#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m77 h PRO 8 N 0.00 0.00 -4.69 -7.13 0.13 -1.97 -3.40 132.00 114.94 3m77 h PRO 8 Ca 0.00 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.44 3m77 h PRO 8 Cb 0.00 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 30.86 3m77 h PRO 8 CO 0.00 0.04 -0.58 -1.17 -0.23 0.00 0.00 178.00 176.06 3m77 s LEU 9 N -7.32 4.29 0.31 1.56 2.96 -1.26 0.23 118.68 119.45 3m77 s LEU 9 Ca -0.04 -0.96 -0.29 0.00 -0.22 0.00 0.00 54.13 52.62 3m77 s LEU 9 Cb 0.14 -1.92 -0.10 0.00 0.50 0.00 0.00 46.19 44.81 3m77 s LEU 9 CO 0.54 -0.30 1.31 -2.84 -1.32 0.00 0.00 176.35 173.75 3m77 s PRO 10 N 1.48 4.36 0.48 0.98 0.02 -1.26 -4.90 135.00 136.15 3m77 s PRO 10 Ca 0.01 2.20 0.16 0.00 0.02 0.00 0.00 61.00 63.38 3m77 s PRO 10 Cb -0.19 -3.09 1.16 0.00 0.02 0.00 0.00 34.50 32.40 3m77 s PRO 10 CO 0.04 -0.20 2.06 1.15 -0.33 0.00 0.00 177.00 179.71 3m77 h THR 11 N 3.14 0.94 0.00 0.99 2.02 -1.96 -0.72 112.91 117.31 3m77 h THR 11 Ca -0.48 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 66.63 3m77 h THR 11 Cb 1.22 0.71 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 3m77 h THR 11 CO 0.68 0.04 0.00 1.23 0.37 0.00 0.00 175.52 177.83 3m77 h GLY 12 N 0.21 0.00 2.00 2.16 0.00 -1.90 -2.09 103.07 103.44 3m77 h GLY 12 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.48 3m77 h GLY 12 CO -0.03 0.00 0.00 -0.97 0.00 0.00 0.00 176.54 175.54 3m77 h TYR 13 N 0.00 0.00 0.00 5.60 -1.99 -1.50 -0.83 116.97 118.25 3m77 h TYR 13 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3m77 h TYR 13 Cb 0.09 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.82 3m77 h TYR 13 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 178.16 179.35 3m77 n PHE 14 N -2.33 0.67 0.31 4.88 3.72 -0.79 -1.11 117.46 122.80 3m77 n PHE 14 Ca 0.00 0.35 0.17 0.00 -0.05 0.00 0.00 57.45 57.93 3m77 n PHE 14 Cb 0.15 -1.06 1.00 0.00 -0.94 0.00 0.00 39.48 38.64 3m77 n PHE 14 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3m77 h ASP 15 N 0.00 0.00 0.42 4.37 3.32 -1.40 -2.32 116.42 120.81 3m77 h ASP 15 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3m77 h ASP 15 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3m77 h ASP 15 CO 0.00 0.01 -0.20 0.40 -1.72 0.00 0.00 179.24 177.73 3m77 h ILE 16 N 0.00 0.30 0.00 0.35 2.04 -1.35 -1.08 117.51 117.77 3m77 h ILE 16 Ca -0.00 -0.62 -0.03 0.00 1.00 0.00 0.00 64.86 65.21 3m77 h ILE 16 Cb 0.02 0.47 -0.00 0.00 -0.74 0.00 0.00 36.82 36.56 3m77 h ILE 16 CO 0.00 0.06 -0.16 1.55 0.00 0.00 0.00 178.15 179.60 3m77 h PRO 17 N -1.04 0.00 0.19 2.37 0.13 -1.73 -1.99 132.00 129.93 3m77 h PRO 17 Ca -0.06 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.08 3m77 h PRO 17 Cb 0.53 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.63 3m77 h PRO 17 CO 0.09 0.16 -0.28 1.25 -0.23 0.00 0.00 178.00 178.99 3m77 h LEU 18 N 0.00 -0.79 -0.50 1.56 6.46 -1.31 0.44 115.31 121.17 3m77 h LEU 18 Ca -0.00 0.08 -0.04 0.00 -0.12 0.00 0.00 57.88 57.80 3m77 h LEU 18 Cb 0.31 0.29 -0.02 0.00 -0.73 0.00 0.00 40.66 40.51 3m77 h LEU 18 CO 0.02 -0.39 0.17 1.23 -0.62 0.00 0.00 178.44 178.85 3m77 h GLY 19 N -0.54 0.82 1.01 3.75 0.00 -0.86 -0.73 103.07 106.53 3m77 h GLY 19 Ca 0.01 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 46.81 3m77 h GLY 19 CO -0.12 0.45 0.14 1.41 0.00 0.00 0.00 176.54 178.42 3m77 h LEU 20 N 0.67 0.89 -0.19 3.11 3.38 -1.30 -1.29 115.31 120.59 3m77 h LEU 20 Ca 0.16 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 3m77 h LEU 20 Cb 0.25 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3m77 h LEU 20 CO -0.01 0.90 -0.01 0.00 0.09 0.00 0.00 178.44 179.41 3m77 h ALA 21 N 1.03 0.25 -0.50 1.53 0.00 -0.72 -0.13 119.26 120.73 3m77 h ALA 21 Ca 0.18 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 3m77 h ALA 21 Cb 0.35 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 3m77 h ALA 21 CO 0.00 -0.02 0.15 0.00 0.00 0.00 0.00 179.25 179.39 3m77 h ALA 22 N 0.76 1.33 -0.38 0.00 0.00 -1.10 -1.81 119.26 118.07 3m77 h ALA 22 Ca 0.05 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 3m77 h ALA 22 Cb 0.42 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3m77 h ALA 22 CO 0.01 0.48 -0.28 1.25 0.00 0.00 0.00 179.25 180.71 3m77 h LEU 23 N 0.73 0.84 -0.62 0.00 5.85 -1.06 -1.71 115.31 119.34 3m77 h LEU 23 Ca 0.17 -0.33 0.08 0.00 0.84 0.00 0.00 57.88 58.64 3m77 h LEU 23 Cb 0.22 -0.23 -0.07 0.00 0.37 0.00 0.00 40.66 40.95 3m77 h LEU 23 CO -0.01 1.07 0.28 -1.28 -0.34 0.00 0.00 178.44 178.16 3m77 h SER 24 N 0.69 0.34 -0.40 1.25 0.87 -0.40 -1.97 113.55 113.95 3m77 h SER 24 Ca 0.08 0.06 -0.07 0.00 -1.23 0.00 0.00 61.79 60.63 3m77 h SER 24 Cb 0.82 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.77 3m77 h SER 24 CO 0.07 0.21 0.01 -0.07 -0.53 0.00 0.00 176.83 176.52 3m77 h LEU 25 N 0.50 0.74 -0.08 2.23 3.38 -0.92 -0.67 115.31 120.49 3m77 h LEU 25 Ca 0.30 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3m77 h LEU 25 Cb 0.31 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 3m77 h LEU 25 CO -0.26 0.81 0.05 0.00 0.09 0.00 0.00 178.44 179.13 3m77 h ALA 26 N 1.28 0.10 -0.25 1.53 0.00 -0.83 -2.54 119.26 118.56 3m77 h ALA 26 Ca 0.14 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 3m77 h ALA 26 Cb 0.43 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3m77 h ALA 26 CO 0.02 -0.39 -0.06 -1.49 0.00 0.00 0.00 179.25 177.33 3m77 h TRP 27 N 0.09 0.40 -0.97 0.00 4.06 -1.09 -2.57 115.95 115.88 3m77 h TRP 27 Ca 0.03 -0.04 0.06 0.00 2.06 0.00 0.00 58.89 60.99 3m77 h TRP 27 Cb 0.01 -0.12 -0.06 0.00 -1.00 0.00 0.00 29.16 27.99 3m77 h TRP 27 CO -0.07 0.45 0.63 0.35 -3.56 0.00 0.00 178.44 176.24 3m77 h PHE 28 N 0.37 1.16 0.00 0.49 3.57 -0.78 -0.39 116.94 121.36 3m77 h PHE 28 Ca 0.08 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.61 3m77 h PHE 28 Cb 0.34 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 38.70 3m77 h PHE 28 CO 0.01 0.63 0.00 0.72 -2.23 0.00 0.00 178.31 177.44 3m77 n HIS 29 N -4.48 0.59 0.24 0.41 8.25 -0.97 -2.50 115.22 116.76 3m77 n HIS 29 Ca 0.14 0.24 0.12 0.00 -0.26 0.00 0.00 57.72 57.96 3m77 n HIS 29 Cb 0.16 -0.88 0.06 0.00 1.12 0.00 0.00 29.99 30.44 3m77 n HIS 29 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3m77 h LEU 30 N 0.00 0.00 -0.82 2.41 5.85 -1.08 -3.39 115.31 118.27 3m77 h LEU 30 Ca 0.00 -0.06 0.20 0.00 0.84 0.00 0.00 57.88 58.86 3m77 h LEU 30 Cb 0.29 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 41.20 3m77 h LEU 30 CO 0.00 0.03 0.22 -0.08 -0.34 0.00 0.00 178.44 178.27 3m77 h GLU 31 N 0.00 0.25 0.00 1.25 4.81 -1.47 0.24 114.58 119.65 3m77 h GLU 31 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3m77 h GLU 31 Cb 0.93 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.26 3m77 h GLU 31 CO 0.00 0.16 0.00 0.27 -0.73 0.00 0.00 179.01 178.71 3m77 n ASN 32 N -5.18 0.00 -0.09 1.04 0.23 -1.26 -2.22 115.26 107.78 3m77 n ASN 32 Ca 0.18 -0.03 -0.12 0.00 -0.53 0.00 0.00 54.58 54.09 3m77 n ASN 32 Cb 0.58 -0.22 -0.08 0.00 -2.08 0.00 0.00 39.78 37.98 3m77 n ASN 32 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 3m77 n LEU 33 N -1.22 2.97 -3.49 -4.53 4.77 0.71 -4.96 117.00 111.25 3m77 n LEU 33 Ca 0.07 -0.09 -0.22 0.00 -0.03 0.00 0.00 56.01 55.74 3m77 n LEU 33 Cb 0.09 -0.60 -0.13 0.00 -2.33 0.00 0.00 43.42 40.46 3m77 n LEU 33 CO 0.10 0.79 -0.25 -0.36 -1.33 0.00 0.00 177.39 176.34 3m77 s PHE 34 N -2.34 -0.09 0.46 -1.77 0.08 -0.45 -5.04 117.98 108.82 3m77 s PHE 34 Ca -0.23 -0.30 0.16 0.00 0.12 0.00 0.00 56.93 56.68 3m77 s PHE 34 Cb 0.06 -0.60 1.11 0.00 -0.57 0.00 0.00 43.02 43.02 3m77 s PHE 34 CO 0.39 -0.76 2.01 -1.35 -0.10 0.00 0.00 175.22 175.41 3m77 h PRO 35 N 8.34 0.29 0.00 0.24 0.11 -1.82 -0.45 132.00 138.71 3m77 h PRO 35 Ca -0.17 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.93 3m77 h PRO 35 Cb 1.09 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.13 3m77 h PRO 35 CO 0.35 0.19 0.00 0.00 -0.21 0.00 0.00 178.00 178.33 3m77 h ALA 36 N 1.74 1.00 0.00 -0.75 0.00 -1.95 -2.23 119.26 117.06 3m77 h ALA 36 Ca 0.24 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 3m77 h ALA 36 Cb 0.53 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3m77 h ALA 36 CO -0.05 0.00 -0.08 0.00 0.00 0.00 0.00 179.25 179.12 3m77 h ALA 37 N 2.09 1.84 -0.76 0.00 0.00 -1.40 -2.67 119.26 118.36 3m77 h ALA 37 Ca 0.00 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 3m77 h ALA 37 Cb 0.21 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3m77 h ALA 37 CO 0.00 0.10 0.33 -0.09 0.00 0.00 0.00 179.25 179.58 3m77 h ARG 38 N 0.00 1.11 -0.57 0.00 9.65 -1.59 -0.34 114.38 122.64 3m77 h ARG 38 Ca -0.00 -0.19 -0.03 0.00 -1.10 0.00 0.00 59.98 58.66 3m77 h ARG 38 Cb 0.14 -0.19 -0.03 0.00 -1.39 0.00 0.00 29.97 28.51 3m77 h ARG 38 CO 0.01 0.89 0.22 1.98 2.80 0.00 0.00 179.97 185.88 3m77 h MET 39 N 1.08 0.86 -0.23 0.20 4.05 -1.68 0.18 114.93 119.40 3m77 h MET 39 Ca 0.25 -0.16 0.01 0.00 -0.28 0.00 0.00 59.70 59.53 3m77 h MET 39 Cb 0.18 -0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 30.82 3m77 h MET 39 CO -0.03 0.75 0.11 0.28 0.23 0.00 0.00 176.91 178.26 3m77 h VAL 40 N 0.79 1.00 -0.37 -5.77 2.07 -1.45 -0.31 116.25 112.22 3m77 h VAL 40 Ca 0.19 -0.08 0.04 0.00 0.82 0.00 0.00 66.70 67.66 3m77 h VAL 40 Cb 0.21 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.68 3m77 h VAL 40 CO -0.01 0.04 0.16 -1.28 0.02 0.00 0.00 177.57 176.50 3m77 h SER 41 N 0.24 0.20 -0.52 0.57 0.87 -0.68 -1.49 113.55 112.75 3m77 h SER 41 Ca 0.09 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.65 3m77 h SER 41 Cb 0.02 -0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.95 3m77 h SER 41 CO -0.06 0.16 0.21 0.44 -0.53 0.00 0.00 176.83 177.05 3m77 h ASP 42 N 0.33 0.72 -0.07 6.23 3.32 -0.37 0.38 116.42 126.96 3m77 h ASP 42 Ca 0.16 -0.17 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 3m77 h ASP 42 Cb 0.11 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.47 3m77 h ASP 42 CO -0.14 0.69 0.04 0.58 -1.72 0.00 0.00 179.24 178.69 3m77 h VAL 43 N 0.70 1.07 -0.97 -1.35 2.07 -0.83 -0.54 116.25 116.41 3m77 h VAL 43 Ca 0.17 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.51 3m77 h VAL 43 Cb 0.20 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 31.00 3m77 h VAL 43 CO -0.01 0.06 0.64 -0.07 0.02 0.00 0.00 177.57 178.21 3m77 h LEU 44 N 0.03 1.09 -0.69 2.57 3.38 -1.17 -1.57 115.31 118.95 3m77 h LEU 44 Ca 0.03 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 3m77 h LEU 44 Cb 0.07 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 3m77 h LEU 44 CO -0.00 0.78 -0.02 1.23 0.09 0.00 0.00 178.44 180.51 3m77 h GLY 45 N 1.28 1.07 0.84 0.83 0.00 -0.58 0.79 103.07 107.30 3m77 h GLY 45 Ca 0.37 -0.78 -0.04 0.00 0.00 0.00 0.00 47.33 46.88 3m77 h GLY 45 CO -0.09 0.72 -0.02 -2.22 0.00 0.00 0.00 176.54 174.93 3m77 h ILE 46 N 0.90 1.26 -0.40 2.60 2.04 -0.85 -0.74 117.51 122.32 3m77 h ILE 46 Ca 0.16 -0.94 -0.01 0.00 1.00 0.00 0.00 64.86 65.06 3m77 h ILE 46 Cb 0.56 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 3m77 h ILE 46 CO 0.03 0.29 0.20 0.58 0.00 0.00 0.00 178.15 179.26 3m77 h VAL 47 N 0.19 1.17 -0.56 1.67 2.07 -1.19 0.15 116.25 119.75 3m77 h VAL 47 Ca 0.07 -0.46 0.01 0.00 0.82 0.00 0.00 66.70 67.14 3m77 h VAL 47 Cb 0.44 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 3m77 h VAL 47 CO 0.02 0.18 0.36 0.00 0.02 0.00 0.00 177.57 178.14 3m77 h ALA 48 N 1.06 0.71 -0.56 1.67 0.00 -0.79 -0.97 119.26 120.38 3m77 h ALA 48 Ca 0.14 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 3m77 h ALA 48 Cb 0.10 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3m77 h ALA 48 CO -0.02 0.13 -0.03 0.77 0.00 0.00 0.00 179.25 180.09 3m77 h SER 49 N 0.74 0.98 -0.27 0.00 0.02 -0.84 -0.36 113.55 113.81 3m77 h SER 49 Ca 0.21 -0.29 -0.02 0.00 -0.84 0.00 0.00 61.79 60.85 3m77 h SER 49 Cb -0.06 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.20 3m77 h SER 49 CO -0.06 1.05 0.09 0.00 -1.14 0.00 0.00 176.83 176.78 3m77 h ALA 50 N 1.04 0.35 -0.66 3.77 0.00 -0.57 -0.11 119.26 123.08 3m77 h ALA 50 Ca 0.16 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3m77 h ALA 50 Cb 0.58 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 3m77 h ALA 50 CO 0.03 -0.03 0.39 0.28 0.00 0.00 0.00 179.25 179.93 3m77 h VAL 51 N 0.28 1.19 -0.23 0.00 2.07 -1.05 -1.81 116.25 116.69 3m77 h VAL 51 Ca 0.09 -0.44 0.01 0.00 0.82 0.00 0.00 66.70 67.18 3m77 h VAL 51 Cb 0.22 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 3m77 h VAL 51 CO -0.00 0.20 0.12 -0.25 0.02 0.00 0.00 177.57 177.66 3m77 h TRP 52 N 0.90 0.22 -0.54 1.57 7.01 -0.83 -0.30 115.95 123.98 3m77 h TRP 52 Ca 0.24 0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.32 3m77 h TRP 52 Cb -0.02 -0.07 -0.06 0.00 -2.10 0.00 0.00 29.16 26.91 3m77 h TRP 52 CO -0.01 0.13 0.19 0.82 -2.79 0.00 0.00 178.44 176.77 3m77 h ILE 53 N 0.25 0.80 -0.38 2.65 2.04 -0.81 0.14 117.51 122.20 3m77 h ILE 53 Ca 0.09 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.81 3m77 h ILE 53 Cb 0.02 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.48 3m77 h ILE 53 CO -0.06 0.07 0.18 0.25 0.00 0.00 0.00 178.15 178.59 3m77 h LEU 54 N 0.37 0.50 -0.67 1.44 5.85 -0.95 -1.28 115.31 120.58 3m77 h LEU 54 Ca 0.27 -0.13 -0.14 0.00 0.84 0.00 0.00 57.88 58.72 3m77 h LEU 54 Cb 0.31 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 3m77 h LEU 54 CO -0.27 0.49 -0.44 -0.26 -0.34 0.00 0.00 178.44 177.62 3m77 h PHE 55 N 0.48 0.62 -0.48 1.25 -1.00 -0.59 -0.11 116.94 117.12 3m77 h PHE 55 Ca 0.13 -0.19 -0.03 0.00 2.81 0.00 0.00 57.97 60.69 3m77 h PHE 55 Cb 0.13 -0.13 -0.02 0.00 3.61 0.00 0.00 35.95 39.53 3m77 h PHE 55 CO -0.01 0.87 0.17 0.82 -1.61 0.00 0.00 178.31 178.55 3m77 h ILE 56 N 0.42 1.22 -0.71 -0.55 1.08 -0.58 0.11 117.51 118.51 3m77 h ILE 56 Ca 0.03 -0.69 -0.06 0.00 -0.39 0.00 0.00 64.86 63.75 3m77 h ILE 56 Cb 0.94 0.77 -0.03 0.00 -3.07 0.00 0.00 36.82 35.43 3m77 h ILE 56 CO 0.08 0.26 0.20 -0.07 -0.69 0.00 0.00 178.15 177.93 3m77 h LEU 57 N 0.63 1.04 -0.58 1.44 3.38 -0.95 0.44 115.31 120.71 3m77 h LEU 57 Ca 0.16 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 3m77 h LEU 57 Cb 0.23 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 3m77 h LEU 57 CO -0.01 0.98 0.25 0.24 0.09 0.00 0.00 178.44 179.99 3m77 h MET 58 N 1.06 0.86 -0.28 1.13 2.86 -0.71 -1.40 114.93 118.45 3m77 h MET 58 Ca 0.23 -0.15 -0.11 0.00 -2.06 0.00 0.00 59.70 57.61 3m77 h MET 58 Cb 0.32 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 3m77 h MET 58 CO -0.00 0.73 -0.28 -0.92 1.06 0.00 0.00 176.91 177.49 3m77 h TYR 59 N 0.80 0.64 -1.01 -0.22 3.20 -0.57 -0.19 116.97 119.62 3m77 h TYR 59 Ca 0.20 -0.15 0.01 0.00 3.14 0.00 0.00 58.73 61.93 3m77 h TYR 59 Cb 0.17 -0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.24 3m77 h TYR 59 CO 0.01 0.79 0.67 0.00 -1.64 0.00 0.00 178.16 177.98 3m77 h ALA 60 N 1.21 1.29 -0.63 1.82 0.00 -0.68 -0.06 119.26 122.20 3m77 h ALA 60 Ca 0.06 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3m77 h ALA 60 Cb 0.74 -0.41 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3m77 h ALA 60 CO 0.06 0.66 0.20 -0.92 0.00 0.00 0.00 179.25 179.25 3m77 h TYR 61 N 1.36 1.01 -0.73 0.00 3.20 -0.70 -1.75 116.97 119.35 3m77 h TYR 61 Ca 0.37 -0.10 0.00 0.00 3.14 0.00 0.00 58.73 62.14 3m77 h TYR 61 Cb -0.15 -0.29 -0.04 0.00 1.54 0.00 0.00 36.73 37.79 3m77 h TYR 61 CO -0.00 0.82 0.48 -0.22 -1.64 0.00 0.00 178.16 177.60 3m77 h LYS 62 N 0.90 0.97 -0.66 1.82 3.64 -0.34 0.26 116.57 123.16 3m77 h LYS 62 Ca 0.20 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.45 3m77 h LYS 62 Cb 0.29 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 3m77 h LYS 62 CO -0.01 0.65 0.13 -0.07 -2.27 0.00 0.00 179.45 177.89 3m77 h LEU 63 N 1.00 1.02 0.03 5.20 3.38 -0.71 0.45 115.31 125.66 3m77 h LEU 63 Ca 0.27 -0.23 -0.24 0.00 0.09 0.00 0.00 57.88 57.78 3m77 h LEU 63 Cb -0.10 -0.27 0.02 0.00 0.09 0.00 0.00 40.66 40.40 3m77 h LEU 63 CO -0.06 1.00 -0.93 -0.09 0.09 0.00 0.00 178.44 178.45 3m77 h ARG 64 N 1.01 0.59 0.00 1.13 9.65 -1.04 -3.34 114.38 122.37 3m77 h ARG 64 Ca 0.21 -0.67 0.00 0.00 -1.10 0.00 0.00 59.98 58.42 3m77 h ARG 64 Cb 0.40 0.20 0.00 0.00 -1.39 0.00 0.00 29.97 29.18 3m77 h ARG 64 CO 0.01 1.27 -0.24 0.66 2.80 0.00 0.00 179.97 184.47 3m77 n TYR 65 N -3.97 0.00 -2.50 2.20 4.01 0.06 -4.65 117.16 112.31 3m77 n TYR 65 Ca -0.11 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.54 3m77 n TYR 65 Cb 0.83 -0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.90 3m77 n TYR 65 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3m77 n TYR 66 N -1.12 1.76 -0.16 -0.72 4.01 0.15 -4.94 117.16 116.14 3m77 n TYR 66 Ca 0.01 -2.11 0.03 0.00 -0.16 0.00 0.00 57.90 55.67 3m77 n TYR 66 Cb 0.07 -0.27 0.32 0.00 -0.31 0.00 0.00 39.34 39.15 3m77 n TYR 66 CO 0.00 0.00 0.00 0.35 -0.46 0.00 0.00 176.86 176.75 3m77 h PHE 67 N 2.37 0.79 0.00 -0.72 3.57 -1.61 -0.85 116.94 120.49 3m77 h PHE 67 Ca 0.05 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.55 3m77 h PHE 67 Cb 1.39 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.85 3m77 h PHE 67 CO 0.63 0.48 -0.11 0.93 -2.23 0.00 0.00 178.31 178.00 3m77 h GLU 68 N 0.84 0.00 -0.42 1.11 4.39 -1.92 0.11 114.58 118.70 3m77 h GLU 68 Ca 0.26 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.81 3m77 h GLU 68 Cb 0.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 3m77 h GLU 68 CO -0.07 0.11 -0.32 0.93 -1.16 0.00 0.00 179.01 178.50 3m77 h GLU 69 N 0.00 0.95 -0.22 2.33 5.08 -1.51 -1.67 114.58 119.53 3m77 h GLU 69 Ca -0.00 -0.47 -0.03 0.00 -1.00 0.00 0.00 59.36 57.86 3m77 h GLU 69 Cb 0.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 3m77 h GLU 69 CO 0.01 1.13 0.02 0.28 -1.00 0.00 0.00 179.01 179.46 3m77 h VAL 70 N 0.78 1.24 -0.48 3.13 2.07 -1.21 -2.11 116.25 119.68 3m77 h VAL 70 Ca 0.08 -0.80 0.09 0.00 0.82 0.00 0.00 66.70 66.88 3m77 h VAL 70 Cb 0.91 1.33 -0.07 0.00 -1.52 0.00 0.00 31.29 31.94 3m77 h VAL 70 CO 0.08 0.25 0.04 -0.09 0.02 0.00 0.00 177.57 177.88 3m77 h ARG 71 N 0.17 0.16 -0.56 1.57 2.43 -0.74 0.48 114.38 117.89 3m77 h ARG 71 Ca 0.07 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.14 3m77 h ARG 71 Cb 0.35 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.84 3m77 h ARG 71 CO 0.01 0.11 0.01 0.00 -1.51 0.00 0.00 179.97 178.59 3m77 h ALA 72 N 1.40 0.75 -0.46 2.80 0.00 -1.19 -1.41 119.26 121.15 3m77 h ALA 72 Ca 0.24 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 3m77 h ALA 72 Cb 0.34 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3m77 h ALA 72 CO -0.36 0.57 -0.16 1.05 0.00 0.00 0.00 179.25 180.35 3m77 h GLU 73 N 0.87 0.89 -0.53 0.00 4.11 -0.99 -1.96 114.58 116.97 3m77 h GLU 73 Ca 0.16 -0.34 -0.02 0.00 0.07 0.00 0.00 59.36 59.23 3m77 h GLU 73 Cb 0.52 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 3m77 h GLU 73 CO 0.03 0.98 0.25 -0.92 0.07 0.00 0.00 179.01 179.42 3m77 h TYR 74 N 0.78 0.76 0.00 2.06 3.20 -0.71 -1.71 116.97 121.35 3m77 h TYR 74 Ca 0.12 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.95 3m77 h TYR 74 Cb 0.70 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.73 3m77 h TYR 74 CO 0.04 0.60 -0.15 0.45 -1.64 0.00 0.00 178.16 177.46 3m77 h HIS 75 N 0.71 0.00 -3.02 -3.82 3.86 -1.17 -3.41 115.15 108.29 3m77 h HIS 75 Ca 0.18 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.87 3m77 h HIS 75 Cb 0.12 0.00 0.05 0.00 1.06 0.00 0.00 27.41 28.64 3m77 h HIS 75 CO -0.00 0.00 0.86 0.45 0.86 0.00 0.00 177.93 180.10 3m77 s SER 76 N -4.65 6.56 0.00 2.45 0.15 -0.74 -4.88 113.70 112.58 3m77 s SER 76 Ca 0.09 2.70 0.20 0.00 0.70 0.00 0.00 55.95 59.64 3m77 s SER 76 Cb 0.12 -2.61 0.95 0.00 -1.71 0.00 0.00 66.02 62.77 3m77 s SER 76 CO 0.63 -0.82 1.64 -0.81 1.20 0.00 0.00 173.24 175.09 3m77 n PRO 77 N 3.30 0.15 -0.08 5.44 -0.04 -1.26 -2.50 135.00 140.01 3m77 n PRO 77 Ca 0.11 0.12 -0.17 0.00 -0.04 0.00 0.00 63.50 63.53 3m77 n PRO 77 Cb 0.38 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.29 3m77 n PRO 77 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3m77 n VAL 78 N -1.39 1.16 0.48 0.52 0.31 -1.26 -4.76 118.33 113.39 3m77 n VAL 78 Ca 0.07 -0.13 0.13 0.00 -0.01 0.00 0.00 64.34 64.40 3m77 n VAL 78 Cb 0.20 -1.86 0.45 0.00 -0.91 0.00 0.00 33.84 31.71 3m77 n VAL 78 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 3m77 h ARG 79 N -0.70 0.00 -0.50 5.55 3.08 -1.77 -3.15 114.38 116.89 3m77 h ARG 79 Ca -0.35 0.00 0.04 0.00 0.07 0.00 0.00 59.98 59.74 3m77 h ARG 79 Cb 1.22 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.24 3m77 h ARG 79 CO -0.21 0.00 0.33 0.27 -1.07 0.00 0.00 179.97 179.29 3m77 h PHE 80 N 0.00 0.50 -0.56 3.04 -5.15 -1.00 -2.84 116.94 110.93 3m77 h PHE 80 Ca 0.00 0.01 0.07 0.00 -0.20 0.00 0.00 57.97 57.85 3m77 h PHE 80 Cb 0.58 -0.17 -0.03 0.00 0.22 0.00 0.00 35.95 36.55 3m77 h PHE 80 CO 0.00 0.28 0.37 0.77 -2.00 0.00 0.00 178.31 177.74 3m77 h SER 81 N 0.51 0.43 0.62 -0.68 0.02 -1.84 -1.80 113.55 110.81 3m77 h SER 81 Ca 0.21 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.13 3m77 h SER 81 Cb 0.18 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.63 3m77 h SER 81 CO -0.05 0.28 -0.12 -0.26 -1.14 0.00 0.00 176.83 175.53 3m77 h PHE 82 N 0.49 0.00 -0.09 3.45 0.04 -1.76 -1.36 116.94 117.70 3m77 h PHE 82 Ca 0.24 0.00 0.03 0.00 2.80 0.00 0.00 57.97 61.04 3m77 h PHE 82 Cb 0.34 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.49 3m77 h PHE 82 CO -0.00 0.12 0.07 0.82 -0.60 0.00 0.00 178.31 178.72 3m77 h ILE 83 N 0.00 0.90 0.00 -0.55 2.04 -1.51 -1.06 117.51 117.33 3m77 h ILE 83 Ca -0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 3m77 h ILE 83 Cb 0.46 0.95 -0.00 0.00 -0.74 0.00 0.00 36.82 37.49 3m77 h ILE 83 CO 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 178.15 178.15 3m77 h ALA 84 N 1.95 1.16 -0.04 1.87 0.00 -1.40 -0.84 119.26 121.96 3m77 h ALA 84 Ca 0.04 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.95 3m77 h ALA 84 Cb 0.18 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 3m77 h ALA 84 CO -0.00 0.02 0.05 -0.07 0.00 0.00 0.00 179.25 179.24 3m77 h LEU 85 N 0.00 0.00 0.29 0.00 3.38 -1.36 -2.12 115.31 115.49 3m77 h LEU 85 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3m77 h LEU 85 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3m77 h LEU 85 CO 0.00 0.00 -0.14 0.40 0.09 0.00 0.00 178.44 178.79 3m77 h ILE 86 N 0.00 0.64 0.00 1.22 2.04 -1.32 -0.66 117.51 119.43 3m77 h ILE 86 Ca 0.02 -0.77 -0.09 0.00 1.00 0.00 0.00 64.86 65.01 3m77 h ILE 86 Cb 0.11 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 3m77 h ILE 86 CO -0.00 0.13 -0.44 1.55 0.00 0.00 0.00 178.15 179.40 3m77 h PRO 87 N -0.86 0.00 -0.01 2.37 0.13 -1.70 -1.38 132.00 130.55 3m77 h PRO 87 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 3m77 h PRO 87 Cb 0.52 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.64 3m77 h PRO 87 CO 0.06 0.44 -0.01 0.82 -0.23 0.00 0.00 178.00 179.09 3m77 h ILE 88 N 0.00 0.98 -0.08 -3.56 2.04 -1.35 -1.67 117.51 113.87 3m77 h ILE 88 Ca -0.00 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.74 3m77 h ILE 88 Cb 0.78 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 3m77 h ILE 88 CO 0.06 0.00 -0.47 0.71 0.00 0.00 0.00 178.15 178.45 3m77 h THR 89 N -0.00 1.34 -0.65 -0.27 1.35 -0.94 -1.73 112.91 111.99 3m77 h THR 89 Ca 0.01 -1.65 0.04 0.00 -0.55 0.00 0.00 66.41 64.26 3m77 h THR 89 Cb 0.02 1.80 -0.05 0.00 -1.73 0.00 0.00 68.15 68.19 3m77 h THR 89 CO -0.02 0.49 0.38 0.74 -0.25 0.00 0.00 175.52 176.86 3m77 h THR 90 N 0.15 1.02 -0.38 6.82 2.02 -1.01 0.27 112.91 121.81 3m77 h THR 90 Ca 0.01 -0.25 -0.13 0.00 0.77 0.00 0.00 66.41 66.81 3m77 h THR 90 Cb 0.89 0.23 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 3m77 h THR 90 CO 0.07 0.13 -0.26 0.24 0.37 0.00 0.00 175.52 176.07 3m77 h MET 91 N 0.72 0.84 -0.71 6.66 2.86 -0.81 -1.38 114.93 123.11 3m77 h MET 91 Ca 0.28 -0.40 -0.07 0.00 -2.06 0.00 0.00 59.70 57.45 3m77 h MET 91 Cb 0.11 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 3m77 h MET 91 CO -0.15 1.04 0.17 -0.07 1.06 0.00 0.00 176.91 178.96 3m77 h LEU 92 N 0.64 1.08 -0.60 1.22 3.38 -1.02 0.11 115.31 120.12 3m77 h LEU 92 Ca 0.07 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 3m77 h LEU 92 Cb 0.83 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 3m77 h LEU 92 CO 0.07 1.03 0.14 0.58 0.09 0.00 0.00 178.44 180.36 3m77 h VAL 93 N 1.07 1.25 -0.69 1.22 2.07 -0.88 -1.13 116.25 119.16 3m77 h VAL 93 Ca 0.22 -0.91 0.11 0.00 0.82 0.00 0.00 66.70 66.94 3m77 h VAL 93 Cb 0.38 0.70 -0.08 0.00 -1.52 0.00 0.00 31.29 30.77 3m77 h VAL 93 CO 0.00 0.34 0.29 1.23 0.02 0.00 0.00 177.57 179.45 3m77 h GLY 94 N 0.86 1.01 1.01 2.17 0.00 -0.77 -0.07 103.07 107.28 3m77 h GLY 94 Ca 0.19 -0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.35 3m77 h GLY 94 CO 0.00 -0.02 0.48 -0.55 0.00 0.00 0.00 176.54 176.46 3m77 h ASP 95 N 0.48 0.96 0.05 0.19 3.32 -0.17 -0.70 116.42 120.55 3m77 h ASP 95 Ca 0.36 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.34 3m77 h ASP 95 Cb 0.46 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.76 3m77 h ASP 95 CO -0.33 0.74 -0.03 0.40 -1.72 0.00 0.00 179.24 178.31 3m77 h ILE 96 N 1.10 0.95 0.00 0.35 2.04 -0.65 -3.13 117.51 118.16 3m77 h ILE 96 Ca 0.29 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.15 3m77 h ILE 96 Cb -0.04 0.95 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 3m77 h ILE 96 CO -0.05 0.00 -0.00 -0.07 0.00 0.00 0.00 178.15 178.02 3m77 h LEU 97 N -0.07 0.00 -1.84 1.44 3.38 -0.37 -2.58 115.31 115.27 3m77 h LEU 97 Ca -0.01 0.00 0.20 0.00 0.09 0.00 0.00 57.88 58.17 3m77 h LEU 97 Cb 0.06 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 3m77 h LEU 97 CO 0.01 0.00 0.54 0.22 0.09 0.00 0.00 178.44 179.30 3m77 h TYR 98 N 0.00 0.18 0.00 1.13 3.20 -1.09 0.17 116.97 120.56 3m77 h TYR 98 Ca -0.00 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 3m77 h TYR 98 Cb 0.45 -0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.66 3m77 h TYR 98 CO 0.00 0.05 -0.11 0.07 -1.64 0.00 0.00 178.16 176.54 3m77 h ARG 99 N 0.14 0.00 0.00 1.82 0.11 -1.64 -3.26 114.38 111.55 3m77 h ARG 99 Ca 0.38 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 60.27 3m77 h ARG 99 Cb 1.29 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 32.33 3m77 h ARG 99 CO -0.06 0.11 -1.71 0.91 0.10 0.00 0.00 179.97 179.31 3m77 n TRP 100 N -3.38 0.00 -3.26 4.08 8.01 0.01 -4.97 117.44 117.93 3m77 n TRP 100 Ca -0.01 0.00 -0.06 0.00 -1.31 0.00 0.00 57.50 56.13 3m77 n TRP 100 Cb 0.29 -0.50 -0.03 0.00 -2.01 0.00 0.00 31.31 29.05 3m77 n TRP 100 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.69 177.89 3m77 s ASN 101 N -4.59 -0.55 0.54 -0.99 3.84 0.38 -5.02 114.94 108.55 3m77 s ASN 101 Ca -0.09 -1.07 0.26 0.00 0.21 0.00 0.00 52.86 52.17 3m77 s ASN 101 Cb 0.04 1.45 1.54 0.00 -0.55 0.00 0.00 41.25 43.73 3m77 s ASN 101 CO 0.38 -0.20 2.14 -0.65 -2.79 0.00 0.00 177.10 175.97 3m77 h PRO 102 N 7.02 0.00 -0.06 0.43 0.11 -1.77 -2.01 132.00 135.73 3m77 h PRO 102 Ca 0.05 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.14 3m77 h PRO 102 Cb 1.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 3m77 h PRO 102 CO 0.14 0.08 -0.04 -0.07 -0.21 0.00 0.00 178.00 177.90 3m77 h LEU 103 N 0.00 0.13 -0.69 2.35 3.38 -1.94 -0.65 115.31 117.90 3m77 h LEU 103 Ca -0.00 -0.45 -0.09 0.00 0.09 0.00 0.00 57.88 57.43 3m77 h LEU 103 Cb 0.20 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 3m77 h LEU 103 CO 0.01 0.55 -0.02 0.40 0.09 0.00 0.00 178.44 179.47 3m77 h ILE 104 N -0.28 1.26 -0.52 1.22 2.04 -1.91 -2.24 117.51 117.07 3m77 h ILE 104 Ca 0.01 -1.14 0.03 0.00 1.00 0.00 0.00 64.86 64.76 3m77 h ILE 104 Cb 0.51 0.84 -0.04 0.00 -0.74 0.00 0.00 36.82 37.39 3m77 h ILE 104 CO 0.01 0.41 0.30 0.00 0.00 0.00 0.00 178.15 178.87 3m77 h ALA 105 N 1.06 0.67 -0.64 1.87 0.00 -1.32 -1.87 119.26 119.02 3m77 h ALA 105 Ca 0.16 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 3m77 h ALA 105 Cb 0.55 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 3m77 h ALA 105 CO 0.03 -0.01 0.09 1.49 0.00 0.00 0.00 179.25 180.85 3m77 h GLU 106 N 0.59 1.05 -0.16 0.00 4.81 -0.79 -0.34 114.58 119.75 3m77 h GLU 106 Ca 0.21 -0.28 0.01 0.00 -0.13 0.00 0.00 59.36 59.18 3m77 h GLU 106 Cb 0.05 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 3m77 h GLU 106 CO -0.11 0.97 0.08 0.28 -0.73 0.00 0.00 179.01 179.50 3m77 h VAL 107 N 0.99 1.00 -0.81 0.32 2.07 -0.98 -1.44 116.25 117.39 3m77 h VAL 107 Ca 0.20 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.63 3m77 h VAL 107 Cb 0.44 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 30.98 3m77 h VAL 107 CO 0.01 0.03 0.40 -0.07 0.02 0.00 0.00 177.57 177.96 3m77 h LEU 108 N 0.17 1.06 -0.58 2.57 3.38 -0.96 -1.04 115.31 119.91 3m77 h LEU 108 Ca 0.06 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 3m77 h LEU 108 Cb 0.01 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 3m77 h LEU 108 CO -0.04 0.89 0.23 0.40 0.09 0.00 0.00 178.44 180.01 3m77 h ILE 109 N 1.15 1.23 -0.37 1.22 2.04 -0.83 0.14 117.51 122.09 3m77 h ILE 109 Ca 0.28 -0.71 -0.17 0.00 1.00 0.00 0.00 64.86 65.26 3m77 h ILE 109 Cb 0.11 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 36.79 3m77 h ILE 109 CO -0.04 0.28 -0.43 -0.50 0.00 0.00 0.00 178.15 177.46 3m77 h TRP 110 N 0.81 1.13 -0.50 1.37 4.06 -1.04 -0.48 115.95 121.30 3m77 h TRP 110 Ca 0.19 -0.36 0.02 0.00 2.06 0.00 0.00 58.89 60.81 3m77 h TRP 110 Cb 0.21 -0.23 -0.03 0.00 -1.00 0.00 0.00 29.16 28.10 3m77 h TRP 110 CO 0.01 1.19 0.30 0.82 -3.56 0.00 0.00 178.44 177.20 3m77 h ILE 111 N 0.75 1.06 -0.27 1.49 2.04 -1.02 0.20 117.51 121.76 3m77 h ILE 111 Ca 0.05 -0.21 -0.11 0.00 1.00 0.00 0.00 64.86 65.60 3m77 h ILE 111 Cb 1.03 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 3m77 h ILE 111 CO 0.10 0.11 -0.28 1.23 0.00 0.00 0.00 178.15 179.31 3m77 h GLY 112 N 0.60 0.58 0.53 5.37 0.00 -0.83 0.02 103.07 109.35 3m77 h GLY 112 Ca 0.20 -0.50 -0.00 0.00 0.00 0.00 0.00 47.33 47.02 3m77 h GLY 112 CO -0.08 0.46 -0.05 -0.84 0.00 0.00 0.00 176.54 176.03 3m77 h THR 113 N 0.47 1.13 -0.52 4.70 2.02 -0.76 -0.44 112.91 119.50 3m77 h THR 113 Ca 0.06 -0.99 0.00 0.00 0.77 0.00 0.00 66.41 66.26 3m77 h THR 113 Cb 0.73 1.74 -0.03 0.00 -1.74 0.00 0.00 68.15 68.86 3m77 h THR 113 CO 0.06 0.24 0.34 0.40 0.37 0.00 0.00 175.52 176.93 3m77 h ILE 114 N -0.60 1.14 -0.29 3.11 1.08 -1.00 -1.76 117.51 119.18 3m77 h ILE 114 Ca -0.01 -0.25 0.01 0.00 -0.39 0.00 0.00 64.86 64.22 3m77 h ILE 114 Cb 0.49 0.37 -0.02 0.00 -3.07 0.00 0.00 36.82 34.59 3m77 h ILE 114 CO 0.02 0.13 0.18 1.23 -0.69 0.00 0.00 178.15 179.02 3m77 h GLY 115 N 0.70 0.41 1.30 5.37 0.00 -0.98 0.13 103.07 110.01 3m77 h GLY 115 Ca 0.19 -0.14 -0.12 0.00 0.00 0.00 0.00 47.33 47.26 3m77 h GLY 115 CO -0.04 0.13 -0.23 0.06 0.00 0.00 0.00 176.54 176.46 3m77 h GLN 116 N 0.37 0.80 -0.38 4.80 -0.00 -0.91 -0.15 115.11 119.64 3m77 h GLN 116 Ca 0.11 -0.33 -0.13 0.00 -0.00 0.00 0.00 58.65 58.31 3m77 h GLN 116 Cb -0.02 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.48 27.42 3m77 h GLN 116 CO -0.04 0.95 -0.26 1.25 -0.00 0.00 0.00 178.83 180.73 3m77 h LEU 117 N 0.69 0.88 -0.45 0.06 5.85 -1.11 -1.02 115.31 120.21 3m77 h LEU 117 Ca 0.09 -0.43 -0.01 0.00 0.84 0.00 0.00 57.88 58.37 3m77 h LEU 117 Cb 0.75 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.51 3m77 h LEU 117 CO 0.06 1.12 0.24 -0.07 -0.34 0.00 0.00 178.44 179.45 3m77 h LEU 118 N 0.64 0.57 -0.00 2.25 3.38 -0.85 -0.66 115.31 120.64 3m77 h LEU 118 Ca 0.08 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.97 3m77 h LEU 118 Cb 0.83 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 3m77 h LEU 118 CO 0.07 0.51 -0.11 0.15 0.09 0.00 0.00 178.44 179.14 3m77 h PHE 119 N 0.59 -0.28 -0.47 1.13 3.57 -0.74 -0.11 116.94 120.64 3m77 h PHE 119 Ca 0.16 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.55 3m77 h PHE 119 Cb 0.07 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 3m77 h PHE 119 CO -0.02 -0.17 -0.17 0.77 -2.23 0.00 0.00 178.31 176.49 3m77 h SER 120 N -0.19 0.96 -0.79 0.41 0.02 -1.15 -0.19 113.55 112.63 3m77 h SER 120 Ca 0.04 -0.38 0.02 0.00 -0.84 0.00 0.00 61.79 60.63 3m77 h SER 120 Cb 0.24 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.48 3m77 h SER 120 CO -0.12 1.13 0.52 0.74 -1.14 0.00 0.00 176.83 177.96 3m77 h THR 121 N 0.79 1.17 -0.00 -2.27 2.02 -0.89 0.49 112.91 114.21 3m77 h THR 121 Ca 0.11 -0.35 -0.00 0.00 0.77 0.00 0.00 66.41 66.93 3m77 h THR 121 Cb 0.74 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 3m77 h THR 121 CO 0.06 0.19 -0.01 -0.07 0.37 0.00 0.00 175.52 176.05 3m77 h LEU 122 N 1.03 0.01 0.03 2.58 3.38 -0.80 -3.37 115.31 118.18 3m77 h LEU 122 Ca 0.30 -0.72 -0.39 0.00 0.09 0.00 0.00 57.88 57.16 3m77 h LEU 122 Cb -0.07 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.62 3m77 h LEU 122 CO -0.07 0.74 -2.35 -1.14 0.09 0.00 0.00 178.44 175.70 3m77 n ARG 123 N -4.73 0.67 -0.15 1.13 3.00 -0.10 -3.52 116.66 112.96 3m77 n ARG 123 Ca -0.09 0.19 -0.10 0.00 -0.00 0.00 0.00 57.85 57.85 3m77 n ARG 123 Cb 0.36 -1.56 -0.01 0.00 0.00 0.00 0.00 32.46 31.25 3m77 n ARG 123 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 3m77 h VAL 124 N -0.08 1.26 -0.56 5.15 2.07 -1.06 -2.83 116.25 120.19 3m77 h VAL 124 Ca -0.55 -0.99 -0.07 0.00 0.82 0.00 0.00 66.70 65.92 3m77 h VAL 124 Cb 1.89 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 32.71 3m77 h VAL 124 CO -0.08 0.34 0.08 0.77 0.02 0.00 0.00 177.57 178.70 3m77 h SER 125 N 0.57 0.85 -0.37 0.57 4.64 -1.70 -2.77 113.55 115.35 3m77 h SER 125 Ca 0.12 -0.18 0.07 0.00 -0.47 0.00 0.00 61.79 61.33 3m77 h SER 125 Cb 0.45 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.30 3m77 h SER 125 CO 0.02 0.87 0.25 -0.08 -0.87 0.00 0.00 176.83 177.02 3m77 h GLU 126 N 0.85 0.19 -0.55 4.77 4.81 -1.54 -0.25 114.58 122.86 3m77 h GLU 126 Ca 0.17 -0.01 0.12 0.00 -0.13 0.00 0.00 59.36 59.51 3m77 h GLU 126 Cb 0.39 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 3m77 h GLU 126 CO 0.01 0.13 0.38 -0.07 -0.73 0.00 0.00 179.01 178.72 3m77 h LEU 127 N 0.20 0.20 0.00 1.64 3.38 -1.39 -1.79 115.31 117.54 3m77 h LEU 127 Ca 0.17 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3m77 h LEU 127 Cb 0.40 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.12 3m77 h LEU 127 CO -0.03 0.11 0.00 0.79 0.09 0.00 0.00 178.44 179.41 3m77 n TRP 128 N -4.44 0.00 0.40 1.13 8.01 -0.11 -1.67 117.44 120.77 3m77 n TRP 128 Ca 0.09 0.00 0.14 0.00 -1.31 0.00 0.00 57.50 56.42 3m77 n TRP 128 Cb 0.47 -0.34 0.48 0.00 -2.01 0.00 0.00 31.31 29.91 3m77 n TRP 128 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.69 178.64 3m77 h GLN 129 N 0.00 0.00 0.00 -0.99 4.20 -1.48 -3.49 115.11 113.34 3m77 h GLN 129 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3m77 h GLN 129 Cb 0.15 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.93 3m77 h GLN 129 CO 0.00 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.57 3m77 n GLY 130 N 0.45 -2.08 2.13 3.46 0.00 -0.67 -4.96 105.19 103.52 3m77 n GLY 130 Ca 0.03 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.55 3m77 n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m77 n GLY 131 N -1.93 1.29 0.84 -0.02 0.00 -1.26 -4.79 105.19 99.32 3m77 n GLY 131 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 3m77 n GLY 131 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3m77 n VAL 132 N -2.00 1.20 -2.01 1.61 0.31 -1.26 -4.98 118.33 111.19 3m77 n VAL 132 Ca 0.00 0.31 -0.41 0.00 -0.01 0.00 0.00 64.34 64.23 3m77 n VAL 132 Cb 0.00 -1.74 -0.02 0.00 -0.91 0.00 0.00 33.84 31.18 3m77 n VAL 132 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 3m77 s PHE 133 N -2.19 2.95 0.36 3.52 5.36 -1.26 -4.87 117.98 121.85 3m77 s PHE 133 Ca -0.07 1.21 0.06 0.00 -0.96 0.00 0.00 56.93 57.17 3m77 s PHE 133 Cb 0.01 -3.80 -0.07 0.00 -0.34 0.00 0.00 43.02 38.82 3m77 s PHE 133 CO 0.09 -2.41 0.02 -1.21 -1.46 0.00 0.00 175.22 170.26 3m77 s GLU 134 N -1.27 1.80 0.30 10.12 2.02 -1.26 -5.01 118.70 125.41 3m77 s GLU 134 Ca 0.54 -2.00 0.02 0.00 0.02 0.00 0.00 54.97 53.55 3m77 s GLU 134 Cb -0.42 -1.29 0.59 0.00 0.10 0.00 0.00 34.13 33.12 3m77 s GLU 134 CO 0.51 -0.09 1.87 0.37 0.02 0.00 0.00 175.26 177.94 3m77 h GLN 135 N 1.96 0.93 0.00 1.61 5.75 -2.01 0.70 115.11 124.05 3m77 h GLN 135 Ca -0.42 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.02 3m77 h GLN 135 Cb 1.24 -0.21 0.00 0.00 1.07 0.00 0.00 27.48 29.58 3m77 h GLN 135 CO 0.75 0.61 0.00 0.36 -2.65 0.00 0.00 178.83 177.90 3m77 n LYS 136 N -4.55 0.06 0.00 1.69 2.85 -1.26 -2.09 118.16 114.85 3m77 n LYS 136 Ca 0.17 0.22 0.15 0.00 -1.05 0.00 0.00 58.31 57.80 3m77 n LYS 136 Cb 0.31 -1.50 0.80 0.00 -0.65 0.00 0.00 35.03 33.99 3m77 n LYS 136 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 3m77 n SER 137 N -1.44 0.14 -4.56 -5.58 7.64 0.24 -4.72 113.62 105.33 3m77 n SER 137 Ca 0.04 -0.59 -0.42 0.00 1.01 0.00 0.00 58.87 58.91 3m77 n SER 137 Cb 0.15 -0.13 -0.02 0.00 -1.01 0.00 0.00 64.21 63.21 3m77 n SER 137 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3m77 s THR 138 N -2.32 4.02 0.19 0.44 2.01 -0.89 -4.78 115.64 114.32 3m77 s THR 138 Ca 0.36 -1.24 0.11 0.00 0.31 0.00 0.00 61.69 61.23 3m77 s THR 138 Cb 0.21 -5.11 -0.04 0.00 0.01 0.00 0.00 72.50 67.57 3m77 s THR 138 CO 0.42 -1.96 -0.23 -1.00 -0.69 0.00 0.00 174.62 171.17 3m77 s HIS 139 N 4.61 2.20 0.52 4.92 3.76 -1.26 -4.88 115.29 125.16 3m77 s HIS 139 Ca 0.49 -0.38 0.22 0.00 -0.15 0.00 0.00 55.06 55.23 3m77 s HIS 139 Cb 0.01 -1.08 1.33 0.00 1.11 0.00 0.00 32.58 33.96 3m77 s HIS 139 CO -0.03 0.48 2.05 -1.35 -0.85 0.00 0.00 174.74 175.03 3m77 h PRO 140 N 3.16 0.02 -0.12 8.40 0.11 -1.92 -2.00 132.00 139.65 3m77 h PRO 140 Ca -0.45 -0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.69 3m77 h PRO 140 Cb 1.21 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 3m77 h PRO 140 CO 0.49 0.02 0.20 0.66 -0.21 0.00 0.00 178.00 179.16 3m77 h SER 141 N 0.02 0.00 -0.19 -2.05 4.64 -1.94 -1.44 113.55 112.59 3m77 h SER 141 Ca 0.17 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.54 3m77 h SER 141 Cb 0.65 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.73 3m77 h SER 141 CO -0.01 0.00 0.17 0.15 -0.87 0.00 0.00 176.83 176.28 3m77 h PHE 142 N 0.00 0.00 -0.11 4.77 3.57 -1.70 -0.77 116.94 122.69 3m77 h PHE 142 Ca 0.06 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.59 3m77 h PHE 142 Cb 0.46 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.19 3m77 h PHE 142 CO 0.00 0.00 0.11 1.88 -2.23 0.00 0.00 178.31 178.07 3m77 h TYR 143 N 0.00 0.00 0.23 0.41 0.05 -1.48 -3.01 116.97 113.16 3m77 h TYR 143 Ca 0.09 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.86 3m77 h TYR 143 Cb 0.44 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.18 3m77 h TYR 143 CO 0.00 0.00 -0.11 -0.07 -1.05 0.00 0.00 178.16 176.93 3m77 h LEU 144 N 0.00 -0.26 -0.15 3.88 3.38 -1.35 0.25 115.31 121.06 3m77 h LEU 144 Ca 0.05 -0.14 -0.16 0.00 0.09 0.00 0.00 57.88 57.73 3m77 h LEU 144 Cb 0.28 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 3m77 h LEU 144 CO -0.00 -0.01 -0.77 1.55 0.09 0.00 0.00 178.44 179.30 3m77 h PRO 145 N -0.51 0.00 0.12 1.13 0.13 -1.75 -1.58 132.00 129.54 3m77 h PRO 145 Ca -0.03 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.81 3m77 h PRO 145 Cb 0.38 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.51 3m77 h PRO 145 CO 0.05 0.77 -1.38 0.00 -0.23 0.00 0.00 178.00 177.21 3m77 h ALA 146 N 1.23 0.19 0.00 -0.56 0.00 -1.52 -3.40 119.26 115.20 3m77 h ALA 146 Ca -0.01 -1.00 0.00 0.00 0.00 0.00 0.00 54.91 53.90 3m77 h ALA 146 Cb 1.52 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.45 3m77 h ALA 146 CO 0.10 1.06 0.00 0.28 0.00 0.00 0.00 179.25 180.69 3m77 n VAL 147 N -3.48 0.61 -0.31 0.00 0.31 -0.20 -4.59 118.33 110.67 3m77 n VAL 147 Ca -0.12 0.20 -0.00 0.00 -0.01 0.00 0.00 64.34 64.41 3m77 n VAL 147 Cb 1.03 -1.07 0.18 0.00 -0.91 0.00 0.00 33.84 33.07 3m77 n VAL 147 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3m77 h ALA 148 N 0.00 1.38 -0.58 3.52 0.00 -1.02 -1.78 119.26 120.78 3m77 h ALA 148 Ca 0.00 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 3m77 h ALA 148 Cb 0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 3m77 h ALA 148 CO 0.00 0.56 0.06 0.00 0.00 0.00 0.00 179.25 179.87 3m77 h ALA 149 N 1.45 0.78 -0.53 0.00 0.00 -1.50 -1.14 119.26 118.32 3m77 h ALA 149 Ca 0.34 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 3m77 h ALA 149 Cb -0.10 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 3m77 h ALA 149 CO -0.08 0.56 -0.11 -0.91 0.00 0.00 0.00 179.25 178.71 3m77 h ASN 150 N 0.89 1.02 -0.29 0.00 2.35 -1.68 -1.62 115.58 116.24 3m77 h ASN 150 Ca 0.17 -0.35 -0.03 0.00 -0.55 0.00 0.00 56.30 55.54 3m77 h ASN 150 Cb 0.47 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.54 3m77 h ASN 150 CO 0.02 1.13 0.10 -0.26 -1.65 0.00 0.00 177.43 176.77 3m77 h PHE 151 N 0.88 0.53 -0.15 1.19 0.04 -1.12 -0.43 116.94 117.88 3m77 h PHE 151 Ca 0.14 -0.03 -0.15 0.00 2.80 0.00 0.00 57.97 60.73 3m77 h PHE 151 Cb 0.68 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.67 3m77 h PHE 151 CO 0.05 0.45 -0.48 1.15 -0.60 0.00 0.00 178.31 178.88 3m77 h THR 152 N 0.52 1.34 -0.74 -1.55 2.02 -1.01 -1.77 112.91 111.72 3m77 h THR 152 Ca 0.12 -1.75 0.06 0.00 0.77 0.00 0.00 66.41 65.61 3m77 h THR 152 Cb 0.18 2.03 -0.06 0.00 -1.74 0.00 0.00 68.15 68.57 3m77 h THR 152 CO -0.01 0.54 0.44 0.28 0.37 0.00 0.00 175.52 177.14 3m77 h SER 153 N 0.23 0.68 0.02 4.18 0.02 -1.06 -0.64 113.55 116.99 3m77 h SER 153 Ca -0.02 0.02 0.02 0.00 -0.84 0.00 0.00 61.79 60.97 3m77 h SER 153 Cb 1.10 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.49 3m77 h SER 153 CO 0.10 0.45 -0.15 0.00 -1.14 0.00 0.00 176.83 176.09 3m77 h ALA 154 N 1.36 -0.20 -0.65 3.77 0.00 -0.75 0.80 119.26 123.60 3m77 h ALA 154 Ca 0.32 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 3m77 h ALA 154 Cb 0.15 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 3m77 h ALA 154 CO -0.17 -0.65 0.30 0.77 0.00 0.00 0.00 179.25 179.50 3m77 h SER 155 N -0.26 0.86 -0.36 0.00 0.02 -1.20 -1.81 113.55 110.79 3m77 h SER 155 Ca 0.04 -0.14 -0.13 0.00 -0.84 0.00 0.00 61.79 60.72 3m77 h SER 155 Cb 0.31 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 3m77 h SER 155 CO -0.13 0.76 -0.28 0.28 -1.14 0.00 0.00 176.83 176.31 3m77 h SER 156 N 0.90 0.87 0.01 3.07 0.02 -0.87 -1.71 113.55 115.84 3m77 h SER 156 Ca 0.22 -0.45 -0.11 0.00 -0.84 0.00 0.00 61.79 60.62 3m77 h SER 156 Cb 0.14 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 3m77 h SER 156 CO -0.03 1.13 -0.32 -0.07 -1.14 0.00 0.00 176.83 176.40 3m77 h LEU 157 N 0.61 0.46 -0.96 5.07 3.38 -0.80 -2.58 115.31 120.50 3m77 h LEU 157 Ca 0.07 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 3m77 h LEU 157 Cb 0.86 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 3m77 h LEU 157 CO 0.07 0.76 0.28 0.00 0.09 0.00 0.00 178.44 179.64 3m77 h ALA 158 N 1.28 1.17 -0.80 1.53 0.00 -1.14 -0.02 119.26 121.28 3m77 h ALA 158 Ca 0.05 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 54.84 3m77 h ALA 158 Cb 0.75 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 3m77 h ALA 158 CO 0.06 0.60 0.52 1.25 0.00 0.00 0.00 179.25 181.68 3m77 h LEU 159 N 1.01 0.76 0.00 0.00 5.85 -0.92 -0.81 115.31 121.21 3m77 h LEU 159 Ca 0.24 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.96 3m77 h LEU 159 Cb 0.19 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.06 3m77 h LEU 159 CO -0.02 0.49 0.00 0.18 -0.34 0.00 0.00 178.44 178.75 3m77 n LEU 160 N -4.48 0.00 0.00 2.25 4.77 -0.80 -4.90 117.00 113.84 3m77 n LEU 160 Ca 0.12 0.17 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 3m77 n LEU 160 Cb 0.21 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 3m77 n LEU 160 CO 0.33 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 3m77 n GLY 161 N 1.17 0.73 2.92 -0.72 0.00 -0.31 -5.01 105.19 103.96 3m77 n GLY 161 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 3m77 n GLY 161 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3m77 n TYR 162 N -2.08 2.60 -0.10 1.61 4.01 -0.09 -4.84 117.16 118.28 3m77 n TYR 162 Ca 0.00 -2.68 -0.12 0.00 -0.16 0.00 0.00 57.90 54.94 3m77 n TYR 162 Cb 0.00 -1.63 -0.04 0.00 -0.31 0.00 0.00 39.34 37.36 3m77 n TYR 162 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3m77 h HIS 163 N 5.58 0.66 -0.44 -0.72 3.86 -1.85 0.29 115.15 122.53 3m77 h HIS 163 Ca 0.31 -0.14 -0.12 0.00 -1.16 0.00 0.00 60.37 59.26 3m77 h HIS 163 Cb 0.62 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.91 3m77 h HIS 163 CO 1.15 0.78 -0.19 -0.44 0.86 0.00 0.00 177.93 180.10 3m77 h ASP 164 N 0.35 0.93 -0.90 2.45 3.32 -1.96 -0.24 116.42 120.37 3m77 h ASP 164 Ca 0.07 -0.39 0.02 0.00 0.02 0.00 0.00 57.03 56.75 3m77 h ASP 164 Cb 0.57 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.82 3m77 h ASP 164 CO 0.03 1.11 0.59 -0.07 -1.72 0.00 0.00 179.24 179.18 3m77 h LEU 165 N 0.74 1.01 -0.83 1.55 3.38 -1.96 -2.21 115.31 116.99 3m77 h LEU 165 Ca 0.10 -0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.12 3m77 h LEU 165 Cb 0.75 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 41.19 3m77 h LEU 165 CO 0.06 0.71 0.50 1.23 0.09 0.00 0.00 178.44 181.03 3m77 h GLY 166 N 1.18 1.25 1.64 0.83 0.00 -0.36 -1.76 103.07 105.85 3m77 h GLY 166 Ca 0.34 -0.36 -0.03 0.00 0.00 0.00 0.00 47.33 47.28 3m77 h GLY 166 CO -0.09 0.23 0.06 -0.97 0.00 0.00 0.00 176.54 175.77 3m77 h TYR 167 N 0.90 0.46 -0.16 5.60 0.99 -0.45 0.65 116.97 124.96 3m77 h TYR 167 Ca 0.37 -0.03 -0.00 0.00 2.00 0.00 0.00 58.73 61.07 3m77 h TYR 167 Cb 0.20 -0.14 -0.01 0.00 1.00 0.00 0.00 36.73 37.78 3m77 h TYR 167 CO -0.04 0.42 0.09 -0.07 -0.00 0.00 0.00 178.16 178.56 3m77 h LEU 168 N 0.45 0.19 -0.83 3.88 3.38 -0.93 0.34 115.31 121.80 3m77 h LEU 168 Ca 0.11 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 3m77 h LEU 168 Cb 0.20 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 3m77 h LEU 168 CO -0.00 0.18 0.07 -0.26 0.09 0.00 0.00 178.44 178.53 3m77 h PHE 169 N 0.18 1.01 -0.33 1.13 0.04 -1.13 -1.35 116.94 116.49 3m77 h PHE 169 Ca 0.06 -0.13 0.00 0.00 2.80 0.00 0.00 57.97 60.70 3m77 h PHE 169 Cb 0.03 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 37.88 3m77 h PHE 169 CO -0.05 0.87 0.21 0.35 -0.60 0.00 0.00 178.31 179.09 3m77 h PHE 170 N 0.90 0.42 -0.65 -0.55 3.57 -0.63 -1.33 116.94 118.67 3m77 h PHE 170 Ca 0.18 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.64 3m77 h PHE 170 Cb 0.42 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 3m77 h PHE 170 CO 0.03 0.29 0.24 0.78 -2.23 0.00 0.00 178.31 177.41 3m77 h GLY 171 N 0.43 1.06 0.61 2.40 0.00 -0.59 0.12 103.07 107.11 3m77 h GLY 171 Ca 0.12 -0.60 0.06 0.00 0.00 0.00 0.00 47.33 46.91 3m77 h GLY 171 CO -0.02 0.56 0.18 0.00 0.00 0.00 0.00 176.54 177.25 3m77 h ALA 172 N 1.10 0.56 -0.39 3.60 0.00 -1.04 -1.07 119.26 122.02 3m77 h ALA 172 Ca 0.21 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.09 3m77 h ALA 172 Cb 0.24 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3m77 h ALA 172 CO -0.01 -0.21 -0.10 0.78 0.00 0.00 0.00 179.25 179.70 3m77 h GLY 173 N 0.36 0.83 0.81 0.00 0.00 -0.81 -1.51 103.07 102.75 3m77 h GLY 173 Ca 0.21 -0.69 -0.05 0.00 0.00 0.00 0.00 47.33 46.80 3m77 h GLY 173 CO -0.21 0.63 -0.08 1.98 0.00 0.00 0.00 176.54 178.86 3m77 h MET 174 N 0.57 0.43 -0.31 4.80 -1.53 -0.59 -1.21 114.93 117.08 3m77 h MET 174 Ca 0.10 -0.18 -0.17 0.00 -3.44 0.00 0.00 59.70 56.01 3m77 h MET 174 Cb 0.63 -0.02 -0.00 0.00 -0.55 0.00 0.00 31.60 31.66 3m77 h MET 174 CO 0.04 0.70 -0.49 0.82 0.14 0.00 0.00 176.91 178.12 3m77 h ILE 175 N 0.13 1.28 -0.86 1.77 2.04 -1.27 -2.38 117.51 118.22 3m77 h ILE 175 Ca 0.05 -1.67 0.08 0.00 1.00 0.00 0.00 64.86 64.32 3m77 h ILE 175 Cb 0.56 1.55 -0.06 0.00 -0.74 0.00 0.00 36.82 38.14 3m77 h ILE 175 CO 0.03 0.55 0.56 0.00 0.00 0.00 0.00 178.15 179.28 3m77 h ALA 176 N 0.76 1.63 0.44 1.87 0.00 -1.19 -0.47 119.26 122.30 3m77 h ALA 176 Ca 0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3m77 h ALA 176 Cb 1.08 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3m77 h ALA 176 CO 0.11 0.22 -0.21 2.35 0.00 0.00 0.00 179.25 181.71 3m77 h TRP 177 N 0.89 -0.55 0.00 0.00 7.01 -0.96 -1.63 115.95 120.71 3m77 h TRP 177 Ca 0.39 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.37 3m77 h TRP 177 Cb 0.33 0.18 -0.00 0.00 -2.10 0.00 0.00 29.16 27.57 3m77 h TRP 177 CO -0.00 -0.29 -0.03 -0.84 -2.79 0.00 0.00 178.44 174.49 3m77 h ILE 178 N -0.69 0.08 0.00 2.65 3.07 -1.12 -0.45 117.51 121.04 3m77 h ILE 178 Ca -0.06 -0.52 -0.13 0.00 1.55 0.00 0.00 64.86 65.69 3m77 h ILE 178 Cb 0.51 1.48 -0.02 0.00 -0.27 0.00 0.00 36.82 38.52 3m77 h ILE 178 CO 0.10 0.03 -0.66 0.40 -1.05 0.00 0.00 178.15 176.97 3m77 h ILE 179 N 0.00 1.06 0.07 0.16 2.04 -0.88 -3.38 117.51 116.58 3m77 h ILE 179 Ca -0.00 -2.51 -0.32 0.00 1.00 0.00 0.00 64.86 63.03 3m77 h ILE 179 Cb 0.48 2.52 -0.03 0.00 -0.74 0.00 0.00 36.82 39.05 3m77 h ILE 179 CO 0.00 0.60 -1.78 0.33 0.00 0.00 0.00 178.15 177.30 3m77 n PHE 180 N -3.24 1.07 -0.30 1.37 7.35 -0.63 -4.48 117.46 118.60 3m77 n PHE 180 Ca 0.01 0.31 0.15 0.00 -0.76 0.00 0.00 57.45 57.16 3m77 n PHE 180 Cb 0.79 -1.13 0.41 0.00 0.35 0.00 0.00 39.48 39.90 3m77 n PHE 180 CO 0.00 0.00 0.00 1.49 -0.76 0.00 0.00 176.76 177.49 3m77 h GLU 181 N -0.36 0.60 -0.82 -4.13 4.81 -1.26 -2.03 114.58 111.39 3m77 h GLU 181 Ca -0.42 -0.04 0.05 0.00 -0.13 0.00 0.00 59.36 58.83 3m77 h GLU 181 Cb 1.75 -0.13 -0.06 0.00 0.63 0.00 0.00 28.75 30.94 3m77 h GLU 181 CO -0.05 0.40 0.51 -1.35 -0.73 0.00 0.00 179.01 177.79 3m77 h PRO 182 N 0.62 0.93 0.00 0.92 0.11 -1.78 -0.67 132.00 132.13 3m77 h PRO 182 Ca 0.52 -0.06 -0.18 0.00 0.11 0.00 0.00 66.00 66.40 3m77 h PRO 182 Cb 1.00 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 31.87 3m77 h PRO 182 CO -0.27 0.62 -0.86 -0.39 -0.21 0.00 0.00 178.00 176.89 3m77 h VAL 183 N 0.96 1.56 -0.03 3.15 -1.51 -1.65 -2.67 116.25 116.06 3m77 h VAL 183 Ca 0.35 -2.99 -0.00 0.00 -1.23 0.00 0.00 66.70 62.82 3m77 h VAL 183 Cb 0.11 2.64 -0.00 0.00 -2.13 0.00 0.00 31.29 31.90 3m77 h VAL 183 CO -0.15 0.84 0.01 0.25 -1.23 0.00 0.00 177.57 177.29 3m77 h LEU 184 N 0.00 0.05 -0.80 4.19 5.85 -0.99 -1.66 115.31 121.95 3m77 h LEU 184 Ca -0.01 -0.18 -0.10 0.00 0.84 0.00 0.00 57.88 58.43 3m77 h LEU 184 Cb 1.57 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 42.57 3m77 h LEU 184 CO 0.11 0.22 -0.15 -0.07 -0.34 0.00 0.00 178.44 178.21 3m77 h LEU 185 N -0.12 0.74 -0.50 2.25 3.38 -1.15 0.02 115.31 119.92 3m77 h LEU 185 Ca 0.01 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 3m77 h LEU 185 Cb 0.18 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3m77 h LEU 185 CO -0.00 0.90 0.31 -0.61 0.09 0.00 0.00 178.44 179.13 3m77 h GLN 186 N 0.67 0.68 -0.58 1.13 5.75 -1.47 -0.70 115.11 120.59 3m77 h GLN 186 Ca 0.11 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.56 3m77 h GLN 186 Cb 0.62 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 29.00 3m77 h GLN 186 CO 0.04 0.49 0.38 1.25 -2.65 0.00 0.00 178.83 178.33 3m77 h HIS 187 N 0.68 0.74 -0.81 3.99 2.76 -0.75 -2.29 115.15 119.47 3m77 h HIS 187 Ca 0.18 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.32 3m77 h HIS 187 Cb -0.03 -0.25 -0.04 0.00 1.55 0.00 0.00 27.41 28.65 3m77 h HIS 187 CO -0.03 0.47 0.34 -0.07 -1.30 0.00 0.00 177.93 177.34 3m77 h LEU 188 N 0.78 1.10 -0.71 0.26 3.38 -0.78 0.17 115.31 119.51 3m77 h LEU 188 Ca 0.21 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 58.06 3m77 h LEU 188 Cb -0.08 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 40.34 3m77 h LEU 188 CO -0.04 0.97 0.43 0.03 0.09 0.00 0.00 178.44 179.91 3m77 h ARG 189 N 1.17 0.78 0.06 1.13 3.08 -0.84 -1.07 114.38 118.70 3m77 h ARG 189 Ca 0.27 -0.05 -0.17 0.00 0.07 0.00 0.00 59.98 60.11 3m77 h ARG 189 Cb 0.20 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 3m77 h ARG 189 CO -0.02 0.52 -0.84 0.82 -1.07 0.00 0.00 179.97 179.37 3m77 h ILE 190 N 0.81 1.32 0.00 2.04 2.04 -1.05 -3.43 117.51 119.24 3m77 h ILE 190 Ca 0.30 -2.36 -0.02 0.00 1.00 0.00 0.00 64.86 63.78 3m77 h ILE 190 Cb 0.11 2.89 -0.00 0.00 -0.74 0.00 0.00 36.82 39.08 3m77 h ILE 190 CO -0.15 0.59 -1.10 -1.20 0.00 0.00 0.00 178.15 176.29 3m77 n SER 191 N -4.28 4.60 0.00 1.72 7.64 0.51 -5.11 113.62 118.70 3m77 n SER 191 Ca -0.20 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.68 3m77 n SER 191 Cb 0.71 0.69 0.00 0.00 -1.01 0.00 0.00 64.21 64.60 3m77 n SER 191 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3m77 n SER 192 N -1.92 -0.02 -4.13 6.43 2.88 -0.41 -4.81 113.62 111.64 3m77 n SER 192 Ca -0.02 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.29 3m77 n SER 192 Cb 0.41 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.72 3m77 n SER 192 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3m77 s LEU 193 N 0.00 2.06 0.66 2.46 1.02 -1.26 -4.75 118.68 118.87 3m77 s LEU 193 Ca 0.00 -0.32 -0.16 0.00 0.02 0.00 0.00 54.13 53.67 3m77 s LEU 193 Cb 0.00 -0.75 -0.00 0.00 0.02 0.00 0.00 46.19 45.46 3m77 s LEU 193 CO 0.00 0.16 1.16 -1.61 0.02 0.00 0.00 176.35 176.08 3m77 s GLU 194 N -0.55 2.68 0.38 1.70 8.01 -1.26 -4.80 118.70 124.85 3m77 s GLU 194 Ca 0.05 1.63 0.14 0.00 0.01 0.00 0.00 54.97 56.80 3m77 s GLU 194 Cb -0.06 -1.91 0.96 0.00 -4.31 0.00 0.00 34.13 28.81 3m77 s GLU 194 CO -0.00 -1.39 1.83 -1.35 0.01 0.00 0.00 175.26 174.36 3m77 h PRO 195 N 0.23 0.52 0.00 0.39 0.11 -1.97 -0.00 132.00 131.28 3m77 h PRO 195 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3m77 h PRO 195 Cb 1.28 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3m77 h PRO 195 CO 0.53 0.34 0.00 -0.56 -0.21 0.00 0.00 178.00 178.10 3m77 h GLN 196 N 0.53 0.00 -0.01 1.05 -0.00 -1.97 -1.63 115.11 113.08 3m77 h GLN 196 Ca 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.15 3m77 h GLN 196 Cb 1.07 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.55 3m77 h GLN 196 CO -0.24 0.00 -0.32 1.19 -0.00 0.00 0.00 178.83 179.47 3m77 n PHE 197 N -2.92 0.00 0.22 0.06 3.72 -0.04 -4.72 117.46 113.78 3m77 n PHE 197 Ca -0.02 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.45 3m77 n PHE 197 Cb 0.12 0.00 0.51 0.00 -0.94 0.00 0.00 39.48 39.17 3m77 n PHE 197 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3m77 h ARG 198 N 1.14 0.00 0.00 -1.08 3.08 -1.00 -1.26 114.38 115.27 3m77 h ARG 198 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 3m77 h ARG 198 Cb 0.40 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.45 3m77 h ARG 198 CO 0.00 0.23 -0.00 0.00 -1.07 0.00 0.00 179.97 179.13 3m77 h ALA 199 N 1.77 1.41 0.00 0.04 0.00 -1.79 0.16 119.26 120.85 3m77 h ALA 199 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3m77 h ALA 199 Cb 0.45 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3m77 h ALA 199 CO 0.03 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.53 3m77 n THR 200 N -3.69 1.00 0.21 0.00 -2.24 -0.47 -1.45 114.28 107.64 3m77 n THR 200 Ca -0.03 0.26 0.18 0.00 -2.27 0.00 0.00 64.05 62.19 3m77 n THR 200 Cb 0.08 -1.04 0.83 0.00 -2.10 0.00 0.00 70.33 68.10 3m77 n THR 200 CO 0.00 0.00 0.00 0.24 -0.57 0.00 0.00 175.07 174.74 3m77 h MET 201 N 0.00 0.00 -0.12 -0.78 2.07 -1.11 -0.57 114.93 114.42 3m77 h MET 201 Ca 0.00 0.00 0.04 0.00 -2.07 0.00 0.00 59.70 57.67 3m77 h MET 201 Cb 0.26 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 29.99 3m77 h MET 201 CO 0.00 0.00 0.11 0.78 1.07 0.00 0.00 176.91 178.87 3m77 h GLY 202 N 0.00 0.00 2.00 8.32 0.00 -1.46 -1.04 103.07 110.89 3m77 h GLY 202 Ca 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.39 3m77 h GLY 202 CO -0.00 0.00 -0.16 -2.22 0.00 0.00 0.00 176.54 174.16 3m77 h ILE 203 N 0.00 0.59 0.00 2.60 2.04 -1.14 -2.12 117.51 119.48 3m77 h ILE 203 Ca 0.06 -0.73 -0.02 0.00 1.00 0.00 0.00 64.86 65.17 3m77 h ILE 203 Cb 0.28 1.47 -0.00 0.00 -0.74 0.00 0.00 36.82 37.83 3m77 h ILE 203 CO -0.00 0.16 -0.10 0.58 0.00 0.00 0.00 178.15 178.79 3m77 h VAL 204 N 0.00 0.69 0.00 1.67 2.07 -1.33 -0.72 116.25 118.63 3m77 h VAL 204 Ca -0.00 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 67.09 3m77 h VAL 204 Cb 0.46 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 3m77 h VAL 204 CO 0.02 0.10 -0.19 0.25 0.02 0.00 0.00 177.57 177.77 3m77 h LEU 205 N 0.00 0.00 -0.16 2.57 5.85 -1.50 -3.37 115.31 118.70 3m77 h LEU 205 Ca -0.00 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 3m77 h LEU 205 Cb 0.23 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.26 3m77 h LEU 205 CO 0.01 0.19 -0.05 0.00 -0.34 0.00 0.00 178.44 178.25 3m77 h ALA 206 N 1.81 0.22 -0.17 1.25 0.00 -1.25 -3.38 119.26 117.74 3m77 h ALA 206 Ca -0.00 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.71 3m77 h ALA 206 Cb 0.53 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.20 3m77 h ALA 206 CO 0.02 0.00 -0.20 -1.35 0.00 0.00 0.00 179.25 177.72 3m77 h PRO 207 N 0.01 -0.23 -0.41 0.00 0.11 -1.73 0.14 132.00 129.89 3m77 h PRO 207 Ca 0.04 0.02 -0.12 0.00 0.11 0.00 0.00 66.00 66.05 3m77 h PRO 207 Cb 0.50 0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 3m77 h PRO 207 CO 0.02 -0.15 -0.22 0.00 -0.21 0.00 0.00 178.00 177.44 3m77 h ALA 208 N 0.80 0.84 -0.08 -0.75 0.00 -1.88 0.97 119.26 119.15 3m77 h ALA 208 Ca 0.11 -0.37 -0.18 0.00 0.00 0.00 0.00 54.91 54.47 3m77 h ALA 208 Cb 0.40 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.05 3m77 h ALA 208 CO -0.30 0.64 -0.65 0.74 0.00 0.00 0.00 179.25 179.67 3m77 h PHE 209 N 0.72 0.82 -0.61 0.00 0.04 -1.62 -1.06 116.94 115.22 3m77 h PHE 209 Ca 0.10 -0.39 -0.07 0.00 2.80 0.00 0.00 57.97 60.41 3m77 h PHE 209 Cb 0.74 -0.12 -0.03 0.00 2.20 0.00 0.00 35.95 38.75 3m77 h PHE 209 CO 0.04 1.19 0.11 -0.39 -0.60 0.00 0.00 178.31 178.66 3m77 h VAL 210 N 0.21 1.25 0.30 -0.55 -1.51 -0.70 -1.34 116.25 113.91 3m77 h VAL 210 Ca -0.06 -0.97 -0.01 0.00 -1.23 0.00 0.00 66.70 64.44 3m77 h VAL 210 Cb 1.31 0.67 -0.01 0.00 -2.13 0.00 0.00 31.29 31.13 3m77 h VAL 210 CO 0.13 0.36 -0.22 0.00 -1.23 0.00 0.00 177.57 176.61 3m77 h VAL 212 N -0.52 1.30 -0.15 0.00 3.04 -1.12 0.25 116.25 119.05 3m77 h VAL 212 Ca -0.02 -1.54 -0.00 0.00 -1.01 0.00 0.00 66.70 64.13 3m77 h VAL 212 Cb 0.45 1.58 -0.01 0.00 -2.01 0.00 0.00 31.29 31.30 3m77 h VAL 212 CO 0.00 0.48 0.09 -1.28 -1.01 0.00 0.00 177.57 175.85 3m77 h SER 213 N 0.38 0.19 -0.66 3.17 0.87 -1.12 -0.66 113.55 115.72 3m77 h SER 213 Ca 0.04 -0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.52 3m77 h SER 213 Cb 0.86 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.74 3m77 h SER 213 CO 0.07 0.20 0.34 0.00 -0.53 0.00 0.00 176.83 176.91 3m77 h ALA 214 N 1.00 0.84 -0.16 6.23 0.00 -0.81 -1.93 119.26 124.44 3m77 h ALA 214 Ca 0.05 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.86 3m77 h ALA 214 Cb 0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3m77 h ALA 214 CO -0.01 0.37 0.06 -0.92 0.00 0.00 0.00 179.25 178.76 3m77 h TYR 215 N 0.90 0.12 0.00 0.00 3.20 -0.64 -2.23 116.97 118.32 3m77 h TYR 215 Ca 0.23 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 62.05 3m77 h TYR 215 Cb 0.07 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 3m77 h TYR 215 CO -0.00 0.06 -0.25 -0.07 -1.64 0.00 0.00 178.16 176.26 3m77 h LEU 216 N 0.15 0.00 -1.00 2.82 3.38 -1.00 -0.82 115.31 118.84 3m77 h LEU 216 Ca 0.06 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 3m77 h LEU 216 Cb 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3m77 h LEU 216 CO -0.06 0.25 -0.28 0.77 0.09 0.00 0.00 178.44 179.22 3m77 h SER 217 N 0.00 0.00 0.29 -0.43 4.64 -0.77 -0.14 113.55 117.14 3m77 h SER 217 Ca -0.00 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 60.99 3m77 h SER 217 Cb 0.52 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.55 3m77 h SER 217 CO 0.03 0.28 -1.99 -0.38 -0.87 0.00 0.00 176.83 173.90 3m77 n ILE 218 N -3.42 1.52 -0.82 0.95 5.41 -0.67 -4.40 119.36 117.93 3m77 n ILE 218 Ca 0.00 -0.82 -0.08 0.00 1.00 0.00 0.00 62.75 62.85 3m77 n ILE 218 Cb 0.47 -0.81 0.25 0.00 -0.71 0.00 0.00 39.64 38.84 3m77 n ILE 218 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 3m77 n ASN 219 N -2.93 4.37 -1.70 4.38 6.94 -0.40 -4.88 115.26 121.04 3m77 n ASN 219 Ca -0.23 -3.14 -0.17 0.00 -0.02 0.00 0.00 54.58 51.02 3m77 n ASN 219 Cb 1.10 -0.74 -0.03 0.00 -2.36 0.00 0.00 39.78 37.75 3m77 n ASN 219 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 3m77 n HIS 220 N -0.25 -0.53 -1.66 -2.53 8.25 -1.23 -2.94 115.22 114.33 3m77 n HIS 220 Ca 0.40 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.76 3m77 n HIS 220 Cb 1.33 -3.23 -0.03 0.00 1.12 0.00 0.00 29.99 29.19 3m77 n HIS 220 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3m77 n GLY 221 N -0.98 0.65 3.62 -1.41 0.00 -0.07 -4.98 105.19 102.01 3m77 n GLY 221 Ca -0.19 -0.55 -0.43 0.00 0.00 0.00 0.00 46.02 44.85 3m77 n GLY 221 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3m77 s GLU 222 N -3.51 3.91 -0.77 1.61 2.12 -1.15 -4.85 118.70 116.06 3m77 s GLU 222 Ca 0.00 0.84 -0.24 0.00 0.36 0.00 0.00 54.97 55.92 3m77 s GLU 222 Cb 0.00 -3.81 0.05 0.00 0.26 0.00 0.00 34.13 30.63 3m77 s GLU 222 CO 0.00 -1.10 1.19 0.08 -0.54 0.00 0.00 175.26 174.89 3m77 s VAL 223 N 3.97 4.03 0.00 3.70 1.01 -1.26 -4.89 120.40 126.96 3m77 s VAL 223 Ca 0.46 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.27 3m77 s VAL 223 Cb -0.10 -4.85 0.00 0.00 0.00 0.00 0.00 36.38 31.43 3m77 s VAL 223 CO 0.22 -1.71 0.00 -0.90 0.00 0.00 0.00 175.10 172.71 3m77 n ASP 224 N 8.54 1.25 -0.12 3.32 5.68 -1.26 -4.93 116.55 129.03 3m77 n ASP 224 Ca 0.07 -0.73 -0.09 0.00 -0.50 0.00 0.00 54.79 53.55 3m77 n ASP 224 Cb 0.48 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.46 3m77 n ASP 224 CO 0.00 0.00 0.00 0.74 -1.33 0.00 0.00 177.20 176.61 3m77 h THR 225 N 0.45 1.12 -0.57 2.12 2.02 -2.00 -1.90 112.91 114.16 3m77 h THR 225 Ca 0.00 -0.28 0.07 0.00 0.77 0.00 0.00 66.41 66.97 3m77 h THR 225 Cb 0.00 0.64 -0.06 0.00 -1.74 0.00 0.00 68.15 66.99 3m77 h THR 225 CO 0.00 0.12 0.26 0.25 0.37 0.00 0.00 175.52 176.52 3m77 h LEU 226 N 0.49 0.32 -0.49 2.58 5.85 -1.97 -0.56 115.31 121.53 3m77 h LEU 226 Ca 0.13 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 3m77 h LEU 226 Cb 0.00 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 3m77 h LEU 226 CO -0.03 0.21 0.27 0.00 -0.34 0.00 0.00 178.44 178.56 3m77 h ALA 227 N 1.34 0.63 -0.72 1.25 0.00 -1.81 -1.02 119.26 118.94 3m77 h ALA 227 Ca 0.27 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 3m77 h ALA 227 Cb 0.25 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 3m77 h ALA 227 CO -0.22 0.14 0.19 0.87 0.00 0.00 0.00 179.25 180.23 3m77 h LYS 228 N 0.65 1.13 -0.49 0.00 1.57 -0.99 -1.64 116.57 116.81 3m77 h LYS 228 Ca 0.17 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 3m77 h LYS 228 Cb 0.04 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 3m77 h LYS 228 CO -0.03 0.99 0.31 0.82 -0.57 0.00 0.00 179.45 180.97 3m77 h ILE 229 N 1.07 1.14 -0.41 1.86 2.04 -0.70 -1.18 117.51 121.33 3m77 h ILE 229 Ca 0.23 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 3m77 h ILE 229 Cb 0.35 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 3m77 h ILE 229 CO -0.00 0.14 0.15 -0.07 0.00 0.00 0.00 178.15 178.37 3m77 h LEU 230 N 0.66 0.57 -0.94 1.44 3.38 -1.00 -2.44 115.31 116.98 3m77 h LEU 230 Ca 0.18 -0.18 0.06 0.00 0.09 0.00 0.00 57.88 58.02 3m77 h LEU 230 Cb -0.04 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.50 3m77 h LEU 230 CO -0.04 0.60 0.60 -0.50 0.09 0.00 0.00 178.44 179.20 3m77 h TRP 231 N 0.52 1.12 -0.24 1.13 4.06 -0.99 -0.50 115.95 121.05 3m77 h TRP 231 Ca 0.13 0.03 -0.01 0.00 2.06 0.00 0.00 58.89 61.11 3m77 h TRP 231 Cb 0.21 -0.37 -0.01 0.00 -1.00 0.00 0.00 29.16 27.99 3m77 h TRP 231 CO 0.00 0.60 0.13 0.78 -3.56 0.00 0.00 178.44 176.39 3m77 h GLY 232 N 1.12 0.35 1.49 1.49 0.00 -0.77 -0.04 103.07 106.72 3m77 h GLY 232 Ca 0.40 -0.16 -0.09 0.00 0.00 0.00 0.00 47.33 47.48 3m77 h GLY 232 CO -0.16 0.16 -0.15 -1.82 0.00 0.00 0.00 176.54 174.57 3m77 h TYR 233 N 0.27 0.66 -0.36 5.60 3.20 -1.30 -1.83 116.97 123.20 3m77 h TYR 233 Ca 0.08 -0.12 0.05 0.00 3.14 0.00 0.00 58.73 61.89 3m77 h TYR 233 Cb 0.08 -0.17 -0.04 0.00 1.54 0.00 0.00 36.73 38.13 3m77 h TYR 233 CO -0.03 0.72 0.09 0.78 -1.64 0.00 0.00 178.16 178.08 3m77 h GLY 234 N 0.97 0.44 1.35 1.82 0.00 -0.66 -1.49 103.07 105.50 3m77 h GLY 234 Ca 0.09 -0.04 -0.09 0.00 0.00 0.00 0.00 47.33 47.29 3m77 h GLY 234 CO 0.04 -0.00 -0.09 0.74 0.00 0.00 0.00 176.54 177.23 3m77 h PHE 235 N 0.23 0.85 -0.21 5.60 0.04 -0.84 -0.99 116.94 121.63 3m77 h PHE 235 Ca 0.17 -0.15 0.05 0.00 2.80 0.00 0.00 57.97 60.85 3m77 h PHE 235 Cb 0.18 -0.22 -0.05 0.00 2.20 0.00 0.00 35.95 38.05 3m77 h PHE 235 CO -0.17 0.83 -0.14 1.25 -0.60 0.00 0.00 178.31 179.48 3m77 h LEU 236 N 0.71 -0.44 -1.00 1.54 5.85 -0.88 -0.61 115.31 120.48 3m77 h LEU 236 Ca 0.12 0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 3m77 h LEU 236 Cb 0.56 0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.78 3m77 h LEU 236 CO 0.03 -0.17 0.35 1.56 -0.34 0.00 0.00 178.44 179.87 3m77 h GLN 237 N -0.13 1.07 -0.32 1.25 1.08 -1.07 -1.40 115.11 115.59 3m77 h GLN 237 Ca 0.12 -0.15 0.03 0.00 -1.45 0.00 0.00 58.65 57.20 3m77 h GLN 237 Cb 0.31 -0.20 -0.03 0.00 -0.05 0.00 0.00 27.48 27.51 3m77 h GLN 237 CO -0.29 0.83 0.14 1.25 -0.95 0.00 0.00 178.83 179.81 3m77 h LEU 238 N 1.06 0.20 -0.62 1.46 5.85 -0.80 -0.22 115.31 122.23 3m77 h LEU 238 Ca 0.26 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.96 3m77 h LEU 238 Cb 0.11 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 3m77 h LEU 238 CO -0.03 0.15 0.23 -0.26 -0.34 0.00 0.00 178.44 178.19 3m77 h PHE 239 N 0.31 0.97 -0.63 1.25 0.04 -0.67 0.11 116.94 118.31 3m77 h PHE 239 Ca 0.14 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 60.83 3m77 h PHE 239 Cb 0.07 -0.29 -0.03 0.00 2.20 0.00 0.00 35.95 37.90 3m77 h PHE 239 CO -0.11 0.78 0.40 0.74 -0.60 0.00 0.00 178.31 179.52 3m77 h PHE 240 N 0.88 0.81 -0.10 -0.55 -1.00 -0.94 -1.97 116.94 114.07 3m77 h PHE 240 Ca 0.20 0.01 -0.15 0.00 2.81 0.00 0.00 57.97 60.84 3m77 h PHE 240 Cb 0.24 -0.27 -0.01 0.00 3.61 0.00 0.00 35.95 39.52 3m77 h PHE 240 CO 0.02 0.53 -0.58 -0.07 -1.61 0.00 0.00 178.31 176.59 3m77 h LEU 241 N 0.85 0.38 -0.45 1.54 3.38 -0.44 -1.31 115.31 119.26 3m77 h LEU 241 Ca 0.23 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3m77 h LEU 241 Cb -0.07 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 3m77 h LEU 241 CO -0.05 0.88 0.28 -0.07 0.09 0.00 0.00 178.44 179.57 3m77 h LEU 242 N 0.25 0.53 -1.07 1.67 3.38 -0.61 -0.93 115.31 118.53 3m77 h LEU 242 Ca -0.00 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3m77 h LEU 242 Cb 1.10 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.68 3m77 h LEU 242 CO 0.10 0.41 0.34 -0.09 0.09 0.00 0.00 178.44 179.29 3m77 h ARG 243 N 0.60 0.99 -0.00 1.13 1.12 -1.02 -2.17 114.38 115.04 3m77 h ARG 243 Ca 0.16 -0.13 0.00 0.00 -1.11 0.00 0.00 59.98 58.90 3m77 h ARG 243 Cb -0.03 -0.19 0.00 0.00 -0.01 0.00 0.00 29.97 29.74 3m77 h ARG 243 CO -0.03 0.76 -0.04 1.28 -3.11 0.00 0.00 179.97 178.83 3m77 n LEU 244 N -4.34 0.16 -0.31 3.80 4.77 -0.53 -4.36 117.00 116.21 3m77 n LEU 244 Ca 0.07 0.18 -0.04 0.00 -0.03 0.00 0.00 56.01 56.18 3m77 n LEU 244 Cb 0.13 -0.24 0.08 0.00 -2.33 0.00 0.00 43.42 41.06 3m77 n LEU 244 CO 0.39 0.03 1.16 0.15 -1.33 0.00 0.00 177.39 177.79 3m77 h PHE 245 N 0.19 1.12 -0.99 -1.77 3.57 -0.49 0.23 116.94 118.80 3m77 h PHE 245 Ca 0.00 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.53 3m77 h PHE 245 Cb 0.30 -0.36 -0.06 0.00 2.79 0.00 0.00 35.95 38.62 3m77 h PHE 245 CO 0.00 0.77 0.64 -1.35 -2.23 0.00 0.00 178.31 176.14 3m77 h PRO 246 N 1.15 1.17 -0.46 6.41 0.11 -1.80 -1.19 132.00 137.40 3m77 h PRO 246 Ca 0.29 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 66.27 3m77 h PRO 246 Cb 0.00 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 30.83 3m77 h PRO 246 CO -0.05 0.78 0.02 2.35 -0.21 0.00 0.00 178.00 180.88 3m77 h TRP 247 N 1.21 0.86 -0.72 0.65 7.01 -1.61 -1.84 115.95 121.52 3m77 h TRP 247 Ca 0.41 -0.14 0.11 0.00 2.11 0.00 0.00 58.89 61.38 3m77 h TRP 247 Cb 0.08 -0.23 -0.08 0.00 -2.10 0.00 0.00 29.16 26.83 3m77 h TRP 247 CO -0.00 0.83 0.32 0.82 -2.79 0.00 0.00 178.44 177.61 3m77 h ILE 248 N 0.65 0.76 -0.76 2.65 2.04 0.12 -2.34 117.51 120.62 3m77 h ILE 248 Ca 0.13 -0.18 -0.33 0.00 1.00 0.00 0.00 64.86 65.48 3m77 h ILE 248 Cb 0.47 0.20 -0.20 0.00 -0.74 0.00 0.00 36.82 36.56 3m77 h ILE 248 CO 0.02 0.09 0.36 1.33 0.00 0.00 0.00 178.15 179.96 3m77 n VAL 249 N -4.94 2.95 -0.25 1.67 0.24 -0.56 -4.50 118.33 112.95 3m77 n VAL 249 Ca 0.12 -2.00 0.05 0.00 -2.04 0.00 0.00 64.34 60.48 3m77 n VAL 249 Cb 0.33 -0.40 0.17 0.00 -1.47 0.00 0.00 33.84 32.48 3m77 n VAL 249 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3m77 h GLU 250 N 1.56 0.20 -0.47 7.34 4.81 -0.76 -0.85 114.58 126.42 3m77 h GLU 250 Ca 0.41 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.63 3m77 h GLU 250 Cb 2.40 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 31.74 3m77 h GLU 250 CO 0.81 0.13 0.00 1.63 -0.73 0.00 0.00 179.01 180.85 3m77 n LYS 251 N -5.22 2.12 0.00 1.92 4.76 -1.26 -5.02 118.16 115.46 3m77 n LYS 251 Ca 0.14 -1.62 0.00 0.00 -2.87 0.00 0.00 58.31 53.95 3m77 n LYS 251 Cb 0.46 -1.39 0.00 0.00 -1.84 0.00 0.00 35.03 32.26 3m77 n LYS 251 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3m77 n GLY 252 N 1.16 2.98 3.75 0.72 0.00 -0.32 -5.04 105.19 108.43 3m77 n GLY 252 Ca 0.15 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.78 3m77 n GLY 252 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m77 s LEU 253 N 0.00 4.46 0.11 0.99 1.43 -1.26 -4.77 118.68 119.64 3m77 s LEU 253 Ca 0.00 2.43 -0.09 0.00 -1.03 0.00 0.00 54.13 55.45 3m77 s LEU 253 Cb 0.00 -3.63 -0.00 0.00 0.03 0.00 0.00 46.19 42.59 3m77 s LEU 253 CO 0.00 -0.40 0.21 0.54 0.23 0.00 0.00 176.35 176.93 3m77 s ASN 254 N -0.28 0.11 0.63 2.29 2.20 -1.26 -5.03 114.94 113.59 3m77 s ASN 254 Ca 0.50 -0.72 0.35 0.00 -0.94 0.00 0.00 52.86 52.05 3m77 s ASN 254 Cb -0.36 0.36 1.96 0.00 -2.00 0.00 0.00 41.25 41.21 3m77 s ASN 254 CO 0.43 -0.77 2.19 -0.29 -2.94 0.00 0.00 177.10 175.73 3m77 h ILE 255 N 2.70 0.24 0.00 0.54 6.09 -1.96 -1.13 117.51 124.00 3m77 h ILE 255 Ca -0.33 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.16 3m77 h ILE 255 Cb 1.21 0.89 0.00 0.00 0.47 0.00 0.00 36.82 39.39 3m77 h ILE 255 CO 0.54 0.00 0.00 1.23 -3.07 0.00 0.00 178.15 176.85 3m77 h GLY 256 N 0.00 0.00 2.00 8.18 0.00 -1.96 -2.08 103.07 109.21 3m77 h GLY 256 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 3m77 h GLY 256 CO -0.00 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.58 3m77 n LEU 257 N -2.89 0.50 0.08 3.11 4.77 -0.43 -0.95 117.00 121.20 3m77 n LEU 257 Ca -0.03 0.71 0.06 0.00 -0.03 0.00 0.00 56.01 56.72 3m77 n LEU 257 Cb 0.07 -0.74 0.31 0.00 -2.33 0.00 0.00 43.42 40.72 3m77 n LEU 257 CO 0.18 -0.82 0.68 0.79 -1.33 0.00 0.00 177.39 176.89 3m77 n TRP 258 N -2.14 0.37 0.13 -1.77 7.02 -0.78 -1.37 117.44 118.89 3m77 n TRP 258 Ca -0.01 0.19 0.18 0.00 -1.02 0.00 0.00 57.50 56.84 3m77 n TRP 258 Cb 0.07 -0.80 0.75 0.00 -2.42 0.00 0.00 31.31 28.91 3m77 n TRP 258 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3m77 h ALA 259 N 2.05 2.10 0.00 6.99 0.00 -1.29 -0.39 119.26 128.71 3m77 h ALA 259 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3m77 h ALA 259 Cb 0.04 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3m77 h ALA 259 CO 0.00 -0.43 0.00 1.19 0.00 0.00 0.00 179.25 180.01 3m77 n PHE 260 N -4.06 0.82 0.16 0.00 3.72 -0.47 -3.56 117.46 114.07 3m77 n PHE 260 Ca 0.05 0.31 0.02 0.00 -0.05 0.00 0.00 57.45 57.78 3m77 n PHE 260 Cb 0.43 -1.00 0.24 0.00 -0.94 0.00 0.00 39.48 38.21 3m77 n PHE 260 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3m77 h SER 261 N 0.00 0.00 -0.18 4.37 4.64 -1.26 -1.09 113.55 120.04 3m77 h SER 261 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3m77 h SER 261 Cb 0.40 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 3m77 h SER 261 CO 0.00 0.51 0.10 0.00 -0.87 0.00 0.00 176.83 176.56 3m77 h ALA 262 N 1.49 0.23 -0.42 5.18 0.00 -1.77 0.36 119.26 124.33 3m77 h ALA 262 Ca -0.01 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3m77 h ALA 262 Cb 1.03 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 3m77 h ALA 262 CO 0.07 -0.24 0.00 0.78 0.00 0.00 0.00 179.25 179.85 3m77 h GLY 263 N 0.19 0.81 0.86 0.00 0.00 -1.77 -1.65 103.07 101.51 3m77 h GLY 263 Ca 0.06 -0.59 -0.01 0.00 0.00 0.00 0.00 47.33 46.79 3m77 h GLY 263 CO -0.01 0.55 0.05 1.41 0.00 0.00 0.00 176.54 178.54 3m77 h LEU 264 N 0.59 0.22 -1.12 3.11 3.38 -1.05 0.34 115.31 120.77 3m77 h LEU 264 Ca 0.12 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 3m77 h LEU 264 Cb 0.49 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 3m77 h LEU 264 CO 0.02 0.35 0.01 0.00 0.09 0.00 0.00 178.44 178.91 3m77 h ALA 265 N 0.88 1.28 0.00 1.53 0.00 -0.92 -1.46 119.26 120.57 3m77 h ALA 265 Ca 0.05 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 3m77 h ALA 265 Cb 0.20 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3m77 h ALA 265 CO -0.00 0.49 -0.57 0.66 0.00 0.00 0.00 179.25 179.82 3m77 h SER 266 N 0.60 0.00 -0.31 0.00 4.64 -1.09 -0.03 113.55 117.36 3m77 h SER 266 Ca 0.13 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3m77 h SER 266 Cb 0.36 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.43 3m77 h SER 266 CO 0.01 0.57 0.19 0.24 -0.87 0.00 0.00 176.83 176.98 3m77 h MET 267 N 0.00 0.42 0.00 4.77 2.07 -0.33 -0.04 114.93 121.82 3m77 h MET 267 Ca -0.01 -0.04 -0.00 0.00 -2.07 0.00 0.00 59.70 57.59 3m77 h MET 267 Cb 1.16 -0.09 0.00 0.00 -1.87 0.00 0.00 31.60 30.80 3m77 h MET 267 CO 0.07 0.32 -0.00 0.00 1.07 0.00 0.00 176.91 178.37 3m77 h ALA 268 N 1.08 -0.00 0.19 6.32 0.00 -0.92 -0.12 119.26 125.81 3m77 h ALA 268 Ca 0.11 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3m77 h ALA 268 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3m77 h ALA 268 CO -0.02 -0.47 -0.09 -0.97 0.00 0.00 0.00 179.25 177.70 3m77 h ASN 269 N -0.06 -0.21 -0.53 0.00 -1.24 -0.90 -2.43 115.58 110.20 3m77 h ASN 269 Ca -0.00 -0.06 0.00 0.00 0.71 0.00 0.00 56.30 56.96 3m77 h ASN 269 Cb 0.06 0.06 -0.03 0.00 0.73 0.00 0.00 38.32 39.14 3m77 h ASN 269 CO 0.00 -0.08 0.35 0.77 -1.29 0.00 0.00 177.43 177.18 3m77 h SER 270 N -0.33 0.61 -0.97 1.15 4.64 -0.97 -1.88 113.55 115.80 3m77 h SER 270 Ca -0.03 -0.02 0.08 0.00 -0.47 0.00 0.00 61.79 61.36 3m77 h SER 270 Cb 0.26 -0.15 -0.07 0.00 -0.31 0.00 0.00 62.40 62.12 3m77 h SER 270 CO 0.04 0.45 0.63 0.00 -0.87 0.00 0.00 176.83 177.07 3m77 h ALA 271 N 1.66 1.48 -0.31 5.18 0.00 -0.74 -0.85 119.26 125.68 3m77 h ALA 271 Ca 0.19 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 3m77 h ALA 271 Cb -0.08 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 3m77 h ALA 271 CO -0.04 0.34 -0.01 1.79 0.00 0.00 0.00 179.25 181.33 3m77 h THR 272 N 1.07 1.19 0.02 0.00 1.35 -0.86 -0.50 112.91 115.18 3m77 h THR 272 Ca 0.44 -0.75 -0.27 0.00 -0.55 0.00 0.00 66.41 65.28 3m77 h THR 272 Cb 0.28 0.96 0.02 0.00 -1.73 0.00 0.00 68.15 67.68 3m77 h THR 272 CO -0.19 0.26 -1.08 0.00 -0.25 0.00 0.00 175.52 174.26 3m77 h ALA 273 N 1.54 0.12 -0.53 6.62 0.00 -1.19 -0.90 119.26 124.92 3m77 h ALA 273 Ca 0.10 -0.71 -0.00 0.00 0.00 0.00 0.00 54.91 54.30 3m77 h ALA 273 Cb 0.31 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 3m77 h ALA 273 CO 0.01 0.70 0.33 0.74 0.00 0.00 0.00 179.25 181.03 3m77 h PHE 274 N 0.36 0.69 -0.23 0.00 -1.00 -1.00 -0.78 116.94 114.98 3m77 h PHE 274 Ca -0.14 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.64 3m77 h PHE 274 Cb 1.73 -0.23 -0.01 0.00 3.61 0.00 0.00 35.95 41.05 3m77 h PHE 274 CO 0.10 0.47 0.14 -0.92 -1.61 0.00 0.00 178.31 176.49 3m77 h TYR 275 N 0.71 0.29 -0.00 -0.55 3.20 -1.02 -1.20 116.97 118.41 3m77 h TYR 275 Ca 0.19 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.04 3m77 h TYR 275 Cb -0.03 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.14 3m77 h TYR 275 CO -0.03 0.22 -0.12 1.25 -1.64 0.00 0.00 178.16 177.84 3m77 h HIS 276 N 0.28 0.01 -0.04 -3.82 2.76 -1.00 -1.15 115.15 112.19 3m77 h HIS 276 Ca 0.08 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.25 3m77 h HIS 276 Cb 0.01 -0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.96 3m77 h HIS 276 CO -0.05 0.13 0.00 0.41 -1.30 0.00 0.00 177.93 177.11 3m77 n GLY 277 N -1.19 -0.41 3.78 5.26 0.00 -0.31 -4.94 105.19 107.39 3m77 n GLY 277 Ca -0.03 -0.31 -0.24 0.00 0.00 0.00 0.00 46.02 45.45 3m77 n GLY 277 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3m77 n ASN 278 N -0.31 -2.04 -4.11 1.61 5.15 -0.44 -5.00 115.26 110.14 3m77 n ASN 278 Ca 0.19 -0.83 -0.32 0.00 -0.60 0.00 0.00 54.58 53.02 3m77 n ASN 278 Cb 0.23 -3.91 -0.16 0.00 -0.53 0.00 0.00 39.78 35.40 3m77 n ASN 278 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3m77 s VAL 279 N -3.60 1.92 -1.24 3.44 1.01 -0.54 -4.81 120.40 116.59 3m77 s VAL 279 Ca 0.18 -0.87 -0.14 0.00 0.00 0.00 0.00 61.98 61.16 3m77 s VAL 279 Cb -0.09 -1.74 -0.00 0.00 0.00 0.00 0.00 36.38 34.55 3m77 s VAL 279 CO 0.82 0.52 0.66 0.18 0.00 0.00 0.00 175.10 177.28 3m77 n LEU 280 N 4.50 -2.50 -0.24 3.92 4.77 -1.26 -4.26 117.00 121.93 3m77 n LEU 280 Ca -0.20 -1.02 -0.04 0.00 -0.03 0.00 0.00 56.01 54.72 3m77 n LEU 280 Cb 0.50 -2.30 0.12 0.00 -2.33 0.00 0.00 43.42 39.41 3m77 n LEU 280 CO 0.25 0.48 1.06 1.56 -1.33 0.00 0.00 177.39 179.41 3m77 h GLN 281 N -1.92 1.08 -0.14 3.23 4.20 -1.87 0.45 115.11 120.14 3m77 h GLN 281 Ca -0.65 -0.18 -0.00 0.00 0.06 0.00 0.00 58.65 57.87 3m77 h GLN 281 Cb 1.37 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.96 3m77 h GLN 281 CO 0.54 0.87 0.07 0.78 -0.67 0.00 0.00 178.83 180.42 3m77 h GLY 282 N 1.11 0.21 0.86 3.46 0.00 -2.00 -0.05 103.07 106.66 3m77 h GLY 282 Ca 0.25 -0.10 0.05 0.00 0.00 0.00 0.00 47.33 47.53 3m77 h GLY 282 CO -0.02 0.10 0.63 -2.08 0.00 0.00 0.00 176.54 175.16 3m77 h VAL 283 N 0.12 1.12 -0.56 4.60 2.07 -1.86 -1.64 116.25 120.09 3m77 h VAL 283 Ca 0.05 -0.40 -0.07 0.00 0.82 0.00 0.00 66.70 67.10 3m77 h VAL 283 Cb 0.09 -0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 29.70 3m77 h VAL 283 CO -0.01 0.21 0.06 0.77 0.02 0.00 0.00 177.57 178.63 3m77 h SER 284 N 1.17 0.91 -0.36 0.57 4.64 -0.41 0.13 113.55 120.20 3m77 h SER 284 Ca 0.40 -0.28 -0.01 0.00 -0.47 0.00 0.00 61.79 61.43 3m77 h SER 284 Cb 0.09 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 61.92 3m77 h SER 284 CO -0.14 0.96 0.19 0.40 -0.87 0.00 0.00 176.83 177.37 3m77 h ILE 285 N 0.84 1.16 -0.14 0.95 2.04 -0.73 -0.51 117.51 121.11 3m77 h ILE 285 Ca 0.17 -0.43 0.04 0.00 1.00 0.00 0.00 64.86 65.63 3m77 h ILE 285 Cb 0.45 0.78 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 3m77 h ILE 285 CO 0.02 0.16 -0.12 0.15 0.00 0.00 0.00 178.15 178.36 3m77 h PHE 286 N 0.45 -0.29 -0.77 1.37 3.57 -0.89 -0.70 116.94 119.67 3m77 h PHE 286 Ca 0.13 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.65 3m77 h PHE 286 Cb 0.09 0.15 -0.04 0.00 2.79 0.00 0.00 35.95 38.95 3m77 h PHE 286 CO -0.02 -0.18 0.49 0.00 -2.23 0.00 0.00 178.31 176.37 3m77 h ALA 287 N 0.97 0.98 -0.27 2.41 0.00 -0.49 0.52 119.26 123.39 3m77 h ALA 287 Ca 0.09 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 3m77 h ALA 287 Cb 0.27 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3m77 h ALA 287 CO -0.22 0.42 -0.03 0.35 0.00 0.00 0.00 179.25 179.77 3m77 h PHE 288 N 1.05 0.55 -0.13 0.00 3.57 -0.80 -1.49 116.94 119.69 3m77 h PHE 288 Ca 0.28 -0.11 -0.02 0.00 3.53 0.00 0.00 57.97 61.65 3m77 h PHE 288 Cb -0.08 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 38.51 3m77 h PHE 288 CO -0.01 0.68 -0.00 0.28 -2.23 0.00 0.00 178.31 177.02 3m77 h VAL 289 N 0.26 1.25 -0.24 1.41 2.07 -0.91 -2.18 116.25 117.92 3m77 h VAL 289 Ca 0.07 -0.83 0.05 0.00 0.82 0.00 0.00 66.70 66.81 3m77 h VAL 289 Cb 0.48 1.55 -0.05 0.00 -1.52 0.00 0.00 31.29 31.75 3m77 h VAL 289 CO 0.02 0.24 -0.08 0.15 0.02 0.00 0.00 177.57 177.92 3m77 h PHE 290 N -0.03 -0.18 -0.52 1.57 3.57 -0.89 -0.30 116.94 120.15 3m77 h PHE 290 Ca 0.04 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 3m77 h PHE 290 Cb 0.37 0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.20 3m77 h PHE 290 CO 0.03 -0.13 0.31 0.77 -2.23 0.00 0.00 178.31 177.06 3m77 h SER 291 N -0.03 0.63 -0.57 0.41 0.02 -1.25 -0.98 113.55 111.78 3m77 h SER 291 Ca 0.12 -0.06 -0.05 0.00 -0.84 0.00 0.00 61.79 60.96 3m77 h SER 291 Cb 0.21 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 3m77 h SER 291 CO -0.26 0.51 0.16 0.78 -1.14 0.00 0.00 176.83 176.87 3m77 h ASN 292 N 0.70 0.85 -0.60 3.07 2.35 -1.03 -1.55 115.58 119.36 3m77 h ASN 292 Ca 0.19 -0.22 -0.01 0.00 -0.55 0.00 0.00 56.30 55.70 3m77 h ASN 292 Cb -0.00 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.12 3m77 h ASN 292 CO -0.03 0.85 0.33 0.58 -1.65 0.00 0.00 177.43 177.50 3m77 h VAL 293 N 0.81 1.20 -0.47 2.81 2.07 -0.75 0.13 116.25 122.04 3m77 h VAL 293 Ca 0.18 -0.50 -0.14 0.00 0.82 0.00 0.00 66.70 67.07 3m77 h VAL 293 Cb 0.32 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 3m77 h VAL 293 CO -0.00 0.21 -0.23 0.24 0.02 0.00 0.00 177.57 177.81 3m77 h MET 294 N 0.82 1.00 -0.24 1.57 2.86 -0.99 0.19 114.93 120.14 3m77 h MET 294 Ca 0.21 -0.44 -0.10 0.00 -2.06 0.00 0.00 59.70 57.32 3m77 h MET 294 Cb 0.05 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 3m77 h MET 294 CO -0.03 1.12 -0.27 0.82 1.06 0.00 0.00 176.91 179.60 3m77 h ILE 295 N 0.85 1.27 -0.57 -1.22 2.04 -1.16 -0.78 117.51 117.95 3m77 h ILE 295 Ca 0.11 -1.30 0.02 0.00 1.00 0.00 0.00 64.86 64.69 3m77 h ILE 295 Cb 0.82 1.39 -0.03 0.00 -0.74 0.00 0.00 36.82 38.25 3m77 h ILE 295 CO 0.07 0.41 0.36 1.23 0.00 0.00 0.00 178.15 180.22 3m77 h GLY 296 N 1.03 0.81 1.01 5.37 0.00 -0.11 0.35 103.07 111.53 3m77 h GLY 296 Ca 0.06 -0.27 -0.03 0.00 0.00 0.00 0.00 47.33 47.09 3m77 h GLY 296 CO 0.05 0.24 0.30 1.41 0.00 0.00 0.00 176.54 178.54 3m77 h LEU 297 N 0.71 0.88 -0.54 3.11 3.38 -0.51 -0.58 115.31 121.76 3m77 h LEU 297 Ca 0.23 -0.15 0.07 0.00 0.09 0.00 0.00 57.88 58.12 3m77 h LEU 297 Cb -0.01 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 40.45 3m77 h LEU 297 CO -0.08 0.78 0.21 -0.07 0.09 0.00 0.00 178.44 179.37 3m77 h LEU 298 N 0.92 0.22 -0.45 1.67 3.38 -0.44 -0.14 115.31 120.48 3m77 h LEU 298 Ca 0.22 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.25 3m77 h LEU 298 Cb 0.15 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 3m77 h LEU 298 CO -0.03 0.15 0.27 0.58 0.09 0.00 0.00 178.44 179.50 3m77 h VAL 299 N 0.40 1.15 -0.42 1.22 2.07 -0.42 -0.76 116.25 119.48 3m77 h VAL 299 Ca 0.26 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 3m77 h VAL 299 Cb 0.28 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 3m77 h VAL 299 CO -0.26 0.15 0.23 -0.07 0.02 0.00 0.00 177.57 177.64 3m77 h LEU 300 N 0.60 0.53 -0.99 2.57 3.38 -0.68 -0.36 115.31 120.37 3m77 h LEU 300 Ca 0.16 -0.10 0.09 0.00 0.09 0.00 0.00 57.88 58.12 3m77 h LEU 300 Cb 0.01 -0.14 -0.07 0.00 0.09 0.00 0.00 40.66 40.55 3m77 h LEU 300 CO -0.03 0.48 0.63 -0.03 0.09 0.00 0.00 178.44 179.58 3m77 h MET 301 N 0.55 1.04 -0.20 1.13 4.05 -0.92 -1.48 114.93 119.10 3m77 h MET 301 Ca 0.15 -0.06 -0.06 0.00 -0.28 0.00 0.00 59.70 59.45 3m77 h MET 301 Cb 0.07 -0.24 -0.00 0.00 -0.80 0.00 0.00 31.60 30.63 3m77 h MET 301 CO -0.02 0.69 -0.11 1.15 0.23 0.00 0.00 176.91 178.85 3m77 h THR 302 N 1.08 1.31 -0.63 -0.77 2.02 -0.31 -1.41 112.91 114.19 3m77 h THR 302 Ca 0.46 -1.18 0.03 0.00 0.77 0.00 0.00 66.41 66.48 3m77 h THR 302 Cb 0.31 1.66 -0.04 0.00 -1.74 0.00 0.00 68.15 68.34 3m77 h THR 302 CO -0.22 0.36 0.39 0.40 0.37 0.00 0.00 175.52 176.82 3m77 h ILE 303 N 0.12 1.07 -0.11 3.11 2.04 -0.98 -0.32 117.51 122.43 3m77 h ILE 303 Ca 0.04 -0.26 0.04 0.00 1.00 0.00 0.00 64.86 65.68 3m77 h ILE 303 Cb 0.60 0.24 -0.04 0.00 -0.74 0.00 0.00 36.82 36.89 3m77 h ILE 303 CO 0.03 0.14 -0.15 0.22 0.00 0.00 0.00 178.15 178.39 3m77 h TYR 304 N 0.76 -0.39 -1.01 1.37 3.20 -1.11 -0.35 116.97 119.45 3m77 h TYR 304 Ca 0.26 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.18 3m77 h TYR 304 Cb 0.03 0.19 -0.06 0.00 1.54 0.00 0.00 36.73 38.44 3m77 h TYR 304 CO -0.05 -0.22 0.66 0.87 -1.64 0.00 0.00 178.16 177.78 3m77 h LYS 305 N -0.20 1.26 -0.55 1.82 1.79 -0.87 -1.89 116.57 117.93 3m77 h LYS 305 Ca 0.09 -0.08 -0.08 0.00 -2.18 0.00 0.00 60.65 58.40 3m77 h LYS 305 Cb 0.32 -0.28 -0.02 0.00 -1.58 0.00 0.00 32.23 30.67 3m77 h LYS 305 CO -0.23 0.83 0.01 -0.07 -1.08 0.00 0.00 179.45 178.92 3m77 h LEU 306 N 1.29 0.94 -1.59 2.94 3.38 -0.66 0.88 115.31 122.49 3m77 h LEU 306 Ca 0.39 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 3m77 h LEU 306 Cb -0.03 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 3m77 h LEU 306 CO -0.12 1.01 -0.11 0.74 0.09 0.00 0.00 178.44 180.05 3m77 h THR 307 N 0.84 1.13 -0.07 0.22 2.02 -0.52 -2.41 112.91 114.13 3m77 h THR 307 Ca 0.16 -0.58 0.00 0.00 0.77 0.00 0.00 66.41 66.76 3m77 h THR 307 Cb 0.52 1.19 0.00 0.00 -1.74 0.00 0.00 68.15 68.12 3m77 h THR 307 CO 0.03 0.17 0.00 0.29 0.37 0.00 0.00 175.52 176.38 3m77 n LYS 308 N -4.34 1.91 -2.14 6.66 4.76 -0.76 -4.95 118.16 119.30 3m77 n LYS 308 Ca -0.02 -1.34 -0.08 0.00 -2.87 0.00 0.00 58.31 54.01 3m77 n LYS 308 Cb 0.22 -1.46 -0.00 0.00 -1.84 0.00 0.00 35.03 31.94 3m77 n LYS 308 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3m77 n GLY 309 N 1.24 0.05 0.69 0.72 0.00 -0.77 -4.94 105.19 102.19 3m77 n GLY 309 Ca 0.17 -0.56 0.04 0.00 0.00 0.00 0.00 46.02 45.67 3m77 n GLY 309 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3m77 n GLN 310 N -1.75 1.66 -0.04 1.61 6.02 0.23 -4.75 117.38 120.38 3m77 n GLN 310 Ca -0.09 -3.17 -0.03 0.00 -0.01 0.00 0.00 57.00 53.70 3m77 n GLN 310 Cb 0.57 -1.66 -0.01 0.00 1.02 0.00 0.00 30.24 30.15 3m77 n GLN 310 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3m77 n PHE 311 N -1.14 0.20 -2.49 1.08 -0.00 -1.23 -4.85 117.46 109.02 3m77 n PHE 311 Ca 0.22 0.09 -0.33 0.00 -0.00 0.00 0.00 57.45 57.43 3m77 n PHE 311 Cb 0.78 -0.35 -0.03 0.00 -0.00 0.00 0.00 39.48 39.88 3m77 n PHE 311 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.76 176.70 3m77 s PHE 312 N -1.74 3.14 -2.00 -5.13 0.08 -1.26 -5.00 117.98 106.07 3m77 s PHE 312 Ca -0.10 1.56 0.21 0.00 0.12 0.00 0.00 56.93 58.71 3m77 s PHE 312 Cb 0.01 -2.96 1.24 0.00 -0.57 0.00 0.00 43.02 40.74 3m77 s PHE 312 CO 0.15 -0.65 1.62 1.28 -0.10 0.00 0.00 175.22 177.53