#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g1f n MET 12 N 0.00 1.10 -2.03 7.34 0.00 -1.26 -1.28 117.12 120.99 3g1f n MET 12 Ca 0.00 0.40 -0.17 0.00 0.00 0.00 0.00 57.70 57.93 3g1f n MET 12 Cb 0.00 -2.03 -0.04 0.00 0.00 0.00 0.00 33.22 31.15 3g1f n MET 12 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 3g1f n ASN 13 N 2.61 -4.77 -3.50 6.12 5.03 -1.26 -2.27 115.26 117.22 3g1f n ASN 13 Ca 0.19 0.22 -0.21 0.00 0.87 0.00 0.00 54.58 55.65 3g1f n ASN 13 Cb 0.18 -4.13 -0.04 0.00 -1.02 0.00 0.00 39.78 34.78 3g1f n ASN 13 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 3g1f n ARG 14 N -2.58 -1.95 -4.16 3.52 5.12 -0.40 -4.87 116.66 111.33 3g1f n ARG 14 Ca -0.19 0.09 -0.29 0.00 -1.93 0.00 0.00 57.85 55.54 3g1f n ARG 14 Cb 0.61 -4.64 -0.17 0.00 -1.16 0.00 0.00 32.46 27.11 3g1f n ARG 14 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 3g1f s LEU 15 N -6.12 1.58 -0.10 0.55 2.96 -0.96 -2.50 118.68 114.07 3g1f s LEU 15 Ca 0.41 -0.41 -0.01 0.00 -0.22 0.00 0.00 54.13 53.89 3g1f s LEU 15 Cb -0.24 -1.05 -0.03 0.00 0.50 0.00 0.00 46.19 45.37 3g1f s LEU 15 CO 0.50 -0.04 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.82 3g1f s ILE 16 N 1.34 3.96 -0.28 6.68 1.01 -0.26 -4.58 121.20 129.07 3g1f s ILE 16 Ca 0.00 -0.37 -0.12 0.00 0.00 0.00 0.00 60.65 60.17 3g1f s ILE 16 Cb -0.14 -2.67 -0.05 0.00 0.01 0.00 0.00 42.46 39.62 3g1f s ILE 16 CO -0.07 0.57 0.22 -0.22 0.00 0.00 0.00 174.94 175.44 3g1f s LEU 17 N -0.45 4.02 -0.51 2.97 2.96 -0.78 -1.43 118.68 125.47 3g1f s LEU 17 Ca 0.07 0.05 -0.22 0.00 -0.22 0.00 0.00 54.13 53.81 3g1f s LEU 17 Cb -0.12 -2.18 0.04 0.00 0.50 0.00 0.00 46.19 44.43 3g1f s LEU 17 CO 0.02 -0.07 0.79 0.00 -1.32 0.00 0.00 176.35 175.77 3g1f s ALA 18 N 1.81 3.27 -0.69 5.97 0.00 0.94 -0.43 121.76 132.62 3g1f s ALA 18 Ca 0.08 -1.31 -0.18 0.00 0.00 0.00 0.00 51.96 50.55 3g1f s ALA 18 Cb -0.16 -3.53 0.13 0.00 0.00 0.00 0.00 23.12 19.56 3g1f s ALA 18 CO 0.11 -2.12 0.78 1.41 0.00 0.00 0.00 175.76 175.93 3g1f s MET 19 N 3.34 3.24 0.00 0.00 1.75 -0.79 -4.06 119.30 122.79 3g1f s MET 19 Ca 0.25 -1.63 0.14 0.00 -1.25 0.00 0.00 55.69 53.21 3g1f s MET 19 Cb -0.14 -4.41 0.33 0.00 2.84 0.00 0.00 34.83 33.45 3g1f s MET 19 CO 0.18 -1.53 1.24 -0.25 -0.65 0.00 0.00 175.02 174.01 3g1f n ASP 20 N 5.87 2.97 -4.72 1.11 8.00 -1.26 -4.39 116.55 124.12 3g1f n ASP 20 Ca 0.00 -1.90 -0.42 0.00 0.71 0.00 0.00 54.79 53.19 3g1f n ASP 20 Cb 0.44 -0.23 -0.03 0.00 -0.02 0.00 0.00 41.12 41.29 3g1f n ASP 20 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3g1f s LEU 21 N -1.06 4.39 0.00 0.64 1.43 -1.26 -4.75 118.68 118.06 3g1f s LEU 21 Ca 0.27 2.38 0.15 0.00 -1.03 0.00 0.00 54.13 55.90 3g1f s LEU 21 Cb 0.15 -3.60 0.87 0.00 0.03 0.00 0.00 46.19 43.64 3g1f s LEU 21 CO 0.20 -0.62 1.54 0.23 0.23 0.00 0.00 176.35 177.94 3g1f n MET 22 N 3.41 0.98 -4.20 1.70 2.81 -1.26 -4.62 117.12 115.93 3g1f n MET 22 Ca 0.09 0.00 -0.34 0.00 -1.81 0.00 0.00 57.70 55.65 3g1f n MET 22 Cb 0.42 -1.23 -0.15 0.00 -0.71 0.00 0.00 33.22 31.55 3g1f n MET 22 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 3g1f s ASN 23 N -1.48 3.86 0.24 7.83 2.47 -1.26 -4.78 114.94 121.83 3g1f s ASN 23 Ca 0.22 -0.46 -0.13 0.00 0.42 0.00 0.00 52.86 52.91 3g1f s ASN 23 Cb 0.10 -1.63 0.32 0.00 -1.45 0.00 0.00 41.25 38.60 3g1f s ASN 23 CO 0.17 0.03 1.57 -0.09 -3.72 0.00 0.00 177.10 175.06 3g1f h ARG 24 N 7.71 -0.02 -0.33 0.43 2.43 -1.95 -2.03 114.38 120.63 3g1f h ARG 24 Ca -0.39 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.78 3g1f h ARG 24 Cb 1.17 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.71 3g1f h ARG 24 CO 0.60 -0.01 0.17 -0.44 -1.51 0.00 0.00 179.97 178.78 3g1f h ASP 25 N -0.02 0.42 -0.16 -3.80 3.32 -1.98 -0.71 116.42 113.49 3g1f h ASP 25 Ca 0.39 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.31 3g1f h ASP 25 Cb 0.63 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 3g1f h ASP 25 CO -0.91 0.40 0.00 0.44 -1.72 0.00 0.00 179.24 177.45 3g1f h ASP 26 N 0.40 0.27 -0.34 6.45 5.19 -1.88 0.16 116.42 126.67 3g1f h ASP 26 Ca 0.11 -0.31 0.07 0.00 -0.62 0.00 0.00 57.03 56.29 3g1f h ASP 26 Cb 0.09 -0.07 -0.07 0.00 0.18 0.00 0.00 39.33 39.46 3g1f h ASP 26 CO -0.02 0.51 -0.09 0.00 -3.12 0.00 0.00 179.24 176.53 3g1f h ALA 27 N 0.77 0.22 -0.15 3.45 0.00 -1.32 0.53 119.26 122.75 3g1f h ALA 27 Ca 0.04 0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.96 3g1f h ALA 27 Cb 0.37 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3g1f h ALA 27 CO 0.01 -0.46 -0.45 -0.07 0.00 0.00 0.00 179.25 178.28 3g1f h LEU 28 N -0.00 0.40 0.19 0.00 3.38 -1.07 0.71 115.31 118.92 3g1f h LEU 28 Ca 0.17 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3g1f h LEU 28 Cb 0.26 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3g1f h LEU 28 CO -0.36 0.80 -0.09 -0.09 0.09 0.00 0.00 178.44 178.80 3g1f h ARG 29 N 0.31 -0.25 0.18 1.13 2.43 0.48 -1.34 114.38 117.33 3g1f h ARG 29 Ca 0.02 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 3g1f h ARG 29 Cb 0.92 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.52 3g1f h ARG 29 CO 0.08 0.10 -0.09 0.28 -1.51 0.00 0.00 179.97 178.83 3g1f h VAL 30 N -0.63 0.85 -0.40 0.20 2.07 0.00 -1.78 116.25 116.56 3g1f h VAL 30 Ca -0.03 -0.12 0.08 0.00 0.82 0.00 0.00 66.70 67.46 3g1f h VAL 30 Cb 0.46 0.92 -0.09 0.00 -1.52 0.00 0.00 31.29 31.06 3g1f h VAL 30 CO 0.04 0.03 -0.21 0.74 0.02 0.00 0.00 177.57 178.19 3g1f h THR 31 N -0.30 0.40 -0.27 2.57 2.02 -0.91 -1.94 112.91 114.47 3g1f h THR 31 Ca -0.02 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.21 3g1f h THR 31 Cb 0.23 0.40 -0.06 0.00 -1.74 0.00 0.00 68.15 66.98 3g1f h THR 31 CO 0.04 0.00 -0.09 1.23 0.37 0.00 0.00 175.52 177.07 3g1f h GLY 32 N -0.13 0.15 0.60 2.16 0.00 -1.01 -0.05 103.07 104.80 3g1f h GLY 32 Ca 0.20 0.12 0.03 0.00 0.00 0.00 0.00 47.33 47.68 3g1f h GLY 32 CO -0.49 -0.12 -0.10 0.83 0.00 0.00 0.00 176.54 176.66 3g1f h GLU 33 N -0.04 -0.11 0.00 4.80 5.08 -0.72 -2.49 114.58 121.10 3g1f h GLU 33 Ca 0.14 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3g1f h GLU 33 Cb 0.25 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.52 3g1f h GLU 33 CO -0.30 -0.07 0.00 1.33 -1.00 0.00 0.00 179.01 178.96 3g1f n VAL 34 N -5.24 0.36 -0.32 3.13 0.24 -0.79 -3.33 118.33 112.38 3g1f n VAL 34 Ca -0.04 -0.03 0.31 0.00 -2.04 0.00 0.00 64.34 62.54 3g1f n VAL 34 Cb 0.16 -0.64 0.67 0.00 -1.47 0.00 0.00 33.84 32.57 3g1f n VAL 34 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 3g1f h ARG 35 N 0.00 0.12 -0.85 7.34 9.65 -0.52 1.35 114.38 131.48 3g1f h ARG 35 Ca 0.00 -0.01 0.22 0.00 -1.10 0.00 0.00 59.98 59.10 3g1f h ARG 35 Cb 0.53 -0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 29.03 3g1f h ARG 35 CO 0.00 0.08 0.59 0.93 2.80 0.00 0.00 179.97 184.37 3g1f h GLU 36 N 0.13 0.16 -0.00 0.20 5.08 -1.72 -2.93 114.58 115.50 3g1f h GLU 36 Ca 0.58 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.93 3g1f h GLU 36 Cb 2.01 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 31.23 3g1f h GLU 36 CO -0.11 0.11 -0.16 0.66 -1.00 0.00 0.00 179.01 178.51 3g1f n TYR 37 N -4.38 0.00 -3.83 4.33 4.02 0.46 -5.05 117.16 112.71 3g1f n TYR 37 Ca 0.18 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.94 3g1f n TYR 37 Cb 0.81 0.00 -0.13 0.00 -0.02 0.00 0.00 39.34 40.00 3g1f n TYR 37 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 3g1f s ILE 38 N -1.16 -0.00 -0.27 -0.72 -5.25 -0.69 -4.58 121.20 108.53 3g1f s ILE 38 Ca 0.03 0.00 0.13 0.00 -0.99 0.00 0.00 60.65 59.82 3g1f s ILE 38 Cb 0.04 -0.17 0.31 0.00 2.95 0.00 0.00 42.46 45.58 3g1f s ILE 38 CO 0.16 0.00 1.22 -0.90 -1.79 0.00 0.00 174.94 173.63 3g1f n ASP 39 N 3.03 2.85 -3.70 4.36 5.75 -1.26 -4.46 116.55 123.12 3g1f n ASP 39 Ca -0.12 -2.64 -0.26 0.00 -0.01 0.00 0.00 54.79 51.76 3g1f n ASP 39 Cb 0.59 -0.34 -0.17 0.00 -1.03 0.00 0.00 41.12 40.17 3g1f n ASP 39 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3g1f s THR 40 N -2.13 0.26 -0.08 2.12 2.01 -1.26 -0.48 115.64 116.07 3g1f s THR 40 Ca 0.27 -0.24 0.00 0.00 0.31 0.00 0.00 61.69 62.03 3g1f s THR 40 Cb 0.21 -0.73 -0.03 0.00 0.01 0.00 0.00 72.50 71.96 3g1f s THR 40 CO 0.06 -0.12 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.12 3g1f s VAL 41 N 1.99 3.69 -0.19 3.82 1.01 0.29 -1.86 120.40 129.16 3g1f s VAL 41 Ca 0.01 -0.47 -0.08 0.00 0.00 0.00 0.00 61.98 61.44 3g1f s VAL 41 Cb -0.15 -2.53 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 3g1f s VAL 41 CO -0.07 0.58 0.09 -0.75 0.00 0.00 0.00 175.10 174.95 3g1f s LYS 42 N -0.58 4.04 -0.09 2.72 2.20 0.43 -0.17 119.74 128.30 3g1f s LYS 42 Ca 0.09 -0.30 0.03 0.00 -0.36 0.00 0.00 55.97 55.42 3g1f s LYS 42 Cb -0.12 -3.31 -0.01 0.00 -1.51 0.00 0.00 37.83 32.88 3g1f s LYS 42 CO 0.02 0.25 -0.18 0.42 -0.36 0.00 0.00 175.35 175.50 3g1f s ILE 43 N 0.45 2.69 0.26 5.43 -1.09 0.19 -1.88 121.20 127.26 3g1f s ILE 43 Ca 0.05 -0.82 0.02 0.00 -2.23 0.00 0.00 60.65 57.67 3g1f s ILE 43 Cb -0.12 -2.07 0.02 0.00 -1.58 0.00 0.00 42.46 38.72 3g1f s ILE 43 CO -0.00 0.56 0.20 0.61 -1.23 0.00 0.00 174.94 175.07 3g1f n GLY 44 N 3.08 2.88 0.16 6.18 0.00 -1.26 0.12 105.19 116.34 3g1f n GLY 44 Ca -0.18 -2.23 0.02 0.00 0.00 0.00 0.00 46.02 43.63 3g1f n GLY 44 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3g1f h TYR 45 N 0.56 0.00 -0.94 1.61 0.99 -1.98 -3.07 116.97 114.14 3g1f h TYR 45 Ca -0.16 0.00 0.01 0.00 2.00 0.00 0.00 58.73 60.58 3g1f h TYR 45 Cb 0.60 0.00 -0.05 0.00 1.00 0.00 0.00 36.73 38.28 3g1f h TYR 45 CO 0.00 0.51 0.62 -1.35 -0.00 0.00 0.00 178.16 177.94 3g1f h PRO 46 N 0.00 1.22 0.18 4.88 0.11 -1.96 0.33 132.00 136.76 3g1f h PRO 46 Ca -0.01 -0.07 -0.27 0.00 0.11 0.00 0.00 66.00 65.76 3g1f h PRO 46 Cb 0.99 -0.28 0.02 0.00 0.11 0.00 0.00 31.00 31.84 3g1f h PRO 46 CO 0.07 0.81 -1.25 1.25 -0.21 0.00 0.00 178.00 178.66 3g1f h LEU 47 N 1.26 0.59 -0.62 2.35 5.85 -1.82 -3.18 115.31 119.74 3g1f h LEU 47 Ca 0.35 -0.92 -0.12 0.00 0.84 0.00 0.00 57.88 58.03 3g1f h LEU 47 Cb -0.12 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.71 3g1f h LEU 47 CO -0.08 1.58 -0.23 0.58 -0.34 0.00 0.00 178.44 179.95 3g1f h VAL 48 N -0.15 1.27 0.00 1.05 2.07 -1.45 -0.30 116.25 118.74 3g1f h VAL 48 Ca -0.23 -1.37 0.00 0.00 0.82 0.00 0.00 66.70 65.92 3g1f h VAL 48 Cb 1.88 1.20 0.00 0.00 -1.52 0.00 0.00 31.29 32.85 3g1f h VAL 48 CO 0.17 0.46 0.00 -0.07 0.02 0.00 0.00 177.57 178.16 3g1f h LEU 49 N 0.73 0.00 0.06 2.57 3.38 -0.47 0.30 115.31 121.88 3g1f h LEU 49 Ca 0.10 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.70 3g1f h LEU 49 Cb 0.77 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.48 3g1f h LEU 49 CO 0.06 0.00 -2.17 -1.20 0.09 0.00 0.00 178.44 175.22 3g1f n SER 50 N -2.95 1.84 -0.00 -0.43 7.64 -1.17 -4.56 113.62 114.00 3g1f n SER 50 Ca 0.04 0.09 0.08 0.00 1.01 0.00 0.00 58.87 60.08 3g1f n SER 50 Cb 0.46 -0.52 -0.09 0.00 -1.01 0.00 0.00 64.21 63.05 3g1f n SER 50 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3g1f n GLU 51 N -3.32 1.56 0.00 1.43 -0.58 -0.13 -5.10 120.64 114.49 3g1f n GLU 51 Ca -0.36 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.37 3g1f n GLU 51 Cb 1.03 -1.28 0.00 0.00 -0.57 0.00 0.00 31.44 30.63 3g1f n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3g1f n GLY 52 N 1.39 1.16 0.00 0.62 0.00 0.10 -4.64 105.19 103.83 3g1f n GLY 52 Ca 0.03 -1.75 0.05 0.00 0.00 0.00 0.00 46.02 44.35 3g1f n GLY 52 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3g1f n MET 53 N 1.17 0.07 0.00 1.61 2.81 -1.25 -2.34 117.12 119.18 3g1f n MET 53 Ca 0.00 0.26 0.14 0.00 -1.81 0.00 0.00 57.70 56.29 3g1f n MET 53 Cb 0.00 -1.50 0.64 0.00 -0.71 0.00 0.00 33.22 31.65 3g1f n MET 53 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3g1f n ASP 54 N -1.41 0.28 0.25 7.83 9.92 -1.26 -2.85 116.55 129.30 3g1f n ASP 54 Ca 0.04 -0.33 0.11 0.00 -0.53 0.00 0.00 54.79 54.08 3g1f n ASP 54 Cb 0.11 -0.16 0.64 0.00 -0.64 0.00 0.00 41.12 41.08 3g1f n ASP 54 CO 0.00 0.00 0.00 -0.29 0.13 0.00 0.00 177.20 177.04 3g1f h ILE 55 N 0.30 0.69 0.09 0.53 6.09 -1.73 -2.68 117.51 120.81 3g1f h ILE 55 Ca 0.00 -0.66 -0.00 0.00 -1.37 0.00 0.00 64.86 62.82 3g1f h ILE 55 Cb 0.35 1.41 0.00 0.00 0.47 0.00 0.00 36.82 39.05 3g1f h ILE 55 CO 0.00 0.16 -0.05 0.40 -3.07 0.00 0.00 178.15 175.59 3g1f h ILE 56 N 0.00 0.00 -0.96 2.19 2.04 -1.76 -2.47 117.51 116.54 3g1f h ILE 56 Ca -0.00 -0.02 0.28 0.00 1.00 0.00 0.00 64.86 66.11 3g1f h ILE 56 Cb 0.40 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.44 3g1f h ILE 56 CO 0.02 0.00 0.87 0.00 0.00 0.00 0.00 178.15 179.04 3g1f h ALA 57 N -1.92 2.82 0.59 1.87 0.00 -1.55 0.87 119.26 121.95 3g1f h ALA 57 Ca -0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 3g1f h ALA 57 Cb 0.10 0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.97 3g1f h ALA 57 CO 0.02 -1.36 -0.29 0.93 0.00 0.00 0.00 179.25 178.55 3g1f h GLU 58 N 0.00 -0.77 -0.91 0.00 5.08 -1.31 -1.08 114.58 115.59 3g1f h GLU 58 Ca 0.46 0.05 0.19 0.00 -1.00 0.00 0.00 59.36 59.06 3g1f h GLU 58 Cb 2.19 0.17 -0.11 0.00 0.50 0.00 0.00 28.75 31.50 3g1f h GLU 58 CO -0.00 -0.46 0.46 0.74 -1.00 0.00 0.00 179.01 178.75 3g1f h PHE 59 N -1.02 0.79 0.81 4.33 -1.00 -0.37 0.26 116.94 120.75 3g1f h PHE 59 Ca -0.08 0.04 -0.04 0.00 2.81 0.00 0.00 57.97 60.70 3g1f h PHE 59 Cb 0.67 -0.21 0.01 0.00 3.61 0.00 0.00 35.95 40.02 3g1f h PHE 59 CO 0.00 0.09 -0.39 0.00 -1.61 0.00 0.00 178.31 176.40 3g1f h ARG 60 N 0.55 -1.05 -0.81 1.51 3.08 -1.33 -0.18 114.38 116.16 3g1f h ARG 60 Ca 0.54 0.07 0.03 0.00 0.07 0.00 0.00 59.98 60.69 3g1f h ARG 60 Cb 0.91 0.24 -0.05 0.00 0.08 0.00 0.00 29.97 31.15 3g1f h ARG 60 CO -0.44 -0.69 0.52 0.87 -1.07 0.00 0.00 179.97 179.16 3g1f h LYS 61 N -1.25 0.99 0.03 0.04 1.57 -0.83 0.16 116.57 117.27 3g1f h LYS 61 Ca -0.11 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.61 3g1f h LYS 61 Cb 0.84 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.93 3g1f h LYS 61 CO 0.18 0.66 -0.01 0.00 -0.57 0.00 0.00 179.45 179.71 3g1f h ARG 62 N 1.02 -0.04 -0.02 3.15 3.08 -0.45 -3.37 114.38 117.76 3g1f h ARG 62 Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.37 3g1f h ARG 62 Cb -0.02 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.04 3g1f h ARG 62 CO -0.10 -0.02 -0.13 1.19 -1.07 0.00 0.00 179.97 179.83 3g1f n PHE 63 N -2.11 0.00 -3.59 3.04 3.01 -0.09 -4.98 117.46 112.74 3g1f n PHE 63 Ca -0.00 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.24 3g1f n PHE 63 Cb 0.01 -0.01 0.05 0.00 -0.01 0.00 0.00 39.48 39.53 3g1f n PHE 63 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3g1f n GLY 64 N 1.34 -0.53 3.69 1.37 0.00 0.55 -4.99 105.19 106.61 3g1f n GLY 64 Ca 0.13 0.24 -0.23 0.00 0.00 0.00 0.00 46.02 46.16 3g1f n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1f s ARG 66 N -3.76 4.74 -0.16 0.00 3.52 0.37 -4.61 118.95 119.05 3g1f s ARG 66 Ca 0.34 1.40 -0.00 0.00 -0.13 0.00 0.00 55.73 57.34 3g1f s ARG 66 Cb -0.04 -3.32 -0.00 0.00 -1.56 0.00 0.00 34.95 30.03 3g1f s ARG 66 CO 0.21 0.40 -0.14 0.42 -0.81 0.00 0.00 175.30 175.39 3g1f s ILE 67 N -0.69 2.80 -0.30 4.11 -1.09 -1.26 -0.54 121.20 124.23 3g1f s ILE 67 Ca 0.42 -0.72 -0.07 0.00 -2.23 0.00 0.00 60.65 58.05 3g1f s ILE 67 Cb -0.24 -2.19 0.01 0.00 -1.58 0.00 0.00 42.46 38.46 3g1f s ILE 67 CO 0.30 0.51 0.08 -0.63 -1.23 0.00 0.00 174.94 173.97 3g1f s ILE 68 N 0.81 3.97 -0.53 2.92 1.01 0.76 -1.81 121.20 128.33 3g1f s ILE 68 Ca -0.05 -0.72 -0.27 0.00 0.00 0.00 0.00 60.65 59.62 3g1f s ILE 68 Cb -0.15 -3.06 0.03 0.00 0.01 0.00 0.00 42.46 39.29 3g1f s ILE 68 CO 0.00 0.06 1.06 0.00 0.00 0.00 0.00 174.94 176.07 3g1f s ALA 69 N 1.50 3.11 -1.33 9.38 0.00 0.41 0.57 121.76 135.40 3g1f s ALA 69 Ca 0.02 -0.88 -0.13 0.00 0.00 0.00 0.00 51.96 50.97 3g1f s ALA 69 Cb -0.17 -3.86 0.11 0.00 0.00 0.00 0.00 23.12 19.20 3g1f s ALA 69 CO 0.03 -2.41 1.88 -3.47 0.00 0.00 0.00 175.76 171.78 3g1f n ASP 70 N 7.84 4.71 -0.47 0.00 -0.08 0.31 -1.25 116.55 127.62 3g1f n ASP 70 Ca 0.07 -2.96 0.12 0.00 -1.51 0.00 0.00 54.79 50.50 3g1f n ASP 70 Cb 0.48 -1.61 0.09 0.00 2.34 0.00 0.00 41.12 42.43 3g1f n ASP 70 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 3g1f n PHE 71 N 5.82 0.00 -4.18 -0.67 0.99 -1.25 -4.25 117.46 113.92 3g1f n PHE 71 Ca 0.45 0.00 -0.30 0.00 -0.00 0.00 0.00 57.45 57.60 3g1f n PHE 71 Cb 0.40 -0.03 -0.07 0.00 -1.00 0.00 0.00 39.48 38.79 3g1f n PHE 71 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 3g1f n LYS 72 N -0.09 -1.64 -1.65 -1.08 5.02 -0.22 -4.74 118.16 113.76 3g1f n LYS 72 Ca 0.10 0.19 -0.55 0.00 -2.02 0.00 0.00 58.31 56.04 3g1f n LYS 72 Cb 0.45 -3.83 -0.07 0.00 -0.02 0.00 0.00 35.03 31.56 3g1f n LYS 72 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3g1f n VAL 73 N -4.55 0.16 -2.72 -0.18 0.31 -0.95 -4.18 118.33 106.21 3g1f n VAL 73 Ca -0.31 -0.03 -0.09 0.00 -0.01 0.00 0.00 64.34 63.90 3g1f n VAL 73 Cb 0.69 -1.03 0.05 0.00 -0.91 0.00 0.00 33.84 32.64 3g1f n VAL 73 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3g1f n ALA 74 N 3.98 2.50 -3.68 3.52 0.00 -1.26 -1.33 120.51 124.24 3g1f n ALA 74 Ca 0.22 -2.58 0.00 0.00 0.00 0.00 0.00 53.44 51.09 3g1f n ALA 74 Cb 0.16 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.65 3g1f n ALA 74 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3g1f n ASP 75 N -0.16 1.82 -4.82 0.00 -0.08 -1.26 -4.96 116.55 107.09 3g1f n ASP 75 Ca 0.07 -0.74 -0.30 0.00 -1.51 0.00 0.00 54.79 52.31 3g1f n ASP 75 Cb 0.81 0.00 0.08 0.00 2.34 0.00 0.00 41.12 44.35 3g1f n ASP 75 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 3g1f s ILE 76 N -0.60 3.18 0.18 5.18 -4.36 -1.26 -4.74 121.20 118.77 3g1f s ILE 76 Ca 0.00 0.38 -0.17 0.00 -0.26 0.00 0.00 60.65 60.60 3g1f s ILE 76 Cb 0.00 -3.17 0.12 0.00 1.25 0.00 0.00 42.46 40.67 3g1f s ILE 76 CO 0.00 -0.50 1.64 -0.65 0.24 0.00 0.00 174.94 175.67 3g1f h PRO 77 N -1.00 -0.07 -0.44 0.37 0.11 -1.87 -0.45 132.00 128.64 3g1f h PRO 77 Ca -0.46 0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.73 3g1f h PRO 77 Cb 1.26 0.02 -0.07 0.00 0.11 0.00 0.00 31.00 32.32 3g1f h PRO 77 CO 0.60 -0.04 0.05 0.93 -0.21 0.00 0.00 178.00 179.32 3g1f h GLU 78 N -0.07 0.16 -0.13 1.05 3.07 -1.95 -1.55 114.58 115.17 3g1f h GLU 78 Ca 0.22 -0.01 -0.19 0.00 -0.50 0.00 0.00 59.36 58.88 3g1f h GLU 78 Cb 0.40 -0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 28.27 3g1f h GLU 78 CO -0.49 0.11 -0.69 1.15 -1.40 0.00 0.00 179.01 177.69 3g1f h THR 79 N 0.17 1.34 -0.60 1.13 2.02 -1.85 -2.91 112.91 112.20 3g1f h THR 79 Ca 0.22 -2.00 0.02 0.00 0.77 0.00 0.00 66.41 65.42 3g1f h THR 79 Cb 0.30 1.98 -0.03 0.00 -1.74 0.00 0.00 68.15 68.65 3g1f h THR 79 CO -0.32 0.61 0.40 0.78 0.37 0.00 0.00 175.52 177.36 3g1f h ASN 80 N 0.39 0.64 -0.20 4.18 4.21 -0.71 0.79 115.58 124.88 3g1f h ASN 80 Ca -0.02 -0.01 -0.02 0.00 1.21 0.00 0.00 56.30 57.46 3g1f h ASN 80 Cb 1.27 -0.15 -0.01 0.00 -1.12 0.00 0.00 38.32 38.30 3g1f h ASN 80 CO 0.13 0.45 0.06 -0.33 -1.29 0.00 0.00 177.43 176.45 3g1f h GLU 81 N 0.75 0.31 -0.37 0.81 5.08 -1.17 -0.31 114.58 119.68 3g1f h GLU 81 Ca 0.23 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.53 3g1f h GLU 81 Cb 0.00 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 3g1f h GLU 81 CO -0.06 0.41 0.23 0.87 -1.00 0.00 0.00 179.01 179.46 3g1f h LYS 82 N 0.14 0.45 -0.86 2.33 6.56 -1.10 -1.34 116.57 122.75 3g1f h LYS 82 Ca 0.06 -0.03 -0.03 0.00 -1.06 0.00 0.00 60.65 59.60 3g1f h LYS 82 Cb 0.24 -0.10 -0.04 0.00 -0.57 0.00 0.00 32.23 31.76 3g1f h LYS 82 CO -0.00 0.30 0.43 0.82 -2.06 0.00 0.00 179.45 178.93 3g1f h ILE 83 N 0.46 1.26 -0.50 1.86 2.04 -0.71 -2.17 117.51 119.76 3g1f h ILE 83 Ca 0.14 -0.71 -0.12 0.00 1.00 0.00 0.00 64.86 65.17 3g1f h ILE 83 Cb -0.02 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.18 3g1f h ILE 83 CO -0.05 0.31 -0.17 0.00 0.00 0.00 0.00 178.15 178.23 3g1f h ARG 85 N 0.87 0.49 -0.38 0.00 3.08 -1.00 -1.63 114.38 115.80 3g1f h ARG 85 Ca 0.12 -0.15 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 3g1f h ARG 85 Cb 0.74 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.73 3g1f h ARG 85 CO 0.06 0.63 0.07 0.00 -1.07 0.00 0.00 179.97 179.65 3g1f h ALA 86 N 0.85 1.40 -0.19 0.04 0.00 -1.40 0.35 119.26 120.32 3g1f h ALA 86 Ca 0.08 -0.17 -0.21 0.00 0.00 0.00 0.00 54.91 54.61 3g1f h ALA 86 Cb 0.39 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.03 3g1f h ALA 86 CO 0.01 0.43 -0.72 1.15 0.00 0.00 0.00 179.25 180.12 3g1f h THR 87 N 0.56 1.28 -0.02 0.00 2.02 -1.20 -2.28 112.91 113.28 3g1f h THR 87 Ca 0.13 -1.92 -0.01 0.00 0.77 0.00 0.00 66.41 65.38 3g1f h THR 87 Cb 0.26 1.89 0.00 0.00 -1.74 0.00 0.00 68.15 68.56 3g1f h THR 87 CO 0.00 0.61 -0.04 -0.26 0.37 0.00 0.00 175.52 176.20 3g1f h PHE 88 N 0.56 0.07 -1.16 3.16 0.04 -1.05 -1.35 116.94 117.21 3g1f h PHE 88 Ca -0.03 -0.03 0.33 0.00 2.80 0.00 0.00 57.97 61.04 3g1f h PHE 88 Cb 1.34 -0.01 -0.06 0.00 2.20 0.00 0.00 35.95 39.41 3g1f h PHE 88 CO 0.08 0.63 0.81 -0.22 -0.60 0.00 0.00 178.31 179.01 3g1f h LYS 89 N -0.51 0.10 -0.01 1.51 3.64 -0.29 4.61 116.57 125.62 3g1f h LYS 89 Ca -0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3g1f h LYS 89 Cb 0.63 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 3g1f h LYS 89 CO 0.01 0.07 0.00 0.00 -2.27 0.00 0.00 179.45 177.26 3g1f n ALA 90 N -2.68 2.65 -0.24 5.00 0.00 -0.86 -4.88 120.51 119.49 3g1f n ALA 90 Ca 0.26 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.50 3g1f n ALA 90 Cb 1.16 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 19.21 3g1f n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g1f n GLY 91 N 0.95 0.66 3.71 0.00 0.00 1.51 -3.36 105.19 108.66 3g1f n GLY 91 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 3g1f n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1f n ALA 92 N -1.29 1.61 0.11 4.61 0.00 -0.53 -4.90 120.51 120.13 3g1f n ALA 92 Ca 0.00 0.38 -0.19 0.00 0.00 0.00 0.00 53.44 53.63 3g1f n ALA 92 Cb 0.00 -2.32 -0.13 0.00 0.00 0.00 0.00 19.45 17.00 3g1f n ALA 92 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3g1f h ASP 93 N 3.51 0.61 -5.14 0.00 3.32 -1.69 -3.42 116.42 113.61 3g1f h ASP 93 Ca -0.46 -0.63 -0.10 0.00 0.02 0.00 0.00 57.03 55.86 3g1f h ASP 93 Cb 1.26 -0.20 -0.15 0.00 0.22 0.00 0.00 39.33 40.47 3g1f h ASP 93 CO 0.70 1.48 -0.41 0.00 -1.72 0.00 0.00 179.24 179.29 3g1f s ALA 94 N -2.74 -0.19 0.01 3.45 0.00 -0.89 -2.18 121.76 119.23 3g1f s ALA 94 Ca -0.06 -0.58 0.03 0.00 0.00 0.00 0.00 51.96 51.35 3g1f s ALA 94 Cb 0.06 0.41 -0.01 0.00 0.00 0.00 0.00 23.12 23.57 3g1f s ALA 94 CO 0.91 -0.45 -0.10 -1.50 0.00 0.00 0.00 175.76 174.61 3g1f s ILE 95 N -3.49 0.78 -0.17 0.00 2.07 -0.46 -0.44 121.20 119.49 3g1f s ILE 95 Ca 0.02 -0.65 -0.13 0.00 -1.41 0.00 0.00 60.65 58.48 3g1f s ILE 95 Cb 0.03 -0.70 -0.05 0.00 0.13 0.00 0.00 42.46 41.88 3g1f s ILE 95 CO -0.09 0.05 0.26 -0.63 -1.91 0.00 0.00 174.94 172.62 3g1f s ILE 96 N -0.56 5.33 -0.04 2.00 1.01 -0.38 0.11 121.20 128.67 3g1f s ILE 96 Ca 0.01 0.47 0.04 0.00 0.00 0.00 0.00 60.65 61.17 3g1f s ILE 96 Cb -0.06 -3.60 -0.00 0.00 0.01 0.00 0.00 42.46 38.82 3g1f s ILE 96 CO 0.00 0.40 -0.15 -0.69 0.00 0.00 0.00 174.94 174.51 3g1f s VAL 97 N 0.41 1.26 0.41 2.92 1.01 0.49 -1.06 120.40 125.84 3g1f s VAL 97 Ca 0.15 -0.63 -0.25 0.00 0.00 0.00 0.00 61.98 61.25 3g1f s VAL 97 Cb -0.13 -1.09 -0.08 0.00 0.00 0.00 0.00 36.38 35.08 3g1f s VAL 97 CO 0.03 0.37 1.14 -1.00 0.00 0.00 0.00 175.10 175.63 3g1f s HIS 98 N 0.03 3.09 -0.38 5.22 3.76 -0.44 -1.18 115.29 125.38 3g1f s HIS 98 Ca -0.02 1.58 0.22 0.00 -0.15 0.00 0.00 55.06 56.68 3g1f s HIS 98 Cb -0.10 -3.33 -0.19 0.00 1.11 0.00 0.00 32.58 30.06 3g1f s HIS 98 CO 0.01 -1.18 0.75 0.41 -0.85 0.00 0.00 174.74 173.89 3g1f n GLY 99 N 0.56 -1.09 0.29 -2.22 0.00 -1.20 -4.51 105.19 97.02 3g1f n GLY 99 Ca 0.05 -0.48 0.14 0.00 0.00 0.00 0.00 46.02 45.73 3g1f n GLY 99 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 3g1f h PHE 100 N 0.00 0.00 0.00 1.61 -0.00 -1.92 -2.22 116.94 114.40 3g1f h PHE 100 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 3g1f h PHE 100 Cb 0.83 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.78 3g1f h PHE 100 CO 0.00 0.01 0.00 -2.30 -0.00 0.00 0.00 178.31 176.02 3g1f n PRO 101 N -3.92 0.02 0.00 6.09 -0.02 -1.26 -4.98 135.00 130.93 3g1f n PRO 101 Ca -0.03 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 3g1f n PRO 101 Cb 0.09 -1.54 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 3g1f n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g1f n GLY 102 N 0.34 2.99 0.27 -1.23 0.00 -0.84 -4.71 105.19 102.02 3g1f n GLY 102 Ca 0.04 -1.96 -0.06 0.00 0.00 0.00 0.00 46.02 44.04 3g1f n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1f h ALA 103 N 0.00 -0.01 -0.55 4.61 0.00 -1.94 -2.14 119.26 119.23 3g1f h ALA 103 Ca 0.00 0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.08 3g1f h ALA 103 Cb 0.00 0.53 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 3g1f h ALA 103 CO 0.00 -0.62 0.37 0.38 0.00 0.00 0.00 179.25 179.38 3g1f h ASP 104 N -0.18 0.47 0.54 0.00 2.03 -1.99 -0.13 116.42 117.17 3g1f h ASP 104 Ca 0.18 -0.00 -0.12 0.00 -0.73 0.00 0.00 57.03 56.36 3g1f h ASP 104 Cb 0.46 -0.10 -0.02 0.00 -0.83 0.00 0.00 39.33 38.84 3g1f h ASP 104 CO -0.47 0.31 -0.57 0.28 -1.03 0.00 0.00 179.24 177.77 3g1f h SER 105 N 0.54 0.03 0.12 4.15 0.02 -1.68 -2.36 113.55 114.37 3g1f h SER 105 Ca 0.23 -0.02 -0.26 0.00 -0.84 0.00 0.00 61.79 60.90 3g1f h SER 105 Cb 0.24 -0.01 0.03 0.00 0.14 0.00 0.00 62.40 62.80 3g1f h SER 105 CO -0.06 0.59 -1.11 0.58 -1.14 0.00 0.00 176.83 175.69 3g1f h VAL 106 N 0.02 1.34 -0.99 2.27 2.07 -0.90 -3.24 116.25 116.82 3g1f h VAL 106 Ca -0.01 -2.44 0.03 0.00 0.82 0.00 0.00 66.70 65.10 3g1f h VAL 106 Cb 1.01 2.81 -0.06 0.00 -1.52 0.00 0.00 31.29 33.53 3g1f h VAL 106 CO 0.08 0.73 0.65 -0.09 0.02 0.00 0.00 177.57 178.96 3g1f h ARG 107 N 0.10 1.24 -0.44 1.57 9.65 -1.03 0.05 114.38 125.52 3g1f h ARG 107 Ca -0.17 -0.07 -0.01 0.00 -1.10 0.00 0.00 59.98 58.62 3g1f h ARG 107 Cb 1.82 -0.28 -0.02 0.00 -1.39 0.00 0.00 29.97 30.10 3g1f h ARG 107 CO 0.21 0.82 0.23 0.00 2.80 0.00 0.00 179.97 184.03 3g1f h ALA 108 N 1.41 1.59 -0.01 2.80 0.00 -1.49 0.37 119.26 123.93 3g1f h ALA 108 Ca 0.39 -0.08 -0.18 0.00 0.00 0.00 0.00 54.91 55.05 3g1f h ALA 108 Cb -0.03 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3g1f h ALA 108 CO -0.12 0.35 -0.80 0.00 0.00 0.00 0.00 179.25 178.68 3g1f h LEU 110 N 0.07 0.84 0.12 0.00 3.38 0.58 -2.61 115.31 117.69 3g1f h LEU 110 Ca -0.02 -0.43 -0.00 0.00 0.09 0.00 0.00 57.88 57.52 3g1f h LEU 110 Cb 1.40 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 3g1f h LEU 110 CO 0.12 1.19 -0.07 0.78 0.09 0.00 0.00 178.44 180.54 3g1f h ASN 111 N 0.60 -0.17 -0.14 -0.43 2.35 -0.30 -0.93 115.58 116.56 3g1f h ASN 111 Ca 0.02 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 3g1f h ASN 111 Cb 1.08 0.05 -0.01 0.00 0.05 0.00 0.00 38.32 39.49 3g1f h ASN 111 CO 0.11 -0.12 0.06 0.58 -1.65 0.00 0.00 177.43 176.42 3g1f h VAL 112 N -0.18 1.12 -0.32 2.81 2.07 -1.57 0.27 116.25 120.46 3g1f h VAL 112 Ca -0.01 -0.36 0.03 0.00 0.82 0.00 0.00 66.70 67.18 3g1f h VAL 112 Cb 0.15 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 3g1f h VAL 112 CO 0.02 0.11 0.21 0.00 0.02 0.00 0.00 177.57 177.93 3g1f h ALA 113 N 0.93 1.92 -0.03 1.67 0.00 -1.42 0.26 119.26 122.60 3g1f h ALA 113 Ca 0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3g1f h ALA 113 Cb 0.12 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3g1f h ALA 113 CO -0.01 0.03 -0.01 1.49 0.00 0.00 0.00 179.25 180.76 3g1f h GLU 114 N 0.30 0.07 -0.67 0.00 4.22 -0.33 0.86 114.58 119.03 3g1f h GLU 114 Ca 0.13 -0.03 -0.06 0.00 0.08 0.00 0.00 59.36 59.49 3g1f h GLU 114 Cb 0.15 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 3g1f h GLU 114 CO -0.03 0.41 0.18 1.49 -2.18 0.00 0.00 179.01 178.89 3g1f h GLU 115 N -0.29 1.06 -0.10 1.92 4.81 0.49 -3.07 114.58 119.39 3g1f h GLU 115 Ca 0.01 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 3g1f h GLU 115 Cb 0.39 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.63 3g1f h GLU 115 CO 0.00 0.94 0.00 -1.33 -0.73 0.00 0.00 179.01 177.89 3g1f n MET 116 N -4.30 1.79 -3.12 1.92 2.81 0.83 -4.96 117.12 112.09 3g1f n MET 116 Ca 0.04 -1.16 -0.14 0.00 -1.81 0.00 0.00 57.70 54.64 3g1f n MET 116 Cb 0.24 -1.44 0.05 0.00 -0.71 0.00 0.00 33.22 31.35 3g1f n MET 116 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g1f n GLY 117 N 1.19 0.08 1.87 3.03 0.00 0.71 -5.02 105.19 107.04 3g1f n GLY 117 Ca 0.17 -0.13 -0.16 0.00 0.00 0.00 0.00 46.02 45.90 3g1f n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g1f n ARG 118 N -3.11 1.20 -4.55 1.61 5.12 0.26 -5.01 116.66 112.18 3g1f n ARG 118 Ca -0.00 -1.91 -0.29 0.00 -1.93 0.00 0.00 57.85 53.71 3g1f n ARG 118 Cb 0.54 0.64 -0.13 0.00 -1.16 0.00 0.00 32.46 32.35 3g1f n ARG 118 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 3g1f s GLU 119 N -2.92 1.55 -0.07 5.56 0.41 -0.93 -4.44 118.70 117.86 3g1f s GLU 119 Ca 0.03 -1.26 0.02 0.00 -0.41 0.00 0.00 54.97 53.35 3g1f s GLU 119 Cb 0.00 -1.94 -0.02 0.00 -1.78 0.00 0.00 34.13 30.39 3g1f s GLU 119 CO 0.02 0.47 -0.13 0.08 -0.49 0.00 0.00 175.26 175.21 3g1f s VAL 120 N -0.98 3.15 -0.11 2.63 1.01 -1.26 -1.36 120.40 123.48 3g1f s VAL 120 Ca 0.13 -0.67 0.03 0.00 0.00 0.00 0.00 61.98 61.47 3g1f s VAL 120 Cb -0.10 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 34.01 3g1f s VAL 120 CO 0.05 0.57 -0.20 -0.36 0.00 0.00 0.00 175.10 175.16 3g1f s PHE 121 N -0.46 2.65 -0.17 5.22 0.40 0.12 -4.21 117.98 121.52 3g1f s PHE 121 Ca 0.06 -0.89 -0.12 0.00 -0.60 0.00 0.00 56.93 55.38 3g1f s PHE 121 Cb -0.12 -1.76 -0.05 0.00 0.51 0.00 0.00 43.02 41.61 3g1f s PHE 121 CO 0.02 -0.33 0.22 -1.17 0.70 0.00 0.00 175.22 174.66 3g1f s LEU 122 N 0.32 4.24 -0.40 -0.37 2.96 -0.58 -0.38 118.68 124.47 3g1f s LEU 122 Ca -0.15 0.40 -0.17 0.00 -0.22 0.00 0.00 54.13 53.98 3g1f s LEU 122 Cb -0.17 -2.25 0.01 0.00 0.50 0.00 0.00 46.19 44.28 3g1f s LEU 122 CO 0.08 0.15 0.45 -0.22 -1.32 0.00 0.00 176.35 175.49 3g1f s LEU 123 N 0.34 4.69 -0.15 -0.68 2.96 -0.33 -0.59 118.68 124.93 3g1f s LEU 123 Ca 0.13 -0.49 -0.26 0.00 -0.22 0.00 0.00 54.13 53.29 3g1f s LEU 123 Cb -0.12 -2.44 -0.25 0.00 0.50 0.00 0.00 46.19 43.88 3g1f s LEU 123 CO 0.02 -0.55 0.63 0.71 -1.32 0.00 0.00 176.35 175.84 3g1f h THR 124 N 5.70 1.51 -3.81 3.68 1.35 -1.82 -3.17 112.91 116.36 3g1f h THR 124 Ca -0.27 -2.33 -0.25 0.00 -0.55 0.00 0.00 66.41 63.01 3g1f h THR 124 Cb 1.12 3.06 -0.16 0.00 -1.73 0.00 0.00 68.15 70.43 3g1f h THR 124 CO 0.78 0.55 -0.71 -0.70 -0.25 0.00 0.00 175.52 175.20 3g1f s GLU 125 N -2.29 0.79 0.34 4.72 2.12 -1.26 -4.31 118.70 118.81 3g1f s GLU 125 Ca -0.21 -1.22 0.08 0.00 0.36 0.00 0.00 54.97 53.99 3g1f s GLU 125 Cb -0.00 -0.28 -0.05 0.00 0.26 0.00 0.00 34.13 34.06 3g1f s GLU 125 CO 0.68 0.01 0.11 -1.64 -0.54 0.00 0.00 175.26 173.88 3g1f s MET 126 N -3.30 2.29 0.01 4.30 -1.94 -1.26 -3.98 119.30 115.43 3g1f s MET 126 Ca 0.07 -1.60 0.21 0.00 -1.71 0.00 0.00 55.69 52.66 3g1f s MET 126 Cb 0.01 -2.11 -0.24 0.00 2.01 0.00 0.00 34.83 34.51 3g1f s MET 126 CO -0.03 0.12 0.59 -1.13 -0.01 0.00 0.00 175.02 174.56 3g1f n SER 127 N -1.10 0.27 -4.75 3.03 3.41 -1.26 -4.83 113.62 108.40 3g1f n SER 127 Ca -0.03 0.11 -0.30 0.00 -0.26 0.00 0.00 58.87 58.38 3g1f n SER 127 Cb 0.62 1.37 0.11 0.00 -0.26 0.00 0.00 64.21 66.05 3g1f n SER 127 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 3g1f s HIS 128 N -3.31 2.50 0.05 7.33 -3.43 -1.26 -4.88 115.29 112.30 3g1f s HIS 128 Ca -0.06 1.34 -0.19 0.00 -0.80 0.00 0.00 55.06 55.35 3g1f s HIS 128 Cb 0.12 -3.11 -0.08 0.00 -1.43 0.00 0.00 32.58 28.08 3g1f s HIS 128 CO 0.87 -2.08 1.30 -1.35 -2.00 0.00 0.00 174.74 171.48 3g1f h PRO 129 N -1.32 -0.40 0.00 -0.38 0.11 -2.03 -2.39 132.00 125.59 3g1f h PRO 129 Ca -0.47 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3g1f h PRO 129 Cb 1.26 0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.46 3g1f h PRO 129 CO 0.54 -0.26 0.78 0.78 -0.21 0.00 0.00 178.00 179.63 3g1f h GLY 130 N -0.41 0.00 2.00 -0.55 0.00 -2.00 0.10 103.07 102.21 3g1f h GLY 130 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 3g1f h GLY 130 CO -0.15 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.39 3g1f n ALA 131 N -1.44 1.33 0.00 3.60 0.00 -0.90 -1.63 120.51 121.48 3g1f n ALA 131 Ca -0.00 0.08 -0.16 0.00 0.00 0.00 0.00 53.44 53.35 3g1f n ALA 131 Cb 0.79 -1.26 -0.06 0.00 0.00 0.00 0.00 19.45 18.92 3g1f n ALA 131 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3g1f h GLU 132 N 0.00 0.70 -0.52 0.00 4.39 -1.18 0.11 114.58 118.08 3g1f h GLU 132 Ca 0.00 -0.61 0.10 0.00 0.34 0.00 0.00 59.36 59.19 3g1f h GLU 132 Cb 0.16 0.14 -0.10 0.00 -0.10 0.00 0.00 28.75 28.84 3g1f h GLU 132 CO 0.00 1.22 -0.14 0.52 -1.16 0.00 0.00 179.01 179.45 3g1f h MET 133 N 0.46 -0.01 0.00 2.33 2.86 -1.53 -3.40 114.93 115.65 3g1f h MET 133 Ca -0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 3g1f h MET 133 Cb 1.45 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.11 3g1f h MET 133 CO 0.16 -0.00 -0.21 1.19 1.06 0.00 0.00 176.91 179.11 3g1f n PHE 134 N -5.38 0.00 0.40 -0.22 3.01 -1.25 -4.88 117.46 109.14 3g1f n PHE 134 Ca 0.05 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.32 3g1f n PHE 134 Cb 0.28 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.65 3g1f n PHE 134 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 3g1f h ILE 135 N 0.00 0.11 -0.66 4.37 2.04 -1.75 -2.66 117.51 118.95 3g1f h ILE 135 Ca 0.00 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.95 3g1f h ILE 135 Cb 0.21 0.11 -0.11 0.00 -0.74 0.00 0.00 36.82 36.29 3g1f h ILE 135 CO 0.00 0.00 -0.45 -0.61 0.00 0.00 0.00 178.15 177.09 3g1f h GLN 136 N -1.10 -0.18 -0.95 2.37 4.15 -0.99 0.33 115.11 118.75 3g1f h GLN 136 Ca -0.09 0.01 0.17 0.00 0.77 0.00 0.00 58.65 59.51 3g1f h GLN 136 Cb 0.88 0.04 -0.08 0.00 0.21 0.00 0.00 27.48 28.53 3g1f h GLN 136 CO 0.10 -0.12 0.60 0.78 -1.93 0.00 0.00 178.83 178.26 3g1f h GLY 137 N -0.18 1.34 1.29 2.39 0.00 -1.77 -2.34 103.07 103.79 3g1f h GLY 137 Ca 0.19 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.22 3g1f h GLY 137 CO -0.74 0.02 -0.70 0.00 0.00 0.00 0.00 176.54 175.11 3g1f h ALA 138 N 1.61 0.65 -0.95 3.60 0.00 -0.17 -3.41 119.26 120.59 3g1f h ALA 138 Ca 0.50 0.00 0.19 0.00 0.00 0.00 0.00 54.91 55.60 3g1f h ALA 138 Cb 0.90 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 18.51 3g1f h ALA 138 CO -0.26 0.00 -0.25 0.00 0.00 0.00 0.00 179.25 178.74 3g1f h ALA 139 N 2.01 0.58 0.02 0.00 0.00 0.04 -1.73 119.26 120.18 3g1f h ALA 139 Ca 0.00 0.36 -0.00 0.00 0.00 0.00 0.00 54.91 55.27 3g1f h ALA 139 Cb 1.00 0.74 0.00 0.00 0.00 0.00 0.00 17.79 19.53 3g1f h ALA 139 CO 0.00 -0.41 -0.01 -0.44 0.00 0.00 0.00 179.25 178.39 3g1f h ASP 140 N -0.00 -0.02 -0.51 0.00 5.19 -1.80 -1.86 116.42 117.41 3g1f h ASP 140 Ca 0.44 -0.07 -0.03 0.00 -0.62 0.00 0.00 57.03 56.76 3g1f h ASP 140 Cb 0.68 0.01 -0.03 0.00 0.18 0.00 0.00 39.33 40.17 3g1f h ASP 140 CO -0.97 0.05 0.23 -0.08 -3.12 0.00 0.00 179.24 175.35 3g1f h GLU 141 N -0.10 0.80 -0.16 3.56 4.81 -1.70 -1.83 114.58 119.96 3g1f h GLU 141 Ca -0.00 -0.12 -0.02 0.00 -0.13 0.00 0.00 59.36 59.09 3g1f h GLU 141 Cb 0.09 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 3g1f h GLU 141 CO 0.00 0.65 0.02 0.82 -0.73 0.00 0.00 179.01 179.78 3g1f h ILE 142 N 0.79 1.23 -0.49 2.32 2.04 -1.20 0.10 117.51 122.31 3g1f h ILE 142 Ca 0.19 -0.76 0.07 0.00 1.00 0.00 0.00 64.86 65.36 3g1f h ILE 142 Cb 0.15 1.41 -0.06 0.00 -0.74 0.00 0.00 36.82 37.58 3g1f h ILE 142 CO -0.02 0.23 0.16 0.00 0.00 0.00 0.00 178.15 178.51 3g1f h ALA 143 N 0.80 0.58 -0.87 1.87 0.00 -1.09 0.10 119.26 120.66 3g1f h ALA 143 Ca 0.05 0.07 0.07 0.00 0.00 0.00 0.00 54.91 55.10 3g1f h ALA 143 Cb 0.33 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 3g1f h ALA 143 CO 0.00 -0.24 0.54 0.00 0.00 0.00 0.00 179.25 179.55 3g1f h ARG 144 N 0.32 0.94 -0.75 0.00 3.08 -1.06 -0.15 114.38 116.76 3g1f h ARG 144 Ca 0.23 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.24 3g1f h ARG 144 Cb 0.26 -0.21 -0.04 0.00 0.08 0.00 0.00 29.97 30.06 3g1f h ARG 144 CO -0.25 0.62 0.50 1.98 -1.07 0.00 0.00 179.97 181.74 3g1f h MET 145 N 0.96 0.98 -0.24 0.04 4.05 0.13 -0.38 114.93 120.49 3g1f h MET 145 Ca 0.38 -0.06 0.02 0.00 -0.28 0.00 0.00 59.70 59.76 3g1f h MET 145 Cb 0.20 -0.22 -0.02 0.00 -0.80 0.00 0.00 31.60 30.75 3g1f h MET 145 CO -0.18 0.65 0.11 0.78 0.23 0.00 0.00 176.91 178.49 3g1f h GLY 146 N 1.01 0.31 0.85 1.39 0.00 0.81 -0.04 103.07 107.41 3g1f h GLY 146 Ca 0.28 -0.07 0.03 0.00 0.00 0.00 0.00 47.33 47.56 3g1f h GLY 146 CO -0.06 0.06 0.25 -2.08 0.00 0.00 0.00 176.54 174.71 3g1f h VAL 147 N 0.23 1.02 -0.55 4.60 2.07 -0.69 0.11 116.25 123.04 3g1f h VAL 147 Ca 0.10 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 67.46 3g1f h VAL 147 Cb 0.04 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.26 3g1f h VAL 147 CO -0.08 0.09 0.37 0.44 0.02 0.00 0.00 177.57 178.41 3g1f h ASP 148 N 0.50 0.61 0.85 0.57 3.32 -0.48 -0.63 116.42 121.16 3g1f h ASP 148 Ca 0.18 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.22 3g1f h ASP 148 Cb 0.04 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.45 3g1f h ASP 148 CO -0.10 0.43 -0.12 0.18 -1.72 0.00 0.00 179.24 177.92 3g1f n LEU 149 N -4.46 0.13 0.00 1.55 4.77 -0.08 -4.93 117.00 113.98 3g1f n LEU 149 Ca 0.06 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 3g1f n LEU 149 Cb 0.08 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 3g1f n LEU 149 CO 0.35 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 3g1f n GLY 150 N 1.48 0.60 3.77 -0.72 0.00 0.19 -5.02 105.19 105.49 3g1f n GLY 150 Ca 0.07 -0.80 -0.41 0.00 0.00 0.00 0.00 46.02 44.89 3g1f n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1f s VAL 151 N -2.00 2.64 -0.29 1.61 1.01 -0.03 -4.92 120.40 118.42 3g1f s VAL 151 Ca 0.00 0.63 0.09 0.00 0.00 0.00 0.00 61.98 62.70 3g1f s VAL 151 Cb 0.00 -3.40 -0.11 0.00 0.00 0.00 0.00 36.38 32.86 3g1f s VAL 151 CO 0.00 0.15 0.32 0.29 0.00 0.00 0.00 175.10 175.86 3g1f n LYS 152 N 0.91 2.79 -4.81 2.72 4.76 -1.26 -4.68 118.16 118.59 3g1f n LYS 152 Ca 0.01 -0.03 -0.27 0.00 -2.87 0.00 0.00 58.31 55.15 3g1f n LYS 152 Cb 0.41 -1.02 -0.17 0.00 -1.84 0.00 0.00 35.03 32.42 3g1f n LYS 152 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3g1f s ASN 153 N -2.25 2.20 0.07 4.39 0.01 -1.26 0.73 114.94 118.82 3g1f s ASN 153 Ca 0.01 -0.38 0.04 0.00 -0.71 0.00 0.00 52.86 51.82 3g1f s ASN 153 Cb 0.07 -0.92 -0.03 0.00 0.41 0.00 0.00 41.25 40.78 3g1f s ASN 153 CO 0.37 0.09 -0.11 -0.31 -1.51 0.00 0.00 177.10 175.64 3g1f s TYR 154 N 0.43 0.99 -0.12 2.20 1.51 0.13 -1.53 117.35 120.97 3g1f s TYR 154 Ca -0.13 -0.53 0.01 0.00 -1.01 0.00 0.00 57.07 55.42 3g1f s TYR 154 Cb -0.15 -0.56 -0.01 0.00 -0.11 0.00 0.00 41.96 41.12 3g1f s TYR 154 CO 0.05 -0.01 -0.17 0.08 -1.11 0.00 0.00 175.55 174.39 3g1f s VAL 155 N -1.62 2.70 0.22 0.71 1.01 0.25 -0.70 120.40 122.97 3g1f s VAL 155 Ca -0.03 -0.79 0.06 0.00 0.00 0.00 0.00 61.98 61.22 3g1f s VAL 155 Cb -0.08 -2.10 -0.05 0.00 0.00 0.00 0.00 36.38 34.14 3g1f s VAL 155 CO 0.01 0.54 -0.08 -0.83 0.00 0.00 0.00 175.10 174.74 3g1f s GLY 156 N 0.34 1.48 0.22 4.51 0.00 0.26 -2.54 107.32 111.58 3g1f s GLY 156 Ca -0.14 -1.71 -0.30 0.00 0.00 0.00 0.00 44.72 42.58 3g1f s GLY 156 CO 0.07 -1.72 1.19 2.56 0.00 0.00 0.00 173.10 175.19 3g1f s PRO 157 N -3.74 4.51 -0.20 2.90 0.04 -1.26 -2.85 135.00 134.41 3g1f s PRO 157 Ca 0.24 1.89 -0.19 0.00 0.04 0.00 0.00 61.00 62.98 3g1f s PRO 157 Cb 0.03 -3.22 -0.20 0.00 0.04 0.00 0.00 34.50 31.15 3g1f s PRO 157 CO 0.07 -0.03 0.20 0.45 0.04 0.00 0.00 177.00 177.73 3g1f n SER 158 N 2.09 1.91 -0.21 6.66 2.88 -0.97 -4.00 113.62 121.98 3g1f n SER 158 Ca 0.03 0.38 0.29 0.00 -1.33 0.00 0.00 58.87 58.24 3g1f n SER 158 Cb 0.44 -0.94 0.55 0.00 -0.75 0.00 0.00 64.21 63.52 3g1f n SER 158 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 3g1f h THR 159 N -0.84 0.09 -2.90 2.46 1.35 -1.83 -2.17 112.91 109.08 3g1f h THR 159 Ca -0.39 0.00 -0.63 0.00 -0.55 0.00 0.00 66.41 64.84 3g1f h THR 159 Cb 1.44 0.15 -0.41 0.00 -1.73 0.00 0.00 68.15 67.60 3g1f h THR 159 CO -0.18 0.00 -0.46 0.54 -0.25 0.00 0.00 175.52 175.17 3g1f n ARG 160 N -3.44 2.22 0.31 4.72 1.74 -1.26 -4.63 116.66 116.33 3g1f n ARG 160 Ca 0.22 -4.54 0.18 0.00 -0.77 0.00 0.00 57.85 52.94 3g1f n ARG 160 Cb 1.39 -2.31 0.97 0.00 -1.02 0.00 0.00 32.46 31.49 3g1f n ARG 160 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3g1f h PRO 161 N 5.18 0.00 0.11 5.56 0.13 -1.61 -2.57 132.00 138.80 3g1f h PRO 161 Ca 0.17 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.29 3g1f h PRO 161 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 3g1f h PRO 161 CO 0.79 0.00 -0.06 1.05 -0.23 0.00 0.00 178.00 179.55 3g1f h GLU 162 N 0.00 -0.15 -0.72 0.86 9.09 -1.91 -3.18 114.58 118.57 3g1f h GLU 162 Ca 0.00 0.01 0.11 0.00 0.05 0.00 0.00 59.36 59.53 3g1f h GLU 162 Cb 0.26 0.03 -0.05 0.00 -1.65 0.00 0.00 28.75 27.35 3g1f h GLU 162 CO 0.00 0.30 0.47 0.00 0.05 0.00 0.00 179.01 179.84 3g1f h ARG 163 N -0.92 0.53 -0.28 1.06 2.47 -1.84 -2.67 114.38 112.73 3g1f h ARG 163 Ca -0.02 -0.03 -0.00 0.00 -1.26 0.00 0.00 59.98 58.67 3g1f h ARG 163 Cb 0.52 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.71 3g1f h ARG 163 CO 0.03 0.35 0.17 1.25 0.56 0.00 0.00 179.97 182.32 3g1f h LEU 164 N 0.55 0.35 -1.52 3.04 5.85 -1.54 -1.82 115.31 120.21 3g1f h LEU 164 Ca 0.34 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.95 3g1f h LEU 164 Cb 0.57 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 3g1f h LEU 164 CO -0.12 0.31 -0.18 -1.28 -0.34 0.00 0.00 178.44 176.84 3g1f h SER 165 N 0.35 0.00 0.73 1.25 0.87 -1.45 -1.48 113.55 113.81 3g1f h SER 165 Ca 0.10 0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 60.47 3g1f h SER 165 Cb 0.03 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 3g1f h SER 165 CO -0.02 0.18 -0.86 -0.09 -0.53 0.00 0.00 176.83 175.51 3g1f h ARG 166 N 0.00 0.09 -0.65 2.24 9.65 -1.47 -3.17 114.38 121.06 3g1f h ARG 166 Ca -0.00 -0.10 -0.02 0.00 -1.10 0.00 0.00 59.98 58.76 3g1f h ARG 166 Cb 0.55 0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 29.13 3g1f h ARG 166 CO 0.02 0.89 0.34 1.25 2.80 0.00 0.00 179.97 185.28 3g1f h LEU 167 N 0.05 0.83 -1.34 3.80 7.12 -0.40 -2.29 115.31 123.07 3g1f h LEU 167 Ca -0.03 -0.11 -0.05 0.00 0.13 0.00 0.00 57.88 57.82 3g1f h LEU 167 Cb 1.50 -0.21 -0.01 0.00 -0.53 0.00 0.00 40.66 41.41 3g1f h LEU 167 CO 0.12 0.70 -0.11 -0.09 -0.13 0.00 0.00 178.44 178.93 3g1f h ARG 168 N 0.89 0.31 -0.84 1.25 9.65 -1.47 -2.12 114.38 122.06 3g1f h ARG 168 Ca 0.23 -0.07 -0.03 0.00 -1.10 0.00 0.00 59.98 59.01 3g1f h ARG 168 Cb 0.07 -0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 28.57 3g1f h ARG 168 CO -0.03 0.43 0.42 0.93 2.80 0.00 0.00 179.97 184.52 3g1f h GLU 169 N 0.30 1.19 -0.01 0.20 5.08 -1.41 -2.09 114.58 117.83 3g1f h GLU 169 Ca 0.06 -0.16 -0.21 0.00 -1.00 0.00 0.00 59.36 58.04 3g1f h GLU 169 Cb 0.38 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 3g1f h GLU 169 CO 0.02 0.90 -0.89 0.82 -1.00 0.00 0.00 179.01 178.86 3g1f h ILE 170 N 1.18 1.41 0.00 3.13 2.04 -1.27 -3.32 117.51 120.68 3g1f h ILE 170 Ca 0.29 -2.42 0.00 0.00 1.00 0.00 0.00 64.86 63.73 3g1f h ILE 170 Cb 0.09 2.37 0.00 0.00 -0.74 0.00 0.00 36.82 38.53 3g1f h ILE 170 CO -0.04 0.72 -0.61 0.16 0.00 0.00 0.00 178.15 178.38 3g1f h ILE 171 N 0.22 0.00 0.00 -0.67 3.07 -1.32 -3.47 117.51 115.33 3g1f h ILE 171 Ca -0.06 -0.58 0.00 0.00 1.55 0.00 0.00 64.86 65.76 3g1f h ILE 171 Cb 1.51 1.20 0.00 0.00 -0.27 0.00 0.00 36.82 39.26 3g1f h ILE 171 CO 0.15 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.86 3g1f n GLY 172 N 1.30 -3.26 0.08 0.16 0.00 -0.79 -4.12 105.19 98.56 3g1f n GLY 172 Ca 0.03 -1.91 -0.09 0.00 0.00 0.00 0.00 46.02 44.05 3g1f n GLY 172 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3g1f h GLN 173 N 0.00 0.02 0.00 1.61 1.08 -1.94 -3.36 115.11 112.52 3g1f h GLN 173 Ca 0.00 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 57.14 3g1f h GLN 173 Cb 0.00 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.44 3g1f h GLN 173 CO 0.00 0.66 -0.15 -0.44 -0.95 0.00 0.00 178.83 177.96 3g1f h ASP 174 N 0.01 0.00 -4.15 1.46 3.32 -1.98 -3.46 116.42 111.62 3g1f h ASP 174 Ca -0.22 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.33 3g1f h ASP 174 Cb 1.96 0.00 0.09 0.00 0.22 0.00 0.00 39.33 41.59 3g1f h ASP 174 CO 0.10 0.15 0.40 -0.44 -1.72 0.00 0.00 179.24 177.72 3g1f s SER 175 N -6.15 5.41 -0.18 6.45 0.01 -1.26 -5.02 113.70 112.97 3g1f s SER 175 Ca 0.04 2.06 -0.09 0.00 1.31 0.00 0.00 55.95 59.27 3g1f s SER 175 Cb 0.07 -2.56 -0.05 0.00 0.21 0.00 0.00 66.02 63.70 3g1f s SER 175 CO 0.65 -1.42 0.11 0.12 0.41 0.00 0.00 173.24 173.11 3g1f s PHE 176 N -2.11 3.39 -0.03 2.43 5.36 0.22 -4.99 117.98 122.25 3g1f s PHE 176 Ca 0.69 0.29 0.02 0.00 -0.96 0.00 0.00 56.93 56.97 3g1f s PHE 176 Cb -0.21 -2.09 0.01 0.00 -0.34 0.00 0.00 43.02 40.38 3g1f s PHE 176 CO 0.35 0.33 -0.06 -1.17 -1.46 0.00 0.00 175.22 173.21 3g1f s LEU 177 N 0.11 1.59 0.01 6.12 2.96 -1.26 0.19 118.68 128.41 3g1f s LEU 177 Ca 0.08 -0.14 0.05 0.00 -0.22 0.00 0.00 54.13 53.90 3g1f s LEU 177 Cb -0.11 -0.46 -0.02 0.00 0.50 0.00 0.00 46.19 46.10 3g1f s LEU 177 CO -0.00 0.01 -0.16 0.27 -1.32 0.00 0.00 176.35 175.14 3g1f s ILE 178 N 0.51 1.28 -0.27 6.68 -4.36 0.12 -0.66 121.20 124.50 3g1f s ILE 178 Ca -0.07 -0.86 0.01 0.00 -0.26 0.00 0.00 60.65 59.46 3g1f s ILE 178 Cb -0.11 -1.10 0.05 0.00 1.25 0.00 0.00 42.46 42.56 3g1f s ILE 178 CO 0.00 0.22 -0.07 -0.44 0.24 0.00 0.00 174.94 174.90 3g1f s SER 179 N -0.74 4.57 0.57 4.36 0.01 -0.97 -0.58 113.70 120.92 3g1f s SER 179 Ca 0.05 -1.29 -0.08 0.00 1.31 0.00 0.00 55.95 55.93 3g1f s SER 179 Cb -0.07 -1.62 -0.03 0.00 0.21 0.00 0.00 66.02 64.52 3g1f s SER 179 CO 0.00 -0.21 0.93 -2.16 0.41 0.00 0.00 173.24 172.22 3g1f s PRO 180 N 1.18 3.42 0.00 12.44 0.04 -1.13 -2.32 135.00 148.63 3g1f s PRO 180 Ca -0.07 0.43 0.00 0.00 0.04 0.00 0.00 61.00 61.40 3g1f s PRO 180 Cb -0.19 -2.21 0.00 0.00 0.04 0.00 0.00 34.50 32.14 3g1f s PRO 180 CO -0.04 -0.50 0.00 0.41 0.04 0.00 0.00 177.00 176.91 3g1f n GLY 181 N -2.58 0.73 3.67 0.56 0.00 -1.26 -2.29 105.19 104.01 3g1f n GLY 181 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3g1f n GLY 181 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1f s VAL 182 N -2.43 3.47 0.00 1.61 1.01 -1.26 -2.48 120.40 120.33 3g1f s VAL 182 Ca 0.00 0.64 0.00 0.00 0.00 0.00 0.00 61.98 62.62 3g1f s VAL 182 Cb 0.00 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.97 3g1f s VAL 182 CO 0.00 -0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.66 3g1f n GLY 183 N 4.12 0.60 0.47 4.51 0.00 0.39 -4.54 105.19 110.75 3g1f n GLY 183 Ca 0.17 -0.72 0.26 0.00 0.00 0.00 0.00 46.02 45.74 3g1f n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1f h ALA 184 N 0.00 2.63 -0.00 4.61 0.00 -1.92 0.41 119.26 124.98 3g1f h ALA 184 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3g1f h ALA 184 Cb 0.00 0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3g1f h ALA 184 CO 0.00 -1.24 0.00 1.04 0.00 0.00 0.00 179.25 179.05 3g1f n GLN 185 N -3.59 0.33 0.00 0.00 6.02 -1.03 -5.10 117.38 114.01 3g1f n GLN 185 Ca 0.17 -0.84 0.00 0.00 -0.01 0.00 0.00 57.00 56.32 3g1f n GLN 185 Cb 1.10 -1.01 0.00 0.00 1.02 0.00 0.00 30.24 31.35 3g1f n GLN 185 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3g1f n GLY 186 N -0.15 1.01 3.32 1.08 0.00 0.14 -4.74 105.19 105.86 3g1f n GLY 186 Ca 0.00 -1.42 -0.28 0.00 0.00 0.00 0.00 46.02 44.32 3g1f n GLY 186 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g1f n GLY 187 N 0.00 -0.44 2.92 -0.02 0.00 -1.26 0.15 105.19 106.55 3g1f n GLY 187 Ca 0.00 1.13 -0.44 0.00 0.00 0.00 0.00 46.02 46.71 3g1f n GLY 187 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3g1f n ASP 188 N -0.47 -0.67 0.00 1.61 2.03 -1.26 -4.14 116.55 113.65 3g1f n ASP 188 Ca -0.04 0.97 0.00 0.00 0.52 0.00 0.00 54.79 56.24 3g1f n ASP 188 Cb 0.61 -0.80 0.00 0.00 -0.72 0.00 0.00 41.12 40.21 3g1f n ASP 188 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 3g1f n PRO 189 N 1.01 0.00 -0.18 -0.67 -0.02 -1.26 -2.83 135.00 131.05 3g1f n PRO 189 Ca 0.16 0.00 0.26 0.00 -2.02 0.00 0.00 63.50 61.90 3g1f n PRO 189 Cb 0.16 -0.76 0.40 0.00 -0.02 0.00 0.00 33.50 33.28 3g1f n PRO 189 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g1f n GLY 190 N -0.22 -0.73 0.16 -1.23 0.00 -1.26 -1.64 105.19 100.27 3g1f n GLY 190 Ca 0.00 0.34 -0.05 0.00 0.00 0.00 0.00 46.02 46.30 3g1f n GLY 190 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3g1f h GLU 191 N 0.00 -0.33 -1.52 1.61 4.39 -1.94 -3.30 114.58 113.48 3g1f h GLU 191 Ca 0.46 0.02 0.46 0.00 0.34 0.00 0.00 59.36 60.64 3g1f h GLU 191 Cb 2.83 0.08 -0.09 0.00 -0.10 0.00 0.00 28.75 31.46 3g1f h GLU 191 CO -0.00 -0.22 1.05 1.15 -1.16 0.00 0.00 179.01 179.83 3g1f h THR 192 N -0.81 0.15 0.00 1.13 2.02 -1.15 0.55 112.91 114.80 3g1f h THR 192 Ca -0.04 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.13 3g1f h THR 192 Cb 0.26 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.77 3g1f h THR 192 CO 0.06 0.01 0.00 -0.11 0.37 0.00 0.00 175.52 175.85 3g1f n LEU 193 N -4.32 0.13 0.08 2.58 7.94 -1.22 -2.98 117.00 119.21 3g1f n LEU 193 Ca 0.37 -0.07 -0.22 0.00 -1.11 0.00 0.00 56.01 54.99 3g1f n LEU 193 Cb 1.58 -0.07 -0.14 0.00 0.53 0.00 0.00 43.42 45.33 3g1f n LEU 193 CO 0.33 0.03 -0.04 0.03 -1.11 0.00 0.00 177.39 176.64 3g1f h ARG 194 N 0.22 0.45 0.00 1.96 3.08 -1.10 -3.42 114.38 115.56 3g1f h ARG 194 Ca 0.00 -0.69 -0.11 0.00 0.07 0.00 0.00 59.98 59.25 3g1f h ARG 194 Cb 0.07 0.25 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 3g1f h ARG 194 CO 0.00 1.32 -1.39 1.19 -1.07 0.00 0.00 179.97 180.02 3g1f n PHE 195 N -3.95 0.00 -2.08 3.04 3.01 -1.17 -5.02 117.46 111.28 3g1f n PHE 195 Ca -0.14 0.00 -0.34 0.00 1.01 0.00 0.00 57.45 57.97 3g1f n PHE 195 Cb 0.92 -0.25 0.02 0.00 -0.01 0.00 0.00 39.48 40.16 3g1f n PHE 195 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3g1f s ALA 196 N -2.13 2.61 -0.33 4.37 0.00 -1.16 -4.94 121.76 120.18 3g1f s ALA 196 Ca -0.09 0.76 0.20 0.00 0.00 0.00 0.00 51.96 52.82 3g1f s ALA 196 Cb 0.03 -3.35 0.22 0.00 0.00 0.00 0.00 23.12 20.02 3g1f s ALA 196 CO 0.14 -0.96 1.51 -0.44 0.00 0.00 0.00 175.76 176.01 3g1f h ASP 197 N 0.81 0.00 -4.81 0.00 5.19 -1.22 -3.41 116.42 112.99 3g1f h ASP 197 Ca -0.49 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 55.90 3g1f h ASP 197 Cb 1.26 0.00 -0.19 0.00 0.18 0.00 0.00 39.33 40.58 3g1f h ASP 197 CO 0.56 0.18 0.28 0.00 -3.12 0.00 0.00 179.24 177.14 3g1f s ALA 198 N -3.13 -1.78 0.12 3.45 0.00 -1.15 -4.71 121.76 114.56 3g1f s ALA 198 Ca 0.05 1.24 0.04 0.00 0.00 0.00 0.00 51.96 53.30 3g1f s ALA 198 Cb 0.06 0.00 -0.04 0.00 0.00 0.00 0.00 23.12 23.15 3g1f s ALA 198 CO 0.70 -0.43 0.10 0.96 0.00 0.00 0.00 175.76 177.10 3g1f s ILE 199 N -1.63 4.49 0.13 0.00 -4.36 -1.04 -2.30 121.20 116.49 3g1f s ILE 199 Ca -0.07 -0.93 0.04 0.00 -0.26 0.00 0.00 60.65 59.43 3g1f s ILE 199 Cb -0.00 -3.23 -0.04 0.00 1.25 0.00 0.00 42.46 40.44 3g1f s ILE 199 CO 0.04 0.01 0.14 -0.63 0.24 0.00 0.00 174.94 174.74 3g1f s ILE 200 N -1.57 4.66 -0.16 8.37 1.01 -0.98 -1.10 121.20 131.43 3g1f s ILE 200 Ca 0.30 -0.90 -0.06 0.00 0.00 0.00 0.00 60.65 59.99 3g1f s ILE 200 Cb -0.11 -3.34 0.08 0.00 0.01 0.00 0.00 42.46 39.10 3g1f s ILE 200 CO 0.23 -0.02 0.33 -0.69 0.00 0.00 0.00 174.94 174.78 3g1f s VAL 201 N -1.63 -0.51 0.00 2.92 1.01 -0.51 -4.10 120.40 117.58 3g1f s VAL 201 Ca 0.31 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.52 3g1f s VAL 201 Cb -0.11 -0.54 0.00 0.00 0.00 0.00 0.00 36.38 35.73 3g1f s VAL 201 CO 0.24 0.10 0.00 0.61 0.00 0.00 0.00 175.10 176.05 3g1f n GLY 202 N 5.37 0.57 0.59 4.51 0.00 -1.26 -0.04 105.19 114.93 3g1f n GLY 202 Ca -0.07 0.00 0.39 0.00 0.00 0.00 0.00 46.02 46.34 3g1f n GLY 202 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g1f n ARG 203 N 0.00 0.01 0.02 1.61 1.74 -1.26 0.44 116.66 119.22 3g1f n ARG 203 Ca 0.00 1.01 0.07 0.00 -0.77 0.00 0.00 57.85 58.15 3g1f n ARG 203 Cb 0.00 -2.41 0.30 0.00 -1.02 0.00 0.00 32.46 29.33 3g1f n ARG 203 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3g1f n SER 204 N -3.49 0.11 0.00 0.55 7.64 -1.26 -3.08 113.62 114.09 3g1f n SER 204 Ca 0.32 0.53 0.00 0.00 1.01 0.00 0.00 58.87 60.73 3g1f n SER 204 Cb 1.70 -0.55 0.00 0.00 -1.01 0.00 0.00 64.21 64.35 3g1f n SER 204 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 3g1f n ILE 205 N -1.62 0.00 0.09 0.44 5.41 0.17 -4.65 119.36 119.19 3g1f n ILE 205 Ca 0.03 0.00 -0.18 0.00 1.00 0.00 0.00 62.75 63.60 3g1f n ILE 205 Cb 0.15 -0.28 -0.14 0.00 -0.71 0.00 0.00 39.64 38.66 3g1f n ILE 205 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 176.55 176.65 3g1f h TYR 206 N 0.00 0.54 -0.01 1.39 -0.00 -1.59 -3.22 116.97 114.08 3g1f h TYR 206 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 58.73 58.34 3g1f h TYR 206 Cb 0.29 -0.02 0.00 0.00 0.00 0.00 0.00 36.73 37.00 3g1f h TYR 206 CO 0.00 1.38 -0.03 1.28 -0.00 0.00 0.00 178.16 180.79 3g1f n LEU 207 N -3.51 0.73 -4.63 0.10 4.77 -1.18 -4.80 117.00 108.47 3g1f n LEU 207 Ca -0.14 -0.21 -0.43 0.00 -0.03 0.00 0.00 56.01 55.20 3g1f n LEU 207 Cb 1.05 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 42.07 3g1f n LEU 207 CO 0.53 0.12 1.08 0.00 -1.33 0.00 0.00 177.39 177.79 3g1f s ALA 208 N -2.11 3.40 0.04 -1.18 0.00 -1.22 -4.91 121.76 115.79 3g1f s ALA 208 Ca 0.40 0.05 -0.08 0.00 0.00 0.00 0.00 51.96 52.33 3g1f s ALA 208 Cb 0.21 -3.75 -0.01 0.00 0.00 0.00 0.00 23.12 19.57 3g1f s ALA 208 CO 0.38 -1.70 0.41 -0.25 0.00 0.00 0.00 175.76 174.59 3g1f n ASP 209 N 7.41 -0.27 -4.45 0.00 8.00 -1.26 -3.40 116.55 122.58 3g1f n ASP 209 Ca 0.14 0.47 -0.37 0.00 0.71 0.00 0.00 54.79 55.74 3g1f n ASP 209 Cb 0.47 -0.07 -0.12 0.00 -0.02 0.00 0.00 41.12 41.38 3g1f n ASP 209 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 3g1f s ASN 210 N -5.13 5.19 -0.01 -2.24 3.84 -1.26 -5.02 114.94 110.31 3g1f s ASN 210 Ca -0.03 -0.24 -0.03 0.00 0.21 0.00 0.00 52.86 52.77 3g1f s ASN 210 Cb 0.03 -1.93 -0.02 0.00 -0.55 0.00 0.00 41.25 38.78 3g1f s ASN 210 CO 0.17 -0.05 0.39 -0.65 -2.79 0.00 0.00 177.10 174.17 3g1f h PRO 211 N 8.25 -0.10 -0.43 0.43 0.11 -1.79 -2.43 132.00 136.03 3g1f h PRO 211 Ca -0.38 0.01 0.13 0.00 0.11 0.00 0.00 66.00 65.87 3g1f h PRO 211 Cb 1.17 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 3g1f h PRO 211 CO 0.58 -0.07 0.80 0.00 -0.21 0.00 0.00 178.00 179.10 3g1f h ALA 212 N -1.81 2.21 0.00 -0.75 0.00 -1.91 0.89 119.26 117.89 3g1f h ALA 212 Ca -0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3g1f h ALA 212 Cb 0.08 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 3g1f h ALA 212 CO 0.02 -1.02 -0.24 0.00 0.00 0.00 0.00 179.25 178.01 3g1f h ALA 213 N 0.81 0.02 0.00 0.00 0.00 -1.98 -2.82 119.26 115.28 3g1f h ALA 213 Ca 0.21 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3g1f h ALA 213 Cb 1.81 0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.80 3g1f h ALA 213 CO -0.00 0.20 0.33 0.00 0.00 0.00 0.00 179.25 179.78 3g1f h ALA 214 N -0.86 1.29 0.00 0.00 0.00 -0.39 1.00 119.26 120.30 3g1f h ALA 214 Ca -0.02 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 3g1f h ALA 214 Cb 0.34 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3g1f h ALA 214 CO -0.01 -0.29 -0.57 0.00 0.00 0.00 0.00 179.25 178.37 3g1f h ALA 215 N 1.26 0.05 0.00 0.00 0.00 -1.16 -3.13 119.26 116.28 3g1f h ALA 215 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.33 3g1f h ALA 215 Cb 0.66 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3g1f h ALA 215 CO 0.00 0.47 0.00 0.00 0.00 0.00 0.00 179.25 179.72 3g1f n ALA 216 N -3.47 1.49 0.13 0.00 0.00 -0.85 -2.46 120.51 115.34 3g1f n ALA 216 Ca -0.11 0.11 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 3g1f n ALA 216 Cb 0.31 -1.35 -0.03 0.00 0.00 0.00 0.00 19.45 18.38 3g1f n ALA 216 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3g1f h GLY 217 N 1.64 -0.39 1.66 0.00 0.00 0.89 0.77 103.07 107.64 3g1f h GLY 217 Ca 0.00 0.15 0.03 0.00 0.00 0.00 0.00 47.33 47.50 3g1f h GLY 217 CO 0.00 -0.14 0.14 -2.22 0.00 0.00 0.00 176.54 174.32 3g1f h ILE 218 N -0.84 0.32 0.19 2.60 2.04 -1.48 -0.64 117.51 119.70 3g1f h ILE 218 Ca -0.04 0.00 -0.35 0.00 1.00 0.00 0.00 64.86 65.47 3g1f h ILE 218 Cb 0.29 0.88 0.01 0.00 -0.74 0.00 0.00 36.82 37.26 3g1f h ILE 218 CO 0.06 0.00 -1.73 0.40 0.00 0.00 0.00 178.15 176.89 3g1f h ILE 219 N 0.00 0.96 -1.08 -0.67 2.04 -1.48 -3.32 117.51 113.96 3g1f h ILE 219 Ca 0.04 -2.52 0.31 0.00 1.00 0.00 0.00 64.86 63.70 3g1f h ILE 219 Cb 0.33 2.78 -0.04 0.00 -0.74 0.00 0.00 36.82 39.15 3g1f h ILE 219 CO -0.00 0.85 0.80 -0.08 0.00 0.00 0.00 178.15 179.72 3g1f h GLU 220 N 0.09 0.00 0.00 2.37 4.81 0.22 0.55 114.58 122.62 3g1f h GLU 220 Ca -0.34 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.89 3g1f h GLU 220 Cb 2.09 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.47 3g1f h GLU 220 CO 0.18 0.00 -0.74 -1.13 -0.73 0.00 0.00 179.01 176.59 3g1f n SER 221 N -4.14 0.74 -0.00 1.04 3.41 -1.16 -4.21 113.62 109.31 3g1f n SER 221 Ca 0.23 -0.61 0.04 0.00 -0.26 0.00 0.00 58.87 58.27 3g1f n SER 221 Cb 1.17 0.61 -0.05 0.00 -0.26 0.00 0.00 64.21 65.68 3g1f n SER 221 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3g1f n ILE 222 N -1.50 0.00 0.09 -1.33 5.41 0.15 -4.37 119.36 117.82 3g1f n ILE 222 Ca 0.05 -0.28 0.06 0.00 1.00 0.00 0.00 62.75 63.57 3g1f n ILE 222 Cb 0.33 0.90 0.32 0.00 -0.71 0.00 0.00 39.64 40.49 3g1f n ILE 222 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 3g1f n LYS 223 N -1.29 0.08 -0.15 0.38 5.02 0.93 -0.18 118.16 122.96 3g1f n LYS 223 Ca 0.01 0.57 0.08 0.00 -2.02 0.00 0.00 58.31 56.95 3g1f n LYS 223 Cb 0.15 -1.77 0.24 0.00 -0.02 0.00 0.00 35.03 33.63 3g1f n LYS 223 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3g1f n ASP 224 N -1.91 1.86 -0.16 4.39 9.92 -1.26 -5.13 116.55 124.26 3g1f n ASP 224 Ca -0.01 -1.89 0.02 0.00 -0.53 0.00 0.00 54.79 52.38 3g1f n ASP 224 Cb 0.04 -0.19 0.02 0.00 -0.64 0.00 0.00 41.12 40.34 3g1f n ASP 224 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51