#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g1f s VAL 11 N 0.00 4.95 0.14 5.18 1.01 -1.26 -5.01 120.40 125.41 3g1f s VAL 11 Ca 0.00 1.53 -0.29 0.00 0.00 0.00 0.00 61.98 63.22 3g1f s VAL 11 Cb 0.00 -4.09 -0.07 0.00 0.00 0.00 0.00 36.38 32.22 3g1f s VAL 11 CO 0.00 0.11 0.92 0.00 0.00 0.00 0.00 175.10 176.13 3g1f s MET 12 N 1.68 4.70 0.00 2.72 0.23 -1.26 -3.39 119.30 123.98 3g1f s MET 12 Ca 0.37 1.39 0.00 0.00 -1.03 0.00 0.00 55.69 56.43 3g1f s MET 12 Cb -0.17 -3.34 0.00 0.00 -1.53 0.00 0.00 34.83 29.79 3g1f s MET 12 CO 0.14 0.32 0.00 0.09 -2.03 0.00 0.00 175.02 173.54 3g1f n ASN 13 N 2.41 0.00 -1.83 -1.18 4.13 -1.26 -3.43 115.26 114.09 3g1f n ASN 13 Ca 0.00 0.00 -0.18 0.00 1.68 0.00 0.00 54.58 56.08 3g1f n ASN 13 Cb 0.49 -0.73 -0.03 0.00 -1.54 0.00 0.00 39.78 37.97 3g1f n ASN 13 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 3g1f n ARG 14 N -2.00 -1.39 -4.29 3.52 1.74 -1.22 -4.98 116.66 108.05 3g1f n ARG 14 Ca 0.00 0.98 -0.26 0.00 -0.77 0.00 0.00 57.85 57.80 3g1f n ARG 14 Cb 0.00 -5.40 -0.17 0.00 -1.02 0.00 0.00 32.46 25.87 3g1f n ARG 14 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3g1f s LEU 15 N -4.84 1.46 -0.17 0.55 0.20 -1.22 -1.10 118.68 113.57 3g1f s LEU 15 Ca 0.00 -0.31 -0.02 0.00 0.69 0.00 0.00 54.13 54.50 3g1f s LEU 15 Cb 0.00 -0.84 -0.01 0.00 -0.43 0.00 0.00 46.19 44.91 3g1f s LEU 15 CO 0.00 -0.03 -0.09 -0.63 -0.29 0.00 0.00 176.35 175.31 3g1f s ILE 16 N 1.11 3.23 0.25 6.68 1.01 -0.48 -4.65 121.20 128.34 3g1f s ILE 16 Ca -0.06 -0.58 -0.30 0.00 0.00 0.00 0.00 60.65 59.72 3g1f s ILE 16 Cb -0.14 -2.40 -0.09 0.00 0.01 0.00 0.00 42.46 39.83 3g1f s ILE 16 CO -0.02 0.49 1.05 -0.22 0.00 0.00 0.00 174.94 176.24 3g1f s LEU 17 N 0.77 4.57 -0.86 2.97 2.96 -1.03 -0.29 118.68 127.77 3g1f s LEU 17 Ca -0.04 2.14 -0.04 0.00 -0.22 0.00 0.00 54.13 55.98 3g1f s LEU 17 Cb -0.15 -3.62 0.21 0.00 0.50 0.00 0.00 46.19 43.14 3g1f s LEU 17 CO 0.01 -0.06 0.74 0.00 -1.32 0.00 0.00 176.35 175.73 3g1f s ALA 18 N -1.02 4.15 -1.10 5.97 0.00 0.18 0.07 121.76 130.01 3g1f s ALA 18 Ca 0.44 -3.68 -0.24 0.00 0.00 0.00 0.00 51.96 48.48 3g1f s ALA 18 Cb -0.30 -2.92 -0.14 0.00 0.00 0.00 0.00 23.12 19.76 3g1f s ALA 18 CO 0.37 -2.16 1.97 -0.12 0.00 0.00 0.00 175.76 175.83 3g1f n MET 19 N 2.73 1.16 -0.15 0.00 1.56 -1.11 -4.60 117.12 116.72 3g1f n MET 19 Ca 0.18 -2.20 0.11 0.00 -0.27 0.00 0.00 57.70 55.52 3g1f n MET 19 Cb 0.38 -3.70 0.28 0.00 2.15 0.00 0.00 33.22 32.33 3g1f n MET 19 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 3g1f n ASP 20 N 15.29 2.63 -4.56 6.12 8.00 -1.26 -4.32 116.55 138.45 3g1f n ASP 20 Ca 0.44 -1.88 -0.29 0.00 0.71 0.00 0.00 54.79 53.77 3g1f n ASP 20 Cb 0.46 -0.20 0.22 0.00 -0.02 0.00 0.00 41.12 41.58 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 -1.46 1.61 -0.49 0.64 1.43 -1.26 -4.49 118.68 114.65 3g1f s LEU 21 Ca 0.35 1.78 0.07 0.00 -1.03 0.00 0.00 54.13 55.30 3g1f s LEU 21 Cb 0.20 -3.87 0.37 0.00 0.03 0.00 0.00 46.19 42.92 3g1f s LEU 21 CO 0.28 -3.78 0.97 0.23 0.23 0.00 0.00 176.35 174.28 3g1f n MET 22 N -4.66 2.85 0.00 1.70 2.81 -1.26 -3.83 117.12 114.73 3g1f n MET 22 Ca 0.06 -4.45 0.00 0.00 -1.81 0.00 0.00 57.70 51.50 3g1f n MET 22 Cb 0.53 -2.10 0.00 0.00 -0.71 0.00 0.00 33.22 30.94 3g1f n MET 22 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 3g1f n ASN 23 N -0.23 0.00 -0.12 7.83 0.23 -1.26 -4.87 115.26 116.83 3g1f n ASN 23 Ca 0.31 0.00 -0.03 0.00 -0.53 0.00 0.00 54.58 54.33 3g1f n ASN 23 Cb 0.53 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 38.21 3g1f n ASN 23 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3g1f n ARG 24 N -0.01 -0.13 -0.11 -3.83 1.74 -1.26 -1.77 116.66 111.29 3g1f n ARG 24 Ca 0.00 1.11 -0.04 0.00 -0.77 0.00 0.00 57.85 58.15 3g1f n ARG 24 Cb 0.00 -1.65 -0.03 0.00 -1.02 0.00 0.00 32.46 29.76 3g1f n ARG 24 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3g1f h ASP 25 N 0.00 -0.69 -0.16 0.55 3.45 -1.99 0.95 116.42 118.53 3g1f h ASP 25 Ca 0.05 0.10 0.04 0.00 0.43 0.00 0.00 57.03 57.64 3g1f h ASP 25 Cb 0.12 0.30 -0.04 0.00 -0.56 0.00 0.00 39.33 39.15 3g1f h ASP 25 CO -0.27 -0.10 -0.08 0.44 -1.57 0.00 0.00 179.24 177.67 3g1f h ASP 26 N -0.05 -0.26 0.15 6.45 5.19 -1.96 -1.58 116.42 124.36 3g1f h ASP 26 Ca 0.04 0.06 0.01 0.00 -0.62 0.00 0.00 57.03 56.53 3g1f h ASP 26 Cb 0.16 0.15 -0.04 0.00 0.18 0.00 0.00 39.33 39.77 3g1f h ASP 26 CO -0.27 -0.10 -0.47 0.00 -3.12 0.00 0.00 179.24 175.27 3g1f h ALA 27 N 1.08 -0.87 -0.19 3.45 0.00 -1.01 -2.49 119.26 119.23 3g1f h ALA 27 Ca 0.09 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.93 3g1f h ALA 27 Cb 0.19 0.78 -0.05 0.00 0.00 0.00 0.00 17.79 18.71 3g1f h ALA 27 CO -0.20 -1.06 -0.36 -0.07 0.00 0.00 0.00 179.25 177.56 3g1f h LEU 28 N -0.72 -1.19 -0.72 0.00 3.38 -0.55 -1.75 115.31 113.76 3g1f h LEU 28 Ca 0.01 0.15 0.14 0.00 0.09 0.00 0.00 57.88 58.26 3g1f h LEU 28 Cb 0.73 0.48 -0.14 0.00 0.09 0.00 0.00 40.66 41.82 3g1f h LEU 28 CO -0.25 -0.29 -0.23 -0.09 0.09 0.00 0.00 178.44 177.68 3g1f h ARG 29 N -0.32 -0.04 0.00 1.13 2.43 -1.17 0.73 114.38 117.14 3g1f h ARG 29 Ca 0.04 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.19 3g1f h ARG 29 Cb 0.42 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.97 3g1f h ARG 29 CO -0.35 -0.02 -0.11 0.28 -1.51 0.00 0.00 179.97 178.26 3g1f h VAL 30 N -0.04 0.61 -0.14 0.20 2.07 -1.15 -2.34 116.25 115.45 3g1f h VAL 30 Ca 0.33 -0.45 -0.09 0.00 0.82 0.00 0.00 66.70 67.31 3g1f h VAL 30 Cb 0.55 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.60 3g1f h VAL 30 CO -0.76 0.10 -0.25 0.74 0.02 0.00 0.00 177.57 177.43 3g1f h THR 31 N 0.00 1.36 0.11 2.57 2.02 0.13 -3.19 112.91 115.92 3g1f h THR 31 Ca -0.00 -1.50 -0.01 0.00 0.77 0.00 0.00 66.41 65.68 3g1f h THR 31 Cb 0.28 1.99 0.00 0.00 -1.74 0.00 0.00 68.15 68.68 3g1f h THR 31 CO 0.01 0.44 -0.05 1.23 0.37 0.00 0.00 175.52 177.52 3g1f h GLY 32 N 0.03 -0.16 1.35 2.16 0.00 -0.72 0.22 103.07 105.96 3g1f h GLY 32 Ca 0.01 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.40 3g1f h GLY 32 CO 0.06 -0.06 0.28 0.83 0.00 0.00 0.00 176.54 177.65 3g1f h GLU 33 N -0.16 0.00 -0.00 4.80 5.08 -1.51 0.54 114.58 123.33 3g1f h GLU 33 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3g1f h GLU 33 Cb 0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 3g1f h GLU 33 CO 0.03 0.00 -0.00 1.33 -1.00 0.00 0.00 179.01 179.36 3g1f n VAL 34 N -2.45 0.00 -0.31 3.13 0.24 -0.95 -4.15 118.33 113.84 3g1f n VAL 34 Ca -0.01 -0.50 0.24 0.00 -2.04 0.00 0.00 64.34 62.02 3g1f n VAL 34 Cb 0.31 1.00 0.54 0.00 -1.47 0.00 0.00 33.84 34.22 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 0.01 0.34 0.00 7.34 9.65 0.18 0.49 114.38 132.39 3g1f h ARG 35 Ca 0.00 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 3g1f h ARG 35 Cb 0.00 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 28.51 3g1f h ARG 35 CO 0.00 0.22 0.00 -0.85 2.80 0.00 0.00 179.97 182.14 3g1f n GLU 36 N -4.56 0.07 0.00 0.20 0.28 -1.26 -3.12 120.64 112.25 3g1f n GLU 36 Ca 0.24 0.22 0.00 0.00 -0.16 0.00 0.00 57.16 57.47 3g1f n GLU 36 Cb 0.89 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 32.26 3g1f n GLU 36 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 3g1f n TYR 37 N -1.43 0.00 -4.72 -1.84 0.53 0.16 -5.05 117.16 104.81 3g1f n TYR 37 Ca 0.05 0.00 -0.24 0.00 -1.02 0.00 0.00 57.90 56.69 3g1f n TYR 37 Cb 0.15 0.00 -0.15 0.00 -1.03 0.00 0.00 39.34 38.31 3g1f n TYR 37 CO 0.00 0.00 0.00 0.96 -1.02 0.00 0.00 176.86 176.80 3g1f s ILE 38 N -1.26 1.30 -0.16 -0.72 -4.36 -0.45 -4.67 121.20 110.88 3g1f s ILE 38 Ca 0.00 -0.76 0.05 0.00 -0.26 0.00 0.00 60.65 59.67 3g1f s ILE 38 Cb 0.00 -1.09 -0.06 0.00 1.25 0.00 0.00 42.46 42.56 3g1f s ILE 38 CO 0.00 0.31 0.17 -0.90 0.24 0.00 0.00 174.94 174.76 3g1f n ASP 39 N 2.54 1.28 -4.02 4.36 5.75 -1.26 -4.66 116.55 120.53 3g1f n ASP 39 Ca -0.15 -0.43 -0.27 0.00 -0.01 0.00 0.00 54.79 53.93 3g1f n ASP 39 Cb 0.54 1.06 -0.17 0.00 -1.03 0.00 0.00 41.12 41.53 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 -1.69 1.30 -0.07 2.12 2.01 -1.26 -0.44 115.64 117.60 3g1f s THR 40 Ca 0.01 -0.53 0.04 0.00 0.31 0.00 0.00 61.69 61.52 3g1f s THR 40 Cb 0.03 -1.20 -0.00 0.00 0.01 0.00 0.00 72.50 71.34 3g1f s THR 40 CO 0.19 0.40 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.62 3g1f s VAL 41 N 0.96 1.76 -0.49 3.82 1.01 -0.28 -2.47 120.40 124.71 3g1f s VAL 41 Ca -0.08 -0.87 -0.16 0.00 0.00 0.00 0.00 61.98 60.87 3g1f s VAL 41 Cb -0.15 -1.52 0.08 0.00 0.00 0.00 0.00 36.38 34.79 3g1f s VAL 41 CO -0.00 0.49 0.45 -0.75 0.00 0.00 0.00 175.10 175.29 3g1f s LYS 42 N 0.20 3.00 0.07 2.72 2.20 0.11 -2.27 119.74 125.78 3g1f s LYS 42 Ca -0.11 -1.36 -0.20 0.00 -0.36 0.00 0.00 55.97 53.94 3g1f s LYS 42 Cb -0.15 -4.16 -0.07 0.00 -1.51 0.00 0.00 37.83 31.94 3g1f s LYS 42 CO 0.05 -1.11 0.59 0.42 -0.36 0.00 0.00 175.35 174.94 3g1f s ILE 43 N 1.77 4.72 0.37 5.43 1.01 -0.88 -2.75 121.20 130.87 3g1f s ILE 43 Ca 0.05 1.26 0.01 0.00 0.00 0.00 0.00 60.65 61.97 3g1f s ILE 43 Cb -0.25 -3.92 0.01 0.00 0.01 0.00 0.00 42.46 38.32 3g1f s ILE 43 CO 0.07 0.54 0.10 0.61 0.00 0.00 0.00 174.94 176.26 3g1f n GLY 44 N 1.77 3.43 0.24 6.18 0.00 -1.26 -0.96 105.19 114.59 3g1f n GLY 44 Ca -0.10 -2.30 0.10 0.00 0.00 0.00 0.00 46.02 43.72 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 0.98 0.00 0.34 1.61 0.99 -1.97 -0.71 116.97 118.21 3g1f h TYR 45 Ca -0.28 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.44 3g1f h TYR 45 Cb 0.89 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 38.61 3g1f h TYR 45 CO 0.00 0.18 -0.23 -1.35 -0.00 0.00 0.00 178.16 176.76 3g1f h PRO 46 N 0.00 -0.54 0.06 4.88 0.11 -1.92 0.26 132.00 134.85 3g1f h PRO 46 Ca -0.00 0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.14 3g1f h PRO 46 Cb 0.47 0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.70 3g1f h PRO 46 CO 0.02 -0.36 -0.03 1.25 -0.21 0.00 0.00 178.00 178.68 3g1f h LEU 47 N -0.56 -0.07 -1.18 2.35 5.85 -1.62 -2.48 115.31 117.60 3g1f h LEU 47 Ca -0.03 -0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.39 3g1f h LEU 47 Cb 0.47 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 3g1f h LEU 47 CO 0.02 0.26 0.42 0.58 -0.34 0.00 0.00 178.44 179.38 3g1f h VAL 48 N -0.40 1.21 -0.08 1.05 2.07 -1.08 -0.82 116.25 118.19 3g1f h VAL 48 Ca -0.01 -0.47 -0.23 0.00 0.82 0.00 0.00 66.70 66.81 3g1f h VAL 48 Cb 0.35 0.20 0.01 0.00 -1.52 0.00 0.00 31.29 30.34 3g1f h VAL 48 CO 0.01 0.22 -0.85 -0.07 0.02 0.00 0.00 177.57 176.90 3g1f h LEU 49 N 0.99 0.78 0.07 2.57 3.38 -0.53 0.64 115.31 123.21 3g1f h LEU 49 Ca 0.26 -0.55 -0.00 0.00 0.09 0.00 0.00 57.88 57.67 3g1f h LEU 49 Cb -0.02 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.50 3g1f h LEU 49 CO -0.05 1.34 -0.03 0.28 0.09 0.00 0.00 178.44 180.07 3g1f h SER 50 N 0.41 -0.08 0.07 -0.43 0.02 -1.25 -3.38 113.55 108.91 3g1f h SER 50 Ca -0.07 -0.34 -0.31 0.00 -0.84 0.00 0.00 61.79 60.24 3g1f h SER 50 Cb 1.48 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 64.01 3g1f h SER 50 CO 0.16 0.30 -1.70 -0.62 -1.14 0.00 0.00 176.83 173.84 3g1f n GLU 51 N -4.96 0.67 0.00 3.45 -0.58 -0.33 -5.03 120.64 113.87 3g1f n GLU 51 Ca -0.08 0.40 0.00 0.00 -0.42 0.00 0.00 57.16 57.05 3g1f n GLU 51 Cb 0.22 -1.72 0.00 0.00 -0.57 0.00 0.00 31.44 29.36 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 1.74 3.52 0.26 0.62 0.00 0.22 -4.89 105.19 106.66 3g1f n GLY 52 Ca -0.32 -1.84 0.09 0.00 0.00 0.00 0.00 46.02 43.94 3g1f n GLY 52 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3g1f h MET 53 N 0.00 0.00 0.00 1.61 2.86 -1.94 -2.08 114.93 115.37 3g1f h MET 53 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3g1f h MET 53 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 3g1f h MET 53 CO 0.00 0.05 0.00 -0.25 1.06 0.00 0.00 176.91 177.77 3g1f n ASP 54 N -4.31 0.00 0.26 1.22 8.00 -1.26 -1.94 116.55 118.51 3g1f n ASP 54 Ca -0.03 0.01 0.11 0.00 0.71 0.00 0.00 54.79 55.59 3g1f n ASP 54 Cb 0.14 -0.19 0.69 0.00 -0.02 0.00 0.00 41.12 41.73 3g1f n ASP 54 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 3g1f h ILE 55 N 0.00 0.67 0.29 0.53 6.09 -1.72 -2.76 117.51 120.62 3g1f h ILE 55 Ca 0.00 -0.55 -0.01 0.00 -1.37 0.00 0.00 64.86 62.92 3g1f h ILE 55 Cb 0.06 1.34 0.00 0.00 0.47 0.00 0.00 36.82 38.69 3g1f h ILE 55 CO 0.00 0.13 -0.14 0.40 -3.07 0.00 0.00 178.15 175.47 3g1f h ILE 56 N 0.00 0.46 -0.78 2.19 2.04 -1.63 -2.32 117.51 117.47 3g1f h ILE 56 Ca -0.00 -0.83 0.18 0.00 1.00 0.00 0.00 64.86 65.20 3g1f h ILE 56 Cb 0.33 0.75 -0.14 0.00 -0.74 0.00 0.00 36.82 37.02 3g1f h ILE 56 CO 0.02 0.11 -0.05 0.00 0.00 0.00 0.00 178.15 178.23 3g1f h ALA 57 N -0.66 0.73 -0.62 1.87 0.00 -1.66 0.31 119.26 119.23 3g1f h ALA 57 Ca -0.04 0.27 0.01 0.00 0.00 0.00 0.00 54.91 55.14 3g1f h ALA 57 Cb 0.48 0.49 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 3g1f h ALA 57 CO 0.07 -0.43 0.41 1.49 0.00 0.00 0.00 179.25 180.78 3g1f h GLU 58 N 0.06 0.82 -0.19 0.00 4.81 -1.54 0.14 114.58 118.68 3g1f h GLU 58 Ca 0.42 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.56 3g1f h GLU 58 Cb 0.72 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 3g1f h GLU 58 CO -0.73 0.55 -0.02 0.74 -0.73 0.00 0.00 179.01 178.82 3g1f h PHE 59 N 0.84 0.29 0.16 0.92 -1.00 0.07 0.71 116.94 118.93 3g1f h PHE 59 Ca 0.23 -0.02 -0.01 0.00 2.81 0.00 0.00 57.97 60.98 3g1f h PHE 59 Cb -0.09 -0.09 0.00 0.00 3.61 0.00 0.00 35.95 39.38 3g1f h PHE 59 CO -0.03 0.32 -0.08 0.00 -1.61 0.00 0.00 178.31 176.91 3g1f h ARG 60 N 0.28 -0.21 0.27 1.51 3.08 0.39 -2.52 114.38 117.18 3g1f h ARG 60 Ca 0.06 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 3g1f h ARG 60 Cb 0.23 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.33 3g1f h ARG 60 CO 0.01 0.18 -0.13 0.87 -1.07 0.00 0.00 179.97 179.83 3g1f h LYS 61 N -0.65 -0.34 -0.04 0.04 1.79 -0.47 0.33 116.57 117.23 3g1f h LYS 61 Ca -0.02 0.02 0.01 0.00 -2.18 0.00 0.00 60.65 58.48 3g1f h LYS 61 Cb 0.48 0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 31.21 3g1f h LYS 61 CO 0.04 -0.23 0.03 -0.09 -1.08 0.00 0.00 179.45 178.11 3g1f h ARG 62 N -0.40 0.00 0.00 3.15 2.43 -1.03 -3.27 114.38 115.26 3g1f h ARG 62 Ca -0.04 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3g1f h ARG 62 Cb 0.27 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 3g1f h ARG 62 CO 0.06 0.00 -0.73 1.19 -1.51 0.00 0.00 179.97 178.98 3g1f n PHE 63 N -4.51 0.00 -1.51 2.20 3.01 -0.96 -5.02 117.46 110.67 3g1f n PHE 63 Ca -0.02 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.27 3g1f n PHE 63 Cb 0.13 -0.05 -0.07 0.00 -0.01 0.00 0.00 39.48 39.48 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 1.76 1.59 3.95 1.37 0.00 0.12 -5.00 105.19 108.98 3g1f n GLY 64 Ca -0.00 -0.23 -0.24 0.00 0.00 0.00 0.00 46.02 45.56 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 -4.68 4.42 -0.17 0.00 0.52 0.41 -4.63 118.95 114.82 3g1f s ARG 66 Ca 0.51 1.16 0.01 0.00 -0.52 0.00 0.00 55.73 56.89 3g1f s ARG 66 Cb -0.10 -2.66 0.02 0.00 0.52 0.00 0.00 34.95 32.74 3g1f s ARG 66 CO 0.40 0.22 -0.16 0.42 0.02 0.00 0.00 175.30 176.20 3g1f s ILE 67 N -1.75 1.77 -0.31 1.52 -1.09 -1.26 -1.13 121.20 118.96 3g1f s ILE 67 Ca 0.52 -0.79 -0.10 0.00 -2.23 0.00 0.00 60.65 58.05 3g1f s ILE 67 Cb -0.16 -1.65 -0.01 0.00 -1.58 0.00 0.00 42.46 39.06 3g1f s ILE 67 CO 0.21 0.47 0.15 -0.63 -1.23 0.00 0.00 174.94 173.91 3g1f s ILE 68 N 1.40 4.66 -0.54 2.92 1.01 -0.96 -1.01 121.20 128.67 3g1f s ILE 68 Ca 0.04 -0.37 -0.26 0.00 0.00 0.00 0.00 60.65 60.06 3g1f s ILE 68 Cb -0.13 -3.36 0.03 0.00 0.01 0.00 0.00 42.46 39.01 3g1f s ILE 68 CO -0.11 0.08 1.05 0.00 0.00 0.00 0.00 174.94 175.96 3g1f s ALA 69 N 1.63 3.11 -1.32 9.38 0.00 0.23 -2.08 121.76 132.70 3g1f s ALA 69 Ca 0.05 -0.96 -0.14 0.00 0.00 0.00 0.00 51.96 50.92 3g1f s ALA 69 Cb -0.17 -3.85 0.11 0.00 0.00 0.00 0.00 23.12 19.21 3g1f s ALA 69 CO 0.07 -2.44 1.86 -3.47 0.00 0.00 0.00 175.76 171.78 3g1f n ASP 70 N 7.83 4.72 -0.55 0.00 -0.08 -0.13 -1.30 116.55 127.03 3g1f n ASP 70 Ca 0.06 -2.96 0.12 0.00 -1.51 0.00 0.00 54.79 50.49 3g1f n ASP 70 Cb 0.48 -1.61 0.07 0.00 2.34 0.00 0.00 41.12 42.40 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 5.92 0.00 -4.24 -0.67 0.99 -1.25 -4.21 117.46 113.99 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 0.41 -0.01 -0.08 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 0.17 -1.41 -1.65 -1.08 5.02 -0.39 -4.73 118.16 114.07 3g1f n LYS 72 Ca 0.11 0.16 -0.55 0.00 -2.02 0.00 0.00 58.31 56.00 3g1f n LYS 72 Cb 0.48 -3.76 -0.07 0.00 -0.02 0.00 0.00 35.03 31.66 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 -4.56 0.15 -2.73 -0.18 0.31 -1.09 -4.39 118.33 105.85 3g1f n VAL 73 Ca -0.32 -0.03 -0.09 0.00 -0.01 0.00 0.00 64.34 63.89 3g1f n VAL 73 Cb 0.69 -0.99 0.06 0.00 -0.91 0.00 0.00 33.84 32.69 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 3.93 2.36 -3.75 3.52 0.00 -1.26 -1.61 120.51 123.71 3g1f n ALA 74 Ca 0.23 -2.49 0.00 0.00 0.00 0.00 0.00 53.44 51.18 3g1f n ALA 74 Cb 0.15 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.63 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 -0.17 1.94 -4.82 0.00 -0.08 -1.26 -5.00 116.55 107.15 3g1f n ASP 75 Ca 0.07 -0.77 -0.30 0.00 -1.51 0.00 0.00 54.79 52.27 3g1f n ASP 75 Cb 0.81 0.00 0.07 0.00 2.34 0.00 0.00 41.12 44.33 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 -0.58 3.63 0.18 5.18 -4.36 -1.26 -4.73 121.20 119.25 3g1f s ILE 76 Ca 0.00 0.53 -0.20 0.00 -0.26 0.00 0.00 60.65 60.72 3g1f s ILE 76 Cb 0.00 -3.30 0.12 0.00 1.25 0.00 0.00 42.46 40.53 3g1f s ILE 76 CO 0.00 -0.69 1.60 -0.65 0.24 0.00 0.00 174.94 175.44 3g1f h PRO 77 N -0.85 -0.16 -0.48 0.37 0.11 -1.86 -0.40 132.00 128.73 3g1f h PRO 77 Ca -0.45 0.01 0.09 0.00 0.11 0.00 0.00 66.00 65.76 3g1f h PRO 77 Cb 1.24 0.04 -0.08 0.00 0.11 0.00 0.00 31.00 32.30 3g1f h PRO 77 CO 0.58 -0.11 -0.00 0.93 -0.21 0.00 0.00 178.00 179.20 3g1f h GLU 78 N -0.16 0.11 -0.22 1.05 3.07 -1.94 -0.79 114.58 115.69 3g1f h GLU 78 Ca 0.22 -0.01 -0.19 0.00 -0.50 0.00 0.00 59.36 58.89 3g1f h GLU 78 Cb 0.52 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.40 3g1f h GLU 78 CO -0.60 0.07 -0.60 1.15 -1.40 0.00 0.00 179.01 177.63 3g1f h THR 79 N 0.11 1.29 -0.73 1.13 2.02 -1.83 -2.88 112.91 112.03 3g1f h THR 79 Ca 0.24 -1.82 0.03 0.00 0.77 0.00 0.00 66.41 65.63 3g1f h THR 79 Cb 0.36 1.76 -0.05 0.00 -1.74 0.00 0.00 68.15 68.49 3g1f h THR 79 CO -0.40 0.58 0.46 0.78 0.37 0.00 0.00 175.52 177.31 3g1f h ASN 80 N 0.56 0.76 -0.92 4.18 4.21 -0.63 -0.12 115.58 123.62 3g1f h ASN 80 Ca -0.00 -0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.49 3g1f h ASN 80 Cb 1.20 -0.17 -0.04 0.00 -1.12 0.00 0.00 38.32 38.19 3g1f h ASN 80 CO 0.13 0.52 0.52 -0.08 -1.29 0.00 0.00 177.43 177.23 3g1f h GLU 81 N 0.90 1.27 -0.48 0.81 4.81 -1.12 0.12 114.58 120.90 3g1f h GLU 81 Ca 0.29 -0.14 -0.13 0.00 -0.13 0.00 0.00 59.36 59.26 3g1f h GLU 81 Cb 0.02 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.13 3g1f h GLU 81 CO -0.11 0.92 -0.20 0.87 -0.73 0.00 0.00 179.01 179.76 3g1f h LYS 82 N 1.28 0.96 -0.32 1.92 1.57 -1.11 -0.93 116.57 119.95 3g1f h LYS 82 Ca 0.33 -0.40 -0.13 0.00 -1.87 0.00 0.00 60.65 58.58 3g1f h LYS 82 Cb -0.00 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.26 3g1f h LYS 82 CO -0.06 1.07 -0.32 0.82 -0.57 0.00 0.00 179.45 180.39 3g1f h ILE 83 N 0.84 1.29 -0.27 1.86 2.04 -0.66 -2.48 117.51 120.12 3g1f h ILE 83 Ca 0.11 -1.49 -0.01 0.00 1.00 0.00 0.00 64.86 64.47 3g1f h ILE 83 Cb 0.76 1.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.36 3g1f h ILE 83 CO 0.06 0.48 0.11 0.00 0.00 0.00 0.00 178.15 178.81 3g1f h ARG 85 N 0.29 0.13 -0.55 0.00 2.43 -1.15 -0.73 114.38 114.80 3g1f h ARG 85 Ca 0.09 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.17 3g1f h ARG 85 Cb 0.16 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 3g1f h ARG 85 CO -0.01 0.09 0.01 0.00 -1.51 0.00 0.00 179.97 178.55 3g1f h ALA 86 N 1.32 0.74 -0.10 2.80 0.00 -1.21 -0.24 119.26 122.58 3g1f h ALA 86 Ca 0.19 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 3g1f h ALA 86 Cb 0.25 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3g1f h ALA 86 CO -0.29 0.56 0.06 1.15 0.00 0.00 0.00 179.25 180.72 3g1f h THR 87 N 0.85 1.08 0.24 0.00 2.02 -0.32 -2.23 112.91 114.55 3g1f h THR 87 Ca 0.16 -0.22 -0.01 0.00 0.77 0.00 0.00 66.41 67.11 3g1f h THR 87 Cb 0.52 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.97 3g1f h THR 87 CO 0.03 0.07 -0.12 -0.26 0.37 0.00 0.00 175.52 175.61 3g1f h PHE 88 N 0.08 -0.30 -1.54 3.16 0.04 -1.10 -2.61 116.94 114.67 3g1f h PHE 88 Ca 0.04 -0.01 0.46 0.00 2.80 0.00 0.00 57.97 61.26 3g1f h PHE 88 Cb 0.06 0.10 -0.08 0.00 2.20 0.00 0.00 35.95 38.23 3g1f h PHE 88 CO -0.05 -0.02 1.08 -0.22 -0.60 0.00 0.00 178.31 178.50 3g1f h LYS 89 N -0.57 0.04 -0.14 1.51 3.64 -0.95 1.19 116.57 121.29 3g1f h LYS 89 Ca -0.03 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3g1f h LYS 89 Cb 0.42 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 3g1f h LYS 89 CO 0.05 0.03 0.00 0.00 -2.27 0.00 0.00 179.45 177.26 3g1f n ALA 90 N -2.76 2.49 -0.26 5.00 0.00 -0.85 -4.87 120.51 119.27 3g1f n ALA 90 Ca 0.36 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.59 3g1f n ALA 90 Cb 1.59 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 20.05 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 0.67 0.86 3.67 0.00 0.00 0.41 -4.04 105.19 106.76 3g1f n GLY 91 Ca 0.04 -0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 3g1f n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1f s ALA 92 N -2.00 3.59 0.41 4.61 0.00 -1.16 -4.78 121.76 122.42 3g1f s ALA 92 Ca 0.00 0.32 0.17 0.00 0.00 0.00 0.00 51.96 52.45 3g1f s ALA 92 Cb 0.00 -3.53 1.01 0.00 0.00 0.00 0.00 23.12 20.60 3g1f s ALA 92 CO 0.00 -0.91 1.95 -0.44 0.00 0.00 0.00 175.76 176.36 3g1f h ASP 93 N 7.47 0.00 -5.10 0.00 3.32 -1.43 -3.43 116.42 117.25 3g1f h ASP 93 Ca -0.25 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.81 3g1f h ASP 93 Cb 1.10 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.58 3g1f h ASP 93 CO 0.93 0.23 0.08 0.00 -1.72 0.00 0.00 179.24 178.77 3g1f s ALA 94 N -4.37 -0.83 -0.02 3.45 0.00 -1.06 -2.42 121.76 116.49 3g1f s ALA 94 Ca -0.03 -0.51 -0.02 0.00 0.00 0.00 0.00 51.96 51.39 3g1f s ALA 94 Cb 0.15 0.94 0.01 0.00 0.00 0.00 0.00 23.12 24.21 3g1f s ALA 94 CO 0.68 -0.95 0.06 -1.50 0.00 0.00 0.00 175.76 174.05 3g1f s ILE 95 N -3.95 -0.01 -0.16 0.00 2.07 -0.99 -0.60 121.20 117.56 3g1f s ILE 95 Ca 0.15 0.04 -0.17 0.00 -1.41 0.00 0.00 60.65 59.26 3g1f s ILE 95 Cb -0.04 -0.10 -0.04 0.00 0.13 0.00 0.00 42.46 42.41 3g1f s ILE 95 CO 0.07 0.01 0.43 -0.63 -1.91 0.00 0.00 174.94 172.92 3g1f s ILE 96 N 0.22 5.20 0.07 2.00 1.01 -0.42 -0.17 121.20 129.11 3g1f s ILE 96 Ca -0.02 0.83 0.09 0.00 0.00 0.00 0.00 60.65 61.56 3g1f s ILE 96 Cb -0.02 -3.77 -0.03 0.00 0.01 0.00 0.00 42.46 38.64 3g1f s ILE 96 CO -0.01 0.30 -0.25 -0.69 0.00 0.00 0.00 174.94 174.29 3g1f s VAL 97 N 0.90 2.31 0.44 2.92 1.01 0.62 -1.27 120.40 127.33 3g1f s VAL 97 Ca 0.23 -1.46 -0.17 0.00 0.00 0.00 0.00 61.98 60.58 3g1f s VAL 97 Cb -0.15 -1.95 -0.09 0.00 0.00 0.00 0.00 36.38 34.19 3g1f s VAL 97 CO 0.09 0.28 0.90 -1.00 0.00 0.00 0.00 175.10 175.36 3g1f s HIS 98 N -0.91 3.40 -0.24 5.22 3.76 -0.63 0.06 115.29 125.95 3g1f s HIS 98 Ca 0.13 1.40 -0.07 0.00 -0.15 0.00 0.00 55.06 56.38 3g1f s HIS 98 Cb -0.10 -2.71 -0.13 0.00 1.11 0.00 0.00 32.58 30.75 3g1f s HIS 98 CO 0.04 -0.18 -0.27 0.41 -0.85 0.00 0.00 174.74 173.88 3g1f n GLY 99 N -1.08 -0.37 0.30 -2.22 0.00 -1.24 -4.59 105.19 95.98 3g1f n GLY 99 Ca 0.06 -0.14 0.25 0.00 0.00 0.00 0.00 46.02 46.19 3g1f n GLY 99 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3g1f n PHE 100 N -3.73 0.44 0.36 1.61 7.35 -1.26 0.46 117.46 122.68 3g1f n PHE 100 Ca -0.46 0.44 0.08 0.00 -0.76 0.00 0.00 57.45 56.75 3g1f n PHE 100 Cb 0.89 -0.83 0.36 0.00 0.35 0.00 0.00 39.48 40.25 3g1f n PHE 100 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 3g1f n PRO 101 N -3.92 0.08 0.00 -7.13 -0.02 -1.26 -4.98 135.00 117.77 3g1f n PRO 101 Ca 0.25 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 3g1f n PRO 101 Cb 0.98 -1.68 0.00 0.00 -0.02 0.00 0.00 33.50 32.78 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 -0.35 1.27 0.08 -1.23 0.00 0.17 -4.72 105.19 100.41 3g1f n GLY 102 Ca 0.02 -2.28 -0.10 0.00 0.00 0.00 0.00 46.02 43.66 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 0.34 -0.26 4.61 0.00 -1.94 -3.11 119.26 118.89 3g1f h ALA 103 Ca 0.00 -0.99 -0.13 0.00 0.00 0.00 0.00 54.91 53.79 3g1f h ALA 103 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3g1f h ALA 103 CO 0.00 1.22 -0.36 0.38 0.00 0.00 0.00 179.25 180.49 3g1f h ASP 104 N 0.02 0.62 -0.06 0.00 2.03 -1.98 0.47 116.42 117.53 3g1f h ASP 104 Ca -0.10 -0.26 -0.01 0.00 -0.73 0.00 0.00 57.03 55.94 3g1f h ASP 104 Cb 1.87 -0.17 -0.00 0.00 -0.83 0.00 0.00 39.33 40.20 3g1f h ASP 104 CO 0.14 0.92 -0.00 0.28 -1.03 0.00 0.00 179.24 179.56 3g1f h SER 105 N 0.49 0.10 0.07 4.15 0.02 -1.85 -1.11 113.55 115.44 3g1f h SER 105 Ca 0.05 -0.31 -0.00 0.00 -0.84 0.00 0.00 61.79 60.69 3g1f h SER 105 Cb 0.85 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.37 3g1f h SER 105 CO 0.07 0.39 -0.04 0.58 -1.14 0.00 0.00 176.83 176.69 3g1f h VAL 106 N -0.19 1.07 -0.78 2.27 2.07 -1.47 -3.03 116.25 116.19 3g1f h VAL 106 Ca 0.02 -0.51 0.15 0.00 0.82 0.00 0.00 66.70 67.18 3g1f h VAL 106 Cb 0.33 1.40 -0.15 0.00 -1.52 0.00 0.00 31.29 31.36 3g1f h VAL 106 CO 0.00 0.13 -0.24 -0.09 0.02 0.00 0.00 177.57 177.39 3g1f h ARG 107 N -0.33 -0.02 -0.84 1.57 9.65 -0.02 0.20 114.38 124.58 3g1f h ARG 107 Ca -0.01 0.00 0.18 0.00 -1.10 0.00 0.00 59.98 59.05 3g1f h ARG 107 Cb 0.28 0.01 -0.11 0.00 -1.39 0.00 0.00 29.97 28.76 3g1f h ARG 107 CO 0.02 -0.02 0.37 0.00 2.80 0.00 0.00 179.97 183.14 3g1f h ALA 108 N 1.64 1.26 -0.00 2.80 0.00 -1.08 -1.86 119.26 122.03 3g1f h ALA 108 Ca 0.36 0.13 -0.11 0.00 0.00 0.00 0.00 54.91 55.29 3g1f h ALA 108 Cb 0.58 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 3g1f h ALA 108 CO -0.81 -0.24 -0.52 0.00 0.00 0.00 0.00 179.25 177.68 3g1f h LEU 110 N 0.01 0.96 0.01 0.00 3.38 -0.98 -1.64 115.31 117.05 3g1f h LEU 110 Ca -0.00 -0.52 0.03 0.00 0.09 0.00 0.00 57.88 57.48 3g1f h LEU 110 Cb 0.92 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 41.33 3g1f h LEU 110 CO 0.07 1.31 -0.44 0.78 0.09 0.00 0.00 178.44 180.25 3g1f h ASN 111 N 0.66 -1.34 -0.69 -0.43 2.35 -1.27 0.95 115.58 115.81 3g1f h ASN 111 Ca 0.01 0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.92 3g1f h ASN 111 Cb 1.15 0.52 -0.03 0.00 0.05 0.00 0.00 38.32 40.01 3g1f h ASN 111 CO 0.12 -0.47 0.41 0.58 -1.65 0.00 0.00 177.43 176.42 3g1f h VAL 112 N -0.60 1.20 0.23 2.81 2.07 -1.57 0.84 116.25 121.23 3g1f h VAL 112 Ca 0.04 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.09 3g1f h VAL 112 Cb 0.67 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 3g1f h VAL 112 CO -0.32 0.21 -0.11 0.00 0.02 0.00 0.00 177.57 177.37 3g1f h ALA 113 N 1.49 -0.31 0.00 1.67 0.00 -0.14 -0.99 119.26 120.98 3g1f h ALA 113 Ca 0.25 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3g1f h ALA 113 Cb -0.02 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 3g1f h ALA 113 CO -0.05 -0.60 -0.05 1.49 0.00 0.00 0.00 179.25 180.05 3g1f h GLU 114 N -0.47 0.00 0.00 0.00 4.81 0.12 -0.58 114.58 118.46 3g1f h GLU 114 Ca -0.03 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.03 3g1f h GLU 114 Cb 0.35 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 3g1f h GLU 114 CO 0.05 0.05 -0.90 1.49 -0.73 0.00 0.00 179.01 178.96 3g1f h GLU 115 N 0.00 0.00 -0.24 1.92 4.81 -0.45 -3.34 114.58 117.28 3g1f h GLU 115 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3g1f h GLU 115 Cb 0.12 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.50 3g1f h GLU 115 CO 0.01 0.63 0.00 -1.33 -0.73 0.00 0.00 179.01 177.59 3g1f n MET 116 N -3.20 2.02 -3.35 1.92 2.81 -0.41 -4.99 117.12 111.92 3g1f n MET 116 Ca -0.02 -1.77 -0.16 0.00 -1.81 0.00 0.00 57.70 53.94 3g1f n MET 116 Cb 0.84 -1.27 0.08 0.00 -0.71 0.00 0.00 33.22 32.16 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 0.65 -0.75 3.20 3.03 0.00 -0.30 -5.03 105.19 105.99 3g1f n GLY 117 Ca 0.11 0.34 -0.09 0.00 0.00 0.00 0.00 46.02 46.37 3g1f n GLY 117 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g1f s ARG 118 N -4.90 0.92 0.23 1.61 1.81 -0.74 -5.06 118.95 112.82 3g1f s ARG 118 Ca 0.22 -1.25 0.06 0.00 -1.72 0.00 0.00 55.73 53.04 3g1f s ARG 118 Cb -0.03 0.29 -0.03 0.00 -0.45 0.00 0.00 34.95 34.73 3g1f s ARG 118 CO 0.74 -0.28 0.25 -1.21 -0.68 0.00 0.00 175.30 174.11 3g1f s GLU 119 N -3.97 3.12 -0.09 3.54 2.02 -1.02 -4.24 118.70 118.06 3g1f s GLU 119 Ca 0.16 -0.91 0.03 0.00 0.02 0.00 0.00 54.97 54.27 3g1f s GLU 119 Cb 0.06 -2.70 -0.01 0.00 0.10 0.00 0.00 34.13 31.58 3g1f s GLU 119 CO -0.03 0.43 -0.19 0.08 0.02 0.00 0.00 175.26 175.56 3g1f s VAL 120 N -2.02 2.52 -0.17 2.63 1.01 -1.26 -2.34 120.40 120.77 3g1f s VAL 120 Ca 0.33 -0.88 -0.03 0.00 0.00 0.00 0.00 61.98 61.40 3g1f s VAL 120 Cb -0.09 -1.98 -0.02 0.00 0.00 0.00 0.00 36.38 34.29 3g1f s VAL 120 CO 0.26 0.56 -0.06 -0.36 0.00 0.00 0.00 175.10 175.50 3g1f s PHE 121 N 0.01 2.95 -0.26 5.22 0.40 0.76 -4.25 117.98 122.82 3g1f s PHE 121 Ca -0.07 -0.58 -0.11 0.00 -0.60 0.00 0.00 56.93 55.57 3g1f s PHE 121 Cb -0.15 -1.99 -0.05 0.00 0.51 0.00 0.00 43.02 41.35 3g1f s PHE 121 CO 0.05 -0.25 0.18 -1.17 0.70 0.00 0.00 175.22 174.73 3g1f s LEU 122 N 0.75 4.06 -0.65 -0.37 2.96 -0.97 0.23 118.68 124.69 3g1f s LEU 122 Ca -0.02 0.05 -0.24 0.00 -0.22 0.00 0.00 54.13 53.70 3g1f s LEU 122 Cb -0.15 -2.12 0.06 0.00 0.50 0.00 0.00 46.19 44.48 3g1f s LEU 122 CO 0.02 0.00 1.01 -0.22 -1.32 0.00 0.00 176.35 175.84 3g1f s LEU 123 N 1.45 4.12 -0.11 -0.68 2.96 0.11 -0.69 118.68 125.84 3g1f s LEU 123 Ca 0.07 -0.75 -0.24 0.00 -0.22 0.00 0.00 54.13 52.99 3g1f s LEU 123 Cb -0.15 -2.54 -0.27 0.00 0.50 0.00 0.00 46.19 43.73 3g1f s LEU 123 CO 0.08 -1.46 0.71 0.71 -1.32 0.00 0.00 176.35 175.08 3g1f h THR 124 N 5.99 1.49 -3.84 3.68 1.35 -1.82 -3.28 112.91 116.48 3g1f h THR 124 Ca -0.28 -2.40 -0.29 0.00 -0.55 0.00 0.00 66.41 62.89 3g1f h THR 124 Cb 1.07 3.09 -0.28 0.00 -1.73 0.00 0.00 68.15 70.30 3g1f h THR 124 CO 1.18 0.62 -0.74 -0.70 -0.25 0.00 0.00 175.52 175.63 3g1f s GLU 125 N -2.34 0.27 0.29 4.72 2.12 -1.26 -4.46 118.70 118.03 3g1f s GLU 125 Ca -0.19 -0.12 -0.03 0.00 0.36 0.00 0.00 54.97 55.00 3g1f s GLU 125 Cb 0.00 -0.26 -0.04 0.00 0.26 0.00 0.00 34.13 34.09 3g1f s GLU 125 CO 0.74 0.07 0.52 -1.64 -0.54 0.00 0.00 175.26 174.41 3g1f s MET 126 N -0.08 3.57 0.00 4.30 -1.94 -1.26 -3.63 119.30 120.26 3g1f s MET 126 Ca 0.01 -0.15 0.26 0.00 -1.71 0.00 0.00 55.69 54.10 3g1f s MET 126 Cb -0.01 -2.68 0.76 0.00 2.01 0.00 0.00 34.83 34.90 3g1f s MET 126 CO -0.00 0.22 1.57 -1.13 -0.01 0.00 0.00 175.02 175.67 3g1f n SER 127 N -1.14 1.14 -4.94 3.03 3.41 -1.26 -4.77 113.62 109.09 3g1f n SER 127 Ca -0.03 -1.00 -0.24 0.00 -0.26 0.00 0.00 58.87 57.34 3g1f n SER 127 Cb 0.54 0.13 -0.01 0.00 -0.26 0.00 0.00 64.21 64.61 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 -2.44 3.50 0.13 7.33 -3.43 -1.26 -4.87 115.29 114.26 3g1f s HIS 128 Ca 0.26 0.37 -0.27 0.00 -0.80 0.00 0.00 55.06 54.62 3g1f s HIS 128 Cb 0.19 -1.91 -0.04 0.00 -1.43 0.00 0.00 32.58 29.39 3g1f s HIS 128 CO 0.50 0.12 1.59 -1.35 -2.00 0.00 0.00 174.74 173.60 3g1f h PRO 129 N 0.82 -0.43 0.00 -0.38 0.11 -2.02 -1.31 132.00 128.78 3g1f h PRO 129 Ca -0.50 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3g1f h PRO 129 Cb 1.22 0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.42 3g1f h PRO 129 CO 0.62 -0.29 0.54 0.78 -0.21 0.00 0.00 178.00 179.43 3g1f h GLY 130 N -0.45 0.00 1.12 -0.55 0.00 -1.98 0.12 103.07 101.33 3g1f h GLY 130 Ca 0.09 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.37 3g1f h GLY 130 CO -0.38 0.00 0.29 0.00 0.00 0.00 0.00 176.54 176.45 3g1f h ALA 131 N 0.75 1.10 -0.14 3.60 0.00 -1.55 -2.45 119.26 120.57 3g1f h ALA 131 Ca 0.00 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.76 3g1f h ALA 131 Cb 1.07 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 3g1f h ALA 131 CO 0.00 0.64 0.16 0.93 0.00 0.00 0.00 179.25 180.97 3g1f h GLU 132 N 1.08 0.00 0.52 0.00 5.08 -0.93 -0.82 114.58 119.52 3g1f h GLU 132 Ca 0.25 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.58 3g1f h GLU 132 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 3g1f h GLU 132 CO -0.02 0.00 -0.28 0.52 -1.00 0.00 0.00 179.01 178.23 3g1f h MET 133 N 0.00 -0.70 0.00 2.33 2.86 -1.61 -3.41 114.93 114.39 3g1f h MET 133 Ca 0.06 0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.71 3g1f h MET 133 Cb 0.38 0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 3g1f h MET 133 CO -0.00 -0.47 -1.15 1.19 1.06 0.00 0.00 176.91 177.54 3g1f n PHE 134 N -4.07 0.00 0.00 -0.22 3.01 -1.16 -4.71 117.46 110.31 3g1f n PHE 134 Ca -0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.37 3g1f n PHE 134 Cb 0.29 -0.10 0.00 0.00 -0.01 0.00 0.00 39.48 39.66 3g1f n PHE 134 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 3g1f n ILE 135 N -2.38 0.00 -0.38 4.37 2.08 -0.37 -3.03 119.36 119.66 3g1f n ILE 135 Ca -0.04 1.42 0.32 0.00 0.56 0.00 0.00 62.75 65.00 3g1f n ILE 135 Cb 0.56 -2.27 0.58 0.00 -0.75 0.00 0.00 39.64 37.76 3g1f n ILE 135 CO 0.00 0.00 0.00 -0.61 0.56 0.00 0.00 176.55 176.50 3g1f h GLN 136 N 0.00 0.13 0.00 0.38 4.15 -1.65 0.58 115.11 118.70 3g1f h GLN 136 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.41 3g1f h GLN 136 Cb 0.00 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.66 3g1f h GLN 136 CO 0.00 0.09 0.00 0.78 -1.93 0.00 0.00 178.83 177.77 3g1f h GLY 137 N 0.13 0.00 0.00 2.39 0.00 -1.77 -2.87 103.07 100.96 3g1f h GLY 137 Ca 0.80 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.13 3g1f h GLY 137 CO -0.56 0.00 0.00 0.00 0.00 0.00 0.00 176.54 175.98 3g1f n ALA 138 N -1.94 2.03 -0.05 3.60 0.00 0.19 -4.83 120.51 119.51 3g1f n ALA 138 Ca -0.01 -0.67 -0.09 0.00 0.00 0.00 0.00 53.44 52.67 3g1f n ALA 138 Cb 0.13 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.56 3g1f n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g1f h ALA 139 N 0.00 0.23 -0.82 0.00 0.00 -1.13 0.26 119.26 117.81 3g1f h ALA 139 Ca 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3g1f h ALA 139 Cb 0.30 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 3g1f h ALA 139 CO 0.00 -0.36 0.42 -0.44 0.00 0.00 0.00 179.25 178.88 3g1f h ASP 140 N 0.16 1.05 -0.16 0.00 5.19 -1.88 0.25 116.42 121.03 3g1f h ASP 140 Ca 0.09 -0.12 -0.10 0.00 -0.62 0.00 0.00 57.03 56.28 3g1f h ASP 140 Cb 0.07 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 39.29 3g1f h ASP 140 CO -0.10 0.87 -0.22 -0.08 -3.12 0.00 0.00 179.24 176.58 3g1f h GLU 141 N 1.15 0.61 -0.25 3.56 4.81 -1.85 -1.16 114.58 121.45 3g1f h GLU 141 Ca 0.28 -0.23 -0.06 0.00 -0.13 0.00 0.00 59.36 59.22 3g1f h GLU 141 Cb 0.08 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 3g1f h GLU 141 CO -0.04 0.79 -0.09 0.82 -0.73 0.00 0.00 179.01 179.75 3g1f h ILE 142 N 0.54 1.29 -0.48 2.32 2.04 -0.37 0.39 117.51 123.23 3g1f h ILE 142 Ca 0.08 -1.14 0.00 0.00 1.00 0.00 0.00 64.86 64.80 3g1f h ILE 142 Cb 0.68 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 38.25 3g1f h ILE 142 CO 0.05 0.36 0.32 0.00 0.00 0.00 0.00 178.15 178.87 3g1f h ALA 143 N 0.74 0.61 -0.77 1.87 0.00 -0.81 0.71 119.26 121.61 3g1f h ALA 143 Ca 0.06 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3g1f h ALA 143 Cb 0.58 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 3g1f h ALA 143 CO 0.03 0.07 0.48 0.00 0.00 0.00 0.00 179.25 179.83 3g1f h ARG 144 N 0.66 1.03 -0.20 0.00 3.08 -1.06 -0.94 114.38 116.95 3g1f h ARG 144 Ca 0.18 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.14 3g1f h ARG 144 Cb -0.07 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 29.75 3g1f h ARG 144 CO -0.04 0.71 0.09 1.98 -1.07 0.00 0.00 179.97 181.64 3g1f h MET 145 N 1.05 0.29 -0.92 0.04 4.05 0.11 -1.77 114.93 117.78 3g1f h MET 145 Ca 0.28 -0.05 0.04 0.00 -0.28 0.00 0.00 59.70 59.69 3g1f h MET 145 Cb -0.07 -0.05 -0.06 0.00 -0.80 0.00 0.00 31.60 30.62 3g1f h MET 145 CO -0.06 0.33 0.60 0.78 0.23 0.00 0.00 176.91 178.80 3g1f h GLY 146 N 0.17 1.36 1.02 1.39 0.00 -0.18 -0.99 103.07 105.83 3g1f h GLY 146 Ca 0.07 -0.45 -0.05 0.00 0.00 0.00 0.00 47.33 46.90 3g1f h GLY 146 CO -0.01 0.38 0.23 -2.08 0.00 0.00 0.00 176.54 175.06 3g1f h VAL 147 N 1.15 1.25 -0.60 4.60 2.07 -0.90 0.27 116.25 124.09 3g1f h VAL 147 Ca 0.37 -0.82 -0.08 0.00 0.82 0.00 0.00 66.70 66.99 3g1f h VAL 147 Cb 0.03 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 3g1f h VAL 147 CO -0.13 0.32 0.06 0.44 0.02 0.00 0.00 177.57 178.28 3g1f h ASP 148 N 0.95 0.99 0.19 0.57 3.32 -0.78 -2.10 116.42 119.56 3g1f h ASP 148 Ca 0.22 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 56.99 3g1f h ASP 148 Cb 0.26 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3g1f h ASP 148 CO -0.01 1.02 0.00 0.18 -1.72 0.00 0.00 179.24 178.71 3g1f n LEU 149 N -4.26 0.00 0.00 1.55 4.77 -0.43 -4.86 117.00 113.77 3g1f n LEU 149 Ca 0.03 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 3g1f n LEU 149 Cb 0.31 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 3g1f n LEU 149 CO 0.43 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 3g1f n GLY 150 N 0.34 0.66 3.76 -0.72 0.00 -0.79 -5.05 105.19 103.39 3g1f n GLY 150 Ca 0.12 -0.49 -0.41 0.00 0.00 0.00 0.00 46.02 45.24 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 2.92 -0.12 1.61 1.01 0.89 -4.94 120.40 119.77 3g1f s VAL 151 Ca 0.00 0.88 0.06 0.00 0.00 0.00 0.00 61.98 62.93 3g1f s VAL 151 Cb 0.00 -3.56 -0.09 0.00 0.00 0.00 0.00 36.38 32.73 3g1f s VAL 151 CO 0.00 0.19 0.19 0.29 0.00 0.00 0.00 175.10 175.77 3g1f n LYS 152 N 1.33 2.04 -5.21 2.72 5.02 -1.26 -4.62 118.16 118.18 3g1f n LYS 152 Ca 0.02 -0.04 -0.32 0.00 -2.02 0.00 0.00 58.31 55.95 3g1f n LYS 152 Cb 0.42 -1.02 -0.16 0.00 -0.02 0.00 0.00 35.03 34.26 3g1f n LYS 152 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3g1f s ASN 153 N -2.30 3.19 0.02 4.39 0.01 -1.26 -0.02 114.94 118.97 3g1f s ASN 153 Ca -0.01 -0.48 -0.01 0.00 -0.71 0.00 0.00 52.86 51.66 3g1f s ASN 153 Cb 0.04 -0.87 -0.02 0.00 0.41 0.00 0.00 41.25 40.81 3g1f s ASN 153 CO 0.27 0.25 -0.01 -0.31 -1.51 0.00 0.00 177.10 175.79 3g1f s TYR 154 N -0.19 0.28 -0.08 2.20 1.51 0.21 -2.30 117.35 118.98 3g1f s TYR 154 Ca -0.02 -0.59 0.02 0.00 -1.01 0.00 0.00 57.07 55.47 3g1f s TYR 154 Cb -0.14 -0.21 -0.02 0.00 -0.11 0.00 0.00 41.96 41.48 3g1f s TYR 154 CO 0.03 -0.24 -0.13 0.08 -1.11 0.00 0.00 175.55 174.18 3g1f s VAL 155 N -1.92 3.12 0.24 0.71 1.01 0.14 -0.75 120.40 122.94 3g1f s VAL 155 Ca -0.12 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.19 3g1f s VAL 155 Cb -0.06 -2.26 -0.05 0.00 0.00 0.00 0.00 36.38 34.01 3g1f s VAL 155 CO -0.02 0.57 0.11 -0.83 0.00 0.00 0.00 175.10 174.92 3g1f s GLY 156 N -0.32 1.66 -0.14 4.51 0.00 0.33 -2.66 107.32 110.70 3g1f s GLY 156 Ca 0.03 -1.82 -0.20 0.00 0.00 0.00 0.00 44.72 42.73 3g1f s GLY 156 CO 0.03 -1.54 0.57 2.56 0.00 0.00 0.00 173.10 174.72 3g1f s PRO 157 N -4.06 4.30 0.22 2.90 0.04 -1.24 -3.11 135.00 134.06 3g1f s PRO 157 Ca 0.38 0.58 0.26 0.00 0.04 0.00 0.00 61.00 62.25 3g1f s PRO 157 Cb 0.07 -3.50 0.71 0.00 0.04 0.00 0.00 34.50 31.83 3g1f s PRO 157 CO 0.13 -0.02 1.71 0.66 0.04 0.00 0.00 177.00 179.52 3g1f h SER 158 N 7.06 0.00 0.79 6.66 4.64 -1.65 -3.14 113.55 127.90 3g1f h SER 158 Ca -0.37 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 3g1f h SER 158 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3g1f h SER 158 CO 0.76 0.01 0.00 0.71 -0.87 0.00 0.00 176.83 177.44 3g1f h THR 159 N 0.00 0.00 -2.36 2.95 1.35 -1.80 -3.33 112.91 109.73 3g1f h THR 159 Ca 0.00 -0.34 -0.59 0.00 -0.55 0.00 0.00 66.41 64.93 3g1f h THR 159 Cb 0.77 1.19 -0.41 0.00 -1.73 0.00 0.00 68.15 67.97 3g1f h THR 159 CO 0.00 0.00 -0.76 0.54 -0.25 0.00 0.00 175.52 175.05 3g1f n ARG 160 N -2.68 1.66 -0.25 4.72 1.74 -1.19 -4.98 116.66 115.68 3g1f n ARG 160 Ca 0.01 -4.10 -0.04 0.00 -0.77 0.00 0.00 57.85 52.95 3g1f n ARG 160 Cb 0.25 -1.94 0.02 0.00 -1.02 0.00 0.00 32.46 29.77 3g1f n ARG 160 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3g1f h PRO 161 N 4.57 -0.11 -0.53 5.56 0.11 -1.78 0.98 132.00 140.80 3g1f h PRO 161 Ca 0.17 0.01 0.11 0.00 0.11 0.00 0.00 66.00 66.39 3g1f h PRO 161 Cb 0.76 0.02 -0.10 0.00 0.11 0.00 0.00 31.00 31.80 3g1f h PRO 161 CO 0.66 -0.07 -0.07 1.05 -0.21 0.00 0.00 178.00 179.36 3g1f h GLU 162 N -0.11 0.05 -0.54 1.05 9.09 -1.95 0.46 114.58 122.63 3g1f h GLU 162 Ca 0.27 -0.00 -0.05 0.00 0.05 0.00 0.00 59.36 59.63 3g1f h GLU 162 Cb 0.56 -0.01 -0.02 0.00 -1.65 0.00 0.00 28.75 27.63 3g1f h GLU 162 CO -0.76 0.03 0.16 0.00 0.05 0.00 0.00 179.01 178.49 3g1f h ARG 163 N 0.05 0.85 0.09 1.06 2.47 -1.22 0.66 114.38 118.33 3g1f h ARG 163 Ca 0.26 -0.19 0.02 0.00 -1.26 0.00 0.00 59.98 58.81 3g1f h ARG 163 Cb 0.41 -0.12 -0.03 0.00 -1.65 0.00 0.00 29.97 28.58 3g1f h ARG 163 CO -0.50 0.78 -0.20 1.25 0.56 0.00 0.00 179.97 181.85 3g1f h LEU 164 N 0.76 -0.57 -1.08 3.04 5.85 0.33 0.94 115.31 124.57 3g1f h LEU 164 Ca 0.17 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.89 3g1f h LEU 164 Cb 0.29 0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 3g1f h LEU 164 CO -0.00 -0.28 -0.13 0.77 -0.34 0.00 0.00 178.44 178.46 3g1f h SER 165 N -0.37 0.48 -0.87 1.25 4.64 -0.08 -1.28 113.55 117.32 3g1f h SER 165 Ca 0.03 -0.13 -0.01 0.00 -0.47 0.00 0.00 61.79 61.22 3g1f h SER 165 Cb 0.40 -0.13 -0.04 0.00 -0.31 0.00 0.00 62.40 62.32 3g1f h SER 165 CO -0.13 0.64 0.51 -0.09 -0.87 0.00 0.00 176.83 176.89 3g1f h ARG 166 N 0.46 1.20 -0.39 4.77 9.65 -0.28 -2.06 114.38 127.73 3g1f h ARG 166 Ca 0.09 -0.12 -0.04 0.00 -1.10 0.00 0.00 59.98 58.81 3g1f h ARG 166 Cb 0.50 -0.24 -0.02 0.00 -1.39 0.00 0.00 29.97 28.82 3g1f h ARG 166 CO 0.03 0.85 0.10 -0.07 2.80 0.00 0.00 179.97 183.68 3g1f h LEU 167 N 1.21 0.58 -0.38 3.80 3.38 0.16 -2.95 115.31 121.11 3g1f h LEU 167 Ca 0.31 -0.23 0.08 0.00 0.09 0.00 0.00 57.88 58.13 3g1f h LEU 167 Cb -0.02 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 40.50 3g1f h LEU 167 CO -0.06 0.66 -0.15 -0.09 0.09 0.00 0.00 178.44 178.89 3g1f h ARG 168 N 0.48 -0.08 -0.35 1.13 9.65 -0.58 -1.26 114.38 123.37 3g1f h ARG 168 Ca 0.12 0.01 0.06 0.00 -1.10 0.00 0.00 59.98 59.07 3g1f h ARG 168 Cb 0.31 0.02 -0.09 0.00 -1.39 0.00 0.00 29.97 28.82 3g1f h ARG 168 CO 0.00 -0.05 -0.42 0.93 2.80 0.00 0.00 179.97 183.23 3g1f h GLU 169 N -0.08 -0.34 -0.65 0.20 5.08 -1.28 0.55 114.58 118.05 3g1f h GLU 169 Ca 0.19 0.02 0.07 0.00 -1.00 0.00 0.00 59.36 58.65 3g1f h GLU 169 Cb 0.37 0.08 -0.06 0.00 0.50 0.00 0.00 28.75 29.64 3g1f h GLU 169 CO -0.44 -0.23 0.33 0.82 -1.00 0.00 0.00 179.01 178.50 3g1f h ILE 170 N -0.35 0.90 -0.00 3.13 2.04 -1.29 -2.47 117.51 119.46 3g1f h ILE 170 Ca 0.13 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.78 3g1f h ILE 170 Cb 0.59 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 3g1f h ILE 170 CO -0.54 0.11 -0.27 2.30 0.00 0.00 0.00 178.15 179.75 3g1f n ILE 171 N -4.85 0.00 -2.62 -0.67 -5.35 -0.54 -4.91 119.36 100.42 3g1f n ILE 171 Ca 0.09 -0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.54 3g1f n ILE 171 Cb 0.21 0.04 0.00 0.00 -1.74 0.00 0.00 39.64 38.15 3g1f n ILE 171 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3g1f n GLY 172 N 1.43 -2.17 0.14 3.28 0.00 0.19 -4.36 105.19 103.69 3g1f n GLY 172 Ca 0.09 -1.48 -0.21 0.00 0.00 0.00 0.00 46.02 44.41 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 0.30 0.00 1.61 1.08 -1.90 -3.38 115.11 112.82 3g1f h GLN 173 Ca 0.00 -0.51 0.00 0.00 -1.45 0.00 0.00 58.65 56.69 3g1f h GLN 173 Cb 0.00 0.19 0.00 0.00 -0.05 0.00 0.00 27.48 27.62 3g1f h GLN 173 CO 0.00 1.23 0.00 -0.40 -0.95 0.00 0.00 178.83 178.71 3g1f n ASP 174 N -3.50 0.00 -4.91 1.46 5.75 -1.26 -4.81 116.55 109.27 3g1f n ASP 174 Ca -0.29 -0.89 -0.27 0.00 -0.01 0.00 0.00 54.79 53.33 3g1f n ASP 174 Cb 1.06 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 41.13 3g1f n ASP 174 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 3g1f s SER 175 N -1.88 6.36 -0.21 -1.12 0.01 -1.26 -5.06 113.70 110.53 3g1f s SER 175 Ca 0.31 0.81 -0.11 0.00 1.31 0.00 0.00 55.95 58.27 3g1f s SER 175 Cb 0.14 -2.19 -0.05 0.00 0.21 0.00 0.00 66.02 64.13 3g1f s SER 175 CO 0.24 -0.40 0.17 0.12 0.41 0.00 0.00 173.24 173.78 3g1f s PHE 176 N -2.44 3.37 -0.11 2.43 5.36 0.96 -4.98 117.98 122.58 3g1f s PHE 176 Ca 0.46 0.32 0.00 0.00 -0.96 0.00 0.00 56.93 56.75 3g1f s PHE 176 Cb -0.10 -2.24 0.02 0.00 -0.34 0.00 0.00 43.02 40.36 3g1f s PHE 176 CO 0.37 0.18 -0.11 -1.17 -1.46 0.00 0.00 175.22 173.03 3g1f s LEU 177 N 0.71 1.44 0.12 6.12 2.96 -1.26 0.67 118.68 129.44 3g1f s LEU 177 Ca 0.09 -0.36 0.07 0.00 -0.22 0.00 0.00 54.13 53.71 3g1f s LEU 177 Cb -0.12 -0.95 -0.04 0.00 0.50 0.00 0.00 46.19 45.58 3g1f s LEU 177 CO 0.02 -0.06 -0.09 0.27 -1.32 0.00 0.00 176.35 175.17 3g1f s ILE 178 N 1.39 3.41 -0.07 6.68 -4.36 0.07 0.08 121.20 128.39 3g1f s ILE 178 Ca 0.00 -1.31 -0.02 0.00 -0.26 0.00 0.00 60.65 59.06 3g1f s ILE 178 Cb -0.13 -2.62 0.03 0.00 1.25 0.00 0.00 42.46 40.99 3g1f s ILE 178 CO -0.06 0.07 0.05 -0.55 0.24 0.00 0.00 174.94 174.68 3g1f s SER 179 N -2.35 1.49 0.33 4.36 0.15 -0.89 -0.51 113.70 116.29 3g1f s SER 179 Ca 0.22 -0.09 0.00 0.00 0.70 0.00 0.00 55.95 56.78 3g1f s SER 179 Cb -0.11 -0.26 0.00 0.00 -1.71 0.00 0.00 66.02 63.94 3g1f s SER 179 CO 0.15 -0.25 0.00 -0.81 1.20 0.00 0.00 173.24 173.53 3g1f n PRO 180 N 5.24 0.99 -0.77 5.44 -0.04 -1.18 -0.76 135.00 143.92 3g1f n PRO 180 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 3g1f n PRO 180 Cb 0.50 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.96 3g1f n PRO 180 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3g1f n GLY 181 N 5.00 0.69 3.76 0.55 0.00 -1.26 -1.87 105.19 112.06 3g1f n GLY 181 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.41 5.17 0.00 1.61 1.01 -1.26 0.32 120.40 124.85 3g1f s VAL 182 Ca 0.00 0.79 0.00 0.00 0.00 0.00 0.00 61.98 62.77 3g1f s VAL 182 Cb 0.00 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.65 3g1f s VAL 182 CO 0.00 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.14 3g1f n GLY 183 N 2.81 1.07 0.00 4.51 0.00 -0.87 -4.49 105.19 108.21 3g1f n GLY 183 Ca -0.11 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 44.97 3g1f n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1f n ALA 184 N 2.90 0.63 0.29 4.61 0.00 -1.26 -0.63 120.51 127.06 3g1f n ALA 184 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 3g1f n ALA 184 Cb 0.00 -0.60 -0.01 0.00 0.00 0.00 0.00 19.45 18.83 3g1f n ALA 184 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3g1f n GLN 185 N -1.26 3.12 0.00 0.00 6.02 -1.26 -5.02 117.38 118.98 3g1f n GLN 185 Ca 0.00 -0.34 0.00 0.00 -0.01 0.00 0.00 57.00 56.65 3g1f n GLN 185 Cb 0.18 -0.92 0.00 0.00 1.02 0.00 0.00 30.24 30.52 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 0.87 1.60 3.73 1.08 0.00 0.20 -4.94 105.19 107.73 3g1f n GLY 186 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 3g1f n GLY 186 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g1f s GLY 187 N -2.23 2.18 -0.17 -0.02 0.00 0.15 -4.76 107.32 102.47 3g1f s GLY 187 Ca 0.00 1.22 -0.22 0.00 0.00 0.00 0.00 44.72 45.72 3g1f s GLY 187 CO 0.00 2.28 0.68 -0.35 0.00 0.00 0.00 173.10 175.71 3g1f s ASP 188 N 0.62 6.79 0.00 1.64 2.15 -1.26 -2.04 116.67 124.57 3g1f s ASP 188 Ca 0.61 0.97 0.00 0.00 0.43 0.00 0.00 52.55 54.56 3g1f s ASP 188 Cb -0.39 -2.38 0.00 0.00 -0.30 0.00 0.00 42.92 39.85 3g1f s ASP 188 CO 0.37 -0.27 0.80 -2.65 -0.17 0.00 0.00 175.17 173.24 3g1f n PRO 189 N 4.87 0.00 -0.08 4.34 -0.02 -1.26 -2.12 135.00 140.74 3g1f n PRO 189 Ca -0.00 0.31 -0.12 0.00 -2.02 0.00 0.00 63.50 61.67 3g1f n PRO 189 Cb 0.50 -1.63 -0.07 0.00 -0.02 0.00 0.00 33.50 32.27 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 -1.30 -0.22 0.31 -1.23 0.00 -1.26 -4.02 105.19 97.47 3g1f n GLY 190 Ca 0.00 -0.10 0.21 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.08 0.00 0.00 1.61 4.39 -1.84 -3.14 114.58 115.52 3g1f h GLU 191 Ca -0.36 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.21 3g1f h GLU 191 Cb 1.51 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.14 3g1f h GLU 191 CO -0.08 0.00 -0.83 1.15 -1.16 0.00 0.00 179.01 178.09 3g1f h THR 192 N 0.00 0.85 0.00 1.13 2.02 -1.69 -3.36 112.91 111.87 3g1f h THR 192 Ca 0.00 -1.92 0.00 0.00 0.77 0.00 0.00 66.41 65.26 3g1f h THR 192 Cb 0.18 1.89 0.00 0.00 -1.74 0.00 0.00 68.15 68.48 3g1f h THR 192 CO 0.00 0.29 0.00 0.18 0.37 0.00 0.00 175.52 176.36 3g1f n LEU 193 N -4.52 0.00 0.01 2.58 4.77 -1.19 -0.45 117.00 118.21 3g1f n LEU 193 Ca -0.22 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.58 3g1f n LEU 193 Cb 0.53 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.51 3g1f n LEU 193 CO 0.19 0.00 0.23 0.03 -1.33 0.00 0.00 177.39 176.51 3g1f h ARG 194 N 0.00 0.47 0.00 3.23 3.08 -1.70 -3.38 114.38 116.08 3g1f h ARG 194 Ca 0.00 -0.49 -0.25 0.00 0.07 0.00 0.00 59.98 59.31 3g1f h ARG 194 Cb 0.00 0.14 -0.05 0.00 0.08 0.00 0.00 29.97 30.14 3g1f h ARG 194 CO 0.00 1.14 -1.98 1.19 -1.07 0.00 0.00 179.97 179.25 3g1f n PHE 195 N -4.16 0.00 -3.61 3.04 3.01 0.33 -5.01 117.46 111.07 3g1f n PHE 195 Ca -0.10 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.04 3g1f n PHE 195 Cb 0.70 -0.69 -0.05 0.00 -0.01 0.00 0.00 39.48 39.43 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 -2.39 3.74 0.00 4.37 0.00 0.41 -4.91 121.76 122.98 3g1f s ALA 196 Ca -0.07 -0.49 0.17 0.00 0.00 0.00 0.00 51.96 51.57 3g1f s ALA 196 Cb 0.05 -2.20 0.38 0.00 0.00 0.00 0.00 23.12 21.34 3g1f s ALA 196 CO 0.59 0.63 1.59 -0.44 0.00 0.00 0.00 175.76 178.13 3g1f h ASP 197 N 2.74 0.00 -2.40 0.00 3.32 -0.68 -3.39 116.42 116.00 3g1f h ASP 197 Ca -0.46 0.00 0.12 0.00 0.02 0.00 0.00 57.03 56.70 3g1f h ASP 197 Cb 1.17 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.45 3g1f h ASP 197 CO 0.72 0.44 0.36 0.00 -1.72 0.00 0.00 179.24 179.03 3g1f s ALA 198 N -3.27 -2.30 0.48 3.45 0.00 -1.17 -4.78 121.76 114.17 3g1f s ALA 198 Ca 0.02 2.20 -0.15 0.00 0.00 0.00 0.00 51.96 54.03 3g1f s ALA 198 Cb 0.09 -1.73 -0.08 0.00 0.00 0.00 0.00 23.12 21.40 3g1f s ALA 198 CO 0.71 -0.41 0.93 0.96 0.00 0.00 0.00 175.76 177.95 3g1f s ILE 199 N 1.46 4.59 -0.15 0.00 -4.36 -0.26 -2.10 121.20 120.39 3g1f s ILE 199 Ca -0.08 1.07 -0.00 0.00 -0.26 0.00 0.00 60.65 61.38 3g1f s ILE 199 Cb -0.04 -3.72 -0.01 0.00 1.25 0.00 0.00 42.46 39.95 3g1f s ILE 199 CO -0.15 -0.62 -0.13 -0.63 0.24 0.00 0.00 174.94 173.64 3g1f s ILE 200 N -2.53 2.92 -0.05 8.37 1.01 0.06 -1.39 121.20 129.58 3g1f s ILE 200 Ca 0.57 -0.69 0.04 0.00 0.00 0.00 0.00 60.65 60.57 3g1f s ILE 200 Cb -0.10 -2.24 0.00 0.00 0.01 0.00 0.00 42.46 40.13 3g1f s ILE 200 CO 0.30 0.51 -0.16 -0.69 0.00 0.00 0.00 174.94 174.90 3g1f s VAL 201 N 0.72 1.39 0.00 2.92 1.01 0.60 -4.12 120.40 122.92 3g1f s VAL 201 Ca -0.06 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.25 3g1f s VAL 201 Cb -0.15 -1.21 0.00 0.00 0.00 0.00 0.00 36.38 35.01 3g1f s VAL 201 CO 0.02 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.13 3g1f n GLY 202 N 3.37 0.70 0.32 4.51 0.00 -1.26 -0.64 105.19 112.18 3g1f n GLY 202 Ca -0.19 -0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.96 3g1f n GLY 202 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3g1f h ARG 203 N 0.00 0.07 0.00 1.61 3.08 -1.92 0.34 114.38 117.56 3g1f h ARG 203 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3g1f h ARG 203 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.03 3g1f h ARG 203 CO 0.00 0.05 0.00 0.43 -1.07 0.00 0.00 179.97 179.38 3g1f n SER 204 N -5.39 0.00 -0.02 7.04 7.64 -1.26 -1.78 113.62 119.85 3g1f n SER 204 Ca 0.22 0.48 -0.02 0.00 1.01 0.00 0.00 58.87 60.56 3g1f n SER 204 Cb 0.72 -0.48 -0.03 0.00 -1.01 0.00 0.00 64.21 63.41 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 -1.48 0.28 -0.86 0.44 -0.00 0.11 -4.32 119.36 113.53 3g1f n ILE 205 Ca 0.00 -0.17 0.08 0.00 -0.00 0.00 0.00 62.75 62.66 3g1f n ILE 205 Cb 0.01 -0.88 0.33 0.00 -0.00 0.00 0.00 39.64 39.10 3g1f n ILE 205 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3g1f n TYR 206 N -2.19 1.46 -0.38 1.39 0.18 -0.78 -3.98 117.16 112.85 3g1f n TYR 206 Ca -0.07 -0.76 0.00 0.00 1.88 0.00 0.00 57.90 58.95 3g1f n TYR 206 Cb 0.63 -0.37 0.00 0.00 -0.38 0.00 0.00 39.34 39.22 3g1f n TYR 206 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3g1f n LEU 207 N 0.24 0.16 -4.77 -3.48 4.77 -0.74 -5.00 117.00 108.19 3g1f n LEU 207 Ca 0.24 -0.22 -0.38 0.00 -0.03 0.00 0.00 56.01 55.62 3g1f n LEU 207 Cb 0.99 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 42.06 3g1f n LEU 207 CO 0.23 0.04 0.84 0.00 -1.33 0.00 0.00 177.39 177.17 3g1f s ALA 208 N -0.13 3.12 0.30 -1.18 0.00 -1.26 -4.91 121.76 117.70 3g1f s ALA 208 Ca 0.00 0.95 0.04 0.00 0.00 0.00 0.00 51.96 52.95 3g1f s ALA 208 Cb 0.00 -3.38 0.65 0.00 0.00 0.00 0.00 23.12 20.39 3g1f s ALA 208 CO 0.00 -0.55 1.82 -0.44 0.00 0.00 0.00 175.76 176.60 3g1f h ASP 209 N 2.52 0.85 -3.37 0.00 3.45 -1.94 -3.25 116.42 114.68 3g1f h ASP 209 Ca -0.49 0.06 -0.61 0.00 0.43 0.00 0.00 57.03 56.42 3g1f h ASP 209 Cb 1.24 -0.10 -0.40 0.00 -0.56 0.00 0.00 39.33 39.50 3g1f h ASP 209 CO 0.62 0.41 -0.74 0.21 -1.57 0.00 0.00 179.24 178.17 3g1f s ASN 210 N -5.62 3.57 0.12 6.45 2.47 -1.26 -5.03 114.94 115.64 3g1f s ASN 210 Ca -0.11 -2.77 -0.23 0.00 0.42 0.00 0.00 52.86 50.17 3g1f s ASN 210 Cb 0.23 -1.04 -0.05 0.00 -1.45 0.00 0.00 41.25 38.94 3g1f s ASN 210 CO 0.80 -0.24 1.20 -2.65 -3.72 0.00 0.00 177.10 172.50 3g1f n PRO 211 N 3.35 -0.33 -0.25 0.43 -0.02 -1.23 -0.36 135.00 136.58 3g1f n PRO 211 Ca 0.11 1.18 0.05 0.00 -2.02 0.00 0.00 63.50 62.83 3g1f n PRO 211 Cb 0.36 -1.74 0.16 0.00 -0.02 0.00 0.00 33.50 32.26 3g1f n PRO 211 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g1f h ALA 212 N 0.33 0.80 0.43 3.55 0.00 -1.86 -2.10 119.26 120.42 3g1f h ALA 212 Ca 0.12 0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 3g1f h ALA 212 Cb 0.31 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3g1f h ALA 212 CO -0.71 -0.42 -0.34 0.00 0.00 0.00 0.00 179.25 177.78 3g1f h ALA 213 N 1.69 -1.08 -1.07 0.00 0.00 -1.03 -0.99 119.26 116.78 3g1f h ALA 213 Ca 0.41 -0.15 0.39 0.00 0.00 0.00 0.00 54.91 55.56 3g1f h ALA 213 Cb 0.73 0.52 -0.16 0.00 0.00 0.00 0.00 17.79 18.88 3g1f h ALA 213 CO -0.64 -1.08 0.61 0.00 0.00 0.00 0.00 179.25 178.14 3g1f h ALA 214 N -1.28 2.21 0.09 0.00 0.00 -0.96 0.42 119.26 119.74 3g1f h ALA 214 Ca -0.06 0.21 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3g1f h ALA 214 Cb 0.62 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3g1f h ALA 214 CO 0.01 -0.90 -0.04 0.00 0.00 0.00 0.00 179.25 178.31 3g1f h ALA 215 N 1.87 -0.12 -0.69 0.00 0.00 -1.09 -2.96 119.26 116.28 3g1f h ALA 215 Ca 0.80 -0.27 0.13 0.00 0.00 0.00 0.00 54.91 55.57 3g1f h ALA 215 Cb 2.11 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.90 3g1f h ALA 215 CO -0.64 -0.23 0.46 0.00 0.00 0.00 0.00 179.25 178.85 3g1f h ALA 216 N -0.07 2.10 0.60 0.00 0.00 0.27 -1.94 119.26 120.22 3g1f h ALA 216 Ca -0.01 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3g1f h ALA 216 Cb 0.59 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.32 3g1f h ALA 216 CO 0.02 -0.27 -0.29 0.78 0.00 0.00 0.00 179.25 179.49 3g1f h GLY 217 N 0.39 -0.84 -0.45 0.00 0.00 -1.04 -2.78 103.07 98.37 3g1f h GLY 217 Ca 0.33 0.31 0.18 0.00 0.00 0.00 0.00 47.33 48.15 3g1f h GLY 217 CO -0.10 -0.30 -0.02 -2.22 0.00 0.00 0.00 176.54 173.90 3g1f h ILE 218 N -1.13 0.29 -0.56 2.60 1.08 -1.27 0.14 117.51 118.66 3g1f h ILE 218 Ca -0.08 -0.03 0.11 0.00 -0.39 0.00 0.00 64.86 64.47 3g1f h ILE 218 Cb 0.66 0.20 -0.09 0.00 -3.07 0.00 0.00 36.82 34.52 3g1f h ILE 218 CO 0.13 0.01 0.06 0.40 -0.69 0.00 0.00 178.15 178.07 3g1f h ILE 219 N 0.08 0.61 0.00 -0.67 2.04 -1.33 0.46 117.51 118.70 3g1f h ILE 219 Ca 0.43 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 66.22 3g1f h ILE 219 Cb 0.76 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 37.24 3g1f h ILE 219 CO -0.71 0.03 0.00 1.21 0.00 0.00 0.00 178.15 178.68 3g1f n GLU 220 N -5.19 0.12 0.00 2.37 4.07 0.38 -2.82 120.64 119.57 3g1f n GLU 220 Ca 0.08 0.05 0.15 0.00 -0.06 0.00 0.00 57.16 57.37 3g1f n GLU 220 Cb 0.31 -1.50 0.71 0.00 -0.06 0.00 0.00 31.44 30.89 3g1f n GLU 220 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 3g1f n SER 221 N -1.43 0.13 -2.70 4.31 3.41 0.15 -4.04 113.62 113.45 3g1f n SER 221 Ca 0.08 -0.24 -0.04 0.00 -0.26 0.00 0.00 58.87 58.41 3g1f n SER 221 Cb 0.27 -0.22 0.10 0.00 -0.26 0.00 0.00 64.21 64.10 3g1f n SER 221 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3g1f n ILE 222 N -1.21 0.27 -0.41 -1.33 -6.64 -1.13 -4.88 119.36 104.04 3g1f n ILE 222 Ca 0.14 -1.67 -0.01 0.00 -1.77 0.00 0.00 62.75 59.44 3g1f n ILE 222 Cb 0.26 1.00 0.25 0.00 -1.44 0.00 0.00 39.64 39.70 3g1f n ILE 222 CO 0.00 0.00 0.00 1.17 -1.77 0.00 0.00 176.55 175.95 3g1f n LYS 223 N -0.90 3.30 -1.72 6.28 4.81 -1.17 -4.45 118.16 124.31 3g1f n LYS 223 Ca -0.06 -2.22 -0.37 0.00 -0.87 0.00 0.00 58.31 54.80 3g1f n LYS 223 Cb 0.85 -2.00 0.03 0.00 0.02 0.00 0.00 35.03 33.94 3g1f n LYS 223 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3g1f n ASP 224 N 0.16 7.40 0.00 3.14 8.00 -1.26 -5.12 116.55 128.87 3g1f n ASP 224 Ca 0.26 -3.72 0.00 0.00 0.71 0.00 0.00 54.79 52.03 3g1f n ASP 224 Cb 1.03 -1.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.06 3g1f n ASP 224 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99