#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g3t s PHE 4 N 0.00 -0.24 -0.00 5.64 -0.71 -1.26 -4.16 117.98 117.25 2g3t s PHE 4 Ca 0.00 -0.03 0.02 0.00 -1.04 0.00 0.00 56.93 55.87 2g3t s PHE 4 Cb 0.00 0.61 -0.00 0.00 -1.21 0.00 0.00 43.02 42.42 2g3t s PHE 4 CO 0.00 -0.82 -0.05 0.54 -1.34 0.00 0.00 175.22 173.55 2g3t s VAL 5 N -3.39 0.40 -0.20 -2.49 0.11 0.12 -4.95 120.40 110.01 2g3t s VAL 5 Ca 0.09 -0.23 -0.07 0.00 -2.93 0.00 0.00 61.98 58.83 2g3t s VAL 5 Cb -0.02 -0.35 -0.04 0.00 -1.53 0.00 0.00 36.38 34.45 2g3t s VAL 5 CO -0.02 0.10 0.06 -0.63 -3.33 0.00 0.00 175.10 171.29 2g3t s ILE 6 N -0.14 4.67 0.12 7.04 -1.09 -1.26 -0.08 121.20 130.46 2g3t s ILE 6 Ca 0.02 -0.07 -0.13 0.00 -2.23 0.00 0.00 60.65 58.24 2g3t s ILE 6 Cb -0.02 -3.12 0.02 0.00 -1.58 0.00 0.00 42.46 37.75 2g3t s ILE 6 CO -0.00 0.43 0.33 0.00 -1.23 0.00 0.00 174.94 174.46 2g3t s ARG 7 N 0.69 1.03 0.50 2.79 1.70 -0.45 -4.97 118.95 120.23 2g3t s ARG 7 Ca 0.03 -0.85 -0.22 0.00 -0.47 0.00 0.00 55.73 54.22 2g3t s ARG 7 Cb -0.13 0.42 -0.06 0.00 -0.57 0.00 0.00 34.95 34.61 2g3t s ARG 7 CO 0.02 -0.38 1.20 -1.25 -1.08 0.00 0.00 175.30 173.81 2g3t s PRO 8 N -3.85 3.50 0.62 3.89 0.04 -1.26 -0.29 135.00 137.65 2g3t s PRO 8 Ca 0.06 1.86 -0.15 0.00 0.04 0.00 0.00 61.00 62.80 2g3t s PRO 8 Cb 0.03 -2.28 -0.02 0.00 0.04 0.00 0.00 34.50 32.26 2g3t s PRO 8 CO -0.10 -0.78 1.06 0.00 0.04 0.00 0.00 177.00 177.22 2g3t s ALA 9 N -1.53 2.69 0.34 8.56 0.00 0.09 -4.74 121.76 127.18 2g3t s ALA 9 Ca 0.68 0.35 0.08 0.00 0.00 0.00 0.00 51.96 53.07 2g3t s ALA 9 Cb -0.31 -3.23 -0.07 0.00 0.00 0.00 0.00 23.12 19.52 2g3t s ALA 9 CO 0.36 -0.94 -0.07 0.95 0.00 0.00 0.00 175.76 176.06 2g3t s THR 10 N -2.55 2.06 0.44 0.00 -4.23 -1.26 -4.94 115.64 105.16 2g3t s THR 10 Ca 0.63 -2.16 0.15 0.00 -1.18 0.00 0.00 61.69 59.13 2g3t s THR 10 Cb -0.16 -2.66 0.35 0.00 1.34 0.00 0.00 72.50 71.37 2g3t s THR 10 CO 0.41 -0.19 1.95 0.00 -0.54 0.00 0.00 174.62 176.25 2g3t h ALA 11 N 2.05 2.09 0.00 3.99 0.00 -1.97 0.14 119.26 125.56 2g3t h ALA 11 Ca -0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2g3t h ALA 11 Cb 1.25 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2g3t h ALA 11 CO 0.71 -0.26 0.00 0.00 0.00 0.00 0.00 179.25 179.70 2g3t h ALA 12 N 1.67 1.00 -0.00 0.00 0.00 -2.03 -1.92 119.26 117.99 2g3t h ALA 12 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2g3t h ALA 12 Cb 0.72 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2g3t h ALA 12 CO -0.09 0.00 -0.29 -0.25 0.00 0.00 0.00 179.25 178.62 2g3t n ASP 13 N -2.54 0.66 -0.32 0.00 8.00 0.50 -4.37 116.55 118.47 2g3t n ASP 13 Ca -0.01 -0.50 0.04 0.00 0.71 0.00 0.00 54.79 55.03 2g3t n ASP 13 Cb 0.13 0.08 0.18 0.00 -0.02 0.00 0.00 41.12 41.50 2g3t n ASP 13 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2g3t h SER 15 N 0.89 0.83 -0.24 0.00 4.64 -1.82 -0.70 113.55 117.16 2g3t h SER 15 Ca 0.42 -0.06 -0.15 0.00 -0.47 0.00 0.00 61.79 61.53 2g3t h SER 15 Cb 0.36 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 2g3t h SER 15 CO -0.24 0.67 -0.41 0.44 -0.87 0.00 0.00 176.83 176.42 2g3t h ASP 16 N 0.94 0.84 -0.40 4.97 3.32 -1.46 -1.43 116.42 123.21 2g3t h ASP 16 Ca 0.24 -0.39 -0.04 0.00 0.02 0.00 0.00 57.03 56.86 2g3t h ASP 16 Cb 0.02 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 2g3t h ASP 16 CO -0.04 1.14 0.09 0.40 -1.72 0.00 0.00 179.24 179.11 2g3t h ILE 17 N 0.64 1.23 -0.34 0.35 1.08 -0.46 -0.56 117.51 119.44 2g3t h ILE 17 Ca 0.05 -0.80 -0.07 0.00 -0.39 0.00 0.00 64.86 63.65 2g3t h ILE 17 Cb 0.97 0.99 -0.02 0.00 -3.07 0.00 0.00 36.82 35.69 2g3t h ILE 17 CO 0.09 0.28 -0.07 0.25 -0.69 0.00 0.00 178.15 178.01 2g3t h LEU 18 N 0.51 0.54 -0.38 1.44 5.85 -1.08 0.16 115.31 122.35 2g3t h LEU 18 Ca 0.13 -0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2g3t h LEU 18 Cb 0.32 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 2g3t h LEU 18 CO 0.00 0.66 0.13 -0.09 -0.34 0.00 0.00 178.44 178.80 2g3t h ARG 19 N 0.53 0.57 0.00 1.25 2.43 -0.83 -0.02 114.38 118.31 2g3t h ARG 19 Ca 0.10 -0.12 -0.11 0.00 -0.81 0.00 0.00 59.98 59.04 2g3t h ARG 19 Cb 0.44 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 2g3t h ARG 19 CO 0.02 0.57 -0.54 -0.07 -1.51 0.00 0.00 179.97 178.45 2g3t h LEU 20 N 0.46 0.00 -0.07 3.80 3.38 -0.63 -0.33 115.31 121.92 2g3t h LEU 20 Ca 0.12 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2g3t h LEU 20 Cb 0.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 2g3t h LEU 20 CO -0.01 0.54 -0.08 0.40 0.09 0.00 0.00 178.44 179.39 2g3t h ILE 21 N 0.00 1.38 0.00 1.22 2.04 -0.43 0.35 117.51 122.07 2g3t h ILE 21 Ca -0.01 -1.25 -0.03 0.00 1.00 0.00 0.00 64.86 64.57 2g3t h ILE 21 Cb 0.96 2.06 -0.00 0.00 -0.74 0.00 0.00 36.82 39.09 2g3t h ILE 21 CO 0.07 0.35 -0.14 0.11 0.00 0.00 0.00 178.15 178.54 2g3t h LYS 22 N -0.27 0.00 -0.25 2.37 1.57 -0.91 0.79 116.57 119.87 2g3t h LYS 22 Ca 0.01 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.66 2g3t h LYS 22 Cb 0.60 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.91 2g3t h LYS 22 CO 0.02 0.14 -0.37 1.49 -0.57 0.00 0.00 179.45 180.16 2g3t h GLU 23 N 0.00 0.68 -0.46 3.15 4.57 -0.74 -3.05 114.58 118.73 2g3t h GLU 23 Ca -0.00 -0.41 -0.08 0.00 -1.18 0.00 0.00 59.36 57.69 2g3t h GLU 23 Cb 0.29 0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.90 2g3t h GLU 23 CO 0.02 1.03 -0.03 1.25 -1.18 0.00 0.00 179.01 180.09 2g3t h LEU 24 N 0.40 0.82 -2.29 1.64 5.85 0.19 -2.67 115.31 119.25 2g3t h LEU 24 Ca 0.02 -0.32 0.04 0.00 0.84 0.00 0.00 57.88 58.46 2g3t h LEU 24 Cb 0.96 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.76 2g3t h LEU 24 CO 0.09 0.95 0.20 0.00 -0.34 0.00 0.00 178.44 179.33 2g3t h ALA 25 N 0.90 1.65 0.00 1.25 0.00 0.53 0.87 119.26 124.46 2g3t h ALA 25 Ca 0.13 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.82 2g3t h ALA 25 Cb 0.55 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 2g3t h ALA 25 CO 0.03 -0.27 -1.38 0.87 0.00 0.00 0.00 179.25 178.50 2g3t h LYS 26 N 0.00 0.00 0.00 0.00 1.57 -1.38 -3.30 116.57 113.47 2g3t h LYS 26 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2g3t h LYS 26 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.77 2g3t h LYS 26 CO -0.00 0.46 0.00 0.98 -0.57 0.00 0.00 179.45 180.32 2g3t n TYR 27 N -3.03 0.70 -2.11 -1.35 9.36 0.19 -4.83 117.16 116.10 2g3t n TYR 27 Ca -0.10 0.20 -0.31 0.00 3.32 0.00 0.00 57.90 61.01 2g3t n TYR 27 Cb 0.91 -0.83 -0.01 0.00 -0.63 0.00 0.00 39.34 38.78 2g3t n TYR 27 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 2g3t s GLU 28 N -3.08 3.75 -0.26 2.98 0.41 -0.55 -5.01 118.70 116.94 2g3t s GLU 28 Ca 0.11 0.83 0.01 0.00 -0.41 0.00 0.00 54.97 55.51 2g3t s GLU 28 Cb 0.14 -2.11 -0.17 0.00 -1.78 0.00 0.00 34.13 30.21 2g3t s GLU 28 CO 0.58 -0.43 -0.22 0.66 -0.49 0.00 0.00 175.26 175.35 2g3t n TYR 29 N -2.23 0.03 -1.83 1.61 0.53 -1.26 -4.63 117.16 109.37 2g3t n TYR 29 Ca 0.06 0.01 -0.33 0.00 -1.02 0.00 0.00 57.90 56.62 2g3t n TYR 29 Cb 0.54 -1.00 -0.06 0.00 -1.03 0.00 0.00 39.34 37.79 2g3t n TYR 29 CO 0.00 0.00 0.00 -1.33 -1.02 0.00 0.00 176.86 174.51 2g3t n MET 30 N -3.31 1.61 -1.53 -0.72 2.81 -1.26 -4.87 117.12 109.85 2g3t n MET 30 Ca -0.46 -2.32 -0.38 0.00 -1.81 0.00 0.00 57.70 52.73 2g3t n MET 30 Cb 0.99 -3.51 -0.07 0.00 -0.71 0.00 0.00 33.22 29.91 2g3t n MET 30 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 2g3t n GLU 31 N 7.95 0.66 -3.84 0.03 0.00 -1.26 -4.92 120.64 119.26 2g3t n GLU 31 Ca 0.46 -0.01 -0.13 0.00 0.00 0.00 0.00 57.16 57.48 2g3t n GLU 31 Cb 0.45 -2.75 -0.15 0.00 0.00 0.00 0.00 31.44 28.99 2g3t n GLU 31 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 2g3t s GLU 32 N 8.55 -0.00 0.09 3.44 8.01 -1.26 -5.16 118.70 132.37 2g3t s GLU 32 Ca 1.12 0.07 0.01 0.00 0.01 0.00 0.00 54.97 56.18 2g3t s GLU 32 Cb -0.57 -0.11 -0.04 0.00 -4.31 0.00 0.00 34.13 29.11 2g3t s GLU 32 CO 0.34 -0.07 0.23 -0.65 0.01 0.00 0.00 175.26 175.12 2g3t s GLN 33 N 0.43 3.40 -0.01 1.61 -1.52 -1.26 -4.96 119.66 117.36 2g3t s GLN 33 Ca -0.04 -0.51 -0.30 0.00 -1.95 0.00 0.00 55.36 52.56 2g3t s GLN 33 Cb -0.05 -2.99 -0.08 0.00 -0.22 0.00 0.00 33.01 29.66 2g3t s GLN 33 CO -0.01 0.58 1.98 0.08 -0.25 0.00 0.00 175.29 177.66 2g3t s VAL 34 N -1.59 3.07 -0.07 1.09 1.01 -1.26 -4.87 120.40 117.77 2g3t s VAL 34 Ca 0.34 0.08 0.21 0.00 0.00 0.00 0.00 61.98 62.61 2g3t s VAL 34 Cb -0.12 -3.05 -0.32 0.00 0.00 0.00 0.00 36.38 32.89 2g3t s VAL 34 CO 0.28 -0.01 0.37 -0.38 0.00 0.00 0.00 175.10 175.36 2g3t n ILE 35 N 5.85 0.36 -1.82 2.22 5.41 -1.26 -4.96 119.36 125.16 2g3t n ILE 35 Ca 0.21 -0.59 -0.38 0.00 1.00 0.00 0.00 62.75 62.99 2g3t n ILE 35 Cb 0.42 -0.12 0.04 0.00 -0.71 0.00 0.00 39.64 39.27 2g3t n ILE 35 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2g3t s LEU 36 N -4.77 3.82 0.43 1.39 1.43 -1.26 -5.03 118.68 114.68 2g3t s LEU 36 Ca -0.09 2.70 0.06 0.00 -1.03 0.00 0.00 54.13 55.78 2g3t s LEU 36 Cb 0.12 -4.33 -0.05 0.00 0.03 0.00 0.00 46.19 41.96 2g3t s LEU 36 CO 0.89 -1.59 0.10 0.42 0.23 0.00 0.00 176.35 176.40 2g3t s THR 37 N -1.34 1.97 0.35 5.49 -4.23 -1.26 -4.99 115.64 111.62 2g3t s THR 37 Ca 0.73 -1.86 0.05 0.00 -1.18 0.00 0.00 61.69 59.43 2g3t s THR 37 Cb -0.39 -2.83 0.17 0.00 1.34 0.00 0.00 72.50 70.79 2g3t s THR 37 CO 0.45 0.00 1.90 -0.08 -0.54 0.00 0.00 174.62 176.35 2g3t h GLU 38 N 1.52 0.50 -0.31 3.99 4.81 -1.96 -1.39 114.58 121.75 2g3t h GLU 38 Ca -0.43 -0.10 -0.05 0.00 -0.13 0.00 0.00 59.36 58.65 2g3t h GLU 38 Cb 1.26 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.54 2g3t h GLU 38 CO 0.74 0.52 -0.01 -0.22 -0.73 0.00 0.00 179.01 179.31 2g3t h LYS 39 N 0.49 0.48 0.08 1.92 3.64 -1.98 -1.54 116.57 119.65 2g3t h LYS 39 Ca 0.11 -0.10 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2g3t h LYS 39 Cb 0.29 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 2g3t h LYS 39 CO 0.01 0.52 -0.04 -0.44 -2.27 0.00 0.00 179.45 177.23 2g3t h ASP 40 N 0.46 -0.09 -0.97 4.20 3.32 -1.65 -0.75 116.42 120.94 2g3t h ASP 40 Ca 0.10 -0.20 0.07 0.00 0.02 0.00 0.00 57.03 57.03 2g3t h ASP 40 Cb 0.32 0.02 -0.07 0.00 0.22 0.00 0.00 39.33 39.83 2g3t h ASP 40 CO 0.01 0.15 0.61 -0.07 -1.72 0.00 0.00 179.24 178.22 2g3t h LEU 41 N -0.33 0.97 -0.06 1.55 3.38 -1.16 0.23 115.31 119.88 2g3t h LEU 41 Ca -0.01 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2g3t h LEU 41 Cb 0.28 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 2g3t h LEU 41 CO 0.02 0.60 -0.01 -0.07 0.09 0.00 0.00 178.44 179.07 2g3t h LEU 42 N 1.09 0.12 -0.54 1.67 3.38 -1.14 -0.11 115.31 119.79 2g3t h LEU 42 Ca 0.43 -0.36 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 2g3t h LEU 42 Cb 0.22 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 2g3t h LEU 42 CO -0.19 0.45 0.08 -0.08 0.09 0.00 0.00 178.44 178.79 2g3t h GLU 43 N -0.21 0.89 0.00 1.13 4.81 -0.79 0.23 114.58 120.65 2g3t h GLU 43 Ca 0.02 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 59.00 2g3t h GLU 43 Cb 0.40 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.67 2g3t h GLU 43 CO 0.01 0.87 -0.20 -0.44 -0.73 0.00 0.00 179.01 178.52 2g3t h ASP 44 N 0.78 0.00 0.00 1.04 3.32 -0.59 -3.05 116.42 117.92 2g3t h ASP 44 Ca 0.16 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.15 2g3t h ASP 44 Cb 0.42 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 2g3t h ASP 44 CO 0.01 0.00 -1.48 0.61 -1.72 0.00 0.00 179.24 176.66 2g3t n GLY 45 N 1.14 -0.42 1.13 2.75 0.00 -0.06 -0.04 105.19 109.69 2g3t n GLY 45 Ca 0.03 -0.19 0.04 0.00 0.00 0.00 0.00 46.02 45.90 2g3t n GLY 45 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2g3t n PHE 46 N -2.00 0.10 -1.20 1.61 3.01 0.82 -4.65 117.46 115.14 2g3t n PHE 46 Ca -0.06 -1.04 0.00 0.00 1.01 0.00 0.00 57.45 57.35 2g3t n PHE 46 Cb 0.44 -0.20 0.00 0.00 -0.01 0.00 0.00 39.48 39.70 2g3t n PHE 46 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2g3t n GLY 47 N -0.31 1.84 0.45 1.37 0.00 -1.15 -4.87 105.19 102.52 2g3t n GLY 47 Ca 0.13 -1.92 -0.17 0.00 0.00 0.00 0.00 46.02 44.06 2g3t n GLY 47 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2g3t h GLU 48 N 0.00 -1.01 -5.14 1.61 4.11 -1.95 -3.41 114.58 108.79 2g3t h GLU 48 Ca 0.00 0.07 -0.66 0.00 0.07 0.00 0.00 59.36 58.84 2g3t h GLU 48 Cb 0.00 0.23 -0.28 0.00 0.50 0.00 0.00 28.75 29.20 2g3t h GLU 48 CO 0.00 -0.68 -0.75 -1.58 0.07 0.00 0.00 179.01 176.07 2g3t s HIS 49 N -5.52 2.88 -0.14 2.06 5.65 -1.26 -5.09 115.29 113.86 2g3t s HIS 49 Ca -0.16 -0.89 -0.28 0.00 0.25 0.00 0.00 55.06 53.97 2g3t s HIS 49 Cb 0.03 -1.98 -0.01 0.00 -1.18 0.00 0.00 32.58 29.44 2g3t s HIS 49 CO 0.52 -0.43 0.97 -1.25 -0.65 0.00 0.00 174.74 173.89 2g3t s PRO 50 N 0.98 4.36 0.00 2.88 0.04 -1.26 -4.76 135.00 137.24 2g3t s PRO 50 Ca -0.01 1.30 0.27 0.00 0.04 0.00 0.00 61.00 62.60 2g3t s PRO 50 Cb -0.15 -3.57 0.86 0.00 0.04 0.00 0.00 34.50 31.68 2g3t s PRO 50 CO -0.01 -0.38 1.63 1.19 0.04 0.00 0.00 177.00 179.47 2g3t n PHE 51 N 5.31 0.00 -3.50 0.56 3.01 0.95 -4.90 117.46 118.88 2g3t n PHE 51 Ca 0.08 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.43 2g3t n PHE 51 Cb 0.48 -0.13 -0.03 0.00 -0.01 0.00 0.00 39.48 39.79 2g3t n PHE 51 CO 0.00 0.00 0.00 1.52 1.01 0.00 0.00 176.76 179.29 2g3t s TYR 52 N -2.48 -0.42 0.04 1.38 -0.85 -1.25 -4.86 117.35 108.91 2g3t s TYR 52 Ca 0.26 0.17 0.04 0.00 -0.52 0.00 0.00 57.07 57.02 2g3t s TYR 52 Cb 0.19 0.46 -0.02 0.00 0.38 0.00 0.00 41.96 42.98 2g3t s TYR 52 CO 0.50 -0.81 -0.13 -1.01 -1.52 0.00 0.00 175.55 172.59 2g3t s HIS 53 N -3.77 1.10 0.03 -3.49 3.76 0.83 -4.69 115.29 109.06 2g3t s HIS 53 Ca 0.02 -0.36 0.05 0.00 -0.15 0.00 0.00 55.06 54.62 2g3t s HIS 53 Cb -0.00 -0.65 -0.02 0.00 1.11 0.00 0.00 32.58 33.02 2g3t s HIS 53 CO -0.12 0.02 -0.15 0.00 -0.85 0.00 0.00 174.74 173.64 2g3t s LEU 55 N -0.94 3.29 0.06 0.00 1.43 -0.15 -0.73 118.68 121.64 2g3t s LEU 55 Ca 0.03 -0.11 0.06 0.00 -1.03 0.00 0.00 54.13 53.08 2g3t s LEU 55 Cb -0.07 -1.90 -0.03 0.00 0.03 0.00 0.00 46.19 44.22 2g3t s LEU 55 CO 0.01 0.27 -0.18 -0.69 0.23 0.00 0.00 176.35 176.00 2g3t s VAL 56 N -1.05 1.41 -0.27 -1.59 1.01 0.60 -1.08 120.40 119.44 2g3t s VAL 56 Ca 0.18 -1.25 -0.07 0.00 0.00 0.00 0.00 61.98 60.84 2g3t s VAL 56 Cb -0.11 -1.28 -0.01 0.00 0.00 0.00 0.00 36.38 34.98 2g3t s VAL 56 CO 0.09 -0.00 0.08 0.00 0.00 0.00 0.00 175.10 175.27 2g3t s ALA 57 N -1.00 3.14 -0.08 5.51 0.00 -0.69 -1.35 121.76 127.29 2g3t s ALA 57 Ca 0.04 -1.25 0.02 0.00 0.00 0.00 0.00 51.96 50.77 2g3t s ALA 57 Cb -0.09 -2.13 -0.02 0.00 0.00 0.00 0.00 23.12 20.88 2g3t s ALA 57 CO 0.02 -0.66 -0.14 -2.00 0.00 0.00 0.00 175.76 172.98 2g3t s GLU 58 N 1.58 2.89 0.29 0.00 2.12 0.88 -1.26 118.70 125.20 2g3t s GLU 58 Ca 0.05 -0.70 0.09 0.00 0.36 0.00 0.00 54.97 54.77 2g3t s GLU 58 Cb -0.16 -2.48 -0.04 0.00 0.26 0.00 0.00 34.13 31.71 2g3t s GLU 58 CO 0.03 0.43 0.07 0.14 -0.54 0.00 0.00 175.26 175.39 2g3t s VAL 59 N -0.23 3.40 0.71 3.70 -7.23 -0.19 0.12 120.40 120.68 2g3t s VAL 59 Ca 0.01 -1.78 -0.16 0.00 -1.81 0.00 0.00 61.98 58.24 2g3t s VAL 59 Cb -0.13 -2.95 0.03 0.00 0.56 0.00 0.00 36.38 33.88 2g3t s VAL 59 CO 0.03 -0.30 1.22 -2.84 -0.31 0.00 0.00 175.10 172.90 2g3t s PRO 60 N -3.75 2.25 0.56 4.82 0.02 -1.26 -4.82 135.00 132.82 2g3t s PRO 60 Ca 0.34 1.82 0.29 0.00 0.02 0.00 0.00 61.00 63.47 2g3t s PRO 60 Cb -0.05 -1.84 1.46 0.00 0.02 0.00 0.00 34.50 34.09 2g3t s PRO 60 CO 0.21 -1.77 1.93 1.57 -0.33 0.00 0.00 177.00 178.62 2g3t h LYS 61 N -0.08 0.00 0.00 5.54 -0.00 -1.98 0.47 116.57 120.51 2g3t h LYS 61 Ca -0.48 0.00 -0.02 0.00 -0.00 0.00 0.00 60.65 60.14 2g3t h LYS 61 Cb 1.30 0.00 -0.00 0.00 -0.00 0.00 0.00 32.23 33.53 2g3t h LYS 61 CO 0.51 0.00 -0.12 0.93 -0.00 0.00 0.00 179.45 180.77 2g3t h GLU 62 N 0.00 0.00 -0.19 0.07 3.07 -2.01 -3.15 114.58 112.37 2g3t h GLU 62 Ca 0.28 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 59.06 2g3t h GLU 62 Cb 1.26 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 29.12 2g3t h GLU 62 CO -0.00 0.12 -0.18 0.72 -1.40 0.00 0.00 179.01 178.26 2g3t n HIS 63 N -3.27 0.60 -1.33 4.33 8.25 0.16 -5.05 115.22 118.91 2g3t n HIS 63 Ca 0.00 -1.40 -0.32 0.00 -0.26 0.00 0.00 57.72 55.75 2g3t n HIS 63 Cb 0.37 -0.35 0.09 0.00 1.12 0.00 0.00 29.99 31.21 2g3t n HIS 63 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2g3t s TRP 64 N -3.14 2.42 0.75 4.41 0.52 -1.11 -4.82 118.94 117.97 2g3t s TRP 64 Ca 0.41 1.59 -0.11 0.00 0.02 0.00 0.00 56.10 58.00 2g3t s TRP 64 Cb 0.37 -3.15 0.05 0.00 -1.15 0.00 0.00 33.47 29.58 2g3t s TRP 64 CO -0.01 -1.97 1.09 0.95 0.02 0.00 0.00 176.95 177.04 2g3t s THR 65 N -2.65 3.33 -0.83 2.01 -4.23 -0.27 -4.82 115.64 108.19 2g3t s THR 65 Ca 0.64 0.46 0.00 0.00 -1.18 0.00 0.00 61.69 61.62 2g3t s THR 65 Cb -0.20 -2.96 0.00 0.00 1.34 0.00 0.00 72.50 70.68 2g3t s THR 65 CO 0.52 -0.53 0.57 -2.65 -0.54 0.00 0.00 174.62 171.99 2g3t n PRO 66 N -3.32 0.00 -0.03 3.99 -0.02 -1.26 0.33 135.00 134.70 2g3t n PRO 66 Ca 0.09 0.16 0.03 0.00 -2.02 0.00 0.00 63.50 61.77 2g3t n PRO 66 Cb 0.53 -1.62 0.05 0.00 -0.02 0.00 0.00 33.50 32.43 2g3t n PRO 66 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2g3t n GLU 67 N -1.07 0.76 -0.35 -0.52 -0.58 -1.26 -5.00 120.64 112.61 2g3t n GLU 67 Ca 0.00 -1.16 0.00 0.00 -0.42 0.00 0.00 57.16 55.58 2g3t n GLU 67 Cb 0.12 -1.14 0.00 0.00 -0.57 0.00 0.00 31.44 29.85 2g3t n GLU 67 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2g3t n GLY 68 N 0.31 0.80 3.87 0.62 0.00 0.15 -5.08 105.19 105.86 2g3t n GLY 68 Ca 0.05 -0.18 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 2g3t n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2g3t s HIS 69 N -2.00 3.46 -0.09 1.61 3.76 -1.25 -4.80 115.29 115.97 2g3t s HIS 69 Ca 0.00 0.88 0.17 0.00 -0.15 0.00 0.00 55.06 55.96 2g3t s HIS 69 Cb 0.00 -2.26 -0.26 0.00 1.11 0.00 0.00 32.58 31.18 2g3t s HIS 69 CO 0.00 0.31 0.40 -1.13 -0.85 0.00 0.00 174.74 173.47 2g3t n SER 70 N 0.05 1.09 -4.59 1.40 3.41 -1.26 -1.11 113.62 112.61 2g3t n SER 70 Ca -0.01 -0.08 -0.41 0.00 -0.26 0.00 0.00 58.87 58.11 2g3t n SER 70 Cb 0.52 1.70 -0.07 0.00 -0.26 0.00 0.00 64.21 66.11 2g3t n SER 70 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2g3t s ILE 71 N -3.12 4.96 -0.13 -1.33 1.09 -1.26 -1.02 121.20 120.39 2g3t s ILE 71 Ca -0.05 0.75 0.19 0.00 -1.10 0.00 0.00 60.65 60.43 2g3t s ILE 71 Cb 0.11 -3.98 0.31 0.00 -1.06 0.00 0.00 42.46 37.84 2g3t s ILE 71 CO 0.70 -0.14 1.18 1.33 -0.10 0.00 0.00 174.94 177.91 2g3t n VAL 72 N 5.39 1.92 -3.61 2.92 0.24 -0.39 -5.02 118.33 119.78 2g3t n VAL 72 Ca -0.02 -2.22 0.00 0.00 -2.04 0.00 0.00 64.34 60.06 2g3t n VAL 72 Cb 0.49 -0.23 -0.01 0.00 -1.47 0.00 0.00 33.84 32.61 2g3t n VAL 72 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2g3t s GLY 73 N -2.76 -0.31 0.15 7.63 0.00 -1.24 -0.69 107.32 110.09 2g3t s GLY 73 Ca 0.33 1.58 -0.24 0.00 0.00 0.00 0.00 44.72 46.39 2g3t s GLY 73 CO 0.04 0.47 0.69 -0.11 0.00 0.00 0.00 173.10 174.19 2g3t s PHE 74 N -2.03 -0.43 -0.02 1.90 -0.12 -0.42 -1.71 117.98 115.15 2g3t s PHE 74 Ca 0.13 0.19 0.01 0.00 -0.05 0.00 0.00 56.93 57.21 2g3t s PHE 74 Cb 0.02 0.58 0.01 0.00 -0.63 0.00 0.00 43.02 43.01 2g3t s PHE 74 CO -0.04 -0.85 -0.02 0.00 -0.05 0.00 0.00 175.22 174.26 2g3t s ALA 75 N -3.63 0.37 -0.12 1.99 0.00 -0.24 -1.17 121.76 118.97 2g3t s ALA 75 Ca 0.04 -0.01 0.01 0.00 0.00 0.00 0.00 51.96 52.00 2g3t s ALA 75 Cb -0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 23.12 22.86 2g3t s ALA 75 CO -0.08 0.01 -0.15 1.41 0.00 0.00 0.00 175.76 176.94 2g3t s MET 76 N 0.53 3.27 0.19 0.00 1.75 0.85 -0.98 119.30 124.92 2g3t s MET 76 Ca -0.06 -0.71 -0.07 0.00 -1.25 0.00 0.00 55.69 53.60 2g3t s MET 76 Cb -0.09 -2.56 -0.02 0.00 2.84 0.00 0.00 34.83 35.00 2g3t s MET 76 CO -0.01 0.24 0.28 1.52 -0.65 0.00 0.00 175.02 176.41 2g3t s TYR 77 N 0.26 0.61 0.33 4.11 -0.85 -0.01 -0.42 117.35 121.37 2g3t s TYR 77 Ca -0.10 -0.94 -0.18 0.00 -0.52 0.00 0.00 57.07 55.32 2g3t s TYR 77 Cb -0.16 -0.15 0.04 0.00 0.38 0.00 0.00 41.96 42.07 2g3t s TYR 77 CO 0.06 -0.76 0.75 1.52 -1.52 0.00 0.00 175.55 175.59 2g3t s TYR 78 N -4.03 -0.03 -0.11 -3.49 -0.85 -0.70 -0.12 117.35 108.02 2g3t s TYR 78 Ca 0.24 -0.53 -0.05 0.00 -0.52 0.00 0.00 57.07 56.22 2g3t s TYR 78 Cb 0.03 0.76 -0.04 0.00 0.38 0.00 0.00 41.96 43.09 2g3t s TYR 78 CO 0.06 -1.39 0.07 -0.06 -1.52 0.00 0.00 175.55 172.71 2g3t s PHE 79 N -3.18 3.38 0.23 -3.49 0.08 -1.26 -0.56 117.98 113.18 2g3t s PHE 79 Ca 0.13 0.36 0.01 0.00 0.12 0.00 0.00 56.93 57.54 2g3t s PHE 79 Cb -0.05 -1.87 -0.00 0.00 -0.57 0.00 0.00 43.02 40.52 2g3t s PHE 79 CO 0.09 0.59 0.02 0.25 -0.10 0.00 0.00 175.22 176.07 2g3t n THR 80 N 2.11 0.00 -3.85 0.64 -2.24 0.27 -4.93 114.28 106.29 2g3t n THR 80 Ca -0.19 -1.17 -0.12 0.00 -2.27 0.00 0.00 64.05 60.30 2g3t n THR 80 Cb 0.54 0.29 -0.13 0.00 -2.10 0.00 0.00 70.33 68.93 2g3t n THR 80 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2g3t s TYR 81 N -2.01 -0.06 -0.12 4.78 5.04 -1.26 -1.17 117.35 122.54 2g3t s TYR 81 Ca 0.03 0.16 0.02 0.00 -2.44 0.00 0.00 57.07 54.84 2g3t s TYR 81 Cb 0.00 0.02 0.01 0.00 0.35 0.00 0.00 41.96 42.34 2g3t s TYR 81 CO 0.02 -0.05 -0.20 0.34 -1.34 0.00 0.00 175.55 174.32 2g3t s ASP 82 N -0.07 2.83 0.62 4.32 2.15 0.38 -4.96 116.67 121.94 2g3t s ASP 82 Ca -0.01 -0.53 0.31 0.00 0.43 0.00 0.00 52.55 52.75 2g3t s ASP 82 Cb -0.01 -1.29 1.68 0.00 -0.30 0.00 0.00 42.92 43.00 2g3t s ASP 82 CO 0.00 0.07 2.02 -0.65 -0.17 0.00 0.00 175.17 176.44 2g3t h PRO 83 N 7.26 0.00 0.07 4.34 0.11 -2.01 0.30 132.00 142.07 2g3t h PRO 83 Ca -0.30 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.48 2g3t h PRO 83 Cb 1.19 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 2g3t h PRO 83 CO 0.52 0.00 -1.82 0.91 -0.21 0.00 0.00 178.00 177.40 2g3t n TRP 84 N -3.42 1.06 0.21 0.65 8.01 -1.26 -4.70 117.44 117.99 2g3t n TRP 84 Ca 0.02 0.29 0.02 0.00 -1.31 0.00 0.00 57.50 56.52 2g3t n TRP 84 Cb 0.40 -1.13 -0.03 0.00 -2.01 0.00 0.00 31.31 28.54 2g3t n TRP 84 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.69 178.19 2g3t n ILE 85 N -3.81 0.00 -0.39 -0.99 0.13 -1.13 -5.12 119.36 108.05 2g3t n ILE 85 Ca -0.34 -0.38 0.00 0.00 -1.10 0.00 0.00 62.75 60.93 2g3t n ILE 85 Cb 0.92 0.97 0.00 0.00 -0.84 0.00 0.00 39.64 40.70 2g3t n ILE 85 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2g3t n GLY 86 N 1.16 0.72 3.75 4.50 0.00 0.10 -4.87 105.19 110.55 2g3t n GLY 86 Ca 0.01 -1.62 -0.41 0.00 0.00 0.00 0.00 46.02 44.00 2g3t n GLY 86 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2g3t s LYS 87 N 0.00 4.20 0.15 1.61 2.20 -1.26 -0.47 119.74 126.17 2g3t s LYS 87 Ca 0.00 2.43 0.06 0.00 -0.36 0.00 0.00 55.97 58.10 2g3t s LYS 87 Cb 0.00 -3.07 -0.04 0.00 -1.51 0.00 0.00 37.83 33.20 2g3t s LYS 87 CO 0.00 -0.53 -0.13 -0.51 -0.36 0.00 0.00 175.35 173.83 2g3t s LEU 88 N -0.33 2.48 -0.15 5.43 1.43 -0.32 -2.34 118.68 124.89 2g3t s LEU 88 Ca 0.62 -0.93 -0.08 0.00 -1.03 0.00 0.00 54.13 52.71 2g3t s LEU 88 Cb -0.45 -0.50 -0.04 0.00 0.03 0.00 0.00 46.19 45.23 2g3t s LEU 88 CO 0.44 -0.22 0.11 -0.22 0.23 0.00 0.00 176.35 176.70 2g3t s LEU 89 N -2.90 4.16 -0.17 1.79 0.20 -0.79 -0.56 118.68 120.41 2g3t s LEU 89 Ca 0.15 0.30 0.01 0.00 0.69 0.00 0.00 54.13 55.27 2g3t s LEU 89 Cb -0.01 -2.03 0.02 0.00 -0.43 0.00 0.00 46.19 43.73 2g3t s LEU 89 CO 0.03 0.30 -0.18 -0.47 -0.29 0.00 0.00 176.35 175.73 2g3t s TYR 90 N -0.35 2.60 -0.39 5.38 5.04 0.28 -0.99 117.35 128.92 2g3t s TYR 90 Ca 0.11 -1.51 -0.21 0.00 -2.44 0.00 0.00 57.07 53.02 2g3t s TYR 90 Cb -0.12 -1.82 0.01 0.00 0.35 0.00 0.00 41.96 40.39 2g3t s TYR 90 CO 0.01 -0.76 0.65 -1.17 -1.34 0.00 0.00 175.55 172.95 2g3t s LEU 91 N 1.31 4.33 -0.06 6.97 2.96 -0.23 -1.73 118.68 132.25 2g3t s LEU 91 Ca 0.04 -0.04 -0.22 0.00 -0.22 0.00 0.00 54.13 53.70 2g3t s LEU 91 Cb -0.13 -2.78 -0.31 0.00 0.50 0.00 0.00 46.19 43.47 2g3t s LEU 91 CO -0.12 -0.69 0.86 -0.08 -1.32 0.00 0.00 176.35 175.01 2g3t h GLU 92 N 8.65 0.28 -1.75 1.98 4.57 -1.05 -3.41 114.58 123.86 2g3t h GLU 92 Ca -0.26 -0.49 0.23 0.00 -1.18 0.00 0.00 59.36 57.66 2g3t h GLU 92 Cb 1.10 0.18 -0.16 0.00 -0.16 0.00 0.00 28.75 29.72 2g3t h GLU 92 CO 0.87 1.23 0.71 0.34 -1.18 0.00 0.00 179.01 180.98 2g3t s ASP 93 N -6.95 -0.18 -0.23 1.04 -1.08 -1.11 -4.91 116.67 103.25 2g3t s ASP 93 Ca -0.14 -0.07 -0.17 0.00 -0.52 0.00 0.00 52.55 51.65 2g3t s ASP 93 Cb 0.01 0.24 0.07 0.00 -1.46 0.00 0.00 42.92 41.77 2g3t s ASP 93 CO 0.82 -0.40 0.60 0.72 0.52 0.00 0.00 175.17 177.42 2g3t s PHE 94 N -2.67 -0.79 -0.05 -5.34 -0.12 -1.26 -0.10 117.98 107.65 2g3t s PHE 94 Ca 0.10 1.73 -0.03 0.00 -0.05 0.00 0.00 56.93 58.69 2g3t s PHE 94 Cb 0.00 0.37 0.03 0.00 -0.63 0.00 0.00 43.02 42.79 2g3t s PHE 94 CO -0.05 -0.39 0.11 0.12 -0.05 0.00 0.00 175.22 174.96 2g3t s PHE 95 N 0.96 -0.11 -0.16 3.49 5.36 -0.31 -4.99 117.98 122.22 2g3t s PHE 95 Ca -0.05 0.35 0.01 0.00 -0.96 0.00 0.00 56.93 56.28 2g3t s PHE 95 Cb -0.05 -0.07 0.01 0.00 -0.34 0.00 0.00 43.02 42.56 2g3t s PHE 95 CO -0.09 -0.12 -0.18 0.08 -1.46 0.00 0.00 175.22 173.45 2g3t s VAL 96 N 0.80 2.35 0.10 3.12 1.01 -1.26 -1.31 120.40 125.21 2g3t s VAL 96 Ca -0.06 -0.87 -0.36 0.00 0.00 0.00 0.00 61.98 60.69 2g3t s VAL 96 Cb -0.08 -1.98 -0.17 0.00 0.00 0.00 0.00 36.38 34.15 2g3t s VAL 96 CO -0.04 0.53 1.22 0.23 0.00 0.00 0.00 175.10 177.05 2g3t n MET 97 N 4.18 0.93 -0.34 2.72 0.00 0.13 -4.47 117.12 120.27 2g3t n MET 97 Ca -0.20 0.33 0.04 0.00 0.00 0.00 0.00 57.70 57.88 2g3t n MET 97 Cb 0.51 -1.90 0.12 0.00 0.00 0.00 0.00 33.22 31.95 2g3t n MET 97 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 2g3t h SER 98 N 3.88 -0.94 0.29 7.83 0.87 -1.97 0.51 113.55 124.02 2g3t h SER 98 Ca -0.46 0.28 0.00 0.00 -1.23 0.00 0.00 61.79 60.38 2g3t h SER 98 Cb 1.36 0.60 0.00 0.00 -0.44 0.00 0.00 62.40 63.92 2g3t h SER 98 CO 0.73 -0.31 0.00 -0.67 -0.53 0.00 0.00 176.83 176.05 2g3t n ASP 99 N -5.58 0.00 0.00 6.23 2.03 -1.26 -2.38 116.55 115.58 2g3t n ASP 99 Ca 0.14 0.42 0.00 0.00 0.52 0.00 0.00 54.79 55.87 2g3t n ASP 99 Cb 0.46 -0.45 0.00 0.00 -0.72 0.00 0.00 41.12 40.41 2g3t n ASP 99 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 2g3t n TYR 100 N -1.45 0.00 0.66 -0.67 4.01 0.14 -4.70 117.16 115.15 2g3t n TYR 100 Ca 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 2g3t n TYR 100 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.13 2g3t n TYR 100 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2g3t n ARG 101 N -0.30 0.56 -0.08 -0.72 0.63 0.97 -3.65 116.66 114.07 2g3t n ARG 101 Ca 0.00 0.00 -0.13 0.00 -0.92 0.00 0.00 57.85 56.80 2g3t n ARG 101 Cb 0.04 -1.23 -0.09 0.00 0.45 0.00 0.00 32.46 31.63 2g3t n ARG 101 CO 0.00 0.00 0.00 0.78 -2.51 0.00 0.00 177.63 175.90 2g3t h GLY 102 N 3.24 0.00 0.00 5.14 0.00 -1.84 -3.47 103.07 106.14 2g3t h GLY 102 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2g3t h GLY 102 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 176.54 178.51 2g3t n PHE 103 N -4.58 0.00 -2.35 5.60 -0.00 -1.24 -4.92 117.46 109.96 2g3t n PHE 103 Ca -0.15 0.00 0.04 0.00 -0.00 0.00 0.00 57.45 57.34 2g3t n PHE 103 Cb 0.44 0.00 0.04 0.00 -0.00 0.00 0.00 39.48 39.96 2g3t n PHE 103 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2g3t n GLY 104 N 0.00 1.46 0.28 4.97 0.00 -1.26 -4.90 105.19 105.74 2g3t n GLY 104 Ca 0.00 -0.85 -0.08 0.00 0.00 0.00 0.00 46.02 45.09 2g3t n GLY 104 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2g3t h ILE 105 N 6.27 0.38 -0.79 -0.61 2.04 -1.91 0.33 117.51 123.22 2g3t h ILE 105 Ca -0.19 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.78 2g3t h ILE 105 Cb 1.76 0.38 -0.08 0.00 -0.74 0.00 0.00 36.82 38.14 2g3t h ILE 105 CO 0.08 0.00 0.43 1.23 0.00 0.00 0.00 178.15 179.89 2g3t h GLY 106 N -0.26 1.23 1.76 5.37 0.00 -1.94 0.20 103.07 109.43 2g3t h GLY 106 Ca 0.13 -0.27 -0.08 0.00 0.00 0.00 0.00 47.33 47.11 2g3t h GLY 106 CO -0.39 0.08 -0.28 0.23 0.00 0.00 0.00 176.54 176.18 2g3t h SER 107 N 0.70 0.28 0.97 0.19 0.87 -1.54 -2.61 113.55 112.40 2g3t h SER 107 Ca 0.39 -0.09 -0.14 0.00 -1.23 0.00 0.00 61.79 60.73 2g3t h SER 107 Cb 0.42 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.28 2g3t h SER 107 CO -0.27 0.56 -0.66 -0.08 -0.53 0.00 0.00 176.83 175.84 2g3t h GLU 108 N 0.25 0.00 -0.16 2.24 4.57 0.14 -3.14 114.58 118.47 2g3t h GLU 108 Ca 0.04 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 2g3t h GLU 108 Cb 0.63 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.22 2g3t h GLU 108 CO 0.05 0.66 0.05 0.82 -1.18 0.00 0.00 179.01 179.40 2g3t h ILE 109 N 0.00 1.19 -0.77 2.32 1.08 -0.33 -2.79 117.51 118.21 2g3t h ILE 109 Ca -0.01 -0.59 0.09 0.00 -0.39 0.00 0.00 64.86 63.97 2g3t h ILE 109 Cb 1.32 1.28 -0.05 0.00 -3.07 0.00 0.00 36.82 36.30 2g3t h ILE 109 CO 0.09 0.18 0.50 -0.07 -0.69 0.00 0.00 178.15 178.16 2g3t h LEU 110 N 0.07 0.62 -0.27 1.44 -0.00 -1.48 -0.57 115.31 115.12 2g3t h LEU 110 Ca 0.05 0.01 -0.03 0.00 -0.00 0.00 0.00 57.88 57.91 2g3t h LEU 110 Cb 0.23 -0.12 -0.01 0.00 -0.00 0.00 0.00 40.66 40.77 2g3t h LEU 110 CO -0.00 0.37 0.04 0.50 -0.00 0.00 0.00 178.44 179.35 2g3t h LYS 111 N 0.69 0.45 -0.73 1.13 3.64 -1.47 -0.51 116.57 119.78 2g3t h LYS 111 Ca 0.35 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.55 2g3t h LYS 111 Cb 0.45 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.18 2g3t h LYS 111 CO -0.13 0.58 0.23 -0.91 -2.27 0.00 0.00 179.45 176.94 2g3t h ASN 112 N 0.27 1.06 -0.54 4.20 2.35 -1.11 -1.32 115.58 120.49 2g3t h ASN 112 Ca 0.08 -0.20 -0.04 0.00 -0.55 0.00 0.00 56.30 55.59 2g3t h ASN 112 Cb 0.34 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 2g3t h ASN 112 CO 0.01 0.98 0.17 -0.07 -1.65 0.00 0.00 177.43 176.87 2g3t h LEU 113 N 1.09 0.79 -1.37 1.61 3.38 -0.99 -1.37 115.31 118.45 2g3t h LEU 113 Ca 0.24 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2g3t h LEU 113 Cb 0.30 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 2g3t h LEU 113 CO -0.01 0.79 0.41 0.28 0.09 0.00 0.00 178.44 180.00 2g3t h SER 114 N 0.75 0.73 0.02 -0.43 0.02 -0.69 -0.98 113.55 112.97 2g3t h SER 114 Ca 0.18 -0.02 -0.12 0.00 -0.84 0.00 0.00 61.79 60.98 2g3t h SER 114 Cb 0.27 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 2g3t h SER 114 CO -0.01 0.53 -0.38 1.56 -1.14 0.00 0.00 176.83 177.40 2g3t h GLN 115 N 0.86 0.47 -0.28 3.45 4.20 -0.69 -1.76 115.11 121.36 2g3t h GLN 115 Ca 0.23 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2g3t h GLN 115 Cb -0.09 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 2g3t h GLN 115 CO -0.05 0.78 0.13 0.28 -0.67 0.00 0.00 178.83 179.31 2g3t h VAL 116 N 0.40 1.15 -0.51 -0.54 2.07 -0.15 -1.71 116.25 116.96 2g3t h VAL 116 Ca 0.04 -0.43 0.06 0.00 0.82 0.00 0.00 66.70 67.18 2g3t h VAL 116 Cb 0.85 0.92 -0.05 0.00 -1.52 0.00 0.00 31.29 31.49 2g3t h VAL 116 CO 0.07 0.15 0.23 0.00 0.02 0.00 0.00 177.57 178.04 2g3t h ALA 117 N 0.99 0.65 -0.73 1.67 0.00 -0.92 0.07 119.26 120.99 2g3t h ALA 117 Ca 0.10 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 2g3t h ALA 117 Cb 0.12 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 2g3t h ALA 117 CO -0.01 -0.14 0.22 0.52 0.00 0.00 0.00 179.25 179.84 2g3t h MET 118 N 0.45 1.14 0.00 0.00 2.07 -1.06 -1.84 114.93 115.69 2g3t h MET 118 Ca 0.24 -0.25 0.00 0.00 -2.07 0.00 0.00 59.70 57.62 2g3t h MET 118 Cb 0.19 -0.16 0.00 0.00 -1.87 0.00 0.00 31.60 29.76 2g3t h MET 118 CO -0.20 0.97 -0.47 2.89 1.07 0.00 0.00 176.91 181.17 2g3t n ARG 119 N -4.27 0.27 -0.54 1.72 1.85 -0.67 -3.77 116.66 111.26 2g3t n ARG 119 Ca 0.06 0.11 0.09 0.00 -1.00 0.00 0.00 57.85 57.11 2g3t n ARG 119 Cb 0.23 -1.70 0.33 0.00 -1.05 0.00 0.00 32.46 30.27 2g3t n ARG 119 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2g3t n ARG 121 N 0.97 -6.62 -3.81 0.00 1.74 -1.12 -5.01 116.66 102.82 2g3t n ARG 121 Ca 0.24 0.78 -0.36 0.00 -0.77 0.00 0.00 57.85 57.74 2g3t n ARG 121 Cb 0.83 -5.71 -0.07 0.00 -1.02 0.00 0.00 32.46 26.48 2g3t n ARG 121 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2g3t h SER 123 N 5.89 0.00 -5.40 0.00 4.64 -1.79 -3.44 113.55 113.46 2g3t h SER 123 Ca -0.47 0.00 0.19 0.00 -0.47 0.00 0.00 61.79 61.04 2g3t h SER 123 Cb 1.19 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.20 2g3t h SER 123 CO 0.67 0.00 0.55 -0.94 -0.87 0.00 0.00 176.83 176.24 2g3t s SER 124 N -5.41 -0.12 -0.10 4.97 1.04 -1.26 -5.09 113.70 107.72 2g3t s SER 124 Ca 0.08 -0.44 0.02 0.00 0.48 0.00 0.00 55.95 56.09 2g3t s SER 124 Cb 0.08 0.46 0.01 0.00 0.10 0.00 0.00 66.02 66.67 2g3t s SER 124 CO 0.63 -0.86 -0.17 -0.32 0.98 0.00 0.00 173.24 173.49 2g3t s MET 125 N -2.93 2.42 0.16 4.02 1.75 -1.26 -1.89 119.30 121.57 2g3t s MET 125 Ca 0.15 -0.64 0.07 0.00 -1.25 0.00 0.00 55.69 54.01 2g3t s MET 125 Cb -0.01 -1.97 -0.04 0.00 2.84 0.00 0.00 34.83 35.65 2g3t s MET 125 CO 0.02 0.01 0.03 -1.01 -0.65 0.00 0.00 175.02 173.42 2g3t s HIS 126 N 0.77 2.92 0.03 4.11 3.76 -0.16 -4.98 115.29 121.75 2g3t s HIS 126 Ca -0.11 -0.10 -0.29 0.00 -0.15 0.00 0.00 55.06 54.42 2g3t s HIS 126 Cb -0.16 -1.42 0.10 0.00 1.11 0.00 0.00 32.58 32.21 2g3t s HIS 126 CO 0.01 0.51 1.08 -0.59 -0.85 0.00 0.00 174.74 174.91 2g3t s PHE 127 N -1.68 -0.14 0.04 1.40 -0.12 -1.26 -1.07 117.98 115.14 2g3t s PHE 127 Ca 0.28 -0.04 0.02 0.00 -0.05 0.00 0.00 56.93 57.15 2g3t s PHE 127 Cb -0.10 0.58 -0.04 0.00 -0.63 0.00 0.00 43.02 42.83 2g3t s PHE 127 CO 0.19 -0.53 0.02 -0.51 -0.05 0.00 0.00 175.22 174.35 2g3t s LEU 128 N -2.77 3.59 -0.02 -1.99 1.43 -1.26 -5.06 118.68 112.60 2g3t s LEU 128 Ca 0.11 -0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.18 2g3t s LEU 128 Cb 0.01 -2.18 0.01 0.00 0.03 0.00 0.00 46.19 44.06 2g3t s LEU 128 CO -0.03 0.23 -0.01 -0.69 0.23 0.00 0.00 176.35 176.08 2g3t s VAL 129 N -1.22 0.21 0.18 -1.59 1.01 -1.26 -5.09 120.40 112.63 2g3t s VAL 129 Ca 0.23 -0.01 -0.30 0.00 0.00 0.00 0.00 61.98 61.91 2g3t s VAL 129 Cb -0.12 -0.25 -0.08 0.00 0.00 0.00 0.00 36.38 35.93 2g3t s VAL 129 CO 0.15 0.11 1.27 0.00 0.00 0.00 0.00 175.10 176.63 2g3t s ALA 130 N 0.56 3.49 0.60 5.51 0.00 -1.26 -4.90 121.76 125.75 2g3t s ALA 130 Ca -0.06 1.03 0.30 0.00 0.00 0.00 0.00 51.96 53.23 2g3t s ALA 130 Cb -0.09 -3.46 1.70 0.00 0.00 0.00 0.00 23.12 21.28 2g3t s ALA 130 CO -0.01 -0.47 2.11 1.05 0.00 0.00 0.00 175.76 178.44 2g3t h GLU 131 N 5.56 0.00 -0.01 0.00 4.11 -2.05 -0.71 114.58 121.49 2g3t h GLU 131 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.99 2g3t h GLU 131 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2g3t h GLU 131 CO 0.77 0.00 -0.25 -2.67 0.07 0.00 0.00 179.01 176.94 2g3t n TRP 132 N -3.72 0.00 -2.48 2.06 4.27 -1.26 -4.53 117.44 111.77 2g3t n TRP 132 Ca 0.01 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.20 2g3t n TRP 132 Cb 0.31 -0.15 0.01 0.00 -1.36 0.00 0.00 31.31 30.11 2g3t n TRP 132 CO 0.00 0.00 0.00 -1.71 -2.29 0.00 0.00 177.69 173.69 2g3t n ASN 133 N -0.81 5.49 -0.06 -0.67 2.85 -0.27 -4.82 115.26 116.97 2g3t n ASN 133 Ca 0.12 -3.19 0.10 0.00 -0.11 0.00 0.00 54.58 51.50 2g3t n ASN 133 Cb 0.33 -1.42 0.49 0.00 1.24 0.00 0.00 39.78 40.42 2g3t n ASN 133 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 2g3t h GLU 134 N 5.62 0.42 -0.58 1.20 5.08 -1.82 -0.41 114.58 124.08 2g3t h GLU 134 Ca 0.36 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.66 2g3t h GLU 134 Cb 0.61 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 2g3t h GLU 134 CO 1.56 0.28 0.25 -1.35 -1.00 0.00 0.00 179.01 178.74 2g3t h PRO 135 N 0.43 0.86 -0.12 2.33 0.11 -1.98 -1.47 132.00 132.17 2g3t h PRO 135 Ca 0.25 -0.15 -0.20 0.00 0.11 0.00 0.00 66.00 66.01 2g3t h PRO 135 Cb 0.43 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.39 2g3t h PRO 135 CO -0.07 0.73 -0.75 1.03 -0.21 0.00 0.00 178.00 178.73 2g3t h SER 136 N 0.80 0.72 0.16 -2.05 0.87 -1.80 -2.33 113.55 109.91 2g3t h SER 136 Ca 0.20 -0.47 -0.00 0.00 -1.23 0.00 0.00 61.79 60.29 2g3t h SER 136 Cb 0.18 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 2g3t h SER 136 CO -0.02 1.24 -0.12 0.40 -0.53 0.00 0.00 176.83 177.80 2g3t h ILE 137 N 0.41 0.73 -0.29 2.23 2.04 -0.92 -2.10 117.51 119.62 2g3t h ILE 137 Ca -0.04 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.76 2g3t h ILE 137 Cb 1.35 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 2g3t h ILE 137 CO 0.14 0.00 -0.09 0.78 0.00 0.00 0.00 178.15 178.98 2g3t h ASN 138 N -0.29 0.46 -0.95 1.72 2.35 -1.32 -0.04 115.58 117.51 2g3t h ASN 138 Ca -0.01 -0.11 0.04 0.00 -0.55 0.00 0.00 56.30 55.68 2g3t h ASN 138 Cb 0.26 -0.12 -0.06 0.00 0.05 0.00 0.00 38.32 38.45 2g3t h ASN 138 CO -0.01 0.59 0.62 0.15 -1.65 0.00 0.00 177.43 177.13 2g3t h PHE 139 N 0.45 1.15 0.00 1.19 3.04 -1.06 -0.31 116.94 121.40 2g3t h PHE 139 Ca 0.09 0.03 -0.20 0.00 3.98 0.00 0.00 57.97 61.86 2g3t h PHE 139 Cb 0.43 -0.38 -0.03 0.00 2.56 0.00 0.00 35.95 38.53 2g3t h PHE 139 CO 0.01 0.65 -1.02 1.88 -2.02 0.00 0.00 178.31 177.82 2g3t h TYR 140 N 1.18 0.00 -0.40 0.41 -1.99 -0.93 -3.21 116.97 112.04 2g3t h TYR 140 Ca 0.38 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 61.04 2g3t h TYR 140 Cb 0.03 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.74 2g3t h TYR 140 CO -0.01 0.92 -0.07 0.87 -0.00 0.00 0.00 178.16 179.87 2g3t h LYS 141 N 0.00 0.68 0.00 4.88 1.79 -0.40 -0.36 116.57 123.16 2g3t h LYS 141 Ca -0.04 -0.20 0.00 0.00 -2.18 0.00 0.00 60.65 58.23 2g3t h LYS 141 Cb 1.74 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 32.32 2g3t h LYS 141 CO 0.11 0.75 0.00 0.54 -1.08 0.00 0.00 179.45 179.77 2g3t n ARG 142 N -4.20 0.06 0.00 3.15 1.74 -0.18 -2.07 116.66 115.16 2g3t n ARG 142 Ca 0.02 0.21 0.12 0.00 -0.77 0.00 0.00 57.85 57.43 2g3t n ARG 142 Cb 0.32 -1.59 0.19 0.00 -1.02 0.00 0.00 32.46 30.36 2g3t n ARG 142 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2g3t n ARG 143 N -1.70 1.87 0.00 5.56 5.12 -0.55 -4.93 116.66 122.03 2g3t n ARG 143 Ca 0.04 -1.45 0.00 0.00 -1.93 0.00 0.00 57.85 54.51 2g3t n ARG 143 Cb 0.25 -1.47 0.00 0.00 -1.16 0.00 0.00 32.46 30.08 2g3t n ARG 143 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2g3t n GLY 144 N 1.33 0.79 3.76 -0.13 0.00 -0.88 -5.08 105.19 104.99 2g3t n GLY 144 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 2g3t n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g3t s ALA 145 N -2.00 2.59 -0.00 4.61 0.00 -0.26 -5.00 121.76 121.70 2g3t s ALA 145 Ca 0.00 0.89 0.08 0.00 0.00 0.00 0.00 51.96 52.93 2g3t s ALA 145 Cb 0.00 -3.40 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 2g3t s ALA 145 CO 0.00 -1.03 -0.25 -1.12 0.00 0.00 0.00 175.76 173.36 2g3t s SER 146 N -1.77 3.19 -0.75 0.00 0.01 -1.26 -4.59 113.70 108.52 2g3t s SER 146 Ca 0.74 -0.48 -0.20 0.00 1.31 0.00 0.00 55.95 57.32 2g3t s SER 146 Cb -0.27 -0.37 0.11 0.00 0.21 0.00 0.00 66.02 65.70 2g3t s SER 146 CO 0.32 0.30 0.96 -0.62 0.41 0.00 0.00 173.24 174.60 2g3t s ASP 147 N -0.83 6.37 0.44 2.44 -1.08 -1.26 -4.89 116.67 117.86 2g3t s ASP 147 Ca 0.11 -1.56 0.19 0.00 -0.52 0.00 0.00 52.55 50.77 2g3t s ASP 147 Cb -0.10 -2.38 1.03 0.00 -1.46 0.00 0.00 42.92 40.01 2g3t s ASP 147 CO 0.00 -1.19 1.93 -0.07 0.52 0.00 0.00 175.17 176.37 2g3t h LEU 148 N 10.53 0.00 -0.35 -1.34 3.38 -1.98 -1.15 115.31 124.40 2g3t h LEU 148 Ca -0.11 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.74 2g3t h LEU 148 Cb 1.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 2g3t h LEU 148 CO 1.12 0.24 -0.26 0.28 0.09 0.00 0.00 178.44 179.91 2g3t h SER 149 N 0.00 0.84 0.01 -0.43 0.02 -1.90 0.22 113.55 112.32 2g3t h SER 149 Ca -0.00 -0.44 -0.16 0.00 -0.84 0.00 0.00 61.79 60.35 2g3t h SER 149 Cb 0.51 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 2g3t h SER 149 CO 0.03 1.10 -0.54 0.28 -1.14 0.00 0.00 176.83 176.57 2g3t h SER 150 N 0.59 0.63 0.06 3.07 0.02 -1.82 0.27 113.55 116.37 2g3t h SER 150 Ca 0.07 -0.33 -0.16 0.00 -0.84 0.00 0.00 61.79 60.52 2g3t h SER 150 Cb 0.83 -0.18 0.02 0.00 0.14 0.00 0.00 62.40 63.21 2g3t h SER 150 CO 0.07 1.04 -0.68 -0.33 -1.14 0.00 0.00 176.83 175.79 2g3t h GLU 151 N 0.44 0.35 -0.01 3.45 5.08 -1.15 -3.39 114.58 119.35 2g3t h GLU 151 Ca 0.01 -0.46 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 2g3t h GLU 151 Cb 1.08 0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2g3t h GLU 151 CO 0.10 1.16 -0.02 0.39 -1.00 0.00 0.00 179.01 179.64 2g3t n GLU 152 N -4.19 0.34 -1.01 2.33 1.02 0.78 -5.02 120.64 114.88 2g3t n GLU 152 Ca -0.12 -0.82 -0.00 0.00 -0.02 0.00 0.00 57.16 56.20 2g3t n GLU 152 Cb 0.73 -1.10 -0.00 0.00 -0.02 0.00 0.00 31.44 31.05 2g3t n GLU 152 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2g3t n GLY 153 N 0.43 0.47 3.76 0.62 0.00 0.93 -4.99 105.19 106.41 2g3t n GLY 153 Ca 0.04 -0.31 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 2g3t n GLY 153 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2g3t s TRP 154 N -1.97 2.90 -0.02 1.61 0.52 -1.24 -4.98 118.94 115.77 2g3t s TRP 154 Ca 0.00 1.07 0.06 0.00 0.02 0.00 0.00 56.10 57.25 2g3t s TRP 154 Cb 0.00 -3.88 -0.01 0.00 -1.15 0.00 0.00 33.47 28.43 2g3t s TRP 154 CO 0.00 -2.76 -0.20 1.03 0.02 0.00 0.00 176.95 175.04 2g3t s ARG 155 N -0.91 1.68 -0.15 4.98 1.81 -1.26 -4.56 118.95 120.54 2g3t s ARG 155 Ca 0.57 -0.71 -0.24 0.00 -1.72 0.00 0.00 55.73 53.64 2g3t s ARG 155 Cb -0.43 -1.59 -0.02 0.00 -0.45 0.00 0.00 34.95 32.46 2g3t s ARG 155 CO 0.49 0.40 0.76 -1.17 -0.68 0.00 0.00 175.30 175.10 2g3t s LEU 156 N -0.39 4.21 0.25 2.53 2.96 -1.26 -5.05 118.68 121.93 2g3t s LEU 156 Ca 0.06 1.12 0.10 0.00 -0.22 0.00 0.00 54.13 55.19 2g3t s LEU 156 Cb -0.08 -3.13 -0.04 0.00 0.50 0.00 0.00 46.19 43.43 2g3t s LEU 156 CO -0.00 -0.30 -0.08 -0.36 -1.32 0.00 0.00 176.35 174.28 2g3t s PHE 157 N 1.74 2.56 -0.06 5.38 0.40 -1.26 -5.15 117.98 121.60 2g3t s PHE 157 Ca 0.36 -0.26 -0.10 0.00 -0.60 0.00 0.00 56.93 56.34 2g3t s PHE 157 Cb -0.17 -1.15 0.02 0.00 0.51 0.00 0.00 43.02 42.23 2g3t s PHE 157 CO 0.14 0.62 0.24 0.21 0.70 0.00 0.00 175.22 177.14 2g3t s LYS 158 N -3.43 0.42 -0.19 0.44 2.20 -1.26 -5.12 119.74 112.79 2g3t s LYS 158 Ca 0.29 0.08 0.00 0.00 -0.36 0.00 0.00 55.97 55.99 2g3t s LYS 158 Cb -0.07 0.19 0.04 0.00 -1.51 0.00 0.00 37.83 36.49 2g3t s LYS 158 CO 0.17 -0.09 -0.08 0.42 -0.36 0.00 0.00 175.35 175.41 2g3t s ILE 159 N -0.50 1.48 0.93 5.43 1.01 -1.26 -5.14 121.20 123.15 2g3t s ILE 159 Ca -0.06 -0.92 -0.13 0.00 0.00 0.00 0.00 60.65 59.54 2g3t s ILE 159 Cb -0.04 -1.60 0.15 0.00 0.01 0.00 0.00 42.46 40.98 2g3t s ILE 159 CO 0.01 0.14 1.17 1.51 0.00 0.00 0.00 174.94 177.77 2g3t s ASP 160 N 1.46 3.35 0.24 3.58 1.47 -1.26 -4.75 116.67 120.77 2g3t s ASP 160 Ca -0.01 0.81 -0.07 0.00 1.18 0.00 0.00 52.55 54.46 2g3t s ASP 160 Cb -0.16 -1.27 0.43 0.00 -0.34 0.00 0.00 42.92 41.58 2g3t s ASP 160 CO -0.08 -2.63 1.63 0.11 0.68 0.00 0.00 175.17 174.88 2g3t h LYS 161 N -1.56 0.09 -0.56 2.11 1.57 -2.00 -1.60 116.57 114.62 2g3t h LYS 161 Ca -0.49 -0.01 0.11 0.00 -1.87 0.00 0.00 60.65 58.40 2g3t h LYS 161 Cb 1.32 -0.02 -0.09 0.00 0.08 0.00 0.00 32.23 33.51 2g3t h LYS 161 CO 0.57 0.06 0.04 1.49 -0.57 0.00 0.00 179.45 181.04 2g3t h GLU 162 N 0.10 0.15 0.00 3.15 4.81 -2.00 0.73 114.58 121.52 2g3t h GLU 162 Ca 0.41 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.58 2g3t h GLU 162 Cb 0.72 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 2g3t h GLU 162 CO -0.67 0.10 -0.43 1.88 -0.73 0.00 0.00 179.01 179.16 2g3t h TYR 163 N 0.16 0.00 -0.32 0.92 -1.99 -1.73 -2.73 116.97 111.28 2g3t h TYR 163 Ca 0.29 0.00 -0.14 0.00 2.00 0.00 0.00 58.73 60.88 2g3t h TYR 163 Cb 0.45 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.17 2g3t h TYR 163 CO -0.31 0.24 -0.36 -0.07 -0.00 0.00 0.00 178.16 177.66 2g3t h LEU 164 N 0.00 0.87 -0.38 3.88 3.38 -0.66 -1.85 115.31 120.55 2g3t h LEU 164 Ca -0.02 -0.48 0.04 0.00 0.09 0.00 0.00 57.88 57.51 2g3t h LEU 164 Cb 1.20 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.66 2g3t h LEU 164 CO 0.03 1.18 0.16 0.25 0.09 0.00 0.00 178.44 180.14 2g3t h LEU 165 N 0.59 0.20 0.24 1.67 5.85 -0.86 0.79 115.31 123.78 2g3t h LEU 165 Ca 0.05 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2g3t h LEU 165 Cb 0.95 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.95 2g3t h LEU 165 CO 0.09 0.15 -0.51 0.11 -0.34 0.00 0.00 178.44 177.94 2g3t h LYS 166 N 0.33 -0.78 -0.26 1.25 1.57 -1.25 -0.31 116.57 117.11 2g3t h LYS 166 Ca 0.17 0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 59.00 2g3t h LYS 166 Cb 0.12 0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 2g3t h LYS 166 CO -0.15 -0.52 0.16 0.52 -0.57 0.00 0.00 179.45 178.88 2g3t h MET 167 N -0.81 0.34 -0.26 3.15 2.86 -1.09 0.39 114.93 119.51 2g3t h MET 167 Ca -0.02 -0.02 -0.14 0.00 -2.06 0.00 0.00 59.70 57.45 2g3t h MET 167 Cb 0.77 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.35 2g3t h MET 167 CO -0.21 0.24 -0.38 0.00 1.06 0.00 0.00 176.91 177.63 2g3t h ALA 168 N 1.82 0.39 -0.01 6.32 0.00 -0.25 -3.31 119.26 124.22 2g3t h ALA 168 Ca 0.09 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2g3t h ALA 168 Cb -0.01 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2g3t h ALA 168 CO -0.02 0.48 -0.60 0.25 0.00 0.00 0.00 179.25 179.36 2g3t n THR 169 N -4.21 0.00 0.00 0.00 -2.24 -0.18 -5.09 114.28 102.57 2g3t n THR 169 Ca -0.05 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 2g3t n THR 169 Cb 0.53 1.13 0.00 0.00 -2.10 0.00 0.00 70.33 69.89 2g3t n THR 169 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88