#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t0t s THR 7 N 0.00 4.71 -0.04 5.09 -4.23 -1.26 -4.85 115.64 115.06 1t0t s THR 7 Ca 0.00 0.88 -0.03 0.00 -1.18 0.00 0.00 61.69 61.36 1t0t s THR 7 Cb 0.00 -3.63 -0.04 0.00 1.34 0.00 0.00 72.50 70.17 1t0t s THR 7 CO 0.00 -0.23 0.14 -0.76 -0.54 0.00 0.00 174.62 173.22 1t0t s LEU 8 N -3.11 4.21 -0.12 4.79 1.43 -0.13 -4.92 118.68 120.83 1t0t s LEU 8 Ca 0.53 0.32 -0.02 0.00 -1.03 0.00 0.00 54.13 53.93 1t0t s LEU 8 Cb -0.10 -2.34 -0.03 0.00 0.03 0.00 0.00 46.19 43.75 1t0t s LEU 8 CO 0.20 0.31 -0.03 -1.81 0.23 0.00 0.00 176.35 175.24 1t0t s ASP 9 N -1.59 4.88 0.00 2.29 1.01 -1.26 -0.84 116.67 121.17 1t0t s ASP 9 Ca 0.22 -0.04 0.00 0.00 0.71 0.00 0.00 52.55 53.44 1t0t s ASP 9 Cb -0.12 -1.59 0.00 0.00 1.01 0.00 0.00 42.92 42.21 1t0t s ASP 9 CO 0.13 0.25 0.00 0.61 0.21 0.00 0.00 175.17 176.37 1t0t n GLY 10 N 2.96 4.27 3.73 0.21 0.00 0.13 -5.01 105.19 111.49 1t0t n GLY 10 Ca -0.18 -1.71 -0.40 0.00 0.00 0.00 0.00 46.02 43.74 1t0t n GLY 10 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1t0t n TRP 11 N 0.00 2.34 -1.75 1.61 8.01 -0.73 -4.56 117.44 122.35 1t0t n TRP 11 Ca 0.00 0.46 -0.34 0.00 -1.31 0.00 0.00 57.50 56.31 1t0t n TRP 11 Cb 0.00 -2.39 0.05 0.00 -2.01 0.00 0.00 31.31 26.96 1t0t n TRP 11 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.69 177.39 1t0t s TYR 12 N -1.23 2.49 -0.02 -5.99 2.02 -0.01 -0.72 117.35 113.88 1t0t s TYR 12 Ca 0.65 1.56 0.00 0.00 -0.37 0.00 0.00 57.07 58.91 1t0t s TYR 12 Cb -0.46 -3.26 0.02 0.00 -0.40 0.00 0.00 41.96 37.86 1t0t s TYR 12 CO 0.55 -1.90 0.01 0.00 -1.57 0.00 0.00 175.55 172.63 1t0t s LEU 14 N 0.85 2.55 -0.28 0.00 2.96 -0.12 -0.85 118.68 123.79 1t0t s LEU 14 Ca -0.08 -0.40 -0.09 0.00 -0.22 0.00 0.00 54.13 53.35 1t0t s LEU 14 Cb -0.11 -1.56 -0.02 0.00 0.50 0.00 0.00 46.19 44.99 1t0t s LEU 14 CO -0.02 0.15 0.11 -1.00 -1.32 0.00 0.00 176.35 174.27 1t0t s HIS 15 N 0.45 3.14 -0.33 5.38 3.76 0.06 -0.91 115.29 126.83 1t0t s HIS 15 Ca -0.11 -0.41 -0.00 0.00 -0.15 0.00 0.00 55.06 54.38 1t0t s HIS 15 Cb -0.16 -2.30 0.07 0.00 1.11 0.00 0.00 32.58 31.31 1t0t s HIS 15 CO 0.05 -0.37 0.04 0.34 -0.85 0.00 0.00 174.74 173.95 1t0t s ASP 16 N 1.63 4.89 -0.15 1.40 -1.08 0.62 -1.06 116.67 122.92 1t0t s ASP 16 Ca 0.06 -1.63 -0.09 0.00 -0.52 0.00 0.00 52.55 50.37 1t0t s ASP 16 Cb -0.16 -1.70 -0.05 0.00 -1.46 0.00 0.00 42.92 39.56 1t0t s ASP 16 CO 0.05 -0.34 0.16 -0.36 0.52 0.00 0.00 175.17 175.21 1t0t s PHE 17 N 1.14 3.53 0.09 -5.34 0.08 -0.31 -0.87 117.98 116.30 1t0t s PHE 17 Ca 0.00 0.49 0.04 0.00 0.12 0.00 0.00 56.93 57.58 1t0t s PHE 17 Cb -0.20 -2.08 -0.04 0.00 -0.57 0.00 0.00 43.02 40.14 1t0t s PHE 17 CO -0.04 0.53 -0.10 1.03 -0.10 0.00 0.00 175.22 176.54 1t0t s ARG 18 N -0.39 0.83 -0.04 0.44 0.52 0.09 -2.51 118.95 117.88 1t0t s ARG 18 Ca 0.13 -1.14 0.01 0.00 -0.52 0.00 0.00 55.73 54.21 1t0t s ARG 18 Cb -0.12 -0.51 -0.03 0.00 0.52 0.00 0.00 34.95 34.80 1t0t s ARG 18 CO 0.02 0.08 -0.04 0.99 0.02 0.00 0.00 175.30 176.37 1t0t s THR 19 N -2.40 3.89 -0.23 0.02 2.01 -0.38 0.28 115.64 118.83 1t0t s THR 19 Ca 0.05 -0.52 -0.18 0.00 0.31 0.00 0.00 61.69 61.34 1t0t s THR 19 Cb -0.03 -2.64 -0.03 0.00 0.01 0.00 0.00 72.50 69.80 1t0t s THR 19 CO -0.00 0.52 0.52 -0.63 -0.69 0.00 0.00 174.62 174.34 1t0t s ILE 20 N -0.91 5.09 -1.34 1.82 1.01 -1.26 -0.35 121.20 125.26 1t0t s ILE 20 Ca 0.15 0.93 -0.14 0.00 0.00 0.00 0.00 60.65 61.58 1t0t s ILE 20 Cb -0.11 -3.84 0.09 0.00 0.01 0.00 0.00 42.46 38.61 1t0t s ILE 20 CO 0.04 0.14 1.91 -0.67 0.00 0.00 0.00 174.94 176.36 1t0t n ASP 21 N 5.10 4.61 -0.31 3.58 -0.08 -0.15 -4.82 116.55 124.48 1t0t n ASP 21 Ca -0.04 -2.94 0.03 0.00 -1.51 0.00 0.00 54.79 50.33 1t0t n ASP 21 Cb 0.50 -1.64 0.17 0.00 2.34 0.00 0.00 41.12 42.50 1t0t n ASP 21 CO 0.00 0.00 0.00 -0.50 0.12 0.00 0.00 177.20 176.82 1t0t h TRP 22 N 6.56 0.94 -0.73 -0.67 4.06 -1.94 -1.46 115.95 122.71 1t0t h TRP 22 Ca 0.47 0.03 -0.02 0.00 2.06 0.00 0.00 58.89 61.42 1t0t h TRP 22 Cb 0.74 -0.29 -0.03 0.00 -1.00 0.00 0.00 29.16 28.57 1t0t h TRP 22 CO 1.36 0.40 0.37 1.03 -3.56 0.00 0.00 178.44 178.04 1t0t h SER 23 N 0.87 0.94 -0.18 -3.49 0.87 -2.00 -0.60 113.55 109.96 1t0t h SER 23 Ca 0.41 -0.12 -0.08 0.00 -1.23 0.00 0.00 61.79 60.77 1t0t h SER 23 Cb 0.34 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 62.06 1t0t h SER 23 CO -0.23 0.79 -0.21 0.00 -0.53 0.00 0.00 176.83 176.65 1t0t h ALA 24 N 1.18 0.27 -0.95 6.23 0.00 -1.94 -2.96 119.26 121.09 1t0t h ALA 24 Ca 0.25 -0.36 0.18 0.00 0.00 0.00 0.00 54.91 54.98 1t0t h ALA 24 Cb 0.09 -0.05 -0.10 0.00 0.00 0.00 0.00 17.79 17.72 1t0t h ALA 24 CO -0.04 0.21 0.55 2.35 0.00 0.00 0.00 179.25 182.32 1t0t h TRP 25 N 0.11 0.97 0.00 0.00 2.91 -1.01 -2.21 115.95 116.71 1t0t h TRP 25 Ca 0.02 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.06 1t0t h TRP 25 Cb 0.76 -0.28 -0.00 0.00 -0.51 0.00 0.00 29.16 29.13 1t0t h TRP 25 CO 0.09 0.21 -0.07 0.87 -1.03 0.00 0.00 178.44 178.50 1t0t h LYS 26 N 0.71 0.00 0.00 2.65 1.57 -0.95 -2.24 116.57 118.32 1t0t h LYS 26 Ca 0.54 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.30 1t0t h LYS 26 Cb 0.83 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.13 1t0t h LYS 26 CO -0.38 0.07 -0.10 1.79 -0.57 0.00 0.00 179.45 180.26 1t0t h THR 27 N 0.00 0.18 -3.51 -0.16 1.35 -1.33 -3.46 112.91 105.98 1t0t h THR 27 Ca -0.00 -1.21 -0.52 0.00 -0.55 0.00 0.00 66.41 64.13 1t0t h THR 27 Cb 0.63 2.05 0.03 0.00 -1.73 0.00 0.00 68.15 69.13 1t0t h THR 27 CO 0.01 0.10 0.61 -0.22 -0.25 0.00 0.00 175.52 175.76 1t0t s LEU 28 N -6.27 4.44 0.45 3.87 2.96 -0.84 -4.96 118.68 118.33 1t0t s LEU 28 Ca 0.06 2.37 -0.25 0.00 -0.22 0.00 0.00 54.13 56.09 1t0t s LEU 28 Cb 0.06 -3.62 -0.08 0.00 0.50 0.00 0.00 46.19 43.05 1t0t s LEU 28 CO 0.68 -0.45 1.43 -2.84 -1.32 0.00 0.00 176.35 173.85 1t0t s PRO 29 N -0.47 3.66 0.29 0.98 0.02 -1.26 -4.70 135.00 133.52 1t0t s PRO 29 Ca 0.53 2.42 0.03 0.00 0.02 0.00 0.00 61.00 64.01 1t0t s PRO 29 Cb -0.35 -2.64 0.64 0.00 0.02 0.00 0.00 34.50 32.16 1t0t s PRO 29 CO 0.40 -0.84 1.81 -0.97 -0.33 0.00 0.00 177.00 177.07 1t0t h ASN 30 N 2.29 0.87 1.13 2.53 -0.73 -1.94 0.35 115.58 120.08 1t0t h ASN 30 Ca -0.51 0.07 -0.05 0.00 1.87 0.00 0.00 56.30 57.68 1t0t h ASN 30 Cb 1.27 -0.10 -0.01 0.00 0.27 0.00 0.00 38.32 39.75 1t0t h ASN 30 CO 0.61 0.40 -0.24 1.05 -0.37 0.00 0.00 177.43 178.88 1t0t h GLU 31 N 0.90 0.00 -0.02 6.67 4.11 -2.00 -1.90 114.58 122.33 1t0t h GLU 31 Ca 0.53 0.00 -0.23 0.00 0.07 0.00 0.00 59.36 59.73 1t0t h GLU 31 Cb 0.67 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.92 1t0t h GLU 31 CO -0.31 0.24 -0.92 0.93 0.07 0.00 0.00 179.01 179.02 1t0t h GLU 32 N 0.00 0.51 -0.69 1.06 5.08 -1.36 -2.11 114.58 117.07 1t0t h GLU 32 Ca -0.00 -0.51 0.01 0.00 -1.00 0.00 0.00 59.36 57.86 1t0t h GLU 32 Cb 0.87 0.14 -0.04 0.00 0.50 0.00 0.00 28.75 30.23 1t0t h GLU 32 CO 0.03 1.15 0.45 0.00 -1.00 0.00 0.00 179.01 179.64 1t0t h ARG 33 N 0.30 0.88 -0.50 2.33 3.08 -0.75 -1.58 114.38 118.14 1t0t h ARG 33 Ca -0.08 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 59.83 1t0t h ARG 33 Cb 1.55 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 31.39 1t0t h ARG 33 CO 0.17 0.58 -0.04 0.93 -1.07 0.00 0.00 179.97 180.54 1t0t h GLU 34 N 0.90 0.91 -0.60 0.04 5.08 -1.29 -0.35 114.58 119.27 1t0t h GLU 34 Ca 0.26 -0.31 -0.05 0.00 -1.00 0.00 0.00 59.36 58.26 1t0t h GLU 34 Cb -0.07 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.08 1t0t h GLU 34 CO -0.07 0.96 0.17 0.00 -1.00 0.00 0.00 179.01 179.07 1t0t h ALA 35 N 0.92 1.18 -0.48 3.43 0.00 -1.35 -0.42 119.26 122.53 1t0t h ALA 35 Ca 0.14 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 1t0t h ALA 35 Cb 0.58 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1t0t h ALA 35 CO 0.03 0.57 -0.10 0.00 0.00 0.00 0.00 179.25 179.76 1t0t h ALA 36 N 1.31 0.66 -0.04 0.00 0.00 -0.75 0.30 119.26 120.73 1t0t h ALA 36 Ca 0.20 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1t0t h ALA 36 Cb 0.28 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1t0t h ALA 36 CO -0.01 0.55 0.02 0.82 0.00 0.00 0.00 179.25 180.64 1t0t h ILE 37 N 0.77 1.09 -0.73 0.00 1.08 -0.78 -1.30 117.51 117.63 1t0t h ILE 37 Ca 0.12 -0.27 0.03 0.00 -0.39 0.00 0.00 64.86 64.35 1t0t h ILE 37 Cb 0.64 1.19 -0.04 0.00 -3.07 0.00 0.00 36.82 35.54 1t0t h ILE 37 CO 0.04 0.08 0.47 0.28 -0.69 0.00 0.00 178.15 178.33 1t0t h SER 38 N -0.03 0.78 -0.51 1.72 0.02 -0.82 -0.56 113.55 114.14 1t0t h SER 38 Ca 0.02 -0.01 0.06 0.00 -0.84 0.00 0.00 61.79 61.02 1t0t h SER 38 Cb 0.10 -0.17 -0.05 0.00 0.14 0.00 0.00 62.40 62.42 1t0t h SER 38 CO -0.00 0.54 0.23 -0.08 -1.14 0.00 0.00 176.83 176.38 1t0t h GLU 39 N 0.92 0.44 -0.40 3.45 4.81 -0.25 -0.31 114.58 123.23 1t0t h GLU 39 Ca 0.29 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.48 1t0t h GLU 39 Cb -0.01 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 1t0t h GLU 39 CO -0.10 0.29 0.22 0.35 -0.73 0.00 0.00 179.01 179.04 1t0t h PHE 40 N 0.45 0.56 -0.47 0.92 3.57 -0.95 -2.00 116.94 119.03 1t0t h PHE 40 Ca 0.24 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.68 1t0t h PHE 40 Cb 0.19 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 1t0t h PHE 40 CO -0.12 0.44 0.12 -0.07 -2.23 0.00 0.00 178.31 176.45 1t0t h LEU 41 N 0.52 0.64 -1.26 0.59 3.38 -0.85 -1.17 115.31 117.16 1t0t h LEU 41 Ca 0.14 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1t0t h LEU 41 Cb 0.07 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 1t0t h LEU 41 CO -0.02 0.63 0.30 0.00 0.09 0.00 0.00 178.44 179.44 1t0t h ALA 42 N 1.46 1.44 -0.08 1.53 0.00 -0.75 0.36 119.26 123.21 1t0t h ALA 42 Ca 0.15 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1t0t h ALA 42 Cb 0.24 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1t0t h ALA 42 CO -0.00 0.46 -0.00 1.25 0.00 0.00 0.00 179.25 180.95 1t0t h LEU 43 N 0.81 0.14 -1.80 0.00 5.85 -0.51 -2.89 115.31 116.92 1t0t h LEU 43 Ca 0.21 -0.32 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 1t0t h LEU 43 Cb 0.05 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.04 1t0t h LEU 43 CO -0.03 0.43 -0.11 0.58 -0.34 0.00 0.00 178.44 178.97 1t0t h VAL 44 N -0.15 1.06 -0.63 1.05 2.07 -0.87 -1.15 116.25 117.63 1t0t h VAL 44 Ca 0.02 -0.36 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 1t0t h VAL 44 Cb 0.36 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.30 1t0t h VAL 44 CO 0.00 0.10 0.39 -0.78 0.02 0.00 0.00 177.57 177.30 1t0t h ASP 45 N 0.00 0.74 -0.17 0.57 3.58 -0.73 0.76 116.42 121.17 1t0t h ASP 45 Ca -0.00 -0.03 -0.01 0.00 0.42 0.00 0.00 57.03 57.41 1t0t h ASP 45 Cb 0.19 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 1t0t h ASP 45 CO 0.01 0.56 0.08 1.56 -2.88 0.00 0.00 179.24 178.57 1t0t h GLN 46 N 0.86 0.25 -0.88 0.28 4.20 -1.09 -1.80 115.11 116.93 1t0t h GLN 46 Ca 0.23 -0.04 0.08 0.00 0.06 0.00 0.00 58.65 58.97 1t0t h GLN 46 Cb -0.05 -0.04 -0.06 0.00 0.30 0.00 0.00 27.48 27.63 1t0t h GLN 46 CO -0.04 0.30 0.57 -1.49 -0.67 0.00 0.00 178.83 177.50 1t0t h TRP 47 N 0.13 0.98 -0.34 2.96 6.55 -0.74 -1.48 115.95 124.01 1t0t h TRP 47 Ca 0.06 0.03 -0.09 0.00 0.95 0.00 0.00 58.89 59.84 1t0t h TRP 47 Cb 0.14 -0.32 -0.02 0.00 -0.86 0.00 0.00 29.16 28.11 1t0t h TRP 47 CO -0.02 0.49 -0.15 0.93 -1.05 0.00 0.00 178.44 178.64 1t0t h GLU 48 N 0.94 0.61 -0.24 0.49 5.08 -0.51 0.11 114.58 121.06 1t0t h GLU 48 Ca 0.39 -0.20 -0.05 0.00 -1.00 0.00 0.00 59.36 58.50 1t0t h GLU 48 Cb 0.28 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1t0t h GLU 48 CO -0.15 0.74 -0.03 1.15 -1.00 0.00 0.00 179.01 179.71 1t0t h THR 49 N 0.55 1.27 -0.47 1.13 2.02 -0.73 0.11 112.91 116.79 1t0t h THR 49 Ca 0.09 -1.00 0.09 0.00 0.77 0.00 0.00 66.41 66.36 1t0t h THR 49 Cb 0.58 1.44 -0.07 0.00 -1.74 0.00 0.00 68.15 68.36 1t0t h THR 49 CO 0.04 0.31 0.03 0.74 0.37 0.00 0.00 175.52 177.01 1t0t h THR 50 N 0.21 0.67 -0.56 3.16 2.02 -1.04 -1.09 112.91 116.27 1t0t h THR 50 Ca 0.06 -0.05 -0.07 0.00 0.77 0.00 0.00 66.41 67.12 1t0t h THR 50 Cb 0.48 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 1t0t h THR 50 CO 0.02 0.03 0.07 -0.08 0.37 0.00 0.00 175.52 175.92 1t0t h GLU 51 N 0.15 0.95 -0.57 6.66 4.81 -0.63 -1.50 114.58 124.44 1t0t h GLU 51 Ca 0.23 -0.27 0.06 0.00 -0.13 0.00 0.00 59.36 59.25 1t0t h GLU 51 Cb 0.34 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 1t0t h GLU 51 CO -0.36 0.92 0.38 0.66 -0.73 0.00 0.00 179.01 179.87 1t0t h SER 52 N 0.84 0.48 -0.10 1.04 4.64 -0.08 -1.19 113.55 119.18 1t0t h SER 52 Ca 0.17 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1t0t h SER 52 Cb 0.45 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1t0t h SER 52 CO 0.02 0.32 0.00 -0.62 -0.87 0.00 0.00 176.83 175.67 1t0t n GLU 53 N -4.47 1.32 -3.37 4.77 -0.58 -0.48 -4.92 120.64 112.91 1t0t n GLU 53 Ca 0.08 -0.48 -0.24 0.00 -0.42 0.00 0.00 57.16 56.09 1t0t n GLU 53 Cb 0.22 -1.25 0.02 0.00 -0.57 0.00 0.00 31.44 29.86 1t0t n GLU 53 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1t0t n LYS 54 N -0.23 -4.73 -0.52 3.49 4.76 -0.45 -4.89 118.16 115.59 1t0t n LYS 54 Ca 0.11 0.68 0.04 0.00 -2.87 0.00 0.00 58.31 56.28 1t0t n LYS 54 Cb 0.16 -5.52 0.22 0.00 -1.84 0.00 0.00 35.03 28.05 1t0t n LYS 54 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1t0t n GLN 55 N -4.14 2.18 -3.82 1.97 1.13 -0.59 -5.04 117.38 109.08 1t0t n GLN 55 Ca -0.04 -2.95 0.00 0.00 -1.94 0.00 0.00 57.00 52.08 1t0t n GLN 55 Cb 0.57 -1.77 0.00 0.00 0.11 0.00 0.00 30.24 29.15 1t0t n GLN 55 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1t0t n GLY 56 N -0.93 -2.63 3.58 1.08 0.00 -1.24 -4.38 105.19 100.67 1t0t n GLY 56 Ca 0.25 -1.35 -0.09 0.00 0.00 0.00 0.00 46.02 44.83 1t0t n GLY 56 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1t0t s SER 57 N -0.40 -0.20 0.14 1.61 0.15 -0.86 -3.93 113.70 110.22 1t0t s SER 57 Ca 0.00 -0.63 -0.18 0.00 0.70 0.00 0.00 55.95 55.83 1t0t s SER 57 Cb 0.00 0.59 0.04 0.00 -1.71 0.00 0.00 66.02 64.95 1t0t s SER 57 CO 0.00 -1.11 0.47 -1.38 1.20 0.00 0.00 173.24 172.42 1t0t s HIS 58 N -3.92 -0.30 -0.02 3.44 -3.43 -1.26 -0.69 115.29 109.12 1t0t s HIS 58 Ca 0.13 0.01 -0.02 0.00 -0.80 0.00 0.00 55.06 54.38 1t0t s HIS 58 Cb -0.01 0.36 0.00 0.00 -1.43 0.00 0.00 32.58 31.50 1t0t s HIS 58 CO 0.02 -0.76 0.06 0.00 -2.00 0.00 0.00 174.74 172.05 1t0t s ALA 59 N -3.79 -0.14 -0.14 -1.38 0.00 0.27 -4.78 121.76 111.81 1t0t s ALA 59 Ca 0.03 0.12 -0.00 0.00 0.00 0.00 0.00 51.96 52.11 1t0t s ALA 59 Cb 0.01 -0.08 0.03 0.00 0.00 0.00 0.00 23.12 23.08 1t0t s ALA 59 CO -0.11 -0.04 -0.08 0.08 0.00 0.00 0.00 175.76 175.60 1t0t s VAL 60 N -0.07 1.18 -0.01 0.00 1.01 -1.26 -1.24 120.40 120.01 1t0t s VAL 60 Ca -0.01 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 61.54 1t0t s VAL 60 Cb -0.01 -1.22 -0.01 0.00 0.00 0.00 0.00 36.38 35.14 1t0t s VAL 60 CO 0.00 0.32 -0.14 -0.31 0.00 0.00 0.00 175.10 174.97 1t0t s TYR 61 N 1.63 1.29 0.15 5.22 1.51 -0.76 -1.81 117.35 124.57 1t0t s TYR 61 Ca 0.04 -0.25 -0.24 0.00 -1.01 0.00 0.00 57.07 55.61 1t0t s TYR 61 Cb -0.13 -0.83 -0.08 0.00 -0.11 0.00 0.00 41.96 40.81 1t0t s TYR 61 CO -0.09 -0.02 0.73 0.95 -1.11 0.00 0.00 175.55 176.02 1t0t s THR 62 N -0.35 4.44 -0.13 -0.71 -4.23 0.85 -0.63 115.64 114.88 1t0t s THR 62 Ca 0.05 1.60 -0.02 0.00 -1.18 0.00 0.00 61.69 62.14 1t0t s THR 62 Cb -0.06 -4.09 -0.03 0.00 1.34 0.00 0.00 72.50 69.67 1t0t s THR 62 CO -0.00 0.53 -0.05 -0.63 -0.54 0.00 0.00 174.62 173.92 1t0t s ILE 63 N -1.15 3.83 0.16 2.99 -1.09 -0.61 -0.70 121.20 124.63 1t0t s ILE 63 Ca 0.34 -0.39 -0.24 0.00 -2.23 0.00 0.00 60.65 58.13 1t0t s ILE 63 Cb -0.22 -2.65 -0.08 0.00 -1.58 0.00 0.00 42.46 37.93 1t0t s ILE 63 CO 0.25 0.53 0.74 -0.69 -1.23 0.00 0.00 174.94 174.53 1t0t s VAL 64 N 0.03 4.45 0.00 2.92 1.01 -0.74 -4.32 120.40 123.74 1t0t s VAL 64 Ca -0.00 1.59 0.00 0.00 0.00 0.00 0.00 61.98 63.57 1t0t s VAL 64 Cb -0.13 -4.07 0.00 0.00 0.00 0.00 0.00 36.38 32.17 1t0t s VAL 64 CO 0.03 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.24 1t0t n GLY 65 N 1.54 -1.78 0.73 4.51 0.00 -1.26 -4.68 105.19 104.25 1t0t n GLY 65 Ca -0.06 -1.91 0.10 0.00 0.00 0.00 0.00 46.02 44.15 1t0t n GLY 65 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1t0t n GLN 66 N 0.00 1.78 0.17 1.61 6.02 -1.26 -4.19 117.38 121.51 1t0t n GLN 66 Ca 0.00 -1.52 0.01 0.00 -0.01 0.00 0.00 57.00 55.48 1t0t n GLN 66 Cb 0.00 -1.40 0.30 0.00 1.02 0.00 0.00 30.24 30.16 1t0t n GLN 66 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 1t0t h LYS 67 N 3.59 0.00 -2.23 -1.09 1.57 -1.95 -3.46 116.57 113.00 1t0t h LYS 67 Ca 0.00 0.00 0.19 0.00 -1.87 0.00 0.00 60.65 58.97 1t0t h LYS 67 Cb 0.82 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.04 1t0t h LYS 67 CO 0.00 0.46 0.53 0.00 -0.57 0.00 0.00 179.45 179.86 1t0t s ALA 68 N -3.98 -1.73 -0.07 3.86 0.00 -1.26 -4.68 121.76 113.90 1t0t s ALA 68 Ca -0.02 0.24 0.06 0.00 0.00 0.00 0.00 51.96 52.24 1t0t s ALA 68 Cb 0.14 0.59 -0.09 0.00 0.00 0.00 0.00 23.12 23.76 1t0t s ALA 68 CO 0.74 -1.03 0.03 -0.25 0.00 0.00 0.00 175.76 175.25 1t0t n ASP 69 N -0.46 3.26 -3.76 0.00 8.00 0.14 -4.45 116.55 119.27 1t0t n ASP 69 Ca -0.06 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.31 1t0t n ASP 69 Cb 0.61 0.68 -0.11 0.00 -0.02 0.00 0.00 41.12 42.28 1t0t n ASP 69 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1t0t s ILE 70 N -2.17 -0.00 -0.11 0.53 2.07 -0.75 -1.57 121.20 119.19 1t0t s ILE 70 Ca -0.03 0.01 0.03 0.00 -1.41 0.00 0.00 60.65 59.24 1t0t s ILE 70 Cb 0.02 -0.44 0.01 0.00 0.13 0.00 0.00 42.46 42.18 1t0t s ILE 70 CO 0.29 0.00 -0.20 -0.22 -1.91 0.00 0.00 174.94 172.90 1t0t s LEU 71 N 0.22 1.98 -0.33 8.50 2.96 0.20 -0.73 118.68 131.47 1t0t s LEU 71 Ca -0.00 -0.52 -0.09 0.00 -0.22 0.00 0.00 54.13 53.30 1t0t s LEU 71 Cb -0.03 -1.30 0.01 0.00 0.50 0.00 0.00 46.19 45.38 1t0t s LEU 71 CO -0.00 0.09 0.14 -0.36 -1.32 0.00 0.00 176.35 174.90 1t0t s PHE 72 N 0.66 3.20 -0.22 5.38 0.08 -0.05 -1.84 117.98 125.19 1t0t s PHE 72 Ca -0.12 -0.92 -0.06 0.00 0.12 0.00 0.00 56.93 55.95 1t0t s PHE 72 Cb -0.16 -2.34 -0.03 0.00 -0.57 0.00 0.00 43.02 39.92 1t0t s PHE 72 CO 0.03 -0.58 0.04 1.41 -0.10 0.00 0.00 175.22 176.02 1t0t s MET 73 N 1.53 3.70 -0.08 0.44 -2.45 -0.37 -0.28 119.30 121.79 1t0t s MET 73 Ca 0.02 -0.47 0.01 0.00 -1.25 0.00 0.00 55.69 54.00 1t0t s MET 73 Cb -0.18 -3.21 0.02 0.00 1.25 0.00 0.00 34.83 32.71 1t0t s MET 73 CO 0.05 -0.03 -0.10 0.42 1.05 0.00 0.00 175.02 176.42 1t0t s ILE 74 N 1.15 1.02 -0.13 10.11 -1.09 -0.09 -0.57 121.20 131.60 1t0t s ILE 74 Ca 0.04 -0.37 0.00 0.00 -2.23 0.00 0.00 60.65 58.09 1t0t s ILE 74 Cb -0.14 -0.99 -0.01 0.00 -1.58 0.00 0.00 42.46 39.74 1t0t s ILE 74 CO 0.03 0.34 -0.15 -0.76 -1.23 0.00 0.00 174.94 173.17 1t0t s LEU 75 N 1.08 2.59 0.07 2.97 1.43 0.14 -0.95 118.68 126.01 1t0t s LEU 75 Ca -0.07 -0.39 -0.06 0.00 -1.03 0.00 0.00 54.13 52.58 1t0t s LEU 75 Cb -0.14 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.48 1t0t s LEU 75 CO -0.01 0.14 0.13 -0.13 0.23 0.00 0.00 176.35 176.71 1t0t s ARG 76 N 0.48 0.76 0.48 1.70 1.81 -0.40 -2.02 118.95 121.77 1t0t s ARG 76 Ca -0.10 -1.01 0.28 0.00 -1.72 0.00 0.00 55.73 53.17 1t0t s ARG 76 Cb -0.16 0.30 0.97 0.00 -0.45 0.00 0.00 34.95 35.61 1t0t s ARG 76 CO 0.05 -0.22 1.84 -1.35 -0.68 0.00 0.00 175.30 174.94 1t0t h PRO 77 N 2.92 0.00 -5.12 3.54 0.11 -1.86 0.01 132.00 131.59 1t0t h PRO 77 Ca -0.34 0.00 -0.34 0.00 0.11 0.00 0.00 66.00 65.43 1t0t h PRO 77 Cb 1.18 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.14 1t0t h PRO 77 CO 0.58 0.09 -0.72 0.95 -0.21 0.00 0.00 178.00 178.70 1t0t s THR 78 N -3.53 1.21 0.25 -1.15 -4.23 -1.26 -4.66 115.64 102.26 1t0t s THR 78 Ca 0.02 -2.03 -0.01 0.00 -1.18 0.00 0.00 61.69 58.49 1t0t s THR 78 Cb 0.08 -1.82 0.06 0.00 1.34 0.00 0.00 72.50 72.16 1t0t s THR 78 CO 0.61 -0.71 1.68 0.25 -0.54 0.00 0.00 174.62 175.91 1t0t h LEU 79 N 2.84 0.65 -1.29 4.79 5.85 -1.97 -2.48 115.31 123.71 1t0t h LEU 79 Ca -0.37 -0.22 0.03 0.00 0.84 0.00 0.00 57.88 58.16 1t0t h LEU 79 Cb 1.19 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 42.00 1t0t h LEU 79 CO 0.62 0.86 0.50 0.44 -0.34 0.00 0.00 178.44 180.52 1t0t h ASP 80 N 0.57 0.80 -0.48 1.25 3.32 -1.99 -1.78 116.42 118.12 1t0t h ASP 80 Ca 0.08 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.04 1t0t h ASP 80 Cb 0.68 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.02 1t0t h ASP 80 CO 0.05 0.56 0.01 -0.33 -1.72 0.00 0.00 179.24 177.81 1t0t h GLU 81 N 0.93 0.90 -0.40 3.56 5.08 -1.86 -0.05 114.58 122.74 1t0t h GLU 81 Ca 0.30 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1t0t h GLU 81 Cb 0.04 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 1t0t h GLU 81 CO -0.08 0.88 0.25 -0.07 -1.00 0.00 0.00 179.01 178.99 1t0t h LEU 82 N 0.83 0.47 -0.92 1.33 3.38 -1.19 -1.17 115.31 118.05 1t0t h LEU 82 Ca 0.16 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1t0t h LEU 82 Cb 0.48 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.06 1t0t h LEU 82 CO 0.02 0.38 0.59 -0.74 0.09 0.00 0.00 178.44 178.78 1t0t h HIS 83 N 0.53 1.17 -0.58 1.13 2.76 -0.88 -1.15 115.15 118.13 1t0t h HIS 83 Ca 0.14 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.29 1t0t h HIS 83 Cb -0.02 -0.39 -0.02 0.00 1.55 0.00 0.00 27.41 28.53 1t0t h HIS 83 CO -0.04 0.75 0.20 0.93 -1.30 0.00 0.00 177.93 178.47 1t0t h GLU 84 N 1.25 0.89 -0.23 5.26 5.08 -0.75 -0.30 114.58 125.78 1t0t h GLU 84 Ca 0.33 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 1t0t h GLU 84 Cb -0.11 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 28.99 1t0t h GLU 84 CO -0.07 0.79 0.04 0.82 -1.00 0.00 0.00 179.01 179.59 1t0t h ILE 85 N 0.81 1.22 -0.88 3.13 1.08 -1.03 -0.55 117.51 121.30 1t0t h ILE 85 Ca 0.19 -0.72 0.02 0.00 -0.39 0.00 0.00 64.86 63.95 1t0t h ILE 85 Cb 0.26 1.27 -0.05 0.00 -3.07 0.00 0.00 36.82 35.23 1t0t h ILE 85 CO -0.01 0.23 0.58 -0.08 -0.69 0.00 0.00 178.15 178.18 1t0t h GLU 86 N 0.18 1.13 -0.19 2.37 4.81 -1.03 -1.23 114.58 120.62 1t0t h GLU 86 Ca 0.07 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 1t0t h GLU 86 Cb 0.30 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1t0t h GLU 86 CO 0.00 0.75 -0.08 1.15 -0.73 0.00 0.00 179.01 180.10 1t0t h THR 87 N 1.16 1.31 -0.76 0.32 2.02 -0.94 -0.72 112.91 115.30 1t0t h THR 87 Ca 0.33 -1.13 0.05 0.00 0.77 0.00 0.00 66.41 66.44 1t0t h THR 87 Cb -0.10 1.65 -0.06 0.00 -1.74 0.00 0.00 68.15 67.91 1t0t h THR 87 CO -0.08 0.34 0.46 0.00 0.37 0.00 0.00 175.52 176.60 1t0t h ALA 88 N 0.70 1.03 -0.34 6.16 0.00 -0.94 -0.54 119.26 125.33 1t0t h ALA 88 Ca 0.04 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1t0t h ALA 88 Cb 0.56 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1t0t h ALA 88 CO 0.03 0.19 0.14 1.25 0.00 0.00 0.00 179.25 180.85 1t0t h LEU 89 N 0.85 0.46 -1.71 0.00 5.85 -1.09 -2.34 115.31 117.34 1t0t h LEU 89 Ca 0.33 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.85 1t0t h LEU 89 Cb 0.14 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1t0t h LEU 89 CO -0.16 0.50 -0.18 0.78 -0.34 0.00 0.00 178.44 179.04 1t0t h ASN 90 N 0.40 0.00 0.42 1.25 2.35 -0.41 -1.32 115.58 118.28 1t0t h ASN 90 Ca 0.11 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 1t0t h ASN 90 Cb 0.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.55 1t0t h ASN 90 CO -0.01 0.18 -0.05 0.29 -1.65 0.00 0.00 177.43 176.19 1t0t n LYS 91 N -3.79 0.61 -2.08 0.81 5.02 -0.28 -4.68 118.16 113.77 1t0t n LYS 91 Ca -0.02 -0.11 -0.33 0.00 -2.02 0.00 0.00 58.31 55.83 1t0t n LYS 91 Cb 0.28 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.80 1t0t n LYS 91 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1t0t s THR 92 N -2.47 3.78 0.31 -0.18 -4.23 -0.50 -4.96 115.64 107.39 1t0t s THR 92 Ca 0.31 0.87 0.05 0.00 -1.18 0.00 0.00 61.69 61.73 1t0t s THR 92 Cb 0.20 -3.38 0.08 0.00 1.34 0.00 0.00 72.50 70.74 1t0t s THR 92 CO 0.46 -0.47 1.75 0.50 -0.54 0.00 0.00 174.62 176.32 1t0t h LYS 93 N 0.53 0.36 -0.51 3.99 1.63 -1.88 -3.03 116.57 117.66 1t0t h LYS 93 Ca -0.47 -0.13 -0.07 0.00 -0.85 0.00 0.00 60.65 59.13 1t0t h LYS 93 Cb 1.22 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.81 1t0t h LYS 93 CO 0.57 0.61 0.04 1.25 -3.45 0.00 0.00 179.45 178.47 1t0t h LEU 94 N 0.32 0.79 -2.56 5.20 5.85 -1.91 -1.69 115.31 121.31 1t0t h LEU 94 Ca 0.05 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.58 1t0t h LEU 94 Cb 0.65 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 1t0t h LEU 94 CO 0.05 0.83 -0.01 0.00 -0.34 0.00 0.00 178.44 178.97 1t0t h ALA 95 N 1.26 1.37 -0.09 1.25 0.00 -1.73 -0.43 119.26 120.88 1t0t h ALA 95 Ca 0.16 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.09 1t0t h ALA 95 Cb 0.42 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1t0t h ALA 95 CO 0.01 0.01 0.18 -0.44 0.00 0.00 0.00 179.25 179.02 1t0t h ASP 96 N 0.00 0.00 -0.10 0.00 3.32 -1.40 -1.87 116.42 116.36 1t0t h ASP 96 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1t0t h ASP 96 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 1t0t h ASP 96 CO 0.00 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.30 1t0t n TYR 97 N -3.40 0.12 -3.53 4.55 4.01 -0.18 -4.75 117.16 113.98 1t0t n TYR 97 Ca -0.00 -0.08 -0.41 0.00 -0.16 0.00 0.00 57.90 57.24 1t0t n TYR 97 Cb 0.28 -0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.25 1t0t n TYR 97 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1t0t s LEU 98 N -1.36 5.96 0.75 7.72 1.43 -0.70 -0.97 118.68 131.50 1t0t s LEU 98 Ca 0.23 -2.94 -0.12 0.00 -1.03 0.00 0.00 54.13 50.27 1t0t s LEU 98 Cb 0.15 -2.03 0.04 0.00 0.03 0.00 0.00 46.19 44.39 1t0t s LEU 98 CO 0.22 -0.42 1.13 -0.76 0.23 0.00 0.00 176.35 176.75 1t0t s LEU 99 N -0.20 2.74 0.38 1.79 1.43 0.53 -4.77 118.68 120.58 1t0t s LEU 99 Ca 0.19 0.99 -0.26 0.00 -1.03 0.00 0.00 54.13 54.02 1t0t s LEU 99 Cb -0.14 -3.67 -0.09 0.00 0.03 0.00 0.00 46.19 42.32 1t0t s LEU 99 CO -0.07 -1.57 1.21 -2.16 0.23 0.00 0.00 176.35 173.99 1t0t s PRO 100 N -5.45 4.15 0.04 1.29 0.05 -1.26 -1.25 135.00 132.58 1t0t s PRO 100 Ca 0.60 1.96 0.00 0.00 0.05 0.00 0.00 61.00 63.60 1t0t s PRO 100 Cb -0.11 -2.81 0.00 0.00 0.05 0.00 0.00 34.50 31.63 1t0t s PRO 100 CO 0.51 -0.27 0.00 0.00 0.05 0.00 0.00 177.00 177.28 1t0t n ALA 101 N 0.33 3.00 -3.54 8.56 0.00 -1.05 -4.55 120.51 123.26 1t0t n ALA 101 Ca 0.03 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.40 1t0t n ALA 101 Cb 0.45 0.13 -0.02 0.00 0.00 0.00 0.00 19.45 20.01 1t0t n ALA 101 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1t0t s TYR 102 N -2.00 -0.28 0.15 0.00 5.04 -1.18 -5.00 117.35 114.09 1t0t s TYR 102 Ca 0.00 0.16 -0.14 0.00 -2.44 0.00 0.00 57.07 54.65 1t0t s TYR 102 Cb 0.00 0.54 0.02 0.00 0.35 0.00 0.00 41.96 42.86 1t0t s TYR 102 CO 0.00 -0.46 0.39 -1.54 -1.34 0.00 0.00 175.55 172.60 1t0t s SER 103 N -2.42 -0.13 -0.17 4.32 1.04 -1.26 -1.16 113.70 113.91 1t0t s SER 103 Ca 0.07 -0.54 -0.11 0.00 0.48 0.00 0.00 55.95 55.85 1t0t s SER 103 Cb -0.01 0.48 0.06 0.00 0.10 0.00 0.00 66.02 66.65 1t0t s SER 103 CO -0.07 -0.91 0.43 -0.47 0.98 0.00 0.00 173.24 173.20 1t0t s TYR 104 N -3.87 -0.59 -0.12 5.02 5.04 -0.23 -4.97 117.35 117.63 1t0t s TYR 104 Ca 0.08 1.30 0.03 0.00 -2.44 0.00 0.00 57.07 56.04 1t0t s TYR 104 Cb 0.02 0.26 0.00 0.00 0.35 0.00 0.00 41.96 42.58 1t0t s TYR 104 CO -0.06 -0.32 -0.21 0.08 -1.34 0.00 0.00 175.55 173.70 1t0t s VAL 105 N 1.09 2.27 0.34 3.14 1.01 -1.26 -0.76 120.40 126.22 1t0t s VAL 105 Ca -0.07 -0.93 -0.17 0.00 0.00 0.00 0.00 61.98 60.81 1t0t s VAL 105 Cb -0.07 -1.90 0.06 0.00 0.00 0.00 0.00 36.38 34.47 1t0t s VAL 105 CO -0.09 0.55 0.86 -0.94 0.00 0.00 0.00 175.10 175.47 1t0t s SER 106 N 0.53 0.01 -0.04 3.32 1.04 -0.03 -4.17 113.70 114.36 1t0t s SER 106 Ca -0.13 -1.04 0.02 0.00 0.48 0.00 0.00 55.95 55.28 1t0t s SER 106 Cb -0.17 0.76 0.01 0.00 0.10 0.00 0.00 66.02 66.73 1t0t s SER 106 CO 0.05 -1.52 -0.07 -0.69 0.98 0.00 0.00 173.24 171.98 1t0t s VAL 107 N -2.24 0.70 0.10 5.02 1.01 0.00 -0.20 120.40 124.79 1t0t s VAL 107 Ca 0.17 -0.27 -0.35 0.00 0.00 0.00 0.00 61.98 61.54 1t0t s VAL 107 Cb -0.04 -0.66 -0.14 0.00 0.00 0.00 0.00 36.38 35.53 1t0t s VAL 107 CO 0.10 0.24 1.57 0.52 0.00 0.00 0.00 175.10 177.53 1t0t n VAL 108 N 3.64 0.08 -4.47 2.92 0.31 0.10 -0.20 118.33 120.71 1t0t n VAL 108 Ca -0.22 -0.01 -0.21 0.00 -0.01 0.00 0.00 64.34 63.88 1t0t n VAL 108 Cb 0.53 -1.40 -0.16 0.00 -0.91 0.00 0.00 33.84 31.90 1t0t n VAL 108 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1t0t s GLU 109 N 1.29 1.13 -0.08 5.55 2.12 -1.09 0.18 118.70 127.81 1t0t s GLU 109 Ca 0.82 -0.36 0.04 0.00 0.36 0.00 0.00 54.97 55.84 1t0t s GLU 109 Cb -0.76 -1.03 -0.01 0.00 0.26 0.00 0.00 34.13 32.59 1t0t s GLU 109 CO 0.43 0.13 -0.21 -0.51 -0.54 0.00 0.00 175.26 174.56 1t0t s LEU 110 N 0.19 2.32 -0.14 2.70 1.02 -0.02 -4.79 118.68 119.97 1t0t s LEU 110 Ca -0.04 -0.42 0.05 0.00 0.02 0.00 0.00 54.13 53.74 1t0t s LEU 110 Cb -0.09 -1.46 -0.12 0.00 0.02 0.00 0.00 46.19 44.54 1t0t s LEU 110 CO 0.01 0.24 -0.06 -1.20 0.02 0.00 0.00 176.35 175.35 1t0t n SER 111 N 3.01 2.52 -4.44 2.29 7.64 -1.26 -0.96 113.62 122.43 1t0t n SER 111 Ca -0.18 -0.05 -0.44 0.00 1.01 0.00 0.00 58.87 59.22 1t0t n SER 111 Cb 0.52 0.19 -0.08 0.00 -1.01 0.00 0.00 64.21 63.83 1t0t n SER 111 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1t0t s ASN 112 N -5.05 6.19 0.09 6.43 2.47 -1.26 -4.91 114.94 118.91 1t0t s ASN 112 Ca -0.14 -0.97 -0.25 0.00 0.42 0.00 0.00 52.86 51.92 1t0t s ASN 112 Cb 0.05 -2.23 0.07 0.00 -1.45 0.00 0.00 41.25 37.68 1t0t s ASN 112 CO 0.40 -0.71 0.60 -0.72 -3.72 0.00 0.00 177.10 172.96 1t0t s TYR 113 N 2.14 -0.54 -0.44 0.43 -0.85 -1.26 -5.11 117.35 111.71 1t0t s TYR 113 Ca 0.10 0.53 -0.29 0.00 -0.52 0.00 0.00 57.07 56.89 1t0t s TYR 113 Cb -0.20 0.49 0.02 0.00 0.38 0.00 0.00 41.96 42.65 1t0t s TYR 113 CO 0.11 -0.76 1.22 -1.17 -1.52 0.00 0.00 175.55 173.42 1t0t s LEU 114 N -2.28 3.65 -0.41 -3.49 0.20 -1.26 -4.99 118.68 110.10 1t0t s LEU 114 Ca -0.03 0.63 -0.16 0.00 0.69 0.00 0.00 54.13 55.26 1t0t s LEU 114 Cb -0.01 -3.55 0.02 0.00 -0.43 0.00 0.00 46.19 42.23 1t0t s LEU 114 CO -0.06 -1.28 0.36 0.00 -0.29 0.00 0.00 176.35 175.08 1t0t s ALA 115 N 4.68 3.46 -0.14 5.97 0.00 -1.26 -4.91 121.76 129.55 1t0t s ALA 115 Ca 0.52 -1.59 0.17 0.00 0.00 0.00 0.00 51.96 51.06 1t0t s ALA 115 Cb -0.10 -2.95 -0.24 0.00 0.00 0.00 0.00 23.12 19.83 1t0t s ALA 115 CO 0.31 -1.48 0.33 -1.13 0.00 0.00 0.00 175.76 173.79 1t0t n SER 116 N 5.36 0.27 0.00 0.00 3.41 -1.26 -4.97 113.62 116.43 1t0t n SER 116 Ca -0.09 0.12 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 1t0t n SER 116 Cb 0.47 0.83 0.00 0.00 -0.26 0.00 0.00 64.21 65.25 1t0t n SER 116 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1t0t n GLY 117 N 1.60 3.03 0.04 5.00 0.00 -1.26 -4.85 105.19 108.75 1t0t n GLY 117 Ca -0.23 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.92 1t0t n GLY 117 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1t0t n SER 118 N 0.19 0.43 -4.22 1.61 3.41 -1.26 -4.88 113.62 108.90 1t0t n SER 118 Ca 0.00 -0.18 -0.13 0.00 -0.26 0.00 0.00 58.87 58.31 1t0t n SER 118 Cb 0.00 0.03 -0.10 0.00 -0.26 0.00 0.00 64.21 63.88 1t0t n SER 118 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1t0t s GLU 119 N -2.89 1.03 -0.42 4.33 2.02 -1.26 -5.10 118.70 116.40 1t0t s GLU 119 Ca 0.15 -1.47 -0.21 0.00 0.02 0.00 0.00 54.97 53.46 1t0t s GLU 119 Cb 0.18 -0.26 0.02 0.00 0.10 0.00 0.00 34.13 34.17 1t0t s GLU 119 CO 0.62 -0.09 0.64 0.34 0.02 0.00 0.00 175.26 176.79 1t0t s ASP 120 N -3.14 6.35 0.34 -0.19 -1.08 -1.26 -4.92 116.67 112.77 1t0t s ASP 120 Ca 0.20 -0.23 0.26 0.00 -0.52 0.00 0.00 52.55 52.27 1t0t s ASP 120 Cb 0.06 -2.32 1.12 0.00 -1.46 0.00 0.00 42.92 40.32 1t0t s ASP 120 CO 0.01 -0.74 1.79 1.55 0.52 0.00 0.00 175.17 178.30 1t0t h PRO 121 N 8.79 0.00 0.00 4.34 0.13 -1.98 0.32 132.00 143.59 1t0t h PRO 121 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1t0t h PRO 121 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1t0t h PRO 121 CO 0.88 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.31 1t0t n TYR 122 N -2.46 0.00 0.13 1.56 4.01 -1.26 -2.57 117.16 116.56 1t0t n TYR 122 Ca 0.01 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.78 1t0t n TYR 122 Cb 0.23 -0.20 0.03 0.00 -0.31 0.00 0.00 39.34 39.09 1t0t n TYR 122 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1t0t n GLN 123 N -1.20 0.43 -3.16 -0.72 1.13 0.10 -4.78 117.38 109.17 1t0t n GLN 123 Ca 0.10 -1.00 -0.39 0.00 -1.94 0.00 0.00 57.00 53.76 1t0t n GLN 123 Cb 0.11 -1.09 -0.06 0.00 0.11 0.00 0.00 30.24 29.31 1t0t n GLN 123 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1t0t s ILE 124 N -0.53 5.08 0.27 5.09 1.01 -1.06 -4.97 121.20 126.09 1t0t s ILE 124 Ca 0.06 1.18 -0.01 0.00 0.00 0.00 0.00 60.65 61.89 1t0t s ILE 124 Cb 0.04 -3.93 0.27 0.00 0.01 0.00 0.00 42.46 38.85 1t0t s ILE 124 CO 0.06 0.22 1.86 -0.65 0.00 0.00 0.00 174.94 176.42 1t0t h PRO 125 N 7.05 1.04 0.00 2.79 0.11 -1.94 0.15 132.00 141.20 1t0t h PRO 125 Ca -0.37 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 65.62 1t0t h PRO 125 Cb 1.17 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 1t0t h PRO 125 CO 0.76 0.69 -0.29 0.93 -0.21 0.00 0.00 178.00 179.88 1t0t h GLU 126 N 1.07 0.00 0.06 1.05 3.07 -1.94 -1.66 114.58 116.22 1t0t h GLU 126 Ca 0.46 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 59.11 1t0t h GLU 126 Cb 0.33 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.23 1t0t h GLU 126 CO -0.22 0.29 -1.13 0.28 -1.40 0.00 0.00 179.01 176.83 1t0t h VAL 127 N 0.00 1.12 -1.02 3.13 2.07 -1.54 -3.39 116.25 116.63 1t0t h VAL 127 Ca -0.00 -2.32 0.25 0.00 0.82 0.00 0.00 66.70 65.45 1t0t h VAL 127 Cb 0.80 2.67 -0.12 0.00 -1.52 0.00 0.00 31.29 33.12 1t0t h VAL 127 CO 0.04 0.56 0.62 0.03 0.02 0.00 0.00 177.57 178.84 1t0t h ARG 128 N -0.65 0.53 0.00 1.57 3.08 -0.62 -0.34 114.38 117.95 1t0t h ARG 128 Ca -0.27 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.75 1t0t h ARG 128 Cb 1.48 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.41 1t0t h ARG 128 CO -0.04 0.35 0.00 0.07 -1.07 0.00 0.00 179.97 179.28 1t0t h ARG 129 N 0.54 0.00 0.10 0.04 0.11 -1.48 -1.73 114.38 111.95 1t0t h ARG 129 Ca 0.63 0.00 -0.36 0.00 0.10 0.00 0.00 59.98 60.35 1t0t h ARG 129 Cb 1.29 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.34 1t0t h ARG 129 CO -0.42 0.00 -2.01 0.54 0.10 0.00 0.00 179.97 178.18 1t0t n ARG 130 N -2.42 0.74 0.12 0.08 1.74 -0.29 -3.77 116.66 112.86 1t0t n ARG 130 Ca 0.03 0.25 0.06 0.00 -0.77 0.00 0.00 57.85 57.42 1t0t n ARG 130 Cb 0.30 -1.70 0.52 0.00 -1.02 0.00 0.00 32.46 30.56 1t0t n ARG 130 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1t0t h LEU 131 N 0.06 0.24 -5.89 0.55 3.38 -0.97 -3.37 115.31 109.31 1t0t h LEU 131 Ca -0.42 -0.01 -0.54 0.00 0.09 0.00 0.00 57.88 57.00 1t0t h LEU 131 Cb 2.03 -0.06 -0.40 0.00 0.09 0.00 0.00 40.66 42.31 1t0t h LEU 131 CO 0.07 0.20 -0.99 -1.22 0.09 0.00 0.00 178.44 176.58 1t0t n TYR 132 N -4.49 1.19 -2.90 1.13 4.01 -0.67 -1.78 117.16 113.66 1t0t n TYR 132 Ca 0.00 -3.82 -0.40 0.00 -0.16 0.00 0.00 57.90 53.52 1t0t n TYR 132 Cb 0.09 -0.43 -0.06 0.00 -0.31 0.00 0.00 39.34 38.63 1t0t n TYR 132 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1t0t s PRO 133 N -2.29 4.67 -0.26 -0.72 0.04 -1.25 -4.76 135.00 130.43 1t0t s PRO 133 Ca 0.40 1.27 -0.29 0.00 0.04 0.00 0.00 61.00 62.43 1t0t s PRO 133 Cb 0.26 -3.27 0.01 0.00 0.04 0.00 0.00 34.50 31.54 1t0t s PRO 133 CO -0.09 0.54 1.03 0.42 0.04 0.00 0.00 177.00 178.94 1t0t s ILE 134 N -1.10 4.64 0.38 0.56 -1.09 -1.26 -4.65 121.20 118.68 1t0t s ILE 134 Ca 0.38 1.88 -0.27 0.00 -2.23 0.00 0.00 60.65 60.41 1t0t s ILE 134 Cb -0.24 -4.33 -0.09 0.00 -1.58 0.00 0.00 42.46 36.22 1t0t s ILE 134 CO 0.28 -0.27 1.25 -0.76 -1.23 0.00 0.00 174.94 174.20 1t0t s LEU 135 N 3.32 4.28 0.45 2.97 1.43 -1.26 -4.97 118.68 124.89 1t0t s LEU 135 Ca 0.43 2.53 -0.23 0.00 -1.03 0.00 0.00 54.13 55.84 1t0t s LEU 135 Cb -0.14 -3.87 -0.08 0.00 0.03 0.00 0.00 46.19 42.13 1t0t s LEU 135 CO 0.09 -0.68 1.09 -2.84 0.23 0.00 0.00 176.35 174.25 1t0t s PRO 136 N -2.11 3.90 -0.93 1.29 0.02 -1.26 -4.94 135.00 130.98 1t0t s PRO 136 Ca 0.54 1.58 -0.00 0.00 0.02 0.00 0.00 61.00 63.14 1t0t s PRO 136 Cb -0.36 -2.37 0.33 0.00 0.02 0.00 0.00 34.50 32.12 1t0t s PRO 136 CO 0.46 -0.38 1.71 1.63 -0.33 0.00 0.00 177.00 180.09 1t0t n LYS 137 N -0.47 4.75 -1.61 5.54 5.02 -1.26 -5.02 118.16 125.11 1t0t n LYS 137 Ca 0.07 -4.55 -0.30 0.00 -2.02 0.00 0.00 58.31 51.51 1t0t n LYS 137 Cb 0.50 -2.41 0.06 0.00 -0.02 0.00 0.00 35.03 33.16 1t0t n LYS 137 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1t0t s THR 138 N -4.48 3.64 0.37 -0.18 -4.23 -1.26 -4.96 115.64 104.54 1t0t s THR 138 Ca 0.42 0.53 0.07 0.00 -1.18 0.00 0.00 61.69 61.53 1t0t s THR 138 Cb 0.24 -3.31 0.18 0.00 1.34 0.00 0.00 72.50 70.95 1t0t s THR 138 CO -0.17 -0.70 1.93 0.78 -0.54 0.00 0.00 174.62 175.93 1t0t h ASN 139 N -0.84 0.39 -3.64 3.99 2.35 -1.84 -3.40 115.58 112.58 1t0t h ASN 139 Ca -0.45 -0.06 -0.41 0.00 -0.55 0.00 0.00 56.30 54.83 1t0t h ASN 139 Cb 1.24 -0.10 -0.15 0.00 0.05 0.00 0.00 38.32 39.35 1t0t h ASN 139 CO 0.59 0.44 -0.74 -0.31 -1.65 0.00 0.00 177.43 175.77 1t0t s TYR 140 N -5.01 1.51 0.03 1.19 2.02 -0.41 -1.13 117.35 115.55 1t0t s TYR 140 Ca -0.07 -0.62 0.00 0.00 -0.37 0.00 0.00 57.07 56.01 1t0t s TYR 140 Cb 0.16 -0.74 -0.03 0.00 -0.40 0.00 0.00 41.96 40.95 1t0t s TYR 140 CO 0.74 0.22 -0.04 -1.50 -1.57 0.00 0.00 175.55 173.41 1t0t s ILE 141 N -2.85 0.22 -0.02 2.71 2.07 -0.72 -2.56 121.20 120.05 1t0t s ILE 141 Ca 0.17 -1.17 0.01 0.00 -1.41 0.00 0.00 60.65 58.25 1t0t s ILE 141 Cb -0.01 -0.63 0.02 0.00 0.13 0.00 0.00 42.46 41.97 1t0t s ILE 141 CO 0.04 -0.61 -0.01 0.00 -1.91 0.00 0.00 174.94 172.46 1t0t s PHE 143 N 0.78 1.69 -0.14 0.00 5.36 -0.17 0.05 117.98 125.55 1t0t s PHE 143 Ca -0.08 -0.33 -0.20 0.00 -0.96 0.00 0.00 56.93 55.36 1t0t s PHE 143 Cb -0.11 -1.07 0.05 0.00 -0.34 0.00 0.00 43.02 41.55 1t0t s PHE 143 CO -0.01 -0.01 0.52 1.52 -1.46 0.00 0.00 175.22 175.78 1t0t s TYR 144 N -0.51 -0.53 0.42 10.12 -0.85 -0.55 -1.60 117.35 123.85 1t0t s TYR 144 Ca 0.07 1.18 -0.03 0.00 -0.52 0.00 0.00 57.07 57.77 1t0t s TYR 144 Cb -0.07 0.22 -0.04 0.00 0.38 0.00 0.00 41.96 42.45 1t0t s TYR 144 CO -0.00 -0.36 0.69 -1.25 -1.52 0.00 0.00 175.55 173.11 1t0t s PRO 145 N -0.26 3.53 0.02 -3.49 0.04 -1.26 -0.48 135.00 133.11 1t0t s PRO 145 Ca -0.04 0.01 -0.05 0.00 0.04 0.00 0.00 61.00 60.95 1t0t s PRO 145 Cb -0.03 -2.49 -0.01 0.00 0.04 0.00 0.00 34.50 32.01 1t0t s PRO 145 CO 0.03 -0.05 0.09 -1.64 0.04 0.00 0.00 177.00 175.47 1t0t s MET 146 N -4.51 0.51 0.27 4.56 -1.94 0.25 -0.78 119.30 117.66 1t0t s MET 146 Ca 0.45 -0.59 0.12 0.00 -1.71 0.00 0.00 55.69 53.95 1t0t s MET 146 Cb -0.10 0.20 -0.05 0.00 2.01 0.00 0.00 34.83 36.89 1t0t s MET 146 CO 0.41 -0.12 -0.20 -0.51 -0.01 0.00 0.00 175.02 174.59 1t0t s ASP 147 N -1.74 3.60 -0.19 3.03 1.01 0.16 -1.37 116.67 121.17 1t0t s ASP 147 Ca -0.10 -1.00 -0.17 0.00 0.71 0.00 0.00 52.55 51.98 1t0t s ASP 147 Cb -0.05 -0.31 -0.04 0.00 1.01 0.00 0.00 42.92 43.53 1t0t s ASP 147 CO -0.02 0.05 0.44 -0.54 0.21 0.00 0.00 175.17 175.31 1t0t s LYS 148 N -3.44 4.20 0.48 8.23 -0.14 -1.26 -1.35 119.74 126.47 1t0t s LYS 148 Ca 0.29 0.29 -0.23 0.00 -1.36 0.00 0.00 55.97 54.96 1t0t s LYS 148 Cb -0.05 -3.53 -0.08 0.00 -1.68 0.00 0.00 37.83 32.49 1t0t s LYS 148 CO 0.15 -0.03 1.25 -2.13 -0.76 0.00 0.00 175.35 173.82 1t0t n ARG 149 N 4.43 1.71 -3.23 1.68 0.63 0.61 -4.81 116.66 117.68 1t0t n ARG 149 Ca -0.07 0.62 -0.24 0.00 -0.92 0.00 0.00 57.85 57.24 1t0t n ARG 149 Cb 0.51 -2.41 -0.06 0.00 0.45 0.00 0.00 32.46 30.95 1t0t n ARG 149 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1t0t n ARG 150 N -0.41 1.30 -4.12 -0.14 1.74 -1.24 -0.65 116.66 113.13 1t0t n ARG 150 Ca 0.09 -3.66 -0.20 0.00 -0.77 0.00 0.00 57.85 53.31 1t0t n ARG 150 Cb 0.42 -1.57 -0.16 0.00 -1.02 0.00 0.00 32.46 30.12 1t0t n ARG 150 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1t0t s GLN 151 N -1.78 0.76 5.85 5.56 -0.21 -0.75 -4.91 119.66 124.17 1t0t s GLN 151 Ca 0.38 -0.08 0.00 0.00 0.02 0.00 0.00 55.36 55.68 1t0t s GLN 151 Cb 0.20 -0.80 0.00 0.00 1.00 0.00 0.00 33.01 33.41 1t0t s GLN 151 CO -0.09 -0.10 0.00 0.41 -2.12 0.00 0.00 175.29 173.40 1t0t n GLY 152 N 4.10 3.25 0.27 3.09 0.00 -1.26 -0.43 105.19 114.21 1t0t n GLY 152 Ca -0.24 -0.11 0.15 0.00 0.00 0.00 0.00 46.02 45.81 1t0t n GLY 152 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1t0t n ASN 153 N 3.51 0.87 -3.73 1.61 3.02 -1.26 -4.07 115.26 115.20 1t0t n ASN 153 Ca 0.00 -1.19 -0.38 0.00 -0.03 0.00 0.00 54.58 52.98 1t0t n ASN 153 Cb 0.00 -0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.16 1t0t n ASN 153 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1t0t n ASP 154 N -0.39 5.98 -4.06 6.41 8.00 0.42 -4.97 116.55 127.95 1t0t n ASP 154 Ca 0.20 -3.50 -0.33 0.00 0.71 0.00 0.00 54.79 51.87 1t0t n ASP 154 Cb 0.27 -1.08 -0.14 0.00 -0.02 0.00 0.00 41.12 40.15 1t0t n ASP 154 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1t0t s ASN 155 N -1.98 4.82 0.28 -2.24 3.84 -1.26 -1.82 114.94 116.59 1t0t s ASN 155 Ca 0.36 -1.90 0.02 0.00 0.21 0.00 0.00 52.86 51.54 1t0t s ASN 155 Cb 0.12 -1.66 0.62 0.00 -0.55 0.00 0.00 41.25 39.77 1t0t s ASN 155 CO 0.02 -0.36 1.77 -0.25 -2.79 0.00 0.00 177.10 175.48 1t0t h TRP 156 N 7.76 0.92 -0.01 0.43 2.91 -1.20 -2.59 115.95 124.18 1t0t h TRP 156 Ca -0.10 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.95 1t0t h TRP 156 Cb 1.03 -0.27 0.00 0.00 -0.51 0.00 0.00 29.16 29.42 1t0t h TRP 156 CO 0.53 0.22 -0.15 0.66 -1.03 0.00 0.00 178.44 178.67 1t0t n TYR 157 N -4.81 0.00 0.77 2.65 4.01 -1.26 -2.51 117.16 116.01 1t0t n TYR 157 Ca 0.20 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 58.03 1t0t n TYR 157 Cb 0.48 -0.16 0.06 0.00 -0.31 0.00 0.00 39.34 39.41 1t0t n TYR 157 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 1t0t n MET 158 N -0.82 1.57 -1.58 -0.72 2.81 -0.98 -4.94 117.12 112.46 1t0t n MET 158 Ca 0.14 -1.41 -0.30 0.00 -1.81 0.00 0.00 57.70 54.32 1t0t n MET 158 Cb 0.30 -1.34 0.08 0.00 -0.71 0.00 0.00 33.22 31.54 1t0t n MET 158 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1t0t s LEU 159 N -1.68 2.78 0.58 4.03 1.43 -1.04 -5.04 118.68 119.73 1t0t s LEU 159 Ca 0.20 1.40 -0.18 0.00 -1.03 0.00 0.00 54.13 54.51 1t0t s LEU 159 Cb 0.15 -4.10 -0.04 0.00 0.03 0.00 0.00 46.19 42.22 1t0t s LEU 159 CO 0.28 -1.77 1.11 -0.94 0.23 0.00 0.00 176.35 175.27 1t0t s SER 160 N -3.90 5.59 0.30 2.29 1.04 -1.26 -4.88 113.70 112.89 1t0t s SER 160 Ca 0.60 2.08 0.05 0.00 0.48 0.00 0.00 55.95 59.16 1t0t s SER 160 Cb -0.14 -2.57 0.83 0.00 0.10 0.00 0.00 66.02 64.24 1t0t s SER 160 CO 0.54 -1.30 1.48 0.80 0.98 0.00 0.00 173.24 175.75 1t0t n MET 161 N -1.65 -0.07 0.06 4.02 1.56 -1.26 -0.95 117.12 118.83 1t0t n MET 161 Ca 0.11 1.39 -0.08 0.00 -0.27 0.00 0.00 57.70 58.85 1t0t n MET 161 Cb 0.51 -2.27 0.06 0.00 2.15 0.00 0.00 33.22 33.68 1t0t n MET 161 CO 0.00 0.00 0.00 0.93 -0.73 0.00 0.00 175.97 176.17 1t0t h GLU 162 N 0.00 0.34 -0.27 2.12 3.07 -1.99 -1.24 114.58 116.61 1t0t h GLU 162 Ca 0.62 -0.26 -0.16 0.00 -0.50 0.00 0.00 59.36 59.05 1t0t h GLU 162 Cb 1.37 0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.33 1t0t h GLU 162 CO -0.86 0.89 -0.47 1.96 -1.40 0.00 0.00 179.01 179.13 1t0t h GLN 163 N 0.24 0.79 -0.71 2.33 4.20 -1.75 -1.70 115.11 118.51 1t0t h GLN 163 Ca -0.02 -0.49 0.00 0.00 0.06 0.00 0.00 58.65 58.20 1t0t h GLN 163 Cb 1.22 0.06 -0.03 0.00 0.30 0.00 0.00 27.48 29.02 1t0t h GLN 163 CO 0.11 1.12 0.45 0.00 -0.67 0.00 0.00 178.83 179.85 1t0t h ARG 164 N 0.55 0.95 -0.63 1.46 3.08 -1.00 -1.39 114.38 117.40 1t0t h ARG 164 Ca 0.02 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 59.95 1t0t h ARG 164 Cb 1.08 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.89 1t0t h ARG 164 CO 0.11 0.65 0.23 -0.09 -1.07 0.00 0.00 179.97 179.80 1t0t h ARG 165 N 0.97 0.97 -0.38 0.04 2.43 -1.06 -1.69 114.38 115.65 1t0t h ARG 165 Ca 0.26 -0.19 -0.04 0.00 -0.81 0.00 0.00 59.98 59.19 1t0t h ARG 165 Cb -0.07 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.31 1t0t h ARG 165 CO -0.05 0.83 0.07 0.93 -1.51 0.00 0.00 179.97 180.24 1t0t h GLU 166 N 0.90 0.63 -0.54 0.20 4.39 -1.03 -2.68 114.58 116.44 1t0t h GLU 166 Ca 0.21 -0.16 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 1t0t h GLU 166 Cb 0.25 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.80 1t0t h GLU 166 CO -0.01 0.68 0.28 -0.07 -1.16 0.00 0.00 179.01 178.72 1t0t h LEU 167 N 0.48 0.67 -0.23 1.33 3.38 -1.07 -1.87 115.31 117.99 1t0t h LEU 167 Ca 0.12 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1t0t h LEU 167 Cb 0.35 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1t0t h LEU 167 CO 0.01 0.56 0.00 0.24 0.09 0.00 0.00 178.44 179.33 1t0t h MET 168 N 0.76 0.00 0.01 1.13 2.86 -1.03 -3.26 114.93 115.40 1t0t h MET 168 Ca 0.19 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.83 1t0t h MET 168 Cb 0.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.71 1t0t h MET 168 CO -0.03 0.00 -0.01 -0.09 1.06 0.00 0.00 176.91 177.85 1t0t h ARG 169 N 0.00 -0.02 -0.98 1.72 2.43 -1.01 0.06 114.38 116.58 1t0t h ARG 169 Ca 0.00 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1t0t h ARG 169 Cb 0.66 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.16 1t0t h ARG 169 CO 0.00 0.34 0.65 0.00 -1.51 0.00 0.00 179.97 179.45 1t0t h ALA 170 N 0.60 1.25 -0.73 2.80 0.00 -1.64 -0.51 119.26 121.04 1t0t h ALA 170 Ca -0.00 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1t0t h ALA 170 Cb 0.37 -0.39 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1t0t h ALA 170 CO 0.00 0.62 0.48 1.25 0.00 0.00 0.00 179.25 181.60 1t0t h HIS 171 N 1.31 0.90 -0.41 0.00 -0.00 -1.54 -1.60 115.15 113.81 1t0t h HIS 171 Ca 0.36 0.02 -0.05 0.00 -0.00 0.00 0.00 60.37 60.71 1t0t h HIS 171 Cb -0.13 -0.30 -0.02 0.00 -0.00 0.00 0.00 27.41 26.96 1t0t h HIS 171 CO -0.00 0.55 0.06 0.78 -0.00 0.00 0.00 177.93 179.32 1t0t h GLY 172 N 0.96 0.67 1.38 5.26 0.00 -0.31 -2.13 103.07 108.90 1t0t h GLY 172 Ca 0.27 -0.38 -0.12 0.00 0.00 0.00 0.00 47.33 47.10 1t0t h GLY 172 CO -0.07 0.36 -0.30 -0.33 0.00 0.00 0.00 176.54 176.20 1t0t h MET 173 N 0.60 0.70 -0.44 4.80 2.86 -0.58 -2.18 114.93 120.69 1t0t h MET 173 Ca 0.13 -0.31 -0.09 0.00 -2.06 0.00 0.00 59.70 57.37 1t0t h MET 173 Cb 0.30 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 1t0t h MET 173 CO 0.00 0.91 -0.08 1.15 1.06 0.00 0.00 176.91 179.96 1t0t h THR 174 N 0.60 1.27 -0.90 2.22 2.02 -0.93 -2.82 112.91 114.37 1t0t h THR 174 Ca 0.07 -1.18 0.06 0.00 0.77 0.00 0.00 66.41 66.13 1t0t h THR 174 Cb 0.80 1.12 -0.06 0.00 -1.74 0.00 0.00 68.15 68.28 1t0t h THR 174 CO 0.07 0.40 0.58 1.23 0.37 0.00 0.00 175.52 178.17 1t0t h GLY 175 N 0.67 1.30 2.00 2.16 0.00 -1.12 -2.10 103.07 105.98 1t0t h GLY 175 Ca 0.12 -0.42 -0.04 0.00 0.00 0.00 0.00 47.33 46.98 1t0t h GLY 175 CO 0.04 0.32 -0.20 3.21 0.00 0.00 0.00 176.54 179.91 1t0t h ARG 176 N 1.05 0.00 -0.11 4.80 3.08 -1.14 -0.58 114.38 121.48 1t0t h ARG 176 Ca 0.38 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.46 1t0t h ARG 176 Cb 0.15 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 1t0t h ARG 176 CO -0.13 0.20 0.19 0.87 -1.07 0.00 0.00 179.97 180.03 1t0t h LYS 177 N 0.00 0.00 -0.29 0.04 1.57 -1.33 -2.48 116.57 114.08 1t0t h LYS 177 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1t0t h LYS 177 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 1t0t h LYS 177 CO 0.03 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.57 1t0t n TYR 178 N -3.47 0.96 -1.67 -1.35 4.01 -0.23 -4.99 117.16 110.43 1t0t n TYR 178 Ca -0.00 -0.82 -0.46 0.00 -0.16 0.00 0.00 57.90 56.46 1t0t n TYR 178 Cb 0.28 -0.29 -0.04 0.00 -0.31 0.00 0.00 39.34 38.98 1t0t n TYR 178 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1t0t n ALA 179 N -0.30 1.29 0.00 -0.72 0.00 -0.94 -0.78 120.51 119.07 1t0t n ALA 179 Ca 0.21 0.43 0.00 0.00 0.00 0.00 0.00 53.44 54.07 1t0t n ALA 179 Cb 0.86 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.94 1t0t n ALA 179 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1t0t n GLY 180 N 3.52 3.10 0.13 0.00 0.00 -1.26 -4.80 105.19 105.88 1t0t n GLY 180 Ca 0.18 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.00 1t0t n GLY 180 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1t0t n LYS 181 N -2.00 0.65 -4.18 1.61 5.02 0.04 -5.01 118.16 114.29 1t0t n LYS 181 Ca 0.00 0.18 -0.16 0.00 -2.02 0.00 0.00 58.31 56.31 1t0t n LYS 181 Cb 0.00 -1.54 -0.13 0.00 -0.02 0.00 0.00 35.03 33.35 1t0t n LYS 181 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1t0t s VAL 182 N -2.52 0.77 0.09 -0.18 1.01 -0.98 -4.38 120.40 114.21 1t0t s VAL 182 Ca -0.34 -0.95 0.09 0.00 0.00 0.00 0.00 61.98 60.78 1t0t s VAL 182 Cb 0.09 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.69 1t0t s VAL 182 CO 0.61 -0.16 -0.23 0.42 0.00 0.00 0.00 175.10 175.73 1t0t s THR 183 N -1.00 1.91 -0.09 3.92 -4.23 -0.42 -4.74 115.64 110.99 1t0t s THR 183 Ca -0.03 -1.50 0.02 0.00 -1.18 0.00 0.00 61.69 59.00 1t0t s THR 183 Cb -0.08 -1.69 0.01 0.00 1.34 0.00 0.00 72.50 72.08 1t0t s THR 183 CO 0.01 0.10 -0.16 -1.58 -0.54 0.00 0.00 174.62 172.46 1t0t s GLN 184 N -1.69 2.16 -0.27 3.99 0.74 -1.26 -0.79 119.66 122.55 1t0t s GLN 184 Ca 0.09 -0.56 -0.08 0.00 0.05 0.00 0.00 55.36 54.87 1t0t s GLN 184 Cb -0.10 -1.77 -0.02 0.00 1.10 0.00 0.00 33.01 32.22 1t0t s GLN 184 CO 0.04 0.02 0.10 0.42 -0.55 0.00 0.00 175.29 175.31 1t0t s ILE 185 N 0.74 4.43 -0.23 -2.34 -1.09 0.21 -4.98 121.20 117.95 1t0t s ILE 185 Ca -0.12 -0.22 -0.11 0.00 -2.23 0.00 0.00 60.65 57.97 1t0t s ILE 185 Cb -0.16 -3.12 -0.05 0.00 -1.58 0.00 0.00 42.46 37.55 1t0t s ILE 185 CO 0.03 0.27 0.20 -0.63 -1.23 0.00 0.00 174.94 173.57 1t0t s ILE 186 N 1.62 5.33 -0.02 2.92 -1.09 -1.26 -1.42 121.20 127.27 1t0t s ILE 186 Ca 0.06 0.28 0.08 0.00 -2.23 0.00 0.00 60.65 58.84 1t0t s ILE 186 Cb -0.16 -3.54 -0.02 0.00 -1.58 0.00 0.00 42.46 37.16 1t0t s ILE 186 CO 0.05 0.33 -0.26 0.42 -1.23 0.00 0.00 174.94 174.25 1t0t s THR 187 N 1.07 2.04 0.01 2.92 -4.23 -0.33 -2.66 115.64 114.45 1t0t s THR 187 Ca 0.10 -1.10 -0.16 0.00 -1.18 0.00 0.00 61.69 59.35 1t0t s THR 187 Cb -0.14 -1.70 -0.06 0.00 1.34 0.00 0.00 72.50 71.95 1t0t s THR 187 CO 0.05 0.58 0.45 -0.83 -0.54 0.00 0.00 174.62 174.32 1t0t s GLY 188 N -0.55 2.51 -0.01 3.99 0.00 0.72 -0.57 107.32 113.43 1t0t s GLY 188 Ca 0.08 -0.16 0.01 0.00 0.00 0.00 0.00 44.72 44.64 1t0t s GLY 188 CO -0.00 0.25 0.71 -1.14 0.00 0.00 0.00 173.10 172.92 1t0t n SER 189 N 1.93 0.70 -4.68 1.64 3.41 0.28 -0.82 113.62 116.08 1t0t n SER 189 Ca -0.13 -1.46 -0.42 0.00 -0.26 0.00 0.00 58.87 56.60 1t0t n SER 189 Cb 0.52 -0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.41 1t0t n SER 189 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1t0t s VAL 190 N -0.42 2.63 0.00 -3.33 1.01 -1.14 -0.61 120.40 118.55 1t0t s VAL 190 Ca 0.01 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.00 1t0t s VAL 190 Cb 0.01 -3.01 0.00 0.00 0.00 0.00 0.00 36.38 33.38 1t0t s VAL 190 CO 0.00 -0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.71 1t0t n GLY 191 N 4.34 1.45 0.00 4.51 0.00 -1.26 -4.80 105.19 109.43 1t0t n GLY 191 Ca 0.18 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.20 1t0t n GLY 191 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1t0t n LEU 192 N 0.00 0.22 0.00 0.99 4.77 0.22 -5.11 117.00 118.09 1t0t n LEU 192 Ca 0.00 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1t0t n LEU 192 Cb 0.00 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1t0t n LEU 192 CO 0.00 0.05 0.00 -0.67 -1.33 0.00 0.00 177.39 175.44 1t0t n ASP 193 N -2.06 0.00 0.11 -1.43 -0.08 -0.60 -4.75 116.55 107.74 1t0t n ASP 193 Ca -0.01 -0.79 0.00 0.00 -1.51 0.00 0.00 54.79 52.48 1t0t n ASP 193 Cb 0.52 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.97 1t0t n ASP 193 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 1t0t h ASP 194 N 0.00 0.00 -5.30 1.67 5.19 -1.92 -3.45 116.42 112.61 1t0t h ASP 194 Ca 0.00 0.00 -0.36 0.00 -0.62 0.00 0.00 57.03 56.05 1t0t h ASP 194 Cb 0.00 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 1t0t h ASP 194 CO 0.00 0.60 -0.13 0.49 -3.12 0.00 0.00 179.24 177.08 1t0t n PHE 195 N -3.21 -1.48 -0.06 4.55 3.72 -1.26 -5.07 117.46 114.65 1t0t n PHE 195 Ca 0.00 -1.50 -0.06 0.00 -0.05 0.00 0.00 57.45 55.84 1t0t n PHE 195 Cb 0.78 -0.32 -0.15 0.00 -0.94 0.00 0.00 39.48 38.85 1t0t n PHE 195 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1t0t n GLU 196 N -1.53 0.67 -3.89 -1.08 1.02 -0.63 -4.11 120.64 111.08 1t0t n GLU 196 Ca 0.03 0.06 -0.11 0.00 -0.02 0.00 0.00 57.16 57.12 1t0t n GLU 196 Cb 0.41 -1.61 -0.11 0.00 -0.02 0.00 0.00 31.44 30.11 1t0t n GLU 196 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1t0t s TRP 197 N -2.68 0.06 -0.17 -0.32 0.51 -0.47 -0.55 118.94 115.32 1t0t s TRP 197 Ca -0.08 -0.14 -0.09 0.00 -2.12 0.00 0.00 56.10 53.67 1t0t s TRP 197 Cb 0.08 -0.07 -0.05 0.00 -0.81 0.00 0.00 33.47 32.62 1t0t s TRP 197 CO 0.84 -0.21 0.13 0.20 -0.51 0.00 0.00 176.95 177.40 1t0t s GLY 198 N -1.07 2.08 -0.22 0.98 0.00 0.27 -0.59 107.32 108.77 1t0t s GLY 198 Ca -0.12 -0.68 -0.02 0.00 0.00 0.00 0.00 44.72 43.91 1t0t s GLY 198 CO 0.01 -0.05 -0.08 0.14 0.00 0.00 0.00 173.10 173.11 1t0t s VAL 199 N -0.14 2.95 -0.22 1.40 1.01 0.37 -1.19 120.40 124.59 1t0t s VAL 199 Ca 0.10 -0.75 -0.01 0.00 0.00 0.00 0.00 61.98 61.32 1t0t s VAL 199 Cb -0.11 -2.38 0.02 0.00 0.00 0.00 0.00 36.38 33.90 1t0t s VAL 199 CO 0.00 0.37 -0.10 -0.89 0.00 0.00 0.00 175.10 174.48 1t0t s THR 200 N 1.39 2.74 -0.10 3.92 2.01 -0.51 -1.49 115.64 123.60 1t0t s THR 200 Ca 0.04 -0.87 -0.03 0.00 0.31 0.00 0.00 61.69 61.14 1t0t s THR 200 Cb -0.15 -2.29 -0.04 0.00 0.01 0.00 0.00 72.50 70.04 1t0t s THR 200 CO -0.06 0.36 0.04 -0.76 -0.69 0.00 0.00 174.62 173.51 1t0t s LEU 201 N 1.35 3.79 -0.08 4.42 1.43 0.11 -0.62 118.68 129.08 1t0t s LEU 201 Ca 0.03 0.22 0.03 0.00 -1.03 0.00 0.00 54.13 53.38 1t0t s LEU 201 Cb -0.15 -1.89 0.00 0.00 0.03 0.00 0.00 46.19 44.19 1t0t s LEU 201 CO -0.07 0.37 -0.19 -0.36 0.23 0.00 0.00 176.35 176.33 1t0t s PHE 202 N -0.83 2.07 0.00 0.29 0.08 0.03 -1.05 117.98 118.58 1t0t s PHE 202 Ca 0.13 -0.80 -0.22 0.00 0.12 0.00 0.00 56.93 56.16 1t0t s PHE 202 Cb -0.12 -1.42 0.05 0.00 -0.57 0.00 0.00 43.02 40.96 1t0t s PHE 202 CO 0.03 -0.34 0.48 0.45 -0.10 0.00 0.00 175.22 175.74 1t0t s SER 203 N 0.42 -0.40 0.00 1.36 0.15 -1.06 -1.30 113.70 112.87 1t0t s SER 203 Ca -0.16 0.26 0.30 0.00 0.70 0.00 0.00 55.95 57.06 1t0t s SER 203 Cb -0.16 0.44 1.44 0.00 -1.71 0.00 0.00 66.02 66.03 1t0t s SER 203 CO 0.06 -0.60 1.98 0.47 1.20 0.00 0.00 173.24 176.35 1t0t n ASP 204 N 0.81 0.44 -3.72 5.45 8.00 -1.26 -1.29 116.55 124.98 1t0t n ASP 204 Ca -0.19 -0.81 -0.28 0.00 0.71 0.00 0.00 54.79 54.22 1t0t n ASP 204 Cb 0.58 -0.06 -0.16 0.00 -0.02 0.00 0.00 41.12 41.46 1t0t n ASP 204 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1t0t s ASP 205 N -2.26 3.05 0.57 -2.24 2.15 -1.26 -4.73 116.67 111.95 1t0t s ASP 205 Ca 0.36 -0.93 0.36 0.00 0.43 0.00 0.00 52.55 52.77 1t0t s ASP 205 Cb 0.21 -0.60 1.58 0.00 -0.30 0.00 0.00 42.92 43.81 1t0t s ASP 205 CO 0.42 -0.33 2.06 0.00 -0.17 0.00 0.00 175.17 177.15 1t0t h ALA 206 N 8.24 1.01 0.00 3.66 0.00 -1.97 -1.55 119.26 128.65 1t0t h ALA 206 Ca -0.16 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1t0t h ALA 206 Cb 1.10 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 1t0t h ALA 206 CO 0.36 0.01 -0.13 -0.07 0.00 0.00 0.00 179.25 179.41 1t0t h LEU 207 N 0.00 0.00 -1.43 0.00 3.38 -1.98 -2.16 115.31 113.11 1t0t h LEU 207 Ca -0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1t0t h LEU 207 Cb 0.41 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1t0t h LEU 207 CO 0.00 0.13 -0.27 1.56 0.09 0.00 0.00 178.44 179.95 1t0t h GLN 208 N 0.00 0.00 -0.04 1.13 1.08 -1.67 -1.28 115.11 114.33 1t0t h GLN 208 Ca -0.00 0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.21 1t0t h GLN 208 Cb 0.34 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.76 1t0t h GLN 208 CO 0.02 0.27 -0.03 0.74 -0.95 0.00 0.00 178.83 178.88 1t0t h PHE 209 N 0.00 -0.07 -0.54 2.96 0.04 -1.54 0.18 116.94 117.96 1t0t h PHE 209 Ca -0.00 0.01 -0.08 0.00 2.80 0.00 0.00 57.97 60.69 1t0t h PHE 209 Cb 0.58 0.04 -0.02 0.00 2.20 0.00 0.00 35.95 38.75 1t0t h PHE 209 CO 0.00 -0.05 0.03 -0.22 -0.60 0.00 0.00 178.31 177.47 1t0t h LYS 210 N -0.03 0.94 -0.20 1.51 3.64 -1.56 -1.32 116.57 119.55 1t0t h LYS 210 Ca 0.03 -0.28 -0.02 0.00 -1.27 0.00 0.00 60.65 59.10 1t0t h LYS 210 Cb 0.07 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 1t0t h LYS 210 CO -0.06 0.93 0.04 0.87 -2.27 0.00 0.00 179.45 178.96 1t0t h LYS 211 N 0.82 0.32 0.35 1.90 1.57 -1.11 -1.09 116.57 119.34 1t0t h LYS 211 Ca 0.16 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 1t0t h LYS 211 Cb 0.49 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1t0t h LYS 211 CO 0.02 0.47 -0.17 1.25 -0.57 0.00 0.00 179.45 180.45 1t0t h LEU 212 N 0.13 -0.40 -1.07 2.94 5.85 -0.95 -1.34 115.31 120.46 1t0t h LEU 212 Ca 0.06 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.63 1t0t h LEU 212 Cb 0.30 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 1t0t h LEU 212 CO 0.00 -0.13 0.11 0.58 -0.34 0.00 0.00 178.44 178.65 1t0t h VAL 213 N -0.67 1.22 -0.35 1.05 2.07 -1.24 0.16 116.25 118.49 1t0t h VAL 213 Ca -0.05 -0.80 -0.05 0.00 0.82 0.00 0.00 66.70 66.61 1t0t h VAL 213 Cb 0.47 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1t0t h VAL 213 CO 0.08 0.30 0.02 0.22 0.02 0.00 0.00 177.57 178.20 1t0t h TYR 214 N 0.74 0.67 -0.68 1.57 3.20 -1.21 -2.70 116.97 118.56 1t0t h TYR 214 Ca 0.16 -0.11 -0.07 0.00 3.14 0.00 0.00 58.73 61.85 1t0t h TYR 214 Cb 0.30 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 1t0t h TYR 214 CO 0.02 0.71 0.14 1.49 -1.64 0.00 0.00 178.16 178.88 1t0t h GLU 215 N 0.43 1.11 -0.71 1.82 4.81 -0.85 -1.63 114.58 119.57 1t0t h GLU 215 Ca 0.10 -0.28 0.08 0.00 -0.13 0.00 0.00 59.36 59.13 1t0t h GLU 215 Cb 0.43 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.63 1t0t h GLU 215 CO 0.02 1.00 0.47 0.52 -0.73 0.00 0.00 179.01 180.28 1t0t h MET 216 N 1.04 0.66 0.00 1.92 2.86 -0.91 -2.22 114.93 118.28 1t0t h MET 216 Ca 0.21 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 1t0t h MET 216 Cb 0.40 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.92 1t0t h MET 216 CO 0.01 0.44 0.00 -0.09 1.06 0.00 0.00 176.91 178.32 1t0t h ARG 217 N 0.68 0.00 -0.01 1.72 2.43 -0.95 -0.01 114.38 118.24 1t0t h ARG 217 Ca 0.32 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.49 1t0t h ARG 217 Cb 0.35 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1t0t h ARG 217 CO -0.11 0.00 -0.26 1.19 -1.51 0.00 0.00 179.97 179.29 1t0t n PHE 218 N -2.33 0.00 -2.59 2.20 3.72 -0.83 -3.38 117.46 114.24 1t0t n PHE 218 Ca 0.01 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.01 1t0t n PHE 218 Cb 0.16 -0.08 -0.05 0.00 -0.94 0.00 0.00 39.48 38.57 1t0t n PHE 218 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1t0t s ASP 219 N -2.42 7.38 0.30 4.37 1.01 -0.02 -4.89 116.67 122.40 1t0t s ASP 219 Ca 0.25 2.12 0.03 0.00 0.71 0.00 0.00 52.55 55.66 1t0t s ASP 219 Cb 0.19 -2.62 0.63 0.00 1.01 0.00 0.00 42.92 42.13 1t0t s ASP 219 CO 0.50 -0.05 1.83 -0.08 0.21 0.00 0.00 175.17 177.59 1t0t h GLU 220 N 3.83 0.89 -0.95 8.23 4.81 -1.87 0.44 114.58 129.95 1t0t h GLU 220 Ca -0.46 -0.05 0.07 0.00 -0.13 0.00 0.00 59.36 58.78 1t0t h GLU 220 Cb 1.21 -0.20 -0.06 0.00 0.63 0.00 0.00 28.75 30.32 1t0t h GLU 220 CO 0.67 0.59 0.62 -0.24 -0.73 0.00 0.00 179.01 179.91 1t0t h VAL 221 N 0.91 1.07 0.21 0.32 3.04 -1.91 0.29 116.25 120.18 1t0t h VAL 221 Ca 0.50 -0.37 -0.34 0.00 -1.01 0.00 0.00 66.70 65.47 1t0t h VAL 221 Cb 0.58 -0.12 0.02 0.00 -2.01 0.00 0.00 31.29 29.77 1t0t h VAL 221 CO -0.27 0.20 -1.63 0.28 -1.01 0.00 0.00 177.57 175.14 1t0t h SER 222 N 1.09 0.70 -0.28 3.17 0.02 -1.30 -1.69 113.55 115.25 1t0t h SER 222 Ca 0.41 -0.90 -0.09 0.00 -0.84 0.00 0.00 61.79 60.37 1t0t h SER 222 Cb 0.20 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 1t0t h SER 222 CO -0.16 1.74 -0.18 0.00 -1.14 0.00 0.00 176.83 177.09 1t0t h ALA 223 N 0.16 0.40 0.11 3.77 0.00 -0.76 -0.71 119.26 122.24 1t0t h ALA 223 Ca -0.30 -0.34 -0.36 0.00 0.00 0.00 0.00 54.91 53.90 1t0t h ALA 223 Cb 2.13 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.80 1t0t h ALA 223 CO 0.22 0.32 -1.97 0.54 0.00 0.00 0.00 179.25 178.36 1t0t n ARG 224 N -4.38 0.75 -0.01 0.00 1.74 0.07 -4.58 116.66 110.24 1t0t n ARG 224 Ca -0.04 0.27 0.03 0.00 -0.77 0.00 0.00 57.85 57.34 1t0t n ARG 224 Cb 0.40 -1.72 0.03 0.00 -1.02 0.00 0.00 32.46 30.15 1t0t n ARG 224 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1t0t n PHE 225 N -3.44 0.03 -2.85 -1.55 3.72 -0.66 -4.83 117.46 107.88 1t0t n PHE 225 Ca -0.30 -0.05 -0.41 0.00 -0.05 0.00 0.00 57.45 56.64 1t0t n PHE 225 Cb 1.05 -0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 39.54 1t0t n PHE 225 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1t0t s GLY 226 N -0.60 2.85 -0.10 1.37 0.00 -0.27 -0.28 107.32 110.28 1t0t s GLY 226 Ca 0.08 0.40 0.02 0.00 0.00 0.00 0.00 44.72 45.22 1t0t s GLY 226 CO 0.08 1.37 -0.13 1.85 0.00 0.00 0.00 173.10 176.27 1t0t s GLU 227 N 0.42 1.99 -0.05 2.90 2.56 -0.46 -4.83 118.70 121.23 1t0t s GLU 227 Ca 0.44 -0.48 0.04 0.00 0.00 0.00 0.00 54.97 54.97 1t0t s GLU 227 Cb -0.21 -1.72 -0.03 0.00 2.00 0.00 0.00 34.13 34.18 1t0t s GLU 227 CO 0.25 -0.06 -0.15 -0.06 -0.56 0.00 0.00 175.26 174.68 1t0t s PHE 228 N 0.99 2.68 0.00 5.30 0.08 -1.26 -0.67 117.98 125.10 1t0t s PHE 228 Ca -0.07 -0.18 0.00 0.00 0.12 0.00 0.00 56.93 56.80 1t0t s PHE 228 Cb -0.15 -1.62 0.00 0.00 -0.57 0.00 0.00 43.02 40.68 1t0t s PHE 228 CO -0.01 0.17 0.00 0.41 -0.10 0.00 0.00 175.22 175.69 1t0t n GLY 229 N 2.32 0.56 3.78 4.36 0.00 0.04 -4.98 105.19 111.27 1t0t n GLY 229 Ca -0.17 -1.65 -0.35 0.00 0.00 0.00 0.00 46.02 43.85 1t0t n GLY 229 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1t0t s SER 230 N -1.00 5.70 -0.09 1.61 0.01 -1.26 -4.85 113.70 113.81 1t0t s SER 230 Ca 0.00 2.14 0.02 0.00 1.31 0.00 0.00 55.95 59.42 1t0t s SER 230 Cb 0.00 -2.58 -0.02 0.00 0.21 0.00 0.00 66.02 63.64 1t0t s SER 230 CO 0.00 -1.23 -0.16 -0.36 0.41 0.00 0.00 173.24 171.90 1t0t s PHE 231 N -1.85 2.70 -0.12 2.43 0.08 -1.26 -4.16 117.98 115.81 1t0t s PHE 231 Ca 0.72 -0.49 0.01 0.00 0.12 0.00 0.00 56.93 57.28 1t0t s PHE 231 Cb -0.23 -1.72 0.02 0.00 -0.57 0.00 0.00 43.02 40.52 1t0t s PHE 231 CO 0.28 -0.07 -0.12 -0.06 -0.10 0.00 0.00 175.22 175.15 1t0t s PHE 232 N -0.14 1.82 0.04 0.36 0.08 -0.62 -4.98 117.98 114.54 1t0t s PHE 232 Ca -0.02 -0.92 0.08 0.00 0.12 0.00 0.00 56.93 56.20 1t0t s PHE 232 Cb -0.14 -1.38 -0.03 0.00 -0.57 0.00 0.00 43.02 40.91 1t0t s PHE 232 CO 0.04 -0.53 -0.24 0.14 -0.10 0.00 0.00 175.22 174.53 1t0t s VAL 233 N 1.35 1.90 0.23 -0.44 -7.23 -1.26 -1.00 120.40 113.95 1t0t s VAL 233 Ca 0.00 -1.28 -0.13 0.00 -1.81 0.00 0.00 61.98 58.76 1t0t s VAL 233 Cb -0.14 -1.63 0.00 0.00 0.56 0.00 0.00 36.38 35.17 1t0t s VAL 233 CO -0.06 0.30 0.47 -0.83 -0.31 0.00 0.00 175.10 174.67 1t0t s GLY 234 N -1.17 0.43 0.04 2.32 0.00 -0.46 -1.79 107.32 106.70 1t0t s GLY 234 Ca 0.10 -0.78 0.07 0.00 0.00 0.00 0.00 44.72 44.11 1t0t s GLY 234 CO 0.02 -0.58 -0.18 -0.51 0.00 0.00 0.00 173.10 171.84 1t0t s THR 235 N -3.99 2.79 0.32 0.90 -4.23 0.12 -1.75 115.64 109.80 1t0t s THR 235 Ca 0.20 -1.20 -0.29 0.00 -1.18 0.00 0.00 61.69 59.22 1t0t s THR 235 Cb -0.00 -2.18 -0.11 0.00 1.34 0.00 0.00 72.50 71.55 1t0t s THR 235 CO 0.07 0.33 1.50 -0.60 -0.54 0.00 0.00 174.62 175.37 1t0t s ARG 236 N -1.47 4.17 -0.53 3.99 3.52 -0.28 -0.10 118.95 128.25 1t0t s ARG 236 Ca 0.15 2.49 -0.06 0.00 -0.13 0.00 0.00 55.73 58.18 1t0t s ARG 236 Cb -0.10 -3.02 0.14 0.00 -1.56 0.00 0.00 34.95 30.40 1t0t s ARG 236 CO 0.05 -0.51 0.36 -1.17 -0.81 0.00 0.00 175.30 173.23 1t0t s LEU 237 N -1.17 5.52 0.41 -0.88 2.96 -0.75 -4.73 118.68 120.03 1t0t s LEU 237 Ca 0.57 -2.29 -0.27 0.00 -0.22 0.00 0.00 54.13 51.93 1t0t s LEU 237 Cb -0.45 -1.93 -0.10 0.00 0.50 0.00 0.00 46.19 44.21 1t0t s LEU 237 CO 0.53 -0.55 1.46 -2.84 -1.32 0.00 0.00 176.35 173.64 1t0t s PRO 238 N 0.78 3.93 0.61 0.98 0.02 -1.26 -4.81 135.00 135.25 1t0t s PRO 238 Ca 0.11 2.51 0.37 0.00 0.02 0.00 0.00 61.00 64.01 1t0t s PRO 238 Cb -0.22 -2.84 2.02 0.00 0.02 0.00 0.00 34.50 33.49 1t0t s PRO 238 CO -0.03 -0.66 2.26 0.52 -0.33 0.00 0.00 177.00 178.76 1t0t h MET 239 N 2.71 0.00 0.00 5.54 2.86 -1.98 0.11 114.93 124.18 1t0t h MET 239 Ca -0.51 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.13 1t0t h MET 239 Cb 1.25 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.91 1t0t h MET 239 CO 0.63 0.02 0.00 -0.85 1.06 0.00 0.00 176.91 177.77 1t0t n GLU 240 N -3.39 0.18 0.00 1.72 0.00 -1.26 -2.42 120.64 115.46 1t0t n GLU 240 Ca -0.03 0.35 0.10 0.00 0.00 0.00 0.00 57.16 57.59 1t0t n GLU 240 Cb 0.12 -1.81 0.07 0.00 0.00 0.00 0.00 31.44 29.83 1t0t n GLU 240 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1t0t n ASN 241 N -2.13 2.59 -0.09 -1.84 3.02 0.38 -4.62 115.26 112.58 1t0t n ASN 241 Ca 0.03 -1.80 -0.09 0.00 -0.03 0.00 0.00 54.58 52.69 1t0t n ASN 241 Cb 0.26 0.07 -0.02 0.00 -0.61 0.00 0.00 39.78 39.48 1t0t n ASN 241 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1t0t h VAL 242 N 3.77 1.10 -0.85 2.41 2.07 -1.39 -0.34 116.25 123.02 1t0t h VAL 242 Ca 0.00 -0.22 0.02 0.00 0.82 0.00 0.00 66.70 67.33 1t0t h VAL 242 Cb 0.83 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 31.25 1t0t h VAL 242 CO 0.00 0.10 0.55 -1.28 0.02 0.00 0.00 177.57 176.96 1t0t h SER 243 N 0.39 0.93 -0.37 0.57 0.87 -1.82 -2.15 113.55 111.97 1t0t h SER 243 Ca 0.11 -0.01 -0.15 0.00 -1.23 0.00 0.00 61.79 60.50 1t0t h SER 243 Cb -0.01 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.73 1t0t h SER 243 CO -0.02 0.65 -0.36 -1.28 -0.53 0.00 0.00 176.83 175.29 1t0t h SER 244 N 1.09 0.97 -0.73 6.23 0.87 -1.78 -1.68 113.55 118.52 1t0t h SER 244 Ca 0.33 -0.46 0.01 0.00 -1.23 0.00 0.00 61.79 60.44 1t0t h SER 244 Cb -0.04 -0.27 -0.04 0.00 -0.44 0.00 0.00 62.40 61.61 1t0t h SER 244 CO -0.10 1.23 0.48 0.15 -0.53 0.00 0.00 176.83 178.06 1t0t h PHE 245 N 0.72 0.91 -0.03 2.24 3.57 -0.82 -2.40 116.94 121.13 1t0t h PHE 245 Ca 0.06 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.58 1t0t h PHE 245 Cb 0.96 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 39.39 1t0t h PHE 245 CO 0.06 0.56 0.00 1.19 -2.23 0.00 0.00 178.31 177.90 1t0t n PHE 246 N -4.59 0.02 -2.14 0.41 3.72 -0.83 -4.89 117.46 109.16 1t0t n PHE 246 Ca 0.07 -0.01 -0.42 0.00 -0.05 0.00 0.00 57.45 57.04 1t0t n PHE 246 Cb 0.03 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.55 1t0t n PHE 246 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 1t0t s HIS 247 N -1.98 2.59 0.00 1.38 2.46 -0.64 -5.07 115.29 114.04 1t0t s HIS 247 Ca 0.39 0.61 0.00 0.00 0.47 0.00 0.00 55.06 56.53 1t0t s HIS 247 Cb 0.21 -3.76 0.00 0.00 -0.13 0.00 0.00 32.58 28.90 1t0t s HIS 247 CO 0.33 -2.93 0.05 1.33 -2.47 0.00 0.00 174.74 171.05