 192 CO 0.49 0.37 1.10 -0.76 0.21 0.00 0.00 175.17 176.58 1s4m s LEU 193 N -1.00 3.80 0.22 1.23 1.43 -1.26 -3.70 118.68 119.39 1s4m s LEU 193 Ca 0.14 2.10 -0.32 0.00 -1.03 0.00 0.00 54.13 55.03 1s4m s LEU 193 Cb -0.11 -4.56 -0.14 0.00 0.03 0.00 0.00 46.19 41.41 1s4m s LEU 193 CO 0.04 -1.06 1.26 1.17 0.23 0.00 0.00 176.35 177.99 1s4m n LYS 194 N -1.14 1.59 -1.68 1.70 4.81 -0.85 -4.87 118.16 117.71 1s4m n LYS 194 Ca 0.11 0.57 -0.40 0.00 -0.87 0.00 0.00 58.31 57.71 1s4m n LYS 194 Cb 0.51 -2.13 0.02 0.00 0.02 0.00 0.00 35.03 33.46 1s4m n LYS 194 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1s4m n ARG 195 N 1.75 1.63 -1.21 1.64 1.74 -1.26 -4.83 116.66 116.13 1s4m n ARG 195 Ca 0.13 0.59 0.00 0.00 -0.77 0.00 0.00 57.85 57.80 1s4m n ARG 195 Cb 0.29 -2.33 0.00 0.00 -1.02 0.00 0.00 32.46 29.40 1s4m n ARG 195 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1s4m n GLY 196 N 0.94 0.19 3.60 -0.13 0.00 0.38 -3.79 105.19 106.37 1s4m n GLY 196 Ca 0.09 -1.72 -0.34 0.00 0.00 0.00 0.00 46.02 44.05 1s4m n GLY 196 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s4m s VAL 197 N -2.12 3.94 0.09 1.61 1.01 0.78 0.15 120.40 125.87 1s4m s VAL 197 Ca 0.00 -0.38 0.06 0.00 0.00 0.00 0.00 61.98 61.66 1s4m s VAL 197 Cb 0.00 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.70 1s4m s VAL 197 CO 0.00 0.58 -0.16 -0.31 0.00 0.00 0.00 175.10 175.21 1s4m s TYR 198 N -0.59 1.40 -0.19 5.22 2.02 0.26 -0.22 117.35 125.25 1s4m s TYR 198 Ca 0.09 -0.46 -0.22 0.00 -0.37 0.00 0.00 57.07 56.11 1s4m s TYR 198 Cb -0.12 -0.77 -0.02 0.00 -0.40 0.00 0.00 41.96 40.65 1s4m s TYR 198 CO 0.02 0.11 0.69 -1.17 -1.57 0.00 0.00 175.55 173.63 1s4m s LEU 199 N -1.90 4.15 0.16 -1.29 2.96 -0.04 -0.60 118.68 122.13 1s4m s LEU 199 Ca 0.02 0.93 0.09 0.00 -0.22 0.00 0.00 54.13 54.95 1s4m s LEU 199 Cb -0.09 -2.99 -0.04 0.00 0.50 0.00 0.00 46.19 43.57 1s4m s LEU 199 CO 0.03 -0.31 -0.20 0.68 -1.32 0.00 0.00 176.35 175.23 1s4m s VAL 200 N 1.99 1.89 -0.25 1.68 -7.23 -0.08 -0.95 120.40 117.44 1s4m s VAL 200 Ca 0.31 -1.87 -0.10 0.00 -1.81 0.00 0.00 61.98 58.52 1s4m s VAL 200 Cb -0.16 -1.84 -0.05 0.00 0.56 0.00 0.00 36.38 34.90 1s4m s VAL 200 CO 0.11 -0.24 0.15 -0.60 -0.31 0.00 0.00 175.10 174.21 1s4m s ARG 201 N -2.62 3.95 -0.32 4.82 6.06 0.11 -0.32 118.95 130.62 1s4m s ARG 201 Ca 0.15 -0.33 -0.12 0.00 -2.50 0.00 0.00 55.73 52.93 1s4m s ARG 201 Cb -0.07 -3.52 -0.02 0.00 0.06 0.00 0.00 34.95 31.40 1s4m s ARG 201 CO 0.07 -0.06 0.22 0.08 -2.50 0.00 0.00 175.30 173.11 1s4m s VAL 202 N 1.36 5.19 -0.49 7.11 1.01 0.38 -0.81 120.40 134.15 1s4m s VAL 202 Ca 0.07 -0.17 -0.20 0.00 0.00 0.00 0.00 61.98 61.68 1s4m s VAL 202 Cb -0.15 -3.62 0.05 0.00 0.00 0.00 0.00 36.38 32.66 1s4m s VAL 202 CO 0.07 0.05 0.64 -2.28 0.00 0.00 0.00 175.10 173.57 1s4m s HIS 203 N 1.71 3.04 0.75 5.22 2.46 0.38 -0.93 115.29 127.92 1s4m s HIS 203 Ca 0.06 -0.39 -0.06 0.00 0.47 0.00 0.00 55.06 55.15 1s4m s HIS 203 Cb -0.17 -3.48 0.11 0.00 -0.13 0.00 0.00 32.58 28.91 1s4m s HIS 203 CO 0.10 -0.99 1.05 -0.51 -2.47 0.00 0.00 174.74 171.91 1s4m s LEU 204 N 2.72 2.90 0.75 8.88 2.01 -0.69 -2.93 118.68 132.32 1s4m s LEU 204 Ca 0.17 0.07 -0.11 0.00 0.01 0.00 0.00 54.13 54.27 1s4m s LEU 204 Cb -0.17 -2.50 0.04 0.00 0.01 0.00 0.00 46.19 43.57 1s4m s LEU 204 CO 0.14 -1.89 1.09 -2.84 1.01 0.00 0.00 176.35 173.86 1s4m s PRO 205 N -5.30 2.46 -0.01 1.29 0.02 -1.26 -3.44 135.00 128.76 1s4m s PRO 205 Ca 0.65 0.68 0.00 0.00 0.02 0.00 0.00 61.00 62.35 1s4m s PRO 205 Cb -0.07 -1.96 0.00 0.00 0.02 0.00 0.00 34.50 32.49 1s4m s PRO 205 CO 0.46 -1.37 0.00 -0.25 -0.33 0.00 0.00 177.00 175.51 1s4m n ASP 206 N -3.27 -3.05 0.00 2.53 10.43 -1.26 -3.77 116.55 118.16 1s4m n ASP 206 Ca 0.07 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.43 1s4m n ASP 206 Cb 0.56 -0.56 0.00 0.00 1.84 0.00 0.00 41.12 42.96 1s4m n ASP 206 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1s4m n GLY 207 N -2.94 1.68 3.73 0.44 0.00 -1.22 -5.00 105.19 101.88 1s4m n GLY 207 Ca -0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1s4m n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s4m s LYS 208 N -0.09 2.26 -0.08 1.61 1.02 -1.25 -4.84 119.74 118.38 1s4m s LYS 208 Ca 0.00 1.79 0.01 0.00 0.02 0.00 0.00 55.97 57.80 1s4m s LYS 208 Cb 0.00 -1.84 0.02 0.00 -0.52 0.00 0.00 37.83 35.48 1s4m s LYS 208 CO 0.00 -1.75 -0.10 0.15 -0.92 0.00 0.00 175.35 172.73 1s4m s LYS 209 N -3.81 1.58 0.30 1.68 1.02 -1.26 -1.71 119.74 117.55 1s4m s LYS 209 Ca 0.75 -0.35 0.03 0.00 0.02 0.00 0.00 55.97 56.43 1s4m s LYS 209 Cb -0.30 -1.40 -0.06 0.00 -0.52 0.00 0.00 37.83 35.55 1s4m s LYS 209 CO 0.44 -0.06 0.07 0.15 -0.92 0.00 0.00 175.35 175.03 1s4m s LYS 210 N 0.94 1.56 0.20 1.68 -0.14 -0.11 -4.96 119.74 118.92 1s4m s LYS 210 Ca -0.09 -1.86 0.06 0.00 -1.36 0.00 0.00 55.97 52.72 1s4m s LYS 210 Cb -0.15 -0.66 -0.04 0.00 -1.68 0.00 0.00 37.83 35.30 1s4m s LYS 210 CO 0.00 -0.22 0.17 -0.06 -0.76 0.00 0.00 175.35 174.48 1s4m s PHE 211 N -3.45 3.14 0.23 3.18 0.08 -1.26 0.15 117.98 120.05 1s4m s PHE 211 Ca 0.37 -0.05 -0.10 0.00 0.12 0.00 0.00 56.93 57.26 1s4m s PHE 211 Cb 0.08 -1.47 -0.01 0.00 -0.57 0.00 0.00 43.02 41.05 1s4m s PHE 211 CO 0.15 0.52 0.38 0.20 -0.10 0.00 0.00 175.22 176.37 1s4m s GLY 212 N -3.43 0.74 -0.17 4.36 0.00 0.56 -0.33 107.32 109.05 1s4m s GLY 212 Ca 0.32 -1.06 0.01 0.00 0.00 0.00 0.00 44.72 43.98 1s4m s GLY 212 CO 0.24 -0.82 -0.12 0.54 0.00 0.00 0.00 173.10 172.94 1s4m s VAL 213 N -4.05 1.61 -0.11 1.40 0.11 -0.37 -0.91 120.40 118.09 1s4m s VAL 213 Ca 0.26 -0.82 0.00 0.00 -2.93 0.00 0.00 61.98 58.49 1s4m s VAL 213 Cb 0.01 -1.60 -0.02 0.00 -1.53 0.00 0.00 36.38 33.24 1s4m s VAL 213 CO 0.09 0.32 -0.12 -0.32 -3.33 0.00 0.00 175.10 171.74 1s4m s MET 214 N 1.44 3.16 -0.10 1.54 0.00 0.24 -0.19 119.30 125.39 1s4m s MET 214 Ca 0.02 -0.65 -0.03 0.00 0.00 0.00 0.00 55.69 55.03 1s4m s MET 214 Cb -0.14 -2.61 -0.03 0.00 0.00 0.00 0.00 34.83 32.04 1s4m s MET 214 CO -0.10 0.35 0.02 1.21 0.00 0.00 0.00 175.02 176.51 1s4m s ASN 215 N -0.01 5.38 -0.22 1.11 3.84 0.09 0.91 114.94 126.04 1s4m s ASN 215 Ca -0.03 0.16 0.02 0.00 0.21 0.00 0.00 52.86 53.22 1s4m s ASN 215 Cb -0.14 -1.61 0.05 0.00 -0.55 0.00 0.00 41.25 39.00 1s4m s ASN 215 CO 0.04 0.35 -0.11 -0.69 -2.79 0.00 0.00 177.10 173.90 1s4m s VAL 216 N -0.71 1.84 0.02 -5.21 1.01 0.40 -2.58 120.40 115.17 1s4m s VAL 216 Ca 0.11 -1.23 -0.05 0.00 0.00 0.00 0.00 61.98 60.81 1s4m s VAL 216 Cb -0.12 -1.92 -0.01 0.00 0.00 0.00 0.00 36.38 34.33 1s4m s VAL 216 CO 0.02 0.11 0.10 -0.83 0.00 0.00 0.00 175.10 174.50 1s4m s GLY 217 N 1.29 0.13 0.02 4.51 0.00 -1.13 0.14 107.32 112.28 1s4m s GLY 217 Ca -0.04 -0.39 -0.30 0.00 0.00 0.00 0.00 44.72 43.99 1s4m s GLY 217 CO -0.07 -0.52 1.76 -1.36 0.00 0.00 0.00 173.10 172.90 1s4m s PHE 218 N -1.97 1.91 -0.47 1.90 2.99 -1.26 -1.42 117.98 119.66 1s4m s PHE 218 Ca -0.10 0.02 0.08 0.00 0.00 0.00 0.00 56.93 56.93 1s4m s PHE 218 Cb -0.05 -4.04 0.32 0.00 0.00 0.00 0.00 43.02 39.24 1s4m s PHE 218 CO -0.02 -4.43 0.76 -2.13 -0.00 0.00 0.00 175.22 169.41 1s4m n ARG 219 N 6.71 1.83 0.00 0.44 0.00 -1.06 -4.91 116.66 119.67 1s4m n ARG 219 Ca 0.18 -3.98 0.00 0.00 -0.00 0.00 0.00 57.85 54.05 1s4m n ARG 219 Cb 0.41 -1.86 0.00 0.00 0.00 0.00 0.00 32.46 31.01 1s4m n ARG 219 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 1s4m n PRO 220 N 0.38 0.00 -3.94 -0.14 -0.02 -1.25 -4.80 135.00 125.23 1s4m n PRO 220 Ca 0.27 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 61.37 1s4m n PRO 220 Cb 0.52 0.00 0.02 0.00 -0.02 0.00 0.00 33.50 34.02 1s4m n PRO 220 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1s4m n THR 221 N -0.02 -3.36 -1.73 3.45 -1.04 -1.26 -4.45 114.28 105.87 1s4m n THR 221 Ca 0.00 -0.45 0.00 0.00 -2.04 0.00 0.00 64.05 61.56 1s4m n THR 221 Cb 0.00 -2.78 0.00 0.00 -1.82 0.00 0.00 70.33 65.73 1s4m n THR 221 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1s4m n ASP 224 N -2.33 -8.67 0.05 8.00 9.92 -1.26 -5.05 116.55 117.21 1s4m n ASP 224 Ca -0.17 1.28 0.00 0.00 -0.53 0.00 0.00 54.79 55.37 1s4m n ASP 224 Cb 0.60 -5.05 0.00 0.00 -0.64 0.00 0.00 41.12 36.03 1s4m n ASP 224 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1s4m n ALA 225 N -0.61 3.00 0.06 2.24 0.00 -1.26 -4.86 120.51 119.08 1s4m n ALA 225 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1s4m n ALA 225 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.46 1s4m n ALA 225 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1s4m n ARG 226 N -2.86 0.06 -2.39 0.00 1.85 -1.26 -4.51 116.66 107.56 1s4m n ARG 226 Ca 0.00 0.00 -0.43 0.00 -1.00 0.00 0.00 57.85 56.42 1s4m n ARG 226 Cb 0.00 -1.21 -0.02 0.00 -1.05 0.00 0.00 32.46 30.18 1s4m n ARG 226 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 1s4m s ASN 227 N -0.15 6.92 -0.05 2.89 2.47 -1.26 -5.01 114.94 120.75 1s4m s ASN 227 Ca 0.00 1.74 0.05 0.00 0.42 0.00 0.00 52.86 55.07 1s4m s ASN 227 Cb 0.00 -2.54 -0.02 0.00 -1.45 0.00 0.00 41.25 37.24 1s4m s ASN 227 CO 0.00 -0.77 -0.21 -0.69 -3.72 0.00 0.00 177.10 171.71 1s4m s VAL 228 N 3.53 2.48 -0.05 -5.21 1.01 -1.26 -2.56 120.40 118.34 1s4m s VAL 228 Ca 0.56 -0.93 -0.03 0.00 0.00 0.00 0.00 61.98 61.58 1s4m s VAL 228 Cb -0.23 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 1s4m s VAL 228 CO 0.16 0.58 0.11 -0.54 0.00 0.00 0.00 175.10 175.41 1s4m s LYS 229 N -0.46 3.25 -0.24 2.72 1.02 -0.51 -4.92 119.74 120.60 1s4m s LYS 229 Ca 0.05 -0.33 0.02 0.00 0.02 0.00 0.00 55.97 55.73 1s4m s LYS 229 Cb -0.12 -3.00 0.05 0.00 -0.52 0.00 0.00 37.83 34.24 1s4m s LYS 229 CO 0.01 0.70 -0.12 0.71 -0.92 0.00 0.00 175.35 175.73 1s4m s TYR 230 N -1.13 3.13 -0.03 3.18 2.02 -1.26 -2.85 117.35 120.41 1s4m s TYR 230 Ca 0.20 -2.08 0.03 0.00 -0.37 0.00 0.00 57.07 54.85 1s4m s TYR 230 Cb -0.12 -1.95 0.00 0.00 -0.40 0.00 0.00 41.96 39.50 1s4m s TYR 230 CO 0.10 -0.85 -0.12 -1.83 -1.57 0.00 0.00 175.55 171.28 1s4m s GLU 231 N 1.17 1.29 0.01 -0.62 -1.05 -1.07 0.21 118.70 118.64 1s4m s GLU 231 Ca -0.05 -0.42 0.07 0.00 -0.15 0.00 0.00 54.97 54.42 1s4m s GLU 231 Cb -0.18 -1.16 -0.02 0.00 -0.44 0.00 0.00 34.13 32.33 1s4m s GLU 231 CO -0.07 0.16 -0.21 0.54 0.95 0.00 0.00 175.26 176.63 1s4m s VAL 232 N 0.16 1.64 -0.38 1.83 0.11 0.70 -0.73 120.40 123.72 1s4m s VAL 232 Ca -0.04 -1.01 -0.10 0.00 -2.93 0.00 0.00 61.98 57.91 1s4m s VAL 232 Cb -0.10 -1.39 0.05 0.00 -1.53 0.00 0.00 36.38 33.41 1s4m s VAL 232 CO 0.01 0.36 0.21 -0.47 -3.33 0.00 0.00 175.10 171.88 1s4m s TYR 233 N -0.61 3.28 0.20 1.54 5.04 0.73 0.50 117.35 128.03 1s4m s TYR 233 Ca 0.08 -1.24 -0.30 0.00 -2.44 0.00 0.00 57.07 53.17 1s4m s TYR 233 Cb -0.08 -2.58 -0.08 0.00 0.35 0.00 0.00 41.96 39.57 1s4m s TYR 233 CO 0.00 -0.73 0.95 0.42 -1.34 0.00 0.00 175.55 174.85 1s4m s ILE 234 N 1.48 4.19 0.05 3.14 1.01 -1.26 -1.24 121.20 128.57 1s4m s ILE 234 Ca 0.02 2.07 -0.21 0.00 0.00 0.00 0.00 60.65 62.53 1s4m s ILE 234 Cb -0.21 -4.32 -0.06 0.00 0.01 0.00 0.00 42.46 37.88 1s4m s ILE 234 CO 0.04 0.44 0.61 -0.76 0.00 0.00 0.00 174.94 175.28 1s4m s LEU 235 N -0.81 4.49 -1.35 2.97 1.02 0.55 -4.19 118.68 121.35 1s4m s LEU 235 Ca 0.43 1.27 -0.06 0.00 0.02 0.00 0.00 54.13 55.79 1s4m s LEU 235 Cb -0.25 -2.97 0.02 0.00 0.02 0.00 0.00 46.19 43.01 1s4m s LEU 235 CO 0.32 0.19 0.98 0.47 0.02 0.00 0.00 176.35 178.32 1s4m n ASP 236 N 2.17 -3.77 -3.66 2.29 8.00 -1.26 -4.38 116.55 115.94 1s4m n ASP 236 Ca -0.08 -0.68 -0.07 0.00 0.71 0.00 0.00 54.79 54.67 1s4m n ASP 236 Cb 0.51 -4.54 -0.08 0.00 -0.02 0.00 0.00 41.12 36.98 1s4m n ASP 236 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1s4m s PHE 237 N -3.41 -0.91 0.42 1.24 5.36 -1.26 -5.08 117.98 114.34 1s4m s PHE 237 Ca 0.33 1.69 0.07 0.00 -0.96 0.00 0.00 56.93 58.07 1s4m s PHE 237 Cb -0.16 0.41 -0.06 0.00 -0.34 0.00 0.00 43.02 42.88 1s4m s PHE 237 CO 0.77 -0.52 0.13 -1.21 -1.46 0.00 0.00 175.22 172.94 1s4m s GLU 238 N 2.65 2.15 0.00 10.12 2.02 -1.26 -4.85 118.70 129.53 1s4m s GLU 238 Ca -0.03 -1.94 0.00 0.00 0.02 0.00 0.00 54.97 53.02 1s4m s GLU 238 Cb -0.12 -1.87 0.00 0.00 0.10 0.00 0.00 34.13 32.24 1s4m s GLU 238 CO -0.14 -0.12 0.00 0.41 0.02 0.00 0.00 175.26 175.43 1s4m n GLY 239 N -1.18 2.74 3.69 -1.39 0.00 -1.26 -5.01 105.19 102.78 1s4m n GLY 239 Ca -0.03 -1.41 -0.42 0.00 0.00 0.00 0.00 46.02 44.16 1s4m n GLY 239 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1s4m s ASP 240 N 0.00 7.26 0.00 1.61 -0.00 -1.26 -4.87 116.67 119.41 1s4m s ASP 240 Ca 0.00 1.54 0.20 0.00 -0.00 0.00 0.00 52.55 54.29 1s4m s ASP 240 Cb 0.00 -2.56 0.53 0.00 -0.00 0.00 0.00 42.92 40.89 1s4m s ASP 240 CO 0.00 -0.43 1.44 0.18 -0.00 0.00 0.00 175.17 176.36 1s4m n LEU 241 N 4.88 2.84 -4.73 1.23 4.77 -1.26 -4.96 117.00 119.77 1s4m n LEU 241 Ca 0.08 -1.31 -0.64 0.00 -0.03 0.00 0.00 56.01 54.11 1s4m n LEU 241 Cb 0.49 -0.28 -0.09 0.00 -2.33 0.00 0.00 43.42 41.21 1s4m n LEU 241 CO 0.52 0.66 1.17 0.00 -1.33 0.00 0.00 177.39 178.41 1s4m n TYR 242 N 1.07 1.80 -0.39 -1.77 9.36 -1.26 0.99 117.16 126.95 1s4m n TYR 242 Ca 0.18 0.95 0.00 0.00 3.32 0.00 0.00 57.90 62.36 1s4m n TYR 242 Cb 0.48 -2.29 0.00 0.00 -0.63 0.00 0.00 39.34 36.90 1s4m n TYR 242 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1s4m n GLY 243 N 3.93 1.28 3.93 2.98 0.00 -0.93 -4.95 105.19 111.43 1s4m n GLY 243 Ca 0.29 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.06 1s4m n GLY 243 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1s4m s GLN 244 N -0.35 3.38 0.04 1.61 -0.21 0.28 -4.77 119.66 119.64 1s4m s GLN 244 Ca 0.00 -0.65 -0.26 0.00 0.02 0.00 0.00 55.36 54.47 1s4m s GLN 244 Cb 0.00 -2.92 -0.05 0.00 1.00 0.00 0.00 33.01 31.04 1s4m s GLN 244 CO 0.00 0.50 0.81 0.50 -2.12 0.00 0.00 175.29 174.98 1s4m s ARG 245 N -3.32 4.53 0.15 2.91 3.52 -1.26 -1.51 118.95 123.97 1s4m s ARG 245 Ca 0.34 1.14 0.07 0.00 -0.13 0.00 0.00 55.73 57.15 1s4m s ARG 245 Cb -0.11 -3.38 -0.04 0.00 -1.56 0.00 0.00 34.95 29.86 1s4m s ARG 245 CO 0.28 0.23 -0.16 -0.51 -0.81 0.00 0.00 175.30 174.33 1s4m s LEU 246 N 0.09 2.44 -0.03 -0.88 1.02 0.25 -4.49 118.68 117.08 1s4m s LEU 246 Ca 0.41 -0.86 0.01 0.00 0.02 0.00 0.00 54.13 53.71 1s4m s LEU 246 Cb -0.21 -0.68 0.02 0.00 0.02 0.00 0.00 46.19 45.34 1s4m s LEU 246 CO 0.24 -0.10 -0.04 -0.54 0.02 0.00 0.00 176.35 175.93 1s4m s LYS 247 N -2.85 0.63 -0.13 1.70 -0.14 -1.15 -2.19 119.74 115.61 1s4m s LYS 247 Ca 0.13 -0.08 -0.00 0.00 -1.36 0.00 0.00 55.97 54.66 1s4m s LYS 247 Cb -0.05 -0.67 0.03 0.00 -1.68 0.00 0.00 37.83 35.46 1s4m s LYS 247 CO 0.05 -0.05 -0.09 -0.51 -0.76 0.00 0.00 175.35 173.99 1s4m s LEU 248 N 0.72 1.35 -0.09 3.17 1.43 0.86 -0.47 118.68 125.65 1s4m s LEU 248 Ca -0.09 -0.38 -0.26 0.00 -1.03 0.00 0.00 54.13 52.36 1s4m s LEU 248 Cb -0.12 -0.93 -0.02 0.00 0.03 0.00 0.00 46.19 45.14 1s4m s LEU 248 CO -0.00 -0.11 0.85 -1.61 0.23 0.00 0.00 176.35 175.71 1s4m s GLU 249 N 1.65 4.42 -0.54 1.70 2.02 0.01 -1.13 118.70 126.81 1s4m s GLU 249 Ca 0.05 1.12 -0.20 0.00 0.02 0.00 0.00 54.97 55.96 1s4m s GLU 249 Cb -0.13 -3.50 0.07 0.00 0.10 0.00 0.00 34.13 30.67 1s4m s GLU 249 CO -0.09 -0.14 0.69 0.08 0.02 0.00 0.00 175.26 175.82 1s4m s VAL 250 N 1.46 4.78 -0.07 2.63 1.01 0.35 -0.71 120.40 129.84 1s4m s VAL 250 Ca 0.43 -0.56 -0.17 0.00 0.00 0.00 0.00 61.98 61.68 1s4m s VAL 250 Cb -0.18 -4.40 -0.29 0.00 0.00 0.00 0.00 36.38 31.51 1s4m s VAL 250 CO 0.19 -0.96 0.69 -0.07 0.00 0.00 0.00 175.10 174.95 1s4m h LEU 251 N 9.99 0.45 -7.19 3.92 3.38 -1.36 -3.40 115.31 121.10 1s4m h LEU 251 Ca -0.28 -0.89 -0.09 0.00 0.09 0.00 0.00 57.88 56.71 1s4m h LEU 251 Cb 1.09 -0.15 -0.22 0.00 0.09 0.00 0.00 40.66 41.47 1s4m h LEU 251 CO 1.03 1.57 -0.08 -0.54 0.09 0.00 0.00 178.44 180.50 1s4m s LYS 252 N -2.48 0.66 -0.10 1.13 1.02 -1.11 -4.18 119.74 114.69 1s4m s LYS 252 Ca -0.17 0.65 -0.28 0.00 0.02 0.00 0.00 55.97 56.19 1s4m s LYS 252 Cb 0.03 0.32 -0.02 0.00 -0.52 0.00 0.00 37.83 37.64 1s4m s LYS 252 CO 0.80 -0.10 0.92 0.12 -0.92 0.00 0.00 175.35 176.18 1s4m s PHE 253 N 0.08 3.52 -0.23 3.18 5.36 -1.26 -0.86 117.98 127.77 1s4m s PHE 253 Ca -0.02 1.49 -0.16 0.00 -0.96 0.00 0.00 56.93 57.28 1s4m s PHE 253 Cb -0.04 -3.09 -0.12 0.00 -0.34 0.00 0.00 43.02 39.44 1s4m s PHE 253 CO 0.02 -0.15 -0.22 -1.33 -1.46 0.00 0.00 175.22 172.07 1s4m n MET 254 N 4.72 0.56 -3.51 10.12 2.81 0.70 -4.93 117.12 127.59 1s4m n MET 254 Ca 0.06 0.34 -0.15 0.00 -1.81 0.00 0.00 57.70 56.14 1s4m n MET 254 Cb 0.49 -1.55 -0.05 0.00 -0.71 0.00 0.00 33.22 31.41 1s4m n MET 254 CO 0.00 0.00 0.00 -0.98 1.51 0.00 0.00 175.97 176.50 1s4m s ARG 255 N -2.54 1.01 0.82 0.03 1.70 -1.17 -4.99 118.95 113.82 1s4m s ARG 255 Ca -0.33 0.08 -0.12 0.00 -0.47 0.00 0.00 55.73 54.89 1s4m s ARG 255 Cb 0.10 0.47 0.09 0.00 -0.57 0.00 0.00 34.95 35.04 1s4m s ARG 255 CO 0.48 -0.35 1.16 -0.51 -1.08 0.00 0.00 175.30 175.00 1s4m s ASP 256 N -1.54 3.66 0.65 -2.89 1.11 -1.26 -0.15 116.67 116.25 1s4m s ASP 256 Ca -0.06 2.20 -0.17 0.00 0.18 0.00 0.00 52.55 54.69 1s4m s ASP 256 Cb -0.00 -2.57 -0.01 0.00 1.07 0.00 0.00 42.92 41.41 1s4m s ASP 256 CO 0.03 -2.61 1.24 -0.70 1.18 0.00 0.00 175.17 174.31 1s4m s GLU 257 N -4.40 2.60 0.09 8.23 2.56 -1.25 -4.61 118.70 121.93 1s4m s GLU 257 Ca 0.69 1.88 0.04 0.00 0.00 0.00 0.00 54.97 57.59 1s4m s GLU 257 Cb -0.24 -1.87 -0.03 0.00 2.00 0.00 0.00 34.13 33.98 1s4m s GLU 257 CO 0.53 -1.51 -0.12 0.15 -0.56 0.00 0.00 175.26 173.75 1s4m s LYS 258 N -3.51 0.86 -0.52 4.30 1.02 -1.26 -4.96 119.74 115.66 1s4m s LYS 258 Ca 0.78 -1.10 -0.10 0.00 0.02 0.00 0.00 55.97 55.57 1s4m s LYS 258 Cb -0.32 -0.66 0.13 0.00 -0.52 0.00 0.00 37.83 36.46 1s4m s LYS 258 CO 0.39 0.12 0.41 -1.59 -0.92 0.00 0.00 175.35 173.76 1s4m s LYS 259 N -2.45 2.65 0.45 1.68 0.00 -1.26 -5.07 119.74 115.75 1s4m s LYS 259 Ca 0.03 -1.88 -0.05 0.00 0.00 0.00 0.00 55.97 54.07 1s4m s LYS 259 Cb -0.05 -4.01 -0.04 0.00 0.00 0.00 0.00 37.83 33.73 1s4m s LYS 259 CO 0.01 -1.22 0.75 -0.06 0.00 0.00 0.00 175.35 174.83 1s4m s PHE 260 N 1.18 3.55 -0.90 1.78 0.40 -1.26 -5.02 117.98 117.71 1s4m s PHE 260 Ca 0.07 0.78 0.00 0.00 -0.60 0.00 0.00 56.93 57.18 1s4m s PHE 260 Cb -0.25 -2.26 0.33 0.00 0.51 0.00 0.00 43.02 41.35 1s4m s PHE 260 CO -0.01 -0.21 1.69 -0.25 0.70 0.00 0.00 175.22 177.14 1s4m n ASP 261 N -2.09 6.82 0.00 1.36 10.43 -1.26 -4.97 116.55 126.84 1s4m n ASP 261 Ca 0.00 -3.72 0.00 0.00 2.57 0.00 0.00 54.79 53.64 1s4m n ASP 261 Cb 0.55 -1.02 0.00 0.00 1.84 0.00 0.00 41.12 42.49 1s4m n ASP 261 CO 0.00 0.00 0.00 -0.24 -1.07 0.00 0.00 177.20 175.89 1s4m n SER 262 N -0.20 -0.17 0.00 -2.24 2.88 -1.26 -4.90 113.62 107.72 1s4m n SER 262 Ca 0.45 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.99 1s4m n SER 262 Cb 0.29 0.10 0.00 0.00 -0.75 0.00 0.00 64.21 63.86 1s4m n SER 262 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 1s4m n ILE 263 N 2.29 0.00 0.04 2.46 5.41 -1.26 -3.19 119.36 125.12 1s4m n ILE 263 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1s4m n ILE 263 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 1s4m n ILE 263 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1s4m n GLU 264 N 0.00 0.00 0.22 0.38 1.02 -1.26 -4.72 120.64 116.28 1s4m n GLU 264 Ca 0.00 0.00 0.10 0.00 -0.02 0.00 0.00 57.16 57.24 1s4m n GLU 264 Cb 0.00 0.00 0.44 0.00 -0.02 0.00 0.00 31.44 31.86 1s4m n GLU 264 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1s4m h GLU 265 N 0.00 0.00 0.59 3.49 5.08 -1.90 0.28 114.58 122.11 1s4m h GLU 265 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1s4m h GLU 265 Cb 0.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.26 1s4m h GLU 265 CO 0.00 0.22 -0.28 1.25 -1.00 0.00 0.00 179.01 179.20 1s4m h LEU 266 N 0.00 -0.67 -0.73 1.33 5.85 -1.89 0.15 115.31 119.36 1s4m h LEU 266 Ca -0.00 0.02 0.14 0.00 0.84 0.00 0.00 57.88 58.88 1s4m h LEU 266 Cb 0.77 0.17 -0.14 0.00 0.37 0.00 0.00 40.66 41.84 1s4m h LEU 266 CO 0.03 -0.28 -0.21 0.50 -0.34 0.00 0.00 178.44 178.14 1s4m h LYS 267 N -1.17 -0.02 -0.21 1.25 1.63 -1.80 0.41 116.57 116.65 1s4m h LYS 267 Ca -0.08 0.00 0.04 0.00 -0.85 0.00 0.00 60.65 59.76 1s4m h LYS 267 Cb 0.60 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.20 1s4m h LYS 267 CO 0.13 -0.01 -0.02 0.00 -3.45 0.00 0.00 179.45 176.10 1s4m h ALA 268 N 1.64 0.17 -0.59 5.00 0.00 -0.37 0.22 119.26 125.33 1s4m h ALA 268 Ca 0.34 0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.34 1s4m h ALA 268 Cb 0.54 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 1s4m h ALA 268 CO -0.76 -0.44 0.37 0.00 0.00 0.00 0.00 179.25 178.42 1s4m h ALA 269 N 1.19 0.77 0.30 0.00 0.00 0.23 0.62 119.26 122.37 1s4m h ALA 269 Ca 0.10 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1s4m h ALA 269 Cb 0.14 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1s4m h ALA 269 CO -0.19 0.12 -0.14 0.82 0.00 0.00 0.00 179.25 179.86 1s4m h ILE 270 N 0.74 0.72 -0.99 0.00 2.04 0.08 0.12 117.51 120.22 1s4m h ILE 270 Ca 0.23 -0.10 0.20 0.00 1.00 0.00 0.00 64.86 66.19 1s4m h ILE 270 Cb -0.00 0.78 -0.10 0.00 -0.74 0.00 0.00 36.82 36.76 1s4m h ILE 270 CO -0.09 0.02 0.62 -0.78 0.00 0.00 0.00 178.15 177.92 1s4m h ASP 271 N -0.45 0.67 -0.07 1.72 -0.00 -0.18 0.67 116.42 118.78 1s4m h ASP 271 Ca -0.04 0.08 -0.10 0.00 -0.00 0.00 0.00 57.03 56.97 1s4m h ASP 271 Cb 0.34 -0.04 -0.01 0.00 -0.00 0.00 0.00 39.33 39.62 1s4m h ASP 271 CO 0.07 0.23 -0.28 1.56 -0.00 0.00 0.00 179.24 180.82 1s4m h GLN 272 N 0.65 0.52 0.06 0.28 7.50 0.09 -1.83 115.11 122.38 1s4m h GLN 272 Ca 0.56 -0.21 -0.00 0.00 0.50 0.00 0.00 58.65 59.50 1s4m h GLN 272 Cb 1.02 -0.02 0.00 0.00 0.05 0.00 0.00 27.48 28.53 1s4m h GLN 272 CO -0.33 0.75 -0.03 -0.44 -1.50 0.00 0.00 178.83 177.28 1s4m h ASP 273 N 0.45 -0.06 -0.27 1.46 3.32 0.29 -1.08 116.42 120.53 1s4m h ASP 273 Ca 0.06 -0.23 0.03 0.00 0.02 0.00 0.00 57.03 56.92 1s4m h ASP 273 Cb 0.72 0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.25 1s4m h ASP 273 CO 0.06 0.19 0.06 0.58 -1.72 0.00 0.00 179.24 178.41 1s4m h VAL 274 N -0.32 0.89 -0.45 -1.35 2.07 -1.04 0.13 116.25 116.18 1s4m h VAL 274 Ca -0.01 -0.06 0.09 0.00 0.82 0.00 0.00 66.70 67.54 1s4m h VAL 274 Cb 0.29 0.70 -0.07 0.00 -1.52 0.00 0.00 31.29 30.69 1s4m h VAL 274 CO 0.01 0.03 -0.01 0.50 0.02 0.00 0.00 177.57 178.12 1s4m h LYS 275 N 0.17 0.10 -0.58 1.57 1.63 -1.26 0.33 116.57 118.54 1s4m h LYS 275 Ca 0.12 -0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.90 1s4m h LYS 275 Cb 0.12 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.70 1s4m h LYS 275 CO -0.15 0.06 0.28 1.03 -3.45 0.00 0.00 179.45 177.22 1s4m h SER 276 N 0.10 0.75 0.17 4.20 0.87 -0.52 -2.23 113.55 116.90 1s4m h SER 276 Ca 0.22 -0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 1s4m h SER 276 Cb 0.33 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.09 1s4m h SER 276 CO -0.38 0.67 -0.14 0.00 -0.53 0.00 0.00 176.83 176.45 1s4m h ALA 277 N 1.11 -0.30 -0.86 6.23 0.00 0.54 -0.37 119.26 125.61 1s4m h ALA 277 Ca 0.20 -0.05 0.18 0.00 0.00 0.00 0.00 54.91 55.24 1s4m h ALA 277 Cb 0.11 0.19 -0.11 0.00 0.00 0.00 0.00 17.79 17.99 1s4m h ALA 277 CO -0.03 -0.69 0.40 0.00 0.00 0.00 0.00 179.25 178.94 1s4m h ARG 278 N -0.33 0.48 -0.55 0.00 2.47 -0.18 0.25 114.38 116.52 1s4m h ARG 278 Ca -0.01 -0.03 -0.09 0.00 -1.26 0.00 0.00 59.98 58.59 1s4m h ARG 278 Cb 0.30 -0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 28.49 1s4m h ARG 278 CO -0.02 0.32 -0.03 -0.91 0.56 0.00 0.00 179.97 179.89 1s4m h ASN 279 N 0.49 0.95 -0.30 7.04 -0.26 -0.79 -0.79 115.58 121.93 1s4m h ASN 279 Ca 0.51 -0.27 -0.05 0.00 -0.56 0.00 0.00 56.30 55.93 1s4m h ASN 279 Cb 0.85 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 37.85 1s4m h ASN 279 CO -0.45 1.02 -0.01 0.24 -1.06 0.00 0.00 177.43 177.17 1s4m h MET 280 N 0.88 0.53 -0.16 0.81 2.86 0.11 -0.20 114.93 119.76 1s4m h MET 280 Ca 0.16 -0.17 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1s4m h MET 280 Cb 0.56 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.16 1s4m h MET 280 CO 0.03 0.68 0.10 0.82 1.06 0.00 0.00 176.91 179.60 1s4m h ILE 281 N 0.31 1.03 -0.79 -1.22 2.04 -0.82 0.38 117.51 118.45 1s4m h ILE 281 Ca 0.08 -0.07 0.03 0.00 1.00 0.00 0.00 64.86 65.91 1s4m h ILE 281 Cb 0.44 0.81 -0.04 0.00 -0.74 0.00 0.00 36.82 37.29 1s4m h ILE 281 CO 0.02 0.04 0.52 -0.78 0.00 0.00 0.00 178.15 177.94 1s4m h ASP 282 N 0.20 0.83 -0.27 1.72 3.58 -1.00 0.31 116.42 121.79 1s4m h ASP 282 Ca 0.06 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.49 1s4m h ASP 282 Cb -0.01 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 40.83 1s4m h ASP 282 CO -0.02 0.57 0.11 0.44 -2.88 0.00 0.00 179.24 177.47 1s4m h ASP 283 N 0.97 0.36 -0.27 2.28 3.32 0.40 -0.74 116.42 122.75 1s4m h ASP 283 Ca 0.31 -0.15 0.03 0.00 0.02 0.00 0.00 57.03 57.24 1s4m h ASP 283 Cb 0.05 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 1s4m h ASP 283 CO -0.09 0.41 0.08 0.40 -1.72 0.00 0.00 179.24 178.32 1s4m h ILE 284 N 0.29 0.91 -0.21 0.35 2.04 0.13 -1.94 117.51 119.07 1s4m h ILE 284 Ca 0.09 -0.07 0.02 0.00 1.00 0.00 0.00 64.86 65.91 1s4m h ILE 284 Cb 0.16 0.70 -0.03 0.00 -0.74 0.00 0.00 36.82 36.91 1s4m h ILE 284 CO -0.01 0.04 0.05 0.40 0.00 0.00 0.00 178.15 178.63 1s4m h ILE 285 N 0.19 0.92 0.00 -0.67 2.04 -0.20 -1.48 117.51 118.32 1s4m h ILE 285 Ca 0.12 -0.05 -0.00 0.00 1.00 0.00 0.00 64.86 65.93 1s4m h ILE 285 Cb 0.10 0.77 -0.00 0.00 -0.74 0.00 0.00 36.82 36.94 1s4m h ILE 285 CO -0.13 0.03 -0.00 0.78 0.00 0.00 0.00 178.15 178.82 1s4m h ASN 286 N 0.14 0.00 0.00 1.72 2.35 -0.79 -0.02 115.58 118.98 1s4m h ASN 286 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1s4m h ASN 286 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 1s4m h ASN 286 CO -0.11 0.00 0.00 -1.20 -1.65 0.00 0.00 177.43 174.47 1s4m n SER 287 N -3.25 3.23 0.00 5.81 7.64 -0.56 -5.10 113.62 121.39 1s4m n SER 287 Ca -0.03 -1.89 0.00 0.00 1.01 0.00 0.00 58.87 57.96 1s4m n SER 287 Cb 0.08 -0.60 0.00 0.00 -1.01 0.00 0.00 64.21 62.68 1s4m n SER 287 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32