#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m4d s HIS 2 N 0.00 1.36 -0.06 1.12 0.00 -1.26 -4.95 115.29 111.50 1m4d s HIS 2 Ca 0.00 0.34 0.28 0.00 -3.00 0.00 0.00 55.06 52.68 1m4d s HIS 2 Cb 0.00 -4.00 1.40 0.00 -4.00 0.00 0.00 32.58 25.98 1m4d s HIS 2 CO 0.00 -2.90 1.85 1.79 -1.00 0.00 0.00 174.74 174.48 1m4d h THR 3 N -1.83 0.00 -0.60 -5.38 1.35 -2.09 -3.46 112.91 100.91 1m4d h THR 3 Ca -0.44 -0.10 -0.19 0.00 -0.55 0.00 0.00 66.41 65.12 1m4d h THR 3 Cb 1.24 0.79 -0.06 0.00 -1.73 0.00 0.00 68.15 68.39 1m4d h THR 3 CO 0.37 0.00 -0.18 0.00 -0.25 0.00 0.00 175.52 175.46 1m4d n GLN 4 N -2.50 -0.66 -1.86 4.72 1.13 -1.26 -4.95 117.38 112.01 1m4d n GLN 4 Ca -0.01 0.76 -0.42 0.00 -1.94 0.00 0.00 57.00 55.39 1m4d n GLN 4 Cb 0.11 -4.67 -0.03 0.00 0.11 0.00 0.00 30.24 25.76 1m4d n GLN 4 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1m4d s VAL 5 N -2.36 2.51 -0.26 5.09 0.11 -1.26 -1.62 120.40 122.61 1m4d s VAL 5 Ca 0.00 0.30 0.00 0.00 -2.93 0.00 0.00 61.98 59.35 1m4d s VAL 5 Cb 0.00 -3.19 0.00 0.00 -1.53 0.00 0.00 36.38 31.66 1m4d s VAL 5 CO 0.00 0.02 0.00 1.41 -3.33 0.00 0.00 175.10 173.20 1m4d n HIS 6 N 4.35 0.00 -2.65 1.54 8.25 -1.26 -4.98 115.22 120.48 1m4d n HIS 6 Ca 0.15 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.20 1m4d n HIS 6 Cb 0.38 -1.92 -0.04 0.00 1.12 0.00 0.00 29.99 29.53 1m4d n HIS 6 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1m4d s THR 7 N -1.34 4.21 0.30 1.59 2.01 -0.64 -4.93 115.64 116.83 1m4d s THR 7 Ca 0.00 1.90 -0.29 0.00 0.31 0.00 0.00 61.69 63.61 1m4d s THR 7 Cb 0.00 -4.21 -0.10 0.00 0.01 0.00 0.00 72.50 68.20 1m4d s THR 7 CO 0.00 0.32 1.19 0.00 -0.69 0.00 0.00 174.62 175.44 1m4d s ALA 8 N -0.22 3.45 -0.10 7.40 0.00 -1.26 -4.79 121.76 126.24 1m4d s ALA 8 Ca 0.47 1.05 -0.02 0.00 0.00 0.00 0.00 51.96 53.47 1m4d s ALA 8 Cb -0.26 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.44 1m4d s ALA 8 CO 0.32 -0.36 -0.03 1.03 0.00 0.00 0.00 175.76 176.72 1m4d s ARG 9 N -1.57 3.10 -0.22 0.00 0.52 0.61 -4.80 118.95 116.59 1m4d s ARG 9 Ca 0.46 -0.48 -0.13 0.00 -0.52 0.00 0.00 55.73 55.06 1m4d s ARG 9 Cb -0.35 -2.76 -0.04 0.00 0.52 0.00 0.00 34.95 32.31 1m4d s ARG 9 CO 0.46 0.56 0.27 -0.51 0.02 0.00 0.00 175.30 176.10 1m4d s LEU 10 N -0.51 4.14 -0.04 2.53 1.43 -1.26 -0.52 118.68 124.45 1m4d s LEU 10 Ca 0.08 0.31 0.01 0.00 -1.03 0.00 0.00 54.13 53.51 1m4d s LEU 10 Cb -0.12 -2.30 0.02 0.00 0.03 0.00 0.00 46.19 43.83 1m4d s LEU 10 CO 0.02 0.01 -0.04 -0.69 0.23 0.00 0.00 176.35 175.88 1m4d s VAL 11 N 1.11 0.47 0.52 -1.59 1.01 0.10 -4.92 120.40 117.09 1m4d s VAL 11 Ca 0.13 -0.08 -0.20 0.00 0.00 0.00 0.00 61.98 61.82 1m4d s VAL 11 Cb -0.14 -0.51 -0.06 0.00 0.00 0.00 0.00 36.38 35.67 1m4d s VAL 11 CO 0.06 0.21 1.14 -2.28 0.00 0.00 0.00 175.10 174.23 1m4d s HIS 12 N 0.93 2.72 0.30 5.22 2.46 -1.26 -0.84 115.29 124.81 1m4d s HIS 12 Ca -0.11 1.54 0.05 0.00 0.47 0.00 0.00 55.06 57.01 1m4d s HIS 12 Cb -0.14 -3.32 0.77 0.00 -0.13 0.00 0.00 32.58 29.76 1m4d s HIS 12 CO -0.00 -1.57 1.69 1.15 -2.47 0.00 0.00 174.74 173.54 1m4d h THR 13 N 1.37 0.45 0.00 0.89 2.02 -1.56 0.48 112.91 116.56 1m4d h THR 13 Ca -0.50 -0.13 -0.00 0.00 0.77 0.00 0.00 66.41 66.54 1m4d h THR 13 Cb 1.26 0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 67.69 1m4d h THR 13 CO 0.58 0.07 -0.02 0.00 0.37 0.00 0.00 175.52 176.52 1m4d h ALA 14 N 1.73 1.03 -0.35 6.16 0.00 -1.91 -1.74 119.26 124.18 1m4d h ALA 14 Ca 0.58 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.47 1m4d h ALA 14 Cb 1.13 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1m4d h ALA 14 CO -0.54 0.02 0.00 -0.25 0.00 0.00 0.00 179.25 178.48 1m4d n ASP 15 N -3.16 2.78 -4.68 0.00 8.00 0.15 -4.92 116.55 114.72 1m4d n ASP 15 Ca -0.01 -1.91 -0.42 0.00 0.71 0.00 0.00 54.79 53.16 1m4d n ASP 15 Cb 0.21 -0.23 -0.03 0.00 -0.02 0.00 0.00 41.12 41.06 1m4d n ASP 15 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1m4d s LEU 16 N -1.41 4.22 0.73 0.64 1.43 -0.66 -4.93 118.68 118.69 1m4d s LEU 16 Ca 0.36 1.47 -0.11 0.00 -1.03 0.00 0.00 54.13 54.83 1m4d s LEU 16 Cb 0.20 -3.52 0.03 0.00 0.03 0.00 0.00 46.19 42.93 1m4d s LEU 16 CO 0.29 -0.48 1.07 1.51 0.23 0.00 0.00 176.35 178.97 1m4d s ASP 17 N 1.12 5.07 0.26 2.29 1.47 -1.26 -4.76 116.67 120.86 1m4d s ASP 17 Ca 0.47 1.58 -0.03 0.00 1.18 0.00 0.00 52.55 55.75 1m4d s ASP 17 Cb -0.18 -2.41 0.54 0.00 -0.34 0.00 0.00 42.92 40.54 1m4d s ASP 17 CO 0.15 -1.64 1.66 -1.28 0.68 0.00 0.00 175.17 174.75 1m4d h SER 18 N -0.85 -0.08 -0.68 2.11 0.87 -1.99 -1.16 113.55 111.77 1m4d h SER 18 Ca -0.44 0.18 -0.08 0.00 -1.23 0.00 0.00 61.79 60.21 1m4d h SER 18 Cb 1.22 0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 63.42 1m4d h SER 18 CO 0.57 -0.11 0.12 -0.33 -0.53 0.00 0.00 176.83 176.54 1m4d h GLU 19 N 0.21 1.12 -0.23 2.24 3.07 -1.99 -1.25 114.58 117.74 1m4d h GLU 19 Ca 0.46 -0.29 -0.06 0.00 -0.50 0.00 0.00 59.36 58.97 1m4d h GLU 19 Cb 0.85 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.62 1m4d h GLU 19 CO -0.60 1.01 -0.10 1.15 -1.40 0.00 0.00 179.01 179.07 1m4d h THR 20 N 1.05 1.30 -0.80 1.13 2.02 -1.72 -0.25 112.91 115.63 1m4d h THR 20 Ca 0.21 -1.16 0.08 0.00 0.77 0.00 0.00 66.41 66.31 1m4d h THR 20 Cb 0.43 1.58 -0.07 0.00 -1.74 0.00 0.00 68.15 68.36 1m4d h THR 20 CO 0.01 0.36 0.47 -0.09 0.37 0.00 0.00 175.52 176.64 1m4d h ARG 21 N 0.18 0.79 -0.40 6.66 2.43 -1.12 0.03 114.38 122.94 1m4d h ARG 21 Ca 0.05 -0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 59.03 1m4d h ARG 21 Cb 0.59 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 1m4d h ARG 21 CO 0.03 0.52 -0.30 1.96 -1.51 0.00 0.00 179.97 180.68 1m4d h GLN 22 N 0.82 0.91 -0.36 0.20 4.20 -1.00 -1.12 115.11 118.76 1m4d h GLN 22 Ca 0.37 -0.44 0.04 0.00 0.06 0.00 0.00 58.65 58.68 1m4d h GLN 22 Cb 0.28 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.02 1m4d h GLN 22 CO -0.22 1.10 0.14 0.22 -0.67 0.00 0.00 178.83 179.41 1m4d h ASP 23 N 0.74 0.18 -0.15 1.46 3.58 -0.57 -1.03 116.42 120.62 1m4d h ASP 23 Ca 0.08 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.56 1m4d h ASP 23 Cb 0.88 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.93 1m4d h ASP 23 CO 0.08 0.14 0.09 0.40 -2.88 0.00 0.00 179.24 177.07 1m4d h ILE 24 N 0.31 1.08 -0.91 2.25 2.04 -0.84 -0.46 117.51 120.99 1m4d h ILE 24 Ca 0.16 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.80 1m4d h ILE 24 Cb 0.12 0.96 -0.04 0.00 -0.74 0.00 0.00 36.82 37.11 1m4d h ILE 24 CO -0.15 0.08 0.55 -0.09 0.00 0.00 0.00 178.15 178.54 1m4d h ARG 25 N 0.16 1.23 -0.06 2.37 2.43 -0.95 0.15 114.38 119.70 1m4d h ARG 25 Ca 0.05 -0.11 -0.24 0.00 -0.81 0.00 0.00 59.98 58.88 1m4d h ARG 25 Cb 0.05 -0.26 0.01 0.00 -0.42 0.00 0.00 29.97 29.35 1m4d h ARG 25 CO -0.01 0.85 -0.91 -0.56 -1.51 0.00 0.00 179.97 177.84 1m4d h GLN 26 N 1.25 0.67 0.16 0.20 -0.00 -1.07 -1.33 115.11 114.99 1m4d h GLN 26 Ca 0.33 -0.64 -0.01 0.00 -0.00 0.00 0.00 58.65 58.33 1m4d h GLN 26 Cb -0.06 0.16 0.00 0.00 -0.00 0.00 0.00 27.48 27.58 1m4d h GLN 26 CO -0.06 1.24 -0.08 1.98 -0.00 0.00 0.00 178.83 181.91 1m4d h MET 27 N 0.42 -0.21 -0.60 0.06 4.05 -0.85 -0.87 114.93 116.93 1m4d h MET 27 Ca -0.09 0.01 -0.04 0.00 -0.28 0.00 0.00 59.70 59.31 1m4d h MET 27 Cb 1.54 0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 32.36 1m4d h MET 27 CO 0.18 -0.11 0.23 0.28 0.23 0.00 0.00 176.91 177.72 1m4d h VAL 28 N -0.26 1.23 -0.65 -5.77 2.07 -1.01 0.28 116.25 112.15 1m4d h VAL 28 Ca -0.02 -0.74 -0.00 0.00 0.82 0.00 0.00 66.70 66.75 1m4d h VAL 28 Cb 0.20 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 1m4d h VAL 28 CO 0.04 0.29 0.39 0.74 0.02 0.00 0.00 177.57 179.04 1m4d h THR 29 N 0.84 1.19 0.00 2.57 2.02 -1.16 -2.33 112.91 116.04 1m4d h THR 29 Ca 0.20 -0.43 -0.11 0.00 0.77 0.00 0.00 66.41 66.83 1m4d h THR 29 Cb 0.22 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 1m4d h THR 29 CO -0.01 0.20 -0.53 1.23 0.37 0.00 0.00 175.52 176.78 1m4d h GLY 30 N 0.88 0.00 2.00 2.16 0.00 -0.91 -3.00 103.07 104.21 1m4d h GLY 30 Ca 0.23 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.51 1m4d h GLY 30 CO -0.04 0.00 -0.24 0.00 0.00 0.00 0.00 176.54 176.26 1m4d h ALA 31 N 1.47 1.27 -0.35 3.60 0.00 0.12 -3.08 119.26 122.30 1m4d h ALA 31 Ca -0.01 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1m4d h ALA 31 Cb 1.02 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1m4d h ALA 31 CO 0.07 0.30 0.00 1.19 0.00 0.00 0.00 179.25 180.80 1m4d n PHE 32 N -3.76 0.46 -3.74 0.00 3.01 -1.11 -4.99 117.46 107.33 1m4d n PHE 32 Ca -0.01 -0.23 -0.25 0.00 1.01 0.00 0.00 57.45 57.96 1m4d n PHE 32 Cb 0.34 0.00 0.01 0.00 -0.01 0.00 0.00 39.48 39.82 1m4d n PHE 32 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1m4d n ALA 33 N 0.67 -2.72 -1.03 4.37 0.00 -1.16 -2.15 120.51 118.48 1m4d n ALA 33 Ca 0.15 -0.29 -0.01 0.00 0.00 0.00 0.00 53.44 53.29 1m4d n ALA 33 Cb 0.37 -1.37 -0.00 0.00 0.00 0.00 0.00 19.45 18.45 1m4d n ALA 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1m4d n GLY 34 N -1.74 0.15 1.75 0.00 0.00 -1.26 -4.85 105.19 99.24 1m4d n GLY 34 Ca -0.23 -0.01 -0.18 0.00 0.00 0.00 0.00 46.02 45.60 1m4d n GLY 34 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1m4d n ASP 35 N -0.93 4.29 -3.79 1.61 2.03 -0.92 -4.87 116.55 113.98 1m4d n ASP 35 Ca -0.01 -3.76 -0.29 0.00 0.52 0.00 0.00 54.79 51.24 1m4d n ASP 35 Cb 0.47 -0.68 -0.15 0.00 -0.72 0.00 0.00 41.12 40.04 1m4d n ASP 35 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 1m4d s PHE 36 N -3.46 1.80 0.78 -0.67 5.36 -1.26 -5.03 117.98 115.50 1m4d s PHE 36 Ca 0.52 -1.62 -0.07 0.00 -0.96 0.00 0.00 56.93 54.80 1m4d s PHE 36 Cb 0.44 -1.61 0.12 0.00 -0.34 0.00 0.00 43.02 41.63 1m4d s PHE 36 CO 0.02 -0.80 1.09 0.95 -1.46 0.00 0.00 175.22 175.01 1m4d s THR 37 N 1.59 2.16 0.32 0.12 -4.23 -1.26 -4.89 115.64 109.45 1m4d s THR 37 Ca 0.05 -0.32 0.00 0.00 -1.18 0.00 0.00 61.69 60.24 1m4d s THR 37 Cb -0.18 -2.85 0.22 0.00 1.34 0.00 0.00 72.50 71.04 1m4d s THR 37 CO -0.17 0.00 1.93 -0.33 -0.54 0.00 0.00 174.62 175.51 1m4d h GLU 38 N -0.85 0.85 -0.36 3.99 5.08 -2.00 -0.45 114.58 120.84 1m4d h GLU 38 Ca -0.42 -0.10 -0.15 0.00 -1.00 0.00 0.00 59.36 57.70 1m4d h GLU 38 Cb 1.28 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 1m4d h GLU 38 CO 0.47 0.65 -0.36 1.15 -1.00 0.00 0.00 179.01 179.92 1m4d h THR 39 N 0.85 1.28 -0.37 1.13 2.02 -1.97 -1.32 112.91 114.53 1m4d h THR 39 Ca 0.21 -1.53 -0.04 0.00 0.77 0.00 0.00 66.41 65.83 1m4d h THR 39 Cb 0.06 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 1m4d h THR 39 CO -0.03 0.51 0.06 0.44 0.37 0.00 0.00 175.52 176.87 1m4d h ASP 40 N 0.69 0.51 -0.34 4.18 3.32 -1.72 -1.25 116.42 121.82 1m4d h ASP 40 Ca 0.06 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 1m4d h ASP 40 Cb 0.92 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.33 1m4d h ASP 40 CO 0.09 0.53 0.11 -0.25 -1.72 0.00 0.00 179.24 178.00 1m4d h TRP 41 N 0.54 0.54 -0.85 4.55 2.91 -0.75 -2.79 115.95 120.10 1m4d h TRP 41 Ca 0.12 -0.05 0.10 0.00 1.13 0.00 0.00 58.89 60.19 1m4d h TRP 41 Cb 0.25 -0.16 -0.06 0.00 -0.51 0.00 0.00 29.16 28.68 1m4d h TRP 41 CO 0.01 0.54 0.55 1.49 -1.03 0.00 0.00 178.44 180.00 1m4d h GLU 42 N 0.39 0.77 0.00 2.65 4.22 -0.54 0.97 114.58 123.05 1m4d h GLU 42 Ca 0.11 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.50 1m4d h GLU 42 Cb 0.25 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1m4d h GLU 42 CO -0.00 0.51 0.00 0.72 -2.18 0.00 0.00 179.01 178.05 1m4d n HIS 43 N -4.52 0.69 1.30 0.92 8.25 -0.54 -1.87 115.22 119.45 1m4d n HIS 43 Ca 0.15 0.30 0.13 0.00 -0.26 0.00 0.00 57.72 58.04 1m4d n HIS 43 Cb 0.33 -0.98 0.38 0.00 1.12 0.00 0.00 29.99 30.84 1m4d n HIS 43 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1m4d n THR 44 N -2.16 0.00 -3.83 1.59 -2.24 0.33 -4.86 114.28 103.12 1m4d n THR 44 Ca 0.01 -0.20 -0.30 0.00 -2.27 0.00 0.00 64.05 61.29 1m4d n THR 44 Cb 0.15 0.55 -0.04 0.00 -2.10 0.00 0.00 70.33 68.90 1m4d n THR 44 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1m4d s LEU 45 N -2.31 4.32 0.00 3.22 1.43 -0.78 -4.59 118.68 119.97 1m4d s LEU 45 Ca 0.29 0.37 0.00 0.00 -1.03 0.00 0.00 54.13 53.75 1m4d s LEU 45 Cb 0.20 -3.08 0.00 0.00 0.03 0.00 0.00 46.19 43.34 1m4d s LEU 45 CO 0.45 0.10 0.00 0.61 0.23 0.00 0.00 176.35 177.75 1m4d n GLY 46 N 0.06 0.89 0.00 -3.19 0.00 -1.26 -4.99 105.19 96.71 1m4d n GLY 46 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1m4d n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m4d n GLY 47 N -0.81 5.40 3.61 -0.02 0.00 -1.26 -4.82 105.19 107.30 1m4d n GLY 47 Ca 0.00 -1.30 -0.36 0.00 0.00 0.00 0.00 46.02 44.35 1m4d n GLY 47 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1m4d s MET 48 N 4.12 3.95 -0.16 1.61 -1.94 -0.66 -1.40 119.30 124.82 1m4d s MET 48 Ca 0.00 -0.33 -0.16 0.00 -1.71 0.00 0.00 55.69 53.49 1m4d s MET 48 Cb 0.00 -3.43 -0.04 0.00 2.01 0.00 0.00 34.83 33.37 1m4d s MET 48 CO 0.00 0.05 0.38 -1.01 -0.01 0.00 0.00 175.02 174.43 1m4d s HIS 49 N 1.05 3.44 -0.25 -0.03 0.09 -0.02 -0.42 115.29 119.15 1m4d s HIS 49 Ca 0.06 0.68 -0.18 0.00 -0.00 0.00 0.00 55.06 55.62 1m4d s HIS 49 Cb -0.14 -2.47 -0.03 0.00 -0.00 0.00 0.00 32.58 29.95 1m4d s HIS 49 CO 0.04 0.13 0.53 0.00 -0.00 0.00 0.00 174.74 175.44 1m4d s ALA 50 N 0.82 3.59 -0.02 -1.40 0.00 0.17 -0.73 121.76 124.18 1m4d s ALA 50 Ca 0.20 -0.54 0.06 0.00 0.00 0.00 0.00 51.96 51.68 1m4d s ALA 50 Cb -0.14 -2.89 -0.01 0.00 0.00 0.00 0.00 23.12 20.07 1m4d s ALA 50 CO 0.07 -0.69 -0.21 -0.51 0.00 0.00 0.00 175.76 174.41 1m4d s LEU 51 N 2.21 2.03 -0.15 0.00 1.43 0.33 -1.95 118.68 122.57 1m4d s LEU 51 Ca 0.22 -0.40 0.02 0.00 -1.03 0.00 0.00 54.13 52.95 1m4d s LEU 51 Cb -0.16 -1.12 0.01 0.00 0.03 0.00 0.00 46.19 44.96 1m4d s LEU 51 CO 0.09 0.25 -0.21 -0.63 0.23 0.00 0.00 176.35 176.07 1m4d s ILE 52 N -0.39 2.08 -0.02 -0.59 1.01 -0.55 -0.29 121.20 122.46 1m4d s ILE 52 Ca 0.05 -0.96 -0.04 0.00 0.00 0.00 0.00 60.65 59.70 1m4d s ILE 52 Cb -0.09 -1.84 -0.04 0.00 0.01 0.00 0.00 42.46 40.49 1m4d s ILE 52 CO 0.00 0.55 0.20 0.26 0.00 0.00 0.00 174.94 175.95 1m4d s TRP 53 N 0.93 3.56 -0.15 3.97 0.52 -1.26 -0.75 118.94 125.76 1m4d s TRP 53 Ca -0.04 0.43 -0.06 0.00 0.02 0.00 0.00 56.10 56.45 1m4d s TRP 53 Cb -0.15 -1.88 0.07 0.00 -1.15 0.00 0.00 33.47 30.36 1m4d s TRP 53 CO -0.04 0.65 0.33 -1.58 0.02 0.00 0.00 176.95 176.32 1m4d s HIS 54 N -1.28 -0.55 -1.53 -1.98 2.46 -0.22 -4.55 115.29 107.64 1m4d s HIS 54 Ca 0.26 1.16 -0.14 0.00 0.47 0.00 0.00 55.06 56.81 1m4d s HIS 54 Cb -0.13 0.12 0.09 0.00 -0.13 0.00 0.00 32.58 32.54 1m4d s HIS 54 CO 0.16 -0.37 0.88 0.72 -2.47 0.00 0.00 174.74 173.66 1m4d n HIS 55 N 5.04 -2.14 -0.97 3.88 8.25 -1.26 -1.04 115.22 126.99 1m4d n HIS 55 Ca -0.12 0.82 0.00 0.00 -0.26 0.00 0.00 57.72 58.16 1m4d n HIS 55 Cb 0.51 -3.69 0.00 0.00 1.12 0.00 0.00 29.99 27.93 1m4d n HIS 55 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1m4d n GLY 56 N -1.57 0.69 3.52 -1.41 0.00 -1.26 -5.01 105.19 100.15 1m4d n GLY 56 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 1m4d n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m4d s ALA 57 N -2.88 2.80 -0.38 4.61 0.00 -0.21 -5.09 121.76 120.61 1m4d s ALA 57 Ca 0.00 -1.41 -0.26 0.00 0.00 0.00 0.00 51.96 50.29 1m4d s ALA 57 Cb 0.00 -0.68 0.02 0.00 0.00 0.00 0.00 23.12 22.45 1m4d s ALA 57 CO 0.00 0.54 0.96 0.42 0.00 0.00 0.00 175.76 177.68 1m4d s ILE 58 N -1.41 4.53 -1.67 0.00 -1.09 -1.26 -1.05 121.20 119.25 1m4d s ILE 58 Ca 0.21 1.20 0.22 0.00 -2.23 0.00 0.00 60.65 60.05 1m4d s ILE 58 Cb -0.10 -4.38 -0.09 0.00 -1.58 0.00 0.00 42.46 36.32 1m4d s ILE 58 CO 0.12 -0.60 1.02 2.30 -1.23 0.00 0.00 174.94 176.55 1m4d n ILE 59 N 6.09 0.00 -3.58 2.92 -5.35 0.07 -4.86 119.36 114.65 1m4d n ILE 59 Ca 0.08 -0.17 -0.17 0.00 -0.27 0.00 0.00 62.75 62.22 1m4d n ILE 59 Cb 0.48 1.17 -0.07 0.00 -1.74 0.00 0.00 39.64 39.48 1m4d n ILE 59 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1m4d s ALA 60 N -2.65 -1.55 -0.07 -1.28 0.00 -1.20 0.13 121.76 115.14 1m4d s ALA 60 Ca 0.15 1.16 -0.16 0.00 0.00 0.00 0.00 51.96 53.10 1m4d s ALA 60 Cb 0.17 -0.08 0.03 0.00 0.00 0.00 0.00 23.12 23.24 1m4d s ALA 60 CO 0.67 -0.34 0.39 -1.58 0.00 0.00 0.00 175.76 174.90 1m4d s HIS 61 N -1.07 -0.33 -0.15 0.00 2.46 0.09 -1.48 115.29 114.81 1m4d s HIS 61 Ca -0.10 0.67 -0.11 0.00 0.47 0.00 0.00 55.06 55.99 1m4d s HIS 61 Cb -0.01 0.15 0.05 0.00 -0.13 0.00 0.00 32.58 32.63 1m4d s HIS 61 CO 0.08 -0.35 0.37 0.00 -2.47 0.00 0.00 174.74 172.37 1m4d s ALA 62 N -0.74 -0.91 0.04 1.58 0.00 -0.82 -1.23 121.76 119.68 1m4d s ALA 62 Ca -0.08 1.21 0.04 0.00 0.00 0.00 0.00 51.96 53.13 1m4d s ALA 62 Cb -0.04 -0.72 -0.04 0.00 0.00 0.00 0.00 23.12 22.32 1m4d s ALA 62 CO 0.03 -0.21 -0.06 0.00 0.00 0.00 0.00 175.76 175.53 1m4d s ALA 63 N 0.76 3.06 -0.25 0.00 0.00 0.13 0.43 121.76 125.90 1m4d s ALA 63 Ca -0.05 -1.09 -0.01 0.00 0.00 0.00 0.00 51.96 50.82 1m4d s ALA 63 Cb -0.06 -1.10 0.03 0.00 0.00 0.00 0.00 23.12 22.00 1m4d s ALA 63 CO -0.05 0.64 -0.07 0.08 0.00 0.00 0.00 175.76 176.35 1m4d s VAL 64 N -1.11 2.77 0.20 0.00 1.01 0.43 -0.37 120.40 123.34 1m4d s VAL 64 Ca 0.20 -1.07 0.09 0.00 0.00 0.00 0.00 61.98 61.20 1m4d s VAL 64 Cb -0.11 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.81 1m4d s VAL 64 CO 0.11 0.20 -0.08 0.27 0.00 0.00 0.00 175.10 175.60 1m4d s ILE 65 N 1.30 3.23 -0.07 2.22 -5.25 0.02 -1.65 121.20 121.01 1m4d s ILE 65 Ca -0.00 -1.74 -0.15 0.00 -0.99 0.00 0.00 60.65 57.77 1m4d s ILE 65 Cb -0.17 -2.64 -0.05 0.00 2.95 0.00 0.00 42.46 42.56 1m4d s ILE 65 CO -0.05 -0.18 0.38 -1.58 -1.79 0.00 0.00 174.94 171.72 1m4d s GLN 66 N -3.06 4.05 0.18 0.37 0.74 -1.26 -0.20 119.66 120.49 1m4d s GLN 66 Ca 0.27 0.32 -0.03 0.00 0.05 0.00 0.00 55.36 55.97 1m4d s GLN 66 Cb -0.08 -3.31 0.01 0.00 1.10 0.00 0.00 33.01 30.73 1m4d s GLN 66 CO 0.16 0.49 0.28 2.89 -0.55 0.00 0.00 175.29 178.56 1m4d n ARG 67 N 2.60 0.41 -5.05 1.67 1.85 -0.39 -4.96 116.66 112.79 1m4d n ARG 67 Ca -0.12 -1.33 -0.32 0.00 -1.00 0.00 0.00 57.85 55.08 1m4d n ARG 67 Cb 0.52 1.36 -0.14 0.00 -1.05 0.00 0.00 32.46 33.15 1m4d n ARG 67 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 1m4d s ARG 68 N -2.31 2.38 -0.10 2.89 1.81 -1.26 -0.84 118.95 121.53 1m4d s ARG 68 Ca 0.13 -0.78 0.04 0.00 -1.72 0.00 0.00 55.73 53.39 1m4d s ARG 68 Cb -0.01 -2.26 -0.00 0.00 -0.45 0.00 0.00 34.95 32.23 1m4d s ARG 68 CO 0.09 0.59 -0.23 -0.51 -0.68 0.00 0.00 175.30 174.56 1m4d s LEU 69 N -0.65 2.13 -0.26 2.53 1.43 -0.95 -2.65 118.68 120.26 1m4d s LEU 69 Ca 0.10 -0.54 -0.19 0.00 -1.03 0.00 0.00 54.13 52.47 1m4d s LEU 69 Cb -0.11 -1.42 -0.02 0.00 0.03 0.00 0.00 46.19 44.67 1m4d s LEU 69 CO 0.00 0.17 0.58 -0.63 0.23 0.00 0.00 176.35 176.71 1m4d s ILE 70 N 0.26 5.02 -0.11 -0.59 1.01 0.14 -0.80 121.20 126.13 1m4d s ILE 70 Ca -0.16 1.03 -0.00 0.00 0.00 0.00 0.00 60.65 61.52 1m4d s ILE 70 Cb -0.17 -3.89 0.02 0.00 0.01 0.00 0.00 42.46 38.43 1m4d s ILE 70 CO 0.08 0.05 -0.09 -0.47 0.00 0.00 0.00 174.94 174.51 1m4d s TYR 71 N 2.42 1.61 -1.56 3.97 5.04 -0.48 -1.52 117.35 126.82 1m4d s TYR 71 Ca 0.24 -0.81 -0.11 0.00 -2.44 0.00 0.00 57.07 53.96 1m4d s TYR 71 Cb -0.16 -1.28 0.09 0.00 0.35 0.00 0.00 41.96 40.96 1m4d s TYR 71 CO 0.09 -0.52 0.69 0.54 -1.34 0.00 0.00 175.55 175.01 1m4d n ARG 72 N 4.80 -3.71 -0.95 4.97 1.74 -1.26 -0.33 116.66 121.91 1m4d n ARG 72 Ca -0.14 0.43 0.00 0.00 -0.77 0.00 0.00 57.85 57.37 1m4d n ARG 72 Cb 0.50 -4.98 0.00 0.00 -1.02 0.00 0.00 32.46 26.96 1m4d n ARG 72 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1m4d n GLY 73 N -1.66 0.38 3.54 -0.13 0.00 -1.26 -5.01 105.19 101.05 1m4d n GLY 73 Ca -0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 1m4d n GLY 73 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1m4d s ASN 74 N -2.15 4.88 -0.77 1.61 -0.87 0.55 -5.06 114.94 113.13 1m4d s ASN 74 Ca 0.00 -0.07 -0.20 0.00 -1.57 0.00 0.00 52.86 51.03 1m4d s ASN 74 Cb 0.00 -1.67 0.11 0.00 -0.02 0.00 0.00 41.25 39.67 1m4d s ASN 74 CO 0.00 0.22 0.98 0.00 -2.57 0.00 0.00 177.10 175.73 1m4d s ALA 75 N 0.04 3.32 0.30 0.60 0.00 -1.26 -1.39 121.76 123.37 1m4d s ALA 75 Ca 0.01 -2.38 -0.29 0.00 0.00 0.00 0.00 51.96 49.30 1m4d s ALA 75 Cb -0.13 -3.86 -0.10 0.00 0.00 0.00 0.00 23.12 19.03 1m4d s ALA 75 CO 0.03 -2.76 1.11 -0.51 0.00 0.00 0.00 175.76 173.62 1m4d s LEU 76 N 3.04 4.50 -0.51 0.00 1.43 0.02 -4.82 118.68 122.34 1m4d s LEU 76 Ca 0.24 2.28 -0.28 0.00 -1.03 0.00 0.00 54.13 55.34 1m4d s LEU 76 Cb -0.13 -3.69 0.03 0.00 0.03 0.00 0.00 46.19 42.43 1m4d s LEU 76 CO 0.00 -0.21 1.12 -0.60 0.23 0.00 0.00 176.35 176.89 1m4d s ARG 77 N -1.59 3.62 -0.13 1.70 3.52 -1.26 -2.25 118.95 122.57 1m4d s ARG 77 Ca 0.46 0.38 -0.01 0.00 -0.13 0.00 0.00 55.73 56.43 1m4d s ARG 77 Cb -0.32 -3.95 -0.02 0.00 -1.56 0.00 0.00 34.95 29.10 1m4d s ARG 77 CO 0.41 -1.46 -0.09 0.00 -0.81 0.00 0.00 175.30 173.35 1m4d s GLY 79 N 0.12 1.67 -0.17 0.00 0.00 -0.57 -1.26 107.32 107.11 1m4d s GLY 79 Ca -0.04 -0.78 -0.06 0.00 0.00 0.00 0.00 44.72 43.85 1m4d s GLY 79 CO 0.04 1.70 0.03 -0.47 0.00 0.00 0.00 173.10 174.40 1m4d s TYR 80 N 3.04 3.19 -0.28 1.90 5.04 0.73 -1.57 117.35 129.40 1m4d s TYR 80 Ca 0.29 -0.01 -0.18 0.00 -2.44 0.00 0.00 57.07 54.74 1m4d s TYR 80 Cb -0.13 -2.02 -0.02 0.00 0.35 0.00 0.00 41.96 40.13 1m4d s TYR 80 CO 0.18 0.14 0.50 0.08 -1.34 0.00 0.00 175.55 175.10 1m4d s VAL 81 N 0.25 5.07 0.19 3.14 1.01 -0.08 -0.80 120.40 129.19 1m4d s VAL 81 Ca 0.02 0.75 0.09 0.00 0.00 0.00 0.00 61.98 62.84 1m4d s VAL 81 Cb -0.13 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 1m4d s VAL 81 CO 0.01 0.04 -0.19 -1.61 0.00 0.00 0.00 175.10 173.35 1m4d s GLU 82 N 2.30 1.36 -1.42 2.72 0.41 0.50 -4.65 118.70 119.92 1m4d s GLU 82 Ca 0.20 -1.49 -0.07 0.00 -0.41 0.00 0.00 54.97 53.19 1m4d s GLU 82 Cb -0.16 -1.41 0.01 0.00 -1.78 0.00 0.00 34.13 30.79 1m4d s GLU 82 CO 0.10 0.28 0.98 0.41 -0.49 0.00 0.00 175.26 176.54 1m4d n GLY 83 N 0.08 -0.53 3.66 -1.39 0.00 -1.26 -0.70 105.19 105.05 1m4d n GLY 83 Ca -0.11 0.21 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 1m4d n GLY 83 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1m4d s VAL 84 N -3.27 4.13 -0.22 1.61 1.01 -1.26 -4.22 120.40 118.18 1m4d s VAL 84 Ca 0.49 1.36 -0.20 0.00 0.00 0.00 0.00 61.98 63.63 1m4d s VAL 84 Cb -0.21 -3.89 0.06 0.00 0.00 0.00 0.00 36.38 32.33 1m4d s VAL 84 CO 0.60 -0.14 0.58 0.00 0.00 0.00 0.00 175.10 176.14 1m4d s ALA 85 N 3.68 -1.44 -0.10 5.51 0.00 -0.37 -5.01 121.76 124.04 1m4d s ALA 85 Ca 0.59 1.67 0.02 0.00 0.00 0.00 0.00 51.96 54.24 1m4d s ALA 85 Cb -0.24 -0.97 -0.01 0.00 0.00 0.00 0.00 23.12 21.90 1m4d s ALA 85 CO 0.18 -0.28 -0.18 0.08 0.00 0.00 0.00 175.76 175.56 1m4d s VAL 86 N 0.41 2.64 0.49 0.00 1.01 -1.26 -0.73 120.40 122.96 1m4d s VAL 86 Ca -0.01 -0.83 -0.24 0.00 0.00 0.00 0.00 61.98 60.91 1m4d s VAL 86 Cb -0.04 -2.05 -0.07 0.00 0.00 0.00 0.00 36.38 34.22 1m4d s VAL 86 CO -0.01 0.55 1.41 -1.14 0.00 0.00 0.00 175.10 175.92 1m4d n ARG 87 N 3.25 2.03 0.25 2.72 0.63 0.12 -4.80 116.66 120.86 1m4d n ARG 87 Ca -0.18 0.73 0.09 0.00 -0.92 0.00 0.00 57.85 57.57 1m4d n ARG 87 Cb 0.53 -2.62 0.66 0.00 0.45 0.00 0.00 32.46 31.47 1m4d n ARG 87 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1m4d h ALA 88 N 1.93 1.99 0.00 5.13 0.00 -1.95 -0.11 119.26 126.26 1m4d h ALA 88 Ca -0.51 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1m4d h ALA 88 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1m4d h ALA 88 CO 0.59 -0.02 0.00 -0.40 0.00 0.00 0.00 179.25 179.42 1m4d n ASP 89 N -4.50 0.27 -0.63 0.00 5.75 -1.26 -3.07 116.55 113.12 1m4d n ASP 89 Ca -0.03 0.55 0.06 0.00 -0.01 0.00 0.00 54.79 55.36 1m4d n ASP 89 Cb 0.10 -0.61 0.14 0.00 -1.03 0.00 0.00 41.12 39.72 1m4d n ASP 89 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1m4d n TRP 90 N -1.78 0.39 -1.93 2.11 7.02 -0.06 -5.03 117.44 118.16 1m4d n TRP 90 Ca 0.05 -0.40 -0.32 0.00 -1.02 0.00 0.00 57.50 55.81 1m4d n TRP 90 Cb 0.28 -0.02 0.02 0.00 -2.42 0.00 0.00 31.31 29.16 1m4d n TRP 90 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1m4d s ARG 91 N -0.99 3.31 0.00 -0.99 0.52 -1.17 -3.94 118.95 115.69 1m4d s ARG 91 Ca 0.22 1.04 0.00 0.00 -0.52 0.00 0.00 55.73 56.47 1m4d s ARG 91 Cb 0.12 -2.04 0.00 0.00 0.52 0.00 0.00 34.95 33.55 1m4d s ARG 91 CO 0.16 -0.80 0.00 0.41 0.02 0.00 0.00 175.30 175.09 1m4d n GLY 92 N -1.57 0.74 0.40 -3.53 0.00 -1.26 -4.90 105.19 95.07 1m4d n GLY 92 Ca 0.08 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.14 1m4d n GLY 92 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1m4d n GLN 93 N -2.36 2.82 -1.27 1.61 6.02 -1.25 -4.99 117.38 117.96 1m4d n GLN 93 Ca 0.00 -1.97 -0.09 0.00 -0.01 0.00 0.00 57.00 54.92 1m4d n GLN 93 Cb 0.00 -1.25 -0.04 0.00 1.02 0.00 0.00 30.24 29.97 1m4d n GLN 93 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1m4d n ARG 94 N -0.08 -0.82 0.16 -1.09 1.74 -1.26 -4.89 116.66 110.42 1m4d n ARG 94 Ca 0.09 0.78 0.05 0.00 -0.77 0.00 0.00 57.85 58.00 1m4d n ARG 94 Cb 0.43 -4.72 0.51 0.00 -1.02 0.00 0.00 32.46 27.66 1m4d n ARG 94 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1m4d h LEU 95 N 0.00 0.17 -2.23 0.55 3.38 -1.94 -0.03 115.31 115.21 1m4d h LEU 95 Ca -0.19 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.79 1m4d h LEU 95 Cb 0.69 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 1m4d h LEU 95 CO 0.27 0.20 0.05 1.62 0.09 0.00 0.00 178.44 180.68 1m4d h VAL 96 N 0.20 0.70 -0.52 1.22 3.04 -1.95 -0.74 116.25 118.20 1m4d h VAL 96 Ca 0.05 0.00 -0.12 0.00 -1.01 0.00 0.00 66.70 65.62 1m4d h VAL 96 Cb 0.11 0.96 -0.02 0.00 -2.01 0.00 0.00 31.29 30.33 1m4d h VAL 96 CO -0.00 0.00 -0.13 -1.28 -1.01 0.00 0.00 177.57 175.15 1m4d h SER 97 N 0.00 1.00 -0.68 3.17 0.87 -1.39 0.00 113.55 116.52 1m4d h SER 97 Ca 0.03 -0.34 -0.05 0.00 -1.23 0.00 0.00 61.79 60.21 1m4d h SER 97 Cb 0.14 -0.27 -0.03 0.00 -0.44 0.00 0.00 62.40 61.79 1m4d h SER 97 CO -0.00 1.12 0.24 0.00 -0.53 0.00 0.00 176.83 177.66 1m4d h ALA 98 N 0.96 0.89 -0.66 6.23 0.00 -1.14 -0.35 119.26 125.19 1m4d h ALA 98 Ca 0.13 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1m4d h ALA 98 Cb 0.69 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1m4d h ALA 98 CO 0.05 0.54 0.44 -0.07 0.00 0.00 0.00 179.25 180.21 1m4d h LEU 99 N 0.98 0.75 -0.89 0.00 3.38 -0.98 -2.94 115.31 115.61 1m4d h LEU 99 Ca 0.22 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 58.06 1m4d h LEU 99 Cb 0.26 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1m4d h LEU 99 CO -0.01 0.55 -0.53 -0.07 0.09 0.00 0.00 178.44 178.47 1m4d h LEU 100 N 0.89 0.08 -0.56 1.67 3.38 -0.65 -0.46 115.31 119.65 1m4d h LEU 100 Ca 0.24 -0.04 0.07 0.00 0.09 0.00 0.00 57.88 58.25 1m4d h LEU 100 Cb -0.10 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.57 1m4d h LEU 100 CO -0.05 0.59 0.23 0.44 0.09 0.00 0.00 178.44 179.74 1m4d h ASP 101 N 0.06 0.27 -0.09 -0.43 3.32 -0.90 0.14 116.42 118.80 1m4d h ASP 101 Ca -0.00 0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.07 1m4d h ASP 101 Cb 0.95 0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.52 1m4d h ASP 101 CO 0.07 0.18 -0.09 0.00 -1.72 0.00 0.00 179.24 177.68 1m4d h ALA 102 N 1.36 0.13 -0.39 3.45 0.00 -1.24 -2.03 119.26 120.54 1m4d h ALA 102 Ca 0.27 -0.30 0.05 0.00 0.00 0.00 0.00 54.91 54.94 1m4d h ALA 102 Cb 0.28 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 1m4d h ALA 102 CO -0.25 -0.04 0.10 0.28 0.00 0.00 0.00 179.25 179.34 1m4d h VAL 103 N -0.21 0.83 -0.19 0.00 2.07 -0.99 -1.67 116.25 116.09 1m4d h VAL 103 Ca 0.01 -0.08 -0.08 0.00 0.82 0.00 0.00 66.70 67.38 1m4d h VAL 103 Cb 0.61 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 1m4d h VAL 103 CO 0.02 0.04 -0.22 -0.33 0.02 0.00 0.00 177.57 177.10 1m4d h GLU 104 N 0.23 0.34 -0.71 1.57 5.08 -0.72 -1.12 114.58 119.26 1m4d h GLU 104 Ca 0.18 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.37 1m4d h GLU 104 Cb 0.20 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 1m4d h GLU 104 CO -0.22 0.55 0.21 0.37 -1.00 0.00 0.00 179.01 178.92 1m4d h GLN 105 N 0.31 1.10 -0.55 2.33 4.15 -1.03 0.10 115.11 121.53 1m4d h GLN 105 Ca 0.05 -0.24 -0.08 0.00 0.77 0.00 0.00 58.65 59.16 1m4d h GLN 105 Cb 0.57 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 28.08 1m4d h GLN 105 CO 0.04 0.94 0.04 0.28 -1.93 0.00 0.00 178.83 178.20 1m4d h VAL 106 N 1.05 1.26 0.25 2.39 2.07 -0.52 -0.94 116.25 121.81 1m4d h VAL 106 Ca 0.23 -1.05 -0.01 0.00 0.82 0.00 0.00 66.70 66.68 1m4d h VAL 106 Cb 0.31 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1m4d h VAL 106 CO -0.01 0.38 -0.12 0.24 0.02 0.00 0.00 177.57 178.08 1m4d h MET 107 N 0.83 -0.33 -0.09 1.57 2.86 -0.55 -0.52 114.93 118.69 1m4d h MET 107 Ca 0.16 0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.80 1m4d h MET 107 Cb 0.49 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.21 1m4d h MET 107 CO 0.02 -0.22 -0.04 0.00 1.06 0.00 0.00 176.91 177.74 1m4d h ARG 108 N -0.34 0.13 0.00 1.72 3.08 -0.65 -1.84 114.38 116.49 1m4d h ARG 108 Ca -0.03 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1m4d h ARG 108 Cb 0.26 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.29 1m4d h ARG 108 CO 0.05 0.18 -0.53 0.41 -1.07 0.00 0.00 179.97 179.02 1m4d n GLY 109 N -1.24 -1.44 0.00 0.04 0.00 -0.37 -4.64 105.19 97.54 1m4d n GLY 109 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1m4d n GLY 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m4d n ALA 110 N -1.78 0.02 -2.33 4.61 0.00 -0.25 -5.08 120.51 115.70 1m4d n ALA 110 Ca 0.04 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.31 1m4d n ALA 110 Cb 0.43 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.77 1m4d n ALA 110 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1m4d s TYR 111 N -0.01 1.57 -0.06 0.00 2.02 -0.71 -5.01 117.35 115.14 1m4d s TYR 111 Ca 0.00 -0.92 0.13 0.00 -0.37 0.00 0.00 57.07 55.90 1m4d s TYR 111 Cb 0.00 -0.91 -0.06 0.00 -0.40 0.00 0.00 41.96 40.58 1m4d s TYR 111 CO 0.00 -0.04 1.26 1.96 -1.57 0.00 0.00 175.55 177.16 1m4d h GLN 112 N 2.46 0.00 -1.99 -0.62 4.20 -1.13 -3.44 115.11 114.58 1m4d h GLN 112 Ca -0.38 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.27 1m4d h GLN 112 Cb 1.22 0.00 -0.19 0.00 0.30 0.00 0.00 27.48 28.81 1m4d h GLN 112 CO 0.65 0.62 0.19 -0.48 -0.67 0.00 0.00 178.83 179.14 1m4d s LEU 113 N -6.42 -0.66 0.30 1.46 2.34 -1.18 -0.40 118.68 114.11 1m4d s LEU 113 Ca 0.02 0.76 0.02 0.00 0.06 0.00 0.00 54.13 54.99 1m4d s LEU 113 Cb 0.08 2.53 -0.03 0.00 -0.56 0.00 0.00 46.19 48.21 1m4d s LEU 113 CO 0.78 -0.58 0.47 -0.83 -1.06 0.00 0.00 176.35 175.13 1m4d s GLY 114 N -1.09 1.36 0.17 -3.48 0.00 0.09 -1.51 107.32 102.87 1m4d s GLY 114 Ca -0.10 -0.99 -0.19 0.00 0.00 0.00 0.00 44.72 43.44 1m4d s GLY 114 CO 0.09 -0.95 0.53 0.00 0.00 0.00 0.00 173.10 172.77 1m4d s ALA 115 N -2.16 -1.13 -0.03 3.20 0.00 -0.61 -0.49 121.76 120.55 1m4d s ALA 115 Ca 0.38 0.01 -0.30 0.00 0.00 0.00 0.00 51.96 52.05 1m4d s ALA 115 Cb -0.10 0.83 0.11 0.00 0.00 0.00 0.00 23.12 23.96 1m4d s ALA 115 CO 0.33 -0.77 1.04 -0.48 0.00 0.00 0.00 175.76 175.88 1m4d s LEU 116 N -2.83 -0.23 -0.27 0.00 0.05 -0.88 -0.90 118.68 113.63 1m4d s LEU 116 Ca 0.06 -0.09 0.00 0.00 0.05 0.00 0.00 54.13 54.14 1m4d s LEU 116 Cb -0.01 1.80 0.05 0.00 -2.05 0.00 0.00 46.19 45.98 1m4d s LEU 116 CO -0.07 -0.53 -0.06 -0.55 -0.55 0.00 0.00 176.35 174.59 1m4d s SER 117 N -2.55 4.53 0.24 1.48 0.15 -1.26 -1.04 113.70 115.24 1m4d s SER 117 Ca 0.09 -1.22 -0.13 0.00 0.70 0.00 0.00 55.95 55.39 1m4d s SER 117 Cb -0.00 -1.63 -0.08 0.00 -1.71 0.00 0.00 66.02 62.60 1m4d s SER 117 CO -0.05 -0.20 0.62 -0.55 1.20 0.00 0.00 173.24 174.26 1m4d s SER 118 N 1.21 6.75 0.68 5.45 0.15 0.31 -4.97 113.70 123.28 1m4d s SER 118 Ca -0.05 1.11 -0.12 0.00 0.70 0.00 0.00 55.95 57.58 1m4d s SER 118 Cb -0.19 -2.30 0.00 0.00 -1.71 0.00 0.00 66.02 61.82 1m4d s SER 118 CO -0.04 -0.07 1.06 -0.44 1.20 0.00 0.00 173.24 174.96 1m4d s SER 119 N -2.14 5.35 0.43 5.45 0.01 -1.26 -4.81 113.70 116.73 1m4d s SER 119 Ca 0.47 1.70 0.13 0.00 1.31 0.00 0.00 55.95 59.56 1m4d s SER 119 Cb -0.12 -2.51 0.95 0.00 0.21 0.00 0.00 66.02 64.55 1m4d s SER 119 CO 0.20 -1.47 1.98 0.00 0.41 0.00 0.00 173.24 174.36 1m4d h ALA 120 N -0.50 1.66 0.02 1.44 0.00 -1.98 -2.70 119.26 117.20 1m4d h ALA 120 Ca -0.44 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.30 1m4d h ALA 120 Cb 1.22 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1m4d h ALA 120 CO 0.56 0.25 -0.01 0.00 0.00 0.00 0.00 179.25 180.05 1m4d h ARG 121 N 0.09 -0.03 0.00 0.00 3.08 -2.05 -3.21 114.38 112.26 1m4d h ARG 121 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1m4d h ARG 121 Cb 0.30 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.36 1m4d h ARG 121 CO 0.02 0.15 0.00 0.00 -1.07 0.00 0.00 179.97 179.07 1m4d n ALA 122 N -2.19 2.25 -0.23 0.04 0.00 -1.04 -4.29 120.51 115.04 1m4d n ALA 122 Ca -0.08 -0.10 0.04 0.00 0.00 0.00 0.00 53.44 53.30 1m4d n ALA 122 Cb 0.12 -1.43 0.16 0.00 0.00 0.00 0.00 19.45 18.29 1m4d n ALA 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1m4d h ARG 123 N 0.00 0.24 -0.35 0.00 3.08 -1.50 -1.95 114.38 113.90 1m4d h ARG 123 Ca 0.00 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 59.97 1m4d h ARG 123 Cb 0.40 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 1m4d h ARG 123 CO 0.00 0.16 -0.05 0.07 -1.07 0.00 0.00 179.97 179.08 1m4d h ARG 124 N 0.25 0.57 0.52 0.04 0.11 -1.83 -1.36 114.38 112.69 1m4d h ARG 124 Ca 0.38 -0.15 -0.02 0.00 0.10 0.00 0.00 59.98 60.29 1m4d h ARG 124 Cb 0.63 -0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.64 1m4d h ARG 124 CO -0.49 0.63 -0.28 1.25 0.10 0.00 0.00 179.97 181.19 1m4d h LEU 125 N 0.54 -0.67 -0.73 0.08 5.85 -1.64 -0.75 115.31 117.98 1m4d h LEU 125 Ca 0.11 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.87 1m4d h LEU 125 Cb 0.42 0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.60 1m4d h LEU 125 CO 0.02 -0.46 0.48 1.88 -0.34 0.00 0.00 178.44 180.03 1m4d h TYR 126 N -0.74 0.91 -0.76 1.25 0.05 -1.14 -2.34 116.97 114.21 1m4d h TYR 126 Ca -0.07 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.74 1m4d h TYR 126 Cb 0.58 -0.31 -0.04 0.00 1.01 0.00 0.00 36.73 37.98 1m4d h TYR 126 CO -0.06 0.57 0.48 0.00 -1.05 0.00 0.00 178.16 178.10 1m4d h ALA 127 N 1.27 1.42 -0.16 3.88 0.00 -1.06 -2.01 119.26 122.60 1m4d h ALA 127 Ca 0.27 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.13 1m4d h ALA 127 Cb -0.11 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 1m4d h ALA 127 CO -0.06 0.52 0.11 0.77 0.00 0.00 0.00 179.25 180.59 1m4d h SER 128 N 1.03 0.11 -0.26 0.00 0.02 -0.57 -0.93 113.55 112.96 1m4d h SER 128 Ca 0.27 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1m4d h SER 128 Cb -0.08 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.43 1m4d h SER 128 CO -0.06 0.08 0.00 0.54 -1.14 0.00 0.00 176.83 176.26 1m4d n ARG 129 N -4.51 1.86 -0.21 3.45 1.74 -0.81 -4.93 116.66 113.26 1m4d n ARG 129 Ca -0.00 -1.31 0.00 0.00 -0.77 0.00 0.00 57.85 55.77 1m4d n ARG 129 Cb 0.14 -1.38 0.00 0.00 -1.02 0.00 0.00 32.46 30.20 1m4d n ARG 129 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1m4d n GLY 130 N 1.16 0.71 3.77 -0.13 0.00 -0.35 -5.06 105.19 105.29 1m4d n GLY 130 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1m4d n GLY 130 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1m4d s TRP 131 N -2.27 3.22 -0.12 1.61 0.52 -0.89 -4.90 118.94 116.11 1m4d s TRP 131 Ca 0.00 1.59 -0.06 0.00 0.02 0.00 0.00 56.10 57.65 1m4d s TRP 131 Cb 0.00 -3.35 -0.04 0.00 -1.15 0.00 0.00 33.47 28.93 1m4d s TRP 131 CO 0.00 -1.07 0.10 -0.51 0.02 0.00 0.00 176.95 175.49 1m4d s LEU 132 N -2.23 4.17 0.24 2.99 1.43 0.43 -4.28 118.68 121.44 1m4d s LEU 132 Ca 0.54 0.37 -0.30 0.00 -1.03 0.00 0.00 54.13 53.70 1m4d s LEU 132 Cb -0.30 -2.01 -0.09 0.00 0.03 0.00 0.00 46.19 43.82 1m4d s LEU 132 CO 0.38 0.38 1.02 -2.16 0.23 0.00 0.00 176.35 176.21 1m4d s PRO 133 N -0.87 4.73 -0.33 1.29 0.04 -1.26 -0.49 135.00 138.11 1m4d s PRO 133 Ca 0.14 1.64 -0.25 0.00 0.04 0.00 0.00 61.00 62.57 1m4d s PRO 133 Cb -0.12 -3.25 0.01 0.00 0.04 0.00 0.00 34.50 31.18 1m4d s PRO 133 CO 0.03 0.32 0.85 -0.46 0.04 0.00 0.00 177.00 177.79 1m4d s TRP 134 N -0.98 3.15 -0.13 0.56 -0.11 0.65 -4.90 118.94 117.19 1m4d s TRP 134 Ca 0.44 0.79 0.17 0.00 1.22 0.00 0.00 56.10 58.72 1m4d s TRP 134 Cb -0.29 -3.40 -0.14 0.00 -1.50 0.00 0.00 33.47 28.15 1m4d s TRP 134 CO 0.36 -0.68 0.81 0.72 -4.62 0.00 0.00 176.95 173.54 1m4d n HIS 135 N 6.45 0.94 -0.99 5.86 8.25 -0.09 -4.30 115.22 131.34 1m4d n HIS 135 Ca 0.05 0.31 -0.29 0.00 -0.26 0.00 0.00 57.72 57.54 1m4d n HIS 135 Cb 0.48 -1.07 0.19 0.00 1.12 0.00 0.00 29.99 30.71 1m4d n HIS 135 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1m4d s GLY 136 N -4.78 1.57 0.37 -1.41 0.00 -0.49 -4.87 107.32 97.71 1m4d s GLY 136 Ca -0.03 -0.20 -0.26 0.00 0.00 0.00 0.00 44.72 44.22 1m4d s GLY 136 CO 0.81 0.41 1.17 2.56 0.00 0.00 0.00 173.10 178.04 1m4d s PRO 137 N -4.82 4.21 0.14 2.90 0.04 -1.26 -4.77 135.00 131.44 1m4d s PRO 137 Ca 0.66 1.86 0.04 0.00 0.04 0.00 0.00 61.00 63.60 1m4d s PRO 137 Cb -0.20 -2.81 -0.04 0.00 0.04 0.00 0.00 34.50 31.49 1m4d s PRO 137 CO 0.59 -0.19 0.16 0.95 0.04 0.00 0.00 177.00 178.54 1m4d s THR 138 N -1.35 4.70 0.34 1.26 -4.23 -1.26 -2.28 115.64 112.83 1m4d s THR 138 Ca 0.54 -0.90 -0.09 0.00 -1.18 0.00 0.00 61.69 60.06 1m4d s THR 138 Cb -0.32 -3.37 0.02 0.00 1.34 0.00 0.00 72.50 70.17 1m4d s THR 138 CO 0.40 -0.04 0.58 -0.94 -0.54 0.00 0.00 174.62 174.08 1m4d s SER 139 N -2.95 0.45 0.03 3.99 1.04 -0.66 -1.51 113.70 114.09 1m4d s SER 139 Ca 0.31 -1.27 0.04 0.00 0.48 0.00 0.00 55.95 55.51 1m4d s SER 139 Cb -0.11 0.72 -0.02 0.00 0.10 0.00 0.00 66.02 66.71 1m4d s SER 139 CO 0.24 -1.41 -0.11 0.54 0.98 0.00 0.00 173.24 173.49 1m4d s VAL 140 N -2.97 0.83 -1.12 5.02 0.11 0.33 -1.69 120.40 120.91 1m4d s VAL 140 Ca 0.24 -0.90 -0.16 0.00 -2.93 0.00 0.00 61.98 58.23 1m4d s VAL 140 Cb -0.02 -0.78 0.15 0.00 -1.53 0.00 0.00 36.38 34.19 1m4d s VAL 140 CO 0.15 -0.10 1.36 -0.22 -3.33 0.00 0.00 175.10 172.97 1m4d s LEU 141 N -1.12 4.89 0.80 2.54 2.96 0.05 -0.85 118.68 127.95 1m4d s LEU 141 Ca -0.02 -2.59 -0.12 0.00 -0.22 0.00 0.00 54.13 51.18 1m4d s LEU 141 Cb -0.08 -2.42 0.07 0.00 0.50 0.00 0.00 46.19 44.26 1m4d s LEU 141 CO 0.01 -0.91 1.15 0.00 -1.32 0.00 0.00 176.35 175.28 1m4d s ALA 142 N 2.27 2.57 0.60 5.97 0.00 -1.02 -3.70 121.76 128.45 1m4d s ALA 142 Ca 0.41 -0.53 0.31 0.00 0.00 0.00 0.00 51.96 52.14 1m4d s ALA 142 Cb -0.03 -3.00 1.79 0.00 0.00 0.00 0.00 23.12 21.88 1m4d s ALA 142 CO -0.03 -1.63 2.18 -1.35 0.00 0.00 0.00 175.76 174.93 1m4d h PRO 143 N -1.02 0.00 -0.01 0.00 0.11 -2.01 0.19 132.00 129.26 1m4d h PRO 143 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1m4d h PRO 143 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1m4d h PRO 143 CO 0.64 0.00 -0.08 0.25 -0.21 0.00 0.00 178.00 178.61 1m4d n THR 144 N -3.72 0.00 0.00 -1.15 -2.24 -1.26 -5.05 114.28 100.86 1m4d n THR 144 Ca -0.01 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 1m4d n THR 144 Cb 0.21 0.47 0.00 0.00 -2.10 0.00 0.00 70.33 68.91 1m4d n THR 144 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1m4d n GLY 145 N 1.23 0.92 3.73 3.38 0.00 0.66 -5.05 105.19 110.06 1m4d n GLY 145 Ca 0.17 -2.31 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 1m4d n GLY 145 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1m4d n PRO 146 N -1.04 2.34 -3.73 1.61 -0.02 -1.26 -2.45 135.00 130.45 1m4d n PRO 146 Ca 0.00 0.82 -0.13 0.00 -2.02 0.00 0.00 63.50 62.17 1m4d n PRO 146 Cb 0.00 -2.46 -0.14 0.00 -0.02 0.00 0.00 33.50 30.88 1m4d n PRO 146 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1m4d s VAL 147 N -1.09 -0.06 0.60 -1.45 0.11 -0.03 -4.89 120.40 113.58 1m4d s VAL 147 Ca 0.55 0.17 -0.20 0.00 -2.93 0.00 0.00 61.98 59.57 1m4d s VAL 147 Cb -0.53 -0.33 -0.03 0.00 -1.53 0.00 0.00 36.38 33.96 1m4d s VAL 147 CO 0.63 0.07 1.31 -0.13 -3.33 0.00 0.00 175.10 173.64 1m4d s ARG 148 N 1.28 2.86 -0.55 1.54 1.81 -1.26 -0.51 118.95 124.11 1m4d s ARG 148 Ca -0.09 2.10 0.07 0.00 -1.72 0.00 0.00 55.73 56.09 1m4d s ARG 148 Cb -0.11 -2.03 0.28 0.00 -0.45 0.00 0.00 34.95 32.64 1m4d s ARG 148 CO -0.08 -1.37 0.74 0.25 -0.68 0.00 0.00 175.30 174.16 1m4d n THR 149 N -1.49 1.66 0.14 0.02 -2.24 -0.57 -4.80 114.28 106.99 1m4d n THR 149 Ca 0.13 -4.99 0.16 0.00 -2.27 0.00 0.00 64.05 57.08 1m4d n THR 149 Cb 0.47 -1.78 0.72 0.00 -2.10 0.00 0.00 70.33 67.63 1m4d n THR 149 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1m4d h PRO 150 N 3.80 0.00 0.00 -0.78 0.13 -1.94 0.13 132.00 133.34 1m4d h PRO 150 Ca 0.15 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1m4d h PRO 150 Cb 0.70 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.83 1m4d h PRO 150 CO 0.73 0.00 -0.02 -0.44 -0.23 0.00 0.00 178.00 178.04 1m4d h ASP 151 N 0.00 0.00 -0.01 1.44 3.32 -1.96 -1.57 116.42 117.64 1m4d h ASP 151 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1m4d h ASP 151 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1m4d h ASP 151 CO -0.00 0.02 -0.07 0.47 -1.72 0.00 0.00 179.24 177.93 1m4d n ASP 152 N -3.16 2.40 -4.76 6.45 8.00 0.03 -4.92 116.55 120.58 1m4d n ASP 152 Ca -0.01 -1.76 -0.38 0.00 0.71 0.00 0.00 54.79 53.36 1m4d n ASP 152 Cb 0.21 0.07 0.01 0.00 -0.02 0.00 0.00 41.12 41.39 1m4d n ASP 152 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1m4d s ASP 153 N -2.09 5.90 -0.19 -2.24 1.01 -0.59 -2.38 116.67 116.10 1m4d s ASP 153 Ca 0.29 2.51 0.00 0.00 0.71 0.00 0.00 52.55 56.06 1m4d s ASP 153 Cb 0.20 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.51 1m4d s ASP 153 CO 0.35 -1.12 0.00 0.61 0.21 0.00 0.00 175.17 175.23 1m4d n GLY 154 N 0.57 0.41 0.00 0.21 0.00 -1.26 -4.84 105.19 100.28 1m4d n GLY 154 Ca 0.08 -0.09 0.02 0.00 0.00 0.00 0.00 46.02 46.02 1m4d n GLY 154 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1m4d n THR 155 N -2.53 0.00 -2.98 2.61 -2.24 -1.00 -5.00 114.28 103.14 1m4d n THR 155 Ca -0.02 -0.20 -0.39 0.00 -2.27 0.00 0.00 64.05 61.17 1m4d n THR 155 Cb 0.27 0.62 -0.06 0.00 -2.10 0.00 0.00 70.33 69.06 1m4d n THR 155 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1m4d s VAL 156 N -1.91 4.37 0.09 2.28 1.01 -1.26 -0.53 120.40 124.45 1m4d s VAL 156 Ca -0.00 1.71 0.07 0.00 0.00 0.00 0.00 61.98 63.76 1m4d s VAL 156 Cb 0.02 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.23 1m4d s VAL 156 CO 0.14 0.52 -0.19 -0.36 0.00 0.00 0.00 175.10 175.21 1m4d s PHE 157 N -1.13 1.59 0.13 5.22 0.40 -0.21 -0.25 117.98 123.74 1m4d s PHE 157 Ca 0.36 -0.43 0.04 0.00 -0.60 0.00 0.00 56.93 56.30 1m4d s PHE 157 Cb -0.23 -0.88 -0.04 0.00 0.51 0.00 0.00 43.02 42.38 1m4d s PHE 157 CO 0.26 0.15 -0.11 0.14 0.70 0.00 0.00 175.22 176.37 1m4d s VAL 158 N -1.18 1.14 -0.39 -0.44 -7.23 0.35 -2.08 120.40 110.58 1m4d s VAL 158 Ca 0.04 -1.92 0.01 0.00 -1.81 0.00 0.00 61.98 58.29 1m4d s VAL 158 Cb -0.10 -1.70 0.13 0.00 0.56 0.00 0.00 36.38 35.27 1m4d s VAL 158 CO 0.03 -0.66 0.20 -0.22 -0.31 0.00 0.00 175.10 174.15 1m4d s LEU 159 N -2.92 1.98 0.23 1.32 2.96 0.35 -0.42 118.68 122.18 1m4d s LEU 159 Ca 0.13 -2.28 -0.30 0.00 -0.22 0.00 0.00 54.13 51.46 1m4d s LEU 159 Cb 0.00 -0.77 -0.09 0.00 0.50 0.00 0.00 46.19 45.83 1m4d s LEU 159 CO 0.01 -0.31 1.29 -2.16 -1.32 0.00 0.00 176.35 173.85 1m4d s PRO 160 N 0.85 4.41 -0.48 0.98 0.04 -1.26 -0.73 135.00 138.81 1m4d s PRO 160 Ca 0.16 2.05 -0.07 0.00 0.04 0.00 0.00 61.00 63.18 1m4d s PRO 160 Cb -0.23 -3.17 0.12 0.00 0.04 0.00 0.00 34.50 31.26 1m4d s PRO 160 CO -0.05 -0.19 0.33 0.42 0.04 0.00 0.00 177.00 177.55 1m4d s ILE 161 N -0.22 3.99 -1.62 0.56 -1.09 0.46 -4.68 121.20 118.60 1m4d s ILE 161 Ca 0.54 -1.95 -0.16 0.00 -2.23 0.00 0.00 60.65 56.85 1m4d s ILE 161 Cb -0.36 -3.64 0.13 0.00 -1.58 0.00 0.00 42.46 37.00 1m4d s ILE 161 CO 0.41 -0.77 0.87 0.47 -1.23 0.00 0.00 174.94 174.69 1m4d n ASP 162 N 4.72 -4.04 -3.97 3.58 8.00 -1.26 -4.82 116.55 118.76 1m4d n ASP 162 Ca -0.05 -0.88 -0.09 0.00 0.71 0.00 0.00 54.79 54.48 1m4d n ASP 162 Cb 0.41 -3.26 -0.10 0.00 -0.02 0.00 0.00 41.12 38.15 1m4d n ASP 162 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1m4d s ILE 163 N -3.27 0.13 -0.22 0.53 -4.36 -1.26 -5.13 121.20 107.62 1m4d s ILE 163 Ca 0.70 -1.08 -0.05 0.00 -0.26 0.00 0.00 60.65 59.96 1m4d s ILE 163 Cb -0.37 -0.68 -0.02 0.00 1.25 0.00 0.00 42.46 42.64 1m4d s ILE 163 CO 0.86 -0.59 0.01 -0.55 0.24 0.00 0.00 174.94 174.91 1m4d s SER 164 N -1.88 4.75 -0.11 4.36 0.15 -1.26 -4.85 113.70 114.86 1m4d s SER 164 Ca -0.09 -0.26 0.01 0.00 0.70 0.00 0.00 55.95 56.31 1m4d s SER 164 Cb -0.04 -1.83 -0.02 0.00 -1.71 0.00 0.00 66.02 62.42 1m4d s SER 164 CO -0.03 0.01 -0.13 -0.76 1.20 0.00 0.00 173.24 173.52 1m4d s LEU 165 N 1.34 2.71 -0.65 3.45 1.43 -1.26 -5.07 118.68 120.64 1m4d s LEU 165 Ca 0.04 -0.30 -0.26 0.00 -1.03 0.00 0.00 54.13 52.59 1m4d s LEU 165 Cb -0.15 -1.59 0.04 0.00 0.03 0.00 0.00 46.19 44.52 1m4d s LEU 165 CO 0.01 0.21 1.12 -0.62 0.23 0.00 0.00 176.35 177.30 1m4d s ASP 166 N 0.07 6.27 0.00 2.29 2.15 -1.26 -4.87 116.67 121.31 1m4d s ASP 166 Ca -0.05 -0.41 0.08 0.00 0.43 0.00 0.00 52.55 52.59 1m4d s ASP 166 Cb -0.15 -2.50 0.45 0.00 -0.30 0.00 0.00 42.92 40.42 1m4d s ASP 166 CO 0.04 -1.54 1.01 0.35 -0.17 0.00 0.00 175.17 174.87 1m4d n THR 167 N 6.31 0.00 1.03 1.71 -2.24 -1.26 -1.91 114.28 117.92 1m4d n THR 167 Ca 0.03 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.91 1m4d n THR 167 Cb 0.48 -0.35 0.01 0.00 -2.10 0.00 0.00 70.33 68.38 1m4d n THR 167 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1m4d n SER 168 N -0.68 1.48 -4.88 3.42 3.41 -1.26 -0.91 113.62 114.20 1m4d n SER 168 Ca 0.06 -1.20 -0.29 0.00 -0.26 0.00 0.00 58.87 57.18 1m4d n SER 168 Cb 0.03 0.61 0.09 0.00 -0.26 0.00 0.00 64.21 64.67 1m4d n SER 168 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1m4d s ALA 169 N -2.69 2.70 0.43 7.33 0.00 -0.80 -3.91 121.76 124.82 1m4d s ALA 169 Ca 0.15 -0.70 -0.25 0.00 0.00 0.00 0.00 51.96 51.16 1m4d s ALA 169 Cb 0.17 -2.91 -0.08 0.00 0.00 0.00 0.00 23.12 20.31 1m4d s ALA 169 CO 0.68 -1.66 1.28 -1.21 0.00 0.00 0.00 175.76 174.85 1m4d s GLU 170 N -5.55 3.83 -0.08 0.00 8.01 -1.26 -3.98 118.70 119.68 1m4d s GLU 170 Ca 0.62 2.09 0.01 0.00 0.01 0.00 0.00 54.97 57.70 1m4d s GLU 170 Cb -0.11 -2.63 0.02 0.00 -4.31 0.00 0.00 34.13 27.11 1m4d s GLU 170 CO 0.49 -0.59 -0.07 -1.17 0.01 0.00 0.00 175.26 173.93 1m4d s LEU 171 N -2.68 1.27 -0.23 1.80 2.96 -0.97 -4.58 118.68 116.26 1m4d s LEU 171 Ca 0.60 -0.23 0.02 0.00 -0.22 0.00 0.00 54.13 54.30 1m4d s LEU 171 Cb -0.36 -0.68 0.05 0.00 0.50 0.00 0.00 46.19 45.70 1m4d s LEU 171 CO 0.46 -0.07 -0.09 -0.32 -1.32 0.00 0.00 176.35 175.01 1m4d s MET 172 N 1.24 2.01 0.65 1.98 -2.45 -0.58 -1.66 119.30 120.50 1m4d s MET 172 Ca -0.05 -1.08 -0.11 0.00 -1.25 0.00 0.00 55.69 53.20 1m4d s MET 172 Cb -0.14 -2.66 -0.02 0.00 1.25 0.00 0.00 34.83 33.26 1m4d s MET 172 CO -0.02 -0.53 1.05 0.00 1.05 0.00 0.00 175.02 176.57 1m4d s ASP 174 N -4.22 4.88 0.34 0.00 1.47 -1.08 -0.77 116.67 117.29 1m4d s ASP 174 Ca 0.56 0.80 -0.18 0.00 1.18 0.00 0.00 52.55 54.91 1m4d s ASP 174 Cb -0.11 -1.44 -0.10 0.00 -0.34 0.00 0.00 42.92 40.94 1m4d s ASP 174 CO 0.53 -1.64 0.82 0.86 0.68 0.00 0.00 175.17 176.42 1m4d s TRP 175 N -3.41 3.42 0.10 2.11 -0.11 -1.24 -4.71 118.94 115.09 1m4d s TRP 175 Ca 0.60 1.41 -0.26 0.00 1.22 0.00 0.00 56.10 59.08 1m4d s TRP 175 Cb -0.11 -2.68 0.08 0.00 -1.50 0.00 0.00 33.47 29.26 1m4d s TRP 175 CO 0.49 0.07 0.83 -0.98 -4.62 0.00 0.00 176.95 172.74 1m4d s ARG 176 N -2.82 1.12 0.89 5.86 1.70 -1.26 -5.11 118.95 119.33 1m4d s ARG 176 Ca 0.55 -0.51 -0.11 0.00 -0.47 0.00 0.00 55.73 55.19 1m4d s ARG 176 Cb -0.11 0.46 0.13 0.00 -0.57 0.00 0.00 34.95 34.85 1m4d s ARG 176 CO 0.17 -0.50 1.09 0.00 -1.08 0.00 0.00 175.30 174.98 1m4d s ALA 177 N -3.39 1.54 0.00 7.88 0.00 -1.26 -4.68 121.76 121.85 1m4d s ALA 177 Ca 0.07 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.12 1m4d s ALA 177 Cb -0.02 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.85 1m4d s ALA 177 CO -0.05 -2.39 0.00 0.41 0.00 0.00 0.00 175.76 173.73 1m4d n GLY 178 N -0.82 0.91 3.68 0.00 0.00 -1.26 -4.61 105.19 103.09 1m4d n GLY 178 Ca 0.08 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.93 1m4d n GLY 178 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1m4d s ASP 179 N -4.00 6.86 0.18 1.61 1.01 -1.26 -4.89 116.67 116.18 1m4d s ASP 179 Ca 0.00 2.00 0.08 0.00 0.71 0.00 0.00 52.55 55.34 1m4d s ASP 179 Cb 0.00 -2.55 0.01 0.00 1.01 0.00 0.00 42.92 41.39 1m4d s ASP 179 CO 0.00 -0.75 1.41 -0.37 0.21 0.00 0.00 175.17 175.67 1m4d h VAL 180 N 5.20 1.60 -0.03 -1.27 -1.51 -1.83 -3.48 116.25 114.93 1m4d h VAL 180 Ca -0.35 -2.91 0.00 0.00 -1.23 0.00 0.00 66.70 62.22 1m4d h VAL 180 Cb 1.16 2.57 0.00 0.00 -2.13 0.00 0.00 31.29 32.89 1m4d h VAL 180 CO 0.93 0.83 0.00 0.79 -1.23 0.00 0.00 177.57 178.89