#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 5.29 -0.11 5.18 1.01 -1.26 -5.03 120.40 125.49 3g1f s VAL 11 Ca 0.00 0.36 -0.39 0.00 0.00 0.00 0.00 61.98 61.95 3g1f s VAL 11 Cb 0.00 -3.59 -0.16 0.00 0.00 0.00 0.00 36.38 32.63 3g1f s VAL 11 CO 0.00 0.29 1.54 0.80 0.00 0.00 0.00 175.10 177.73 3g1f n MET 12 N 4.57 1.11 -1.40 2.72 1.56 -1.26 0.16 117.12 124.58 3g1f n MET 12 Ca -0.12 0.40 -0.14 0.00 -0.27 0.00 0.00 57.70 57.57 3g1f n MET 12 Cb 0.52 -2.06 -0.06 0.00 2.15 0.00 0.00 33.22 33.77 3g1f n MET 12 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 3g1f n ASN 13 N 3.95 -5.52 -0.41 6.12 3.02 -1.26 -2.83 115.26 118.32 3g1f n ASN 13 Ca 0.23 0.34 -0.04 0.00 -0.03 0.00 0.00 54.58 55.08 3g1f n ASN 13 Cb 0.15 -4.23 -0.02 0.00 -0.61 0.00 0.00 39.78 35.07 3g1f n ASN 13 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3g1f n ARG 14 N -1.45 -1.80 -3.76 3.52 1.74 0.43 -4.90 116.66 110.44 3g1f n ARG 14 Ca -0.14 0.47 -0.37 0.00 -0.77 0.00 0.00 57.85 57.05 3g1f n ARG 14 Cb 0.60 -4.43 -0.13 0.00 -1.02 0.00 0.00 32.46 27.48 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 -1.12 3.82 -0.01 0.55 2.96 -1.13 -1.79 118.68 121.96 3g1f s LEU 15 Ca 0.00 -0.69 -0.10 0.00 -0.22 0.00 0.00 54.13 53.12 3g1f s LEU 15 Cb 0.00 -1.88 -0.05 0.00 0.50 0.00 0.00 46.19 44.76 3g1f s LEU 15 CO 0.00 -0.19 0.30 -0.63 -1.32 0.00 0.00 176.35 174.52 3g1f s ILE 16 N 1.50 5.24 -0.15 6.68 1.01 0.85 -4.52 121.20 131.80 3g1f s ILE 16 Ca 0.03 0.42 -0.06 0.00 0.00 0.00 0.00 60.65 61.05 3g1f s ILE 16 Cb -0.17 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 38.68 3g1f s ILE 16 CO 0.02 0.48 0.04 -0.22 0.00 0.00 0.00 174.94 175.26 3g1f s LEU 17 N -1.40 3.73 -0.50 2.97 2.96 -1.05 -0.78 118.68 124.61 3g1f s LEU 17 Ca 0.24 0.10 -0.14 0.00 -0.22 0.00 0.00 54.13 54.11 3g1f s LEU 17 Cb -0.14 -1.91 0.11 0.00 0.50 0.00 0.00 46.19 44.75 3g1f s LEU 17 CO 0.13 0.24 0.43 0.00 -1.32 0.00 0.00 176.35 175.83 3g1f s ALA 18 N -0.04 3.56 -1.08 5.97 0.00 0.15 0.93 121.76 131.25 3g1f s ALA 18 Ca 0.05 -2.40 -0.15 0.00 0.00 0.00 0.00 51.96 49.46 3g1f s ALA 18 Cb -0.12 -3.11 0.16 0.00 0.00 0.00 0.00 23.12 20.05 3g1f s ALA 18 CO 0.01 -1.90 1.27 1.41 0.00 0.00 0.00 175.76 176.56 3g1f s MET 19 N 1.56 3.89 0.00 0.00 1.75 -0.87 -4.33 119.30 121.31 3g1f s MET 19 Ca 0.04 -2.30 0.25 0.00 -1.25 0.00 0.00 55.69 52.43 3g1f s MET 19 Cb -0.27 -4.96 0.54 0.00 2.84 0.00 0.00 34.83 32.98 3g1f s MET 19 CO 0.03 -1.72 1.44 -0.25 -0.65 0.00 0.00 175.02 173.87 3g1f n ASP 20 N 5.76 1.87 -4.66 1.11 8.00 -1.26 -4.55 116.55 122.82 3g1f n ASP 20 Ca 0.30 -1.48 -0.42 0.00 0.71 0.00 0.00 54.79 53.91 3g1f n ASP 20 Cb 0.45 0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.69 3g1f n ASP 20 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3g1f n LEU 21 N 0.22 3.23 -1.09 0.64 4.77 -1.26 -4.35 117.00 119.16 3g1f n LEU 21 Ca 0.14 1.12 0.11 0.00 -0.03 0.00 0.00 56.01 57.35 3g1f n LEU 21 Cb 0.44 -1.43 0.26 0.00 -2.33 0.00 0.00 43.42 40.36 3g1f n LEU 21 CO 0.21 -0.93 0.73 0.23 -1.33 0.00 0.00 177.39 176.29 3g1f n MET 22 N 0.29 2.40 -4.11 3.23 2.81 -1.26 -4.22 117.12 116.26 3g1f n MET 22 Ca 0.07 -2.14 -0.35 0.00 -1.81 0.00 0.00 57.70 53.48 3g1f n MET 22 Cb 0.38 -1.49 -0.07 0.00 -0.71 0.00 0.00 33.22 31.32 3g1f n MET 22 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 3g1f s ASN 23 N -1.34 5.81 0.04 7.83 0.01 -1.26 -4.80 114.94 121.23 3g1f s ASN 23 Ca 0.39 0.27 -0.20 0.00 -0.71 0.00 0.00 52.86 52.61 3g1f s ASN 23 Cb 0.22 -1.75 -0.14 0.00 0.41 0.00 0.00 41.25 39.99 3g1f s ASN 23 CO 0.30 0.36 1.35 -0.09 -1.51 0.00 0.00 177.10 177.51 3g1f h ARG 24 N 4.76 0.39 -0.67 -0.60 2.43 -1.95 -1.08 114.38 117.66 3g1f h ARG 24 Ca -0.52 -0.20 0.03 0.00 -0.81 0.00 0.00 59.98 58.48 3g1f h ARG 24 Cb 1.20 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.71 3g1f h ARG 24 CO 0.58 0.76 0.41 -0.44 -1.51 0.00 0.00 179.97 179.78 3g1f h ASP 25 N 0.03 0.66 0.71 -3.80 3.45 -1.99 0.80 116.42 116.28 3g1f h ASP 25 Ca 0.03 0.01 -0.17 0.00 0.43 0.00 0.00 57.03 57.32 3g1f h ASP 25 Cb 0.69 -0.13 -0.02 0.00 -0.56 0.00 0.00 39.33 39.31 3g1f h ASP 25 CO 0.04 0.45 -0.81 0.44 -1.57 0.00 0.00 179.24 177.79 3g1f h ASP 26 N 0.80 0.09 0.60 6.45 3.32 -1.98 -1.35 116.42 124.34 3g1f h ASP 26 Ca 0.28 -0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.23 3g1f h ASP 26 Cb 0.05 -0.03 0.01 0.00 0.22 0.00 0.00 39.33 39.58 3g1f h ASP 26 CO -0.12 0.86 -0.29 0.00 -1.72 0.00 0.00 179.24 177.97 3g1f h ALA 27 N 1.14 -0.81 -0.10 3.45 0.00 -0.50 -1.29 119.26 121.15 3g1f h ALA 27 Ca -0.02 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 3g1f h ALA 27 Cb 1.42 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.51 3g1f h ALA 27 CO 0.11 -0.87 -0.38 -0.07 0.00 0.00 0.00 179.25 178.04 3g1f h LEU 28 N -0.98 0.22 -0.29 0.00 3.38 -0.95 -0.85 115.31 115.85 3g1f h LEU 28 Ca -0.08 -0.09 -0.14 0.00 0.09 0.00 0.00 57.88 57.66 3g1f h LEU 28 Cb 0.67 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 3g1f h LEU 28 CO 0.14 0.59 -0.38 -0.09 0.09 0.00 0.00 178.44 178.79 3g1f h ARG 29 N 0.19 0.77 -0.00 1.13 2.43 -1.22 -1.22 114.38 116.46 3g1f h ARG 29 Ca 0.02 -0.44 -0.23 0.00 -0.81 0.00 0.00 59.98 58.52 3g1f h ARG 29 Cb 0.76 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 3g1f h ARG 29 CO 0.06 1.07 -0.94 0.28 -1.51 0.00 0.00 179.97 178.93 3g1f h VAL 30 N 0.53 1.40 -0.30 0.20 2.07 -1.20 -2.75 116.25 116.21 3g1f h VAL 30 Ca 0.04 -2.44 -0.01 0.00 0.82 0.00 0.00 66.70 65.10 3g1f h VAL 30 Cb 0.97 2.42 -0.01 0.00 -1.52 0.00 0.00 31.29 33.14 3g1f h VAL 30 CO 0.09 0.73 0.14 0.74 0.02 0.00 0.00 177.57 179.29 3g1f h THR 31 N 0.23 1.16 -0.18 2.57 2.02 -1.13 -2.57 112.91 115.02 3g1f h THR 31 Ca -0.08 -0.46 -0.04 0.00 0.77 0.00 0.00 66.41 66.60 3g1f h THR 31 Cb 1.58 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 68.89 3g1f h THR 31 CO 0.16 0.16 -0.06 1.23 0.37 0.00 0.00 175.52 177.38 3g1f h GLY 32 N 0.35 0.29 2.00 2.16 0.00 -1.25 0.15 103.07 106.77 3g1f h GLY 32 Ca 0.10 -0.16 -0.03 0.00 0.00 0.00 0.00 47.33 47.24 3g1f h GLY 32 CO -0.01 0.15 -0.13 0.83 0.00 0.00 0.00 176.54 177.37 3g1f h GLU 33 N 0.26 0.00 0.00 4.80 5.08 -1.15 -3.14 114.58 120.43 3g1f h GLU 33 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3g1f h GLU 33 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 3g1f h GLU 33 CO 0.01 0.13 -0.91 1.33 -1.00 0.00 0.00 179.01 178.58 3g1f n VAL 34 N -3.37 0.00 -1.41 3.13 0.24 -0.73 -4.21 118.33 111.98 3g1f n VAL 34 Ca -0.00 -0.24 -0.34 0.00 -2.04 0.00 0.00 64.34 61.72 3g1f n VAL 34 Cb 0.33 0.74 -0.08 0.00 -1.47 0.00 0.00 33.84 33.36 3g1f n VAL 34 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 3g1f n ARG 35 N -1.50 1.07 0.00 7.34 3.00 0.46 -1.27 116.66 125.75 3g1f n ARG 35 Ca 0.01 -1.89 0.00 0.00 -0.00 0.00 0.00 57.85 55.97 3g1f n ARG 35 Cb 0.24 -3.27 0.00 0.00 0.00 0.00 0.00 32.46 29.43 3g1f n ARG 35 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 3g1f n GLU 36 N 7.77 0.00 0.03 -0.14 1.02 -1.26 -4.90 120.64 123.16 3g1f n GLU 36 Ca 0.46 0.00 0.07 0.00 -0.02 0.00 0.00 57.16 57.67 3g1f n GLU 36 Cb 0.44 0.00 -0.09 0.00 -0.02 0.00 0.00 31.44 31.77 3g1f n GLU 36 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3g1f n TYR 37 N -1.14 0.58 -4.43 -0.32 4.02 -0.40 -4.98 117.16 110.49 3g1f n TYR 37 Ca 0.00 0.18 -0.21 0.00 -0.01 0.00 0.00 57.90 57.86 3g1f n TYR 37 Cb 0.00 -0.85 -0.10 0.00 -0.02 0.00 0.00 39.34 38.37 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 -3.23 0.88 0.00 -0.72 -5.25 -1.18 -4.52 121.20 107.19 3g1f s ILE 38 Ca -0.04 -2.00 0.00 0.00 -0.99 0.00 0.00 60.65 57.62 3g1f s ILE 38 Cb 0.10 -2.65 0.00 0.00 2.95 0.00 0.00 42.46 42.86 3g1f s ILE 38 CO 0.84 0.00 0.00 -0.90 -1.79 0.00 0.00 174.94 173.09 3g1f n ASP 39 N -0.77 0.00 -4.59 4.36 5.75 -1.26 -4.72 116.55 115.31 3g1f n ASP 39 Ca -0.02 0.00 -0.34 0.00 -0.01 0.00 0.00 54.79 54.42 3g1f n ASP 39 Cb 0.66 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 40.64 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 0.00 3.76 -0.08 2.12 2.01 -1.26 -0.93 115.64 121.25 3g1f s THR 40 Ca 0.00 -0.46 -0.01 0.00 0.31 0.00 0.00 61.69 61.53 3g1f s THR 40 Cb 0.00 -2.54 0.03 0.00 0.01 0.00 0.00 72.50 70.00 3g1f s THR 40 CO 0.00 0.60 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.82 3g1f s VAL 41 N -0.81 0.56 -0.42 3.82 1.01 -0.04 -2.52 120.40 122.00 3g1f s VAL 41 Ca 0.12 -0.00 -0.24 0.00 0.00 0.00 0.00 61.98 61.86 3g1f s VAL 41 Cb -0.11 -0.67 0.02 0.00 0.00 0.00 0.00 36.38 35.62 3g1f s VAL 41 CO 0.01 0.29 0.86 -0.75 0.00 0.00 0.00 175.10 175.51 3g1f s LYS 42 N 1.84 3.62 -0.24 2.72 2.20 0.26 -2.18 119.74 127.96 3g1f s LYS 42 Ca 0.04 0.22 -0.07 0.00 -0.36 0.00 0.00 55.97 55.80 3g1f s LYS 42 Cb -0.12 -3.88 -0.03 0.00 -1.51 0.00 0.00 37.83 32.29 3g1f s LYS 42 CO -0.06 -1.06 0.05 0.42 -0.36 0.00 0.00 175.35 174.34 3g1f s ILE 43 N 3.45 4.20 0.44 5.43 1.01 -0.36 -2.05 121.20 133.32 3g1f s ILE 43 Ca 0.34 -0.21 0.06 0.00 0.00 0.00 0.00 60.65 60.84 3g1f s ILE 43 Cb -0.12 -2.95 0.06 0.00 0.01 0.00 0.00 42.46 39.46 3g1f s ILE 43 CO 0.22 0.36 0.46 0.61 0.00 0.00 0.00 174.94 176.59 3g1f n GLY 44 N 4.77 2.42 0.34 6.18 0.00 -1.26 -0.73 105.19 116.91 3g1f n GLY 44 Ca -0.16 -2.24 0.01 0.00 0.00 0.00 0.00 46.02 43.62 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 0.38 0.90 -0.55 1.61 -1.99 -1.98 -3.06 116.97 112.28 3g1f h TYR 45 Ca -0.25 0.02 0.06 0.00 2.00 0.00 0.00 58.73 60.56 3g1f h TYR 45 Cb 0.99 -0.30 -0.09 0.00 2.00 0.00 0.00 36.73 39.33 3g1f h TYR 45 CO 0.00 0.57 -0.54 -1.35 -0.00 0.00 0.00 178.16 176.84 3g1f h PRO 46 N 0.97 -0.26 -0.30 4.88 0.11 -1.95 0.87 132.00 136.31 3g1f h PRO 46 Ca 0.26 0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.33 3g1f h PRO 46 Cb -0.11 0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.05 3g1f h PRO 46 CO -0.06 -0.17 -0.06 1.25 -0.21 0.00 0.00 178.00 178.75 3g1f h LEU 47 N -0.27 0.58 -0.04 2.35 5.85 -1.73 -3.08 115.31 118.97 3g1f h LEU 47 Ca 0.09 -0.36 -0.01 0.00 0.84 0.00 0.00 57.88 58.45 3g1f h LEU 47 Cb 0.51 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.38 3g1f h LEU 47 CO -0.66 0.80 -0.00 0.58 -0.34 0.00 0.00 178.44 178.82 3g1f h VAL 48 N 0.35 1.26 -0.53 1.05 2.07 -1.33 0.16 116.25 119.27 3g1f h VAL 48 Ca 0.08 -0.79 0.08 0.00 0.82 0.00 0.00 66.70 66.88 3g1f h VAL 48 Cb 0.54 1.72 -0.03 0.00 -1.52 0.00 0.00 31.29 32.00 3g1f h VAL 48 CO 0.03 0.21 0.36 -0.07 0.02 0.00 0.00 177.57 178.12 3g1f h LEU 49 N -0.24 0.35 0.00 2.57 3.38 0.66 0.43 115.31 122.46 3g1f h LEU 49 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3g1f h LEU 49 Cb 0.34 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3g1f h LEU 49 CO 0.00 0.22 -0.97 -1.54 0.09 0.00 0.00 178.44 176.23 3g1f n SER 50 N -4.47 0.78 0.00 -0.43 3.41 -1.16 -4.46 113.62 107.28 3g1f n SER 50 Ca 0.08 -0.68 0.00 0.00 -0.26 0.00 0.00 58.87 58.01 3g1f n SER 50 Cb 0.32 0.89 0.00 0.00 -0.26 0.00 0.00 64.21 65.16 3g1f n SER 50 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3g1f n GLU 51 N -1.61 5.11 0.00 4.33 -0.58 0.54 -5.05 120.64 123.38 3g1f n GLU 51 Ca 0.03 -0.11 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 3g1f n GLU 51 Cb 0.36 -0.61 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 0.76 1.50 0.20 0.62 0.00 0.15 -4.56 105.19 103.85 3g1f n GLY 52 Ca 0.00 -1.86 0.07 0.00 0.00 0.00 0.00 46.02 44.23 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 -1.96 -2.96 114.93 114.48 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 0.32 0.01 -0.25 1.06 0.00 0.00 176.91 178.05 3g1f n ASP 54 N -3.55 0.45 0.31 1.22 9.92 -1.26 -1.61 116.55 122.02 3g1f n ASP 54 Ca -0.00 0.70 0.19 0.00 -0.53 0.00 0.00 54.79 55.15 3g1f n ASP 54 Cb 0.46 -0.76 1.01 0.00 -0.64 0.00 0.00 41.12 41.19 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 0.00 0.22 0.41 0.53 6.09 -1.76 -2.23 117.51 120.76 3g1f h ILE 55 Ca 0.00 -0.16 -0.02 0.00 -1.37 0.00 0.00 64.86 63.31 3g1f h ILE 55 Cb 0.03 1.12 0.00 0.00 0.47 0.00 0.00 36.82 38.45 3g1f h ILE 55 CO 0.00 0.02 -0.19 0.40 -3.07 0.00 0.00 178.15 175.31 3g1f h ILE 56 N 0.00 0.00 -0.95 2.19 1.08 -1.56 -2.10 117.51 116.16 3g1f h ILE 56 Ca -0.00 -0.18 0.23 0.00 -0.39 0.00 0.00 64.86 64.53 3g1f h ILE 56 Cb 0.12 0.00 -0.12 0.00 -3.07 0.00 0.00 36.82 33.75 3g1f h ILE 56 CO 0.00 0.00 0.51 0.00 -0.69 0.00 0.00 178.15 177.97 3g1f h ALA 57 N -1.57 1.62 -0.23 1.87 0.00 -1.57 0.12 119.26 119.50 3g1f h ALA 57 Ca -0.06 0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.04 3g1f h ALA 57 Cb 0.42 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 3g1f h ALA 57 CO 0.09 -0.29 -0.12 1.49 0.00 0.00 0.00 179.25 180.43 3g1f h GLU 58 N 0.51 -0.09 -0.22 0.00 4.57 -1.35 0.33 114.58 118.33 3g1f h GLU 58 Ca 0.60 0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.78 3g1f h GLU 58 Cb 1.13 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.73 3g1f h GLU 58 CO -0.49 -0.06 0.10 0.74 -1.18 0.00 0.00 179.01 178.11 3g1f h PHE 59 N -0.09 0.33 0.56 0.92 -1.00 -0.09 -2.00 116.94 115.56 3g1f h PHE 59 Ca 0.12 -0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.86 3g1f h PHE 59 Cb 0.28 -0.10 -0.01 0.00 3.61 0.00 0.00 35.95 39.73 3g1f h PHE 59 CO -0.29 0.34 -0.35 0.00 -1.61 0.00 0.00 178.31 176.40 3g1f h ARG 60 N 0.21 -0.84 -0.24 1.51 3.08 -0.94 0.84 114.38 118.01 3g1f h ARG 60 Ca 0.07 0.06 0.07 0.00 0.07 0.00 0.00 59.98 60.25 3g1f h ARG 60 Cb 0.15 0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 3g1f h ARG 60 CO -0.01 -0.56 0.20 -0.22 -1.07 0.00 0.00 179.97 178.31 3g1f h LYS 61 N -0.87 0.00 0.00 0.04 3.64 -0.95 0.39 116.57 118.82 3g1f h LYS 61 Ca -0.07 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3g1f h LYS 61 Cb 0.71 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 3g1f h LYS 61 CO 0.06 0.00 -1.19 0.54 -2.27 0.00 0.00 179.45 176.59 3g1f n ARG 62 N -4.20 0.18 0.00 1.90 1.74 -0.75 -4.62 116.66 110.90 3g1f n ARG 62 Ca 0.03 -0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 3g1f n ARG 62 Cb 0.34 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 3g1f n ARG 62 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3g1f n PHE 63 N -1.72 0.00 -2.33 -1.55 3.01 0.26 -5.00 117.46 110.12 3g1f n PHE 63 Ca 0.02 -0.01 -0.03 0.00 1.01 0.00 0.00 57.45 58.45 3g1f n PHE 63 Cb 0.40 -0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.86 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 -0.01 -0.42 3.89 1.37 0.00 0.13 -4.88 105.19 105.28 3g1f n GLY 64 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.68 3.82 -0.19 0.00 0.52 -0.11 -4.63 118.95 115.69 3g1f s ARG 66 Ca 0.42 1.78 0.01 0.00 -0.52 0.00 0.00 55.73 57.42 3g1f s ARG 66 Cb -0.12 -2.46 0.03 0.00 0.52 0.00 0.00 34.95 32.92 3g1f s ARG 66 CO 0.24 -0.50 -0.18 0.42 0.02 0.00 0.00 175.30 175.30 3g1f s ILE 67 N -1.53 2.04 -0.30 1.52 -1.09 -1.26 -0.87 121.20 119.71 3g1f s ILE 67 Ca 0.62 -1.02 -0.08 0.00 -2.23 0.00 0.00 60.65 57.94 3g1f s ILE 67 Cb -0.29 -1.89 0.00 0.00 -1.58 0.00 0.00 42.46 38.70 3g1f s ILE 67 CO 0.35 0.44 0.12 -0.63 -1.23 0.00 0.00 174.94 173.99 3g1f s ILE 68 N 1.28 4.29 -0.57 2.92 1.01 -0.93 -0.47 121.20 128.73 3g1f s ILE 68 Ca 0.03 -0.56 -0.26 0.00 0.00 0.00 0.00 60.65 59.86 3g1f s ILE 68 Cb -0.14 -3.20 0.04 0.00 0.01 0.00 0.00 42.46 39.16 3g1f s ILE 68 CO -0.12 0.07 1.08 0.00 0.00 0.00 0.00 174.94 175.98 3g1f s ALA 69 N 1.56 3.06 -1.33 9.38 0.00 -0.87 -1.22 121.76 132.34 3g1f s ALA 69 Ca 0.04 -1.02 -0.14 0.00 0.00 0.00 0.00 51.96 50.83 3g1f s ALA 69 Cb -0.17 -3.91 0.10 0.00 0.00 0.00 0.00 23.12 19.14 3g1f s ALA 69 CO 0.04 -2.55 1.86 -3.47 0.00 0.00 0.00 175.76 171.64 3g1f n ASP 70 N 8.03 4.69 -0.60 0.00 -0.08 0.09 -2.16 116.55 126.52 3g1f n ASP 70 Ca 0.05 -2.95 0.12 0.00 -1.51 0.00 0.00 54.79 50.50 3g1f n ASP 70 Cb 0.48 -1.63 0.07 0.00 2.34 0.00 0.00 41.12 42.38 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 6.20 0.00 -4.28 -0.67 0.99 -1.26 -4.24 117.46 114.21 3g1f n PHE 71 Ca 0.46 0.00 -0.31 0.00 -0.00 0.00 0.00 57.45 57.60 3g1f n PHE 71 Cb 0.41 -0.01 -0.09 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 0.31 -1.11 -1.64 -1.08 5.02 -0.32 -4.73 118.16 114.61 3g1f n LYS 72 Ca 0.11 0.12 -0.55 0.00 -2.02 0.00 0.00 58.31 55.96 3g1f n LYS 72 Cb 0.49 -3.62 -0.07 0.00 -0.02 0.00 0.00 35.03 31.82 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 -4.59 0.13 -2.75 -0.18 0.31 -1.07 -4.23 118.33 105.94 3g1f n VAL 73 Ca -0.32 -0.02 -0.10 0.00 -0.01 0.00 0.00 64.34 63.89 3g1f n VAL 73 Cb 0.69 -0.93 0.05 0.00 -0.91 0.00 0.00 33.84 32.74 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 3.73 2.28 -3.86 3.52 0.00 -1.26 -0.81 120.51 124.10 3g1f n ALA 74 Ca 0.22 -2.53 0.00 0.00 0.00 0.00 0.00 53.44 51.13 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 -0.12 1.87 -4.81 0.00 -0.08 -1.26 -4.94 116.55 107.21 3g1f n ASP 75 Ca 0.08 -0.92 -0.31 0.00 -1.51 0.00 0.00 54.79 52.13 3g1f n ASP 75 Cb 0.80 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 -0.91 3.58 0.19 5.18 -4.36 -1.26 -4.72 121.20 118.90 3g1f s ILE 76 Ca 0.00 0.51 -0.19 0.00 -0.26 0.00 0.00 60.65 60.71 3g1f s ILE 76 Cb 0.00 -3.23 0.14 0.00 1.25 0.00 0.00 42.46 40.62 3g1f s ILE 76 CO 0.00 -0.67 1.60 -0.65 0.24 0.00 0.00 174.94 175.46 3g1f h PRO 77 N -0.91 -0.13 -0.45 0.37 0.11 -1.85 -0.06 132.00 129.08 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 0.03 -0.08 0.00 0.11 0.00 0.00 31.00 32.30 3g1f h PRO 77 CO 0.57 -0.09 -0.04 0.93 -0.21 0.00 0.00 178.00 179.17 3g1f h GLU 78 N -0.14 0.07 -0.19 1.05 3.07 -1.93 -1.68 114.58 114.83 3g1f h GLU 78 Ca 0.24 -0.00 -0.19 0.00 -0.50 0.00 0.00 59.36 58.90 3g1f h GLU 78 Cb 0.52 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 3g1f h GLU 78 CO -0.62 0.05 -0.64 1.15 -1.40 0.00 0.00 179.01 177.55 3g1f h THR 79 N 0.07 1.31 -0.60 1.13 2.02 -1.81 -3.00 112.91 112.02 3g1f h THR 79 Ca 0.22 -1.88 0.07 0.00 0.77 0.00 0.00 66.41 65.59 3g1f h THR 79 Cb 0.34 1.84 -0.04 0.00 -1.74 0.00 0.00 68.15 68.55 3g1f h THR 79 CO -0.41 0.59 0.40 0.78 0.37 0.00 0.00 175.52 177.26 3g1f h ASN 80 N 0.50 0.49 0.51 4.18 4.21 -0.54 -0.97 115.58 123.96 3g1f h ASN 80 Ca -0.01 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.48 3g1f h ASN 80 Cb 1.23 -0.10 -0.01 0.00 -1.12 0.00 0.00 38.32 38.32 3g1f h ASN 80 CO 0.13 0.32 -0.36 -0.33 -1.29 0.00 0.00 177.43 175.89 3g1f h GLU 81 N 0.56 -0.80 -0.69 0.81 4.39 -1.18 0.14 114.58 117.82 3g1f h GLU 81 Ca 0.26 0.05 0.11 0.00 0.34 0.00 0.00 59.36 60.13 3g1f h GLU 81 Cb 0.33 0.18 -0.08 0.00 -0.10 0.00 0.00 28.75 29.08 3g1f h GLU 81 CO -0.08 -0.53 0.28 0.87 -1.16 0.00 0.00 179.01 178.38 3g1f h LYS 82 N -0.83 0.44 -0.47 2.33 1.57 -1.47 0.23 116.57 118.36 3g1f h LYS 82 Ca -0.07 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.73 3g1f h LYS 82 Cb 0.68 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.85 3g1f h LYS 82 CO 0.04 0.29 0.22 0.82 -0.57 0.00 0.00 179.45 180.25 3g1f h ILE 83 N 0.45 0.94 -0.10 1.86 2.04 -0.94 0.19 117.51 121.95 3g1f h ILE 83 Ca 0.36 -0.15 -0.13 0.00 1.00 0.00 0.00 64.86 65.94 3g1f h ILE 83 Cb 0.48 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 3g1f h ILE 83 CO -0.34 0.08 -0.51 0.00 0.00 0.00 0.00 178.15 177.38 3g1f h ARG 85 N 0.21 0.27 -0.76 0.00 3.08 0.00 -1.91 114.38 115.27 3g1f h ARG 85 Ca 0.01 -0.13 -0.04 0.00 0.07 0.00 0.00 59.98 59.89 3g1f h ARG 85 Cb 0.98 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.99 3g1f h ARG 85 CO 0.08 0.64 0.32 0.00 -1.07 0.00 0.00 179.97 179.95 3g1f h ALA 86 N 0.62 1.13 0.21 0.04 0.00 -0.61 0.76 119.26 121.41 3g1f h ALA 86 Ca 0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3g1f h ALA 86 Cb 0.58 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3g1f h ALA 86 CO 0.02 0.63 -0.10 1.15 0.00 0.00 0.00 179.25 180.96 3g1f h THR 87 N 1.10 0.86 -0.55 0.00 2.02 -1.24 -2.75 112.91 112.35 3g1f h THR 87 Ca 0.26 -0.36 -0.09 0.00 0.77 0.00 0.00 66.41 66.99 3g1f h THR 87 Cb 0.18 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 3g1f h THR 87 CO -0.03 0.08 0.00 -0.26 0.37 0.00 0.00 175.52 175.69 3g1f h PHE 88 N -0.45 1.02 0.00 3.16 0.04 -1.12 -1.28 116.94 118.31 3g1f h PHE 88 Ca -0.03 -0.16 0.00 0.00 2.80 0.00 0.00 57.97 60.58 3g1f h PHE 88 Cb 0.35 -0.27 0.00 0.00 2.20 0.00 0.00 35.95 38.22 3g1f h PHE 88 CO -0.01 0.92 0.00 1.17 -0.60 0.00 0.00 178.31 179.78 3g1f n LYS 89 N -4.19 0.04 -0.09 1.51 4.81 0.26 -1.09 118.16 119.41 3g1f n LYS 89 Ca 0.03 0.54 0.11 0.00 -0.87 0.00 0.00 58.31 58.11 3g1f n LYS 89 Cb 0.33 -1.62 0.15 0.00 0.02 0.00 0.00 35.03 33.90 3g1f n LYS 89 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3g1f n ALA 90 N -1.57 2.43 0.00 3.14 0.00 -0.49 -4.99 120.51 119.04 3g1f n ALA 90 Ca -0.00 -0.83 0.00 0.00 0.00 0.00 0.00 53.44 52.60 3g1f n ALA 90 Cb 0.01 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 18.69 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 1.30 1.79 3.63 0.00 0.00 -0.25 -3.60 105.19 108.06 3g1f n GLY 91 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.35 -0.49 -0.11 4.61 0.00 -1.23 -4.86 120.51 117.07 3g1f n ALA 92 Ca 0.00 -0.35 -0.13 0.00 0.00 0.00 0.00 53.44 52.96 3g1f n ALA 92 Cb 0.00 -2.15 -0.13 0.00 0.00 0.00 0.00 19.45 17.17 3g1f n ALA 92 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3g1f n ASP 93 N -2.71 1.12 -4.06 0.00 8.00 0.38 -4.75 116.55 114.52 3g1f n ASP 93 Ca 0.12 -0.06 -0.26 0.00 0.71 0.00 0.00 54.79 55.30 3g1f n ASP 93 Cb 0.51 0.32 -0.08 0.00 -0.02 0.00 0.00 41.12 41.84 3g1f n ASP 93 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3g1f s ALA 94 N -2.48 2.93 -0.29 2.24 0.00 -0.95 -1.48 121.76 121.73 3g1f s ALA 94 Ca -0.21 -1.23 -0.15 0.00 0.00 0.00 0.00 51.96 50.37 3g1f s ALA 94 Cb 0.07 0.78 0.13 0.00 0.00 0.00 0.00 23.12 24.10 3g1f s ALA 94 CO 0.69 -0.35 0.85 -1.50 0.00 0.00 0.00 175.76 175.45 3g1f s ILE 95 N -3.20 -0.23 -0.02 0.00 2.07 -1.13 -2.06 121.20 116.62 3g1f s ILE 95 Ca 0.24 0.00 -0.22 0.00 -1.41 0.00 0.00 60.65 59.25 3g1f s ILE 95 Cb 0.02 -1.00 -0.05 0.00 0.13 0.00 0.00 42.46 41.56 3g1f s ILE 95 CO 0.15 0.00 0.66 -0.63 -1.91 0.00 0.00 174.94 173.21 3g1f s ILE 96 N 1.85 4.94 0.09 2.00 1.01 -0.92 -1.38 121.20 128.78 3g1f s ILE 96 Ca -0.08 1.38 0.09 0.00 0.00 0.00 0.00 60.65 62.04 3g1f s ILE 96 Cb -0.06 -4.00 -0.03 0.00 0.01 0.00 0.00 42.46 38.38 3g1f s ILE 96 CO -0.17 0.34 -0.23 -0.69 0.00 0.00 0.00 174.94 174.19 3g1f s VAL 97 N 0.25 1.88 0.30 2.92 1.01 0.19 -1.17 120.40 125.78 3g1f s VAL 97 Ca 0.35 -1.49 -0.22 0.00 0.00 0.00 0.00 61.98 60.61 3g1f s VAL 97 Cb -0.18 -1.67 -0.09 0.00 0.00 0.00 0.00 36.38 34.44 3g1f s VAL 97 CO 0.18 0.09 0.86 -1.00 0.00 0.00 0.00 175.10 175.23 3g1f s HIS 98 N -1.01 3.61 -0.09 5.22 3.76 0.01 -0.32 115.29 126.47 3g1f s HIS 98 Ca 0.09 1.59 0.20 0.00 -0.15 0.00 0.00 55.06 56.79 3g1f s HIS 98 Cb -0.10 -2.78 -0.30 0.00 1.11 0.00 0.00 32.58 30.51 3g1f s HIS 98 CO 0.04 0.21 0.31 0.41 -0.85 0.00 0.00 174.74 174.86 3g1f n GLY 99 N 0.41 -0.97 0.26 -2.22 0.00 -1.26 -4.48 105.19 96.92 3g1f n GLY 99 Ca 0.01 -0.44 0.10 0.00 0.00 0.00 0.00 46.02 45.70 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 -5.15 -1.94 -2.53 116.94 108.93 3g1f h PHE 100 Ca -0.21 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.56 3g1f h PHE 100 Cb 1.46 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.63 3g1f h PHE 100 CO 0.00 0.08 0.00 -2.30 -2.00 0.00 0.00 178.31 174.09 3g1f n PRO 101 N -4.09 0.02 0.00 6.09 -0.02 -1.26 -4.91 135.00 130.82 3g1f n PRO 101 Ca -0.03 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 3g1f n PRO 101 Cb 0.17 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 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 -1.20 0.64 0.53 -1.23 0.00 -0.95 -4.81 105.19 98.17 3g1f n GLY 102 Ca 0.01 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.40 3g1f n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1f n ALA 103 N -1.00 2.38 0.31 4.61 0.00 -1.26 -4.60 120.51 120.94 3g1f n ALA 103 Ca 0.00 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.64 3g1f n ALA 103 Cb 0.00 0.29 0.98 0.00 0.00 0.00 0.00 19.45 20.72 3g1f n ALA 103 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 3g1f h ASP 104 N 0.00 0.00 1.07 0.00 2.03 -1.98 0.07 116.42 117.61 3g1f h ASP 104 Ca 0.00 0.00 -0.16 0.00 -0.73 0.00 0.00 57.03 56.14 3g1f h ASP 104 Cb 0.58 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.06 3g1f h ASP 104 CO 0.00 0.01 -0.99 0.28 -1.03 0.00 0.00 179.24 177.51 3g1f h SER 105 N 0.00 0.00 0.60 4.15 0.02 -1.87 -2.70 113.55 113.75 3g1f h SER 105 Ca -0.00 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.67 3g1f h SER 105 Cb 0.23 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 3g1f h SER 105 CO 0.00 0.64 -1.39 0.58 -1.14 0.00 0.00 176.83 175.52 3g1f h VAL 106 N 0.00 1.29 0.51 2.27 2.07 -1.54 -3.28 116.25 117.57 3g1f h VAL 106 Ca -0.08 -2.96 -0.02 0.00 0.82 0.00 0.00 66.70 64.46 3g1f h VAL 106 Cb 1.56 2.77 -0.00 0.00 -1.52 0.00 0.00 31.29 34.09 3g1f h VAL 106 CO 0.07 0.82 -0.29 -0.09 0.02 0.00 0.00 177.57 178.10 3g1f h ARG 107 N 0.05 -0.72 -1.08 1.57 9.65 -1.09 -1.68 114.38 121.07 3g1f h ARG 107 Ca -0.18 0.05 0.39 0.00 -1.10 0.00 0.00 59.98 59.13 3g1f h ARG 107 Cb 1.96 0.16 -0.15 0.00 -1.39 0.00 0.00 29.97 30.54 3g1f h ARG 107 CO 0.15 -0.48 0.63 0.00 2.80 0.00 0.00 179.97 183.07 3g1f h ALA 108 N -0.29 2.23 0.15 2.80 0.00 -1.57 0.39 119.26 122.97 3g1f h ALA 108 Ca -0.06 0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3g1f h ALA 108 Cb 0.60 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.62 3g1f h ALA 108 CO 0.08 -0.92 -0.07 0.00 0.00 0.00 0.00 179.25 178.34 3g1f h LEU 110 N -0.71 0.65 0.42 0.00 3.38 0.47 -0.59 115.31 118.93 3g1f h LEU 110 Ca -0.02 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 3g1f h LEU 110 Cb 0.51 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3g1f h LEU 110 CO 0.03 0.32 -0.21 0.78 0.09 0.00 0.00 178.44 179.45 3g1f h ASN 111 N 0.69 -0.51 -0.42 -0.43 2.35 -0.53 0.11 115.58 116.84 3g1f h ASN 111 Ca 0.45 0.02 0.02 0.00 -0.55 0.00 0.00 56.30 56.25 3g1f h ASN 111 Cb 0.74 0.14 -0.03 0.00 0.05 0.00 0.00 38.32 39.22 3g1f h ASN 111 CO -0.21 -0.36 0.25 0.58 -1.65 0.00 0.00 177.43 176.04 3g1f h VAL 112 N -0.58 1.04 -0.70 2.81 2.07 -0.95 -2.23 116.25 117.70 3g1f h VAL 112 Ca -0.05 -0.17 -0.07 0.00 0.82 0.00 0.00 66.70 67.22 3g1f h VAL 112 Cb 0.45 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 3g1f h VAL 112 CO 0.08 0.09 0.14 0.00 0.02 0.00 0.00 177.57 177.91 3g1f h ALA 113 N 1.19 0.93 0.01 1.67 0.00 -1.07 -1.64 119.26 120.35 3g1f h ALA 113 Ca 0.17 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3g1f h ALA 113 Cb 0.01 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 3g1f h ALA 113 CO -0.08 0.67 -0.02 1.49 0.00 0.00 0.00 179.25 181.32 3g1f h GLU 114 N 1.07 -0.03 -0.93 0.00 4.22 -0.43 0.37 114.58 118.85 3g1f h GLU 114 Ca 0.22 0.00 0.16 0.00 0.08 0.00 0.00 59.36 59.82 3g1f h GLU 114 Cb 0.41 0.01 -0.16 0.00 0.50 0.00 0.00 28.75 29.51 3g1f h GLU 114 CO 0.01 -0.02 -0.34 1.49 -2.18 0.00 0.00 179.01 177.97 3g1f h GLU 115 N -0.03 -0.02 0.00 1.92 4.81 -1.37 0.13 114.58 120.01 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 0.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.41 3g1f h GLU 115 CO -0.00 -0.01 0.00 -1.33 -0.73 0.00 0.00 179.01 176.93 3g1f n MET 116 N -5.50 0.74 -3.23 1.92 2.81 -0.62 -4.92 117.12 108.32 3g1f n MET 116 Ca 0.11 0.01 -0.18 0.00 -1.81 0.00 0.00 57.70 55.82 3g1f n MET 116 Cb 0.42 -1.50 0.05 0.00 -0.71 0.00 0.00 33.22 31.48 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 0.97 -0.19 3.46 3.03 0.00 0.11 -5.03 105.19 107.56 3g1f n GLY 117 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 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 -5.88 1.64 0.31 1.61 1.81 -0.15 -5.04 118.95 113.26 3g1f s ARG 118 Ca 0.40 -1.78 -0.02 0.00 -1.72 0.00 0.00 55.73 52.61 3g1f s ARG 118 Cb -0.18 -1.59 -0.04 0.00 -0.45 0.00 0.00 34.95 32.70 3g1f s ARG 118 CO 0.50 0.23 0.54 -1.21 -0.68 0.00 0.00 175.30 174.68 3g1f s GLU 119 N -3.58 3.54 -0.11 3.54 2.02 -0.55 -4.30 118.70 119.27 3g1f s GLU 119 Ca 0.29 -0.19 0.02 0.00 0.02 0.00 0.00 54.97 55.11 3g1f s GLU 119 Cb -0.02 -2.67 0.02 0.00 0.10 0.00 0.00 34.13 31.56 3g1f s GLU 119 CO 0.14 0.20 -0.14 0.08 0.02 0.00 0.00 175.26 175.55 3g1f s VAL 120 N -2.18 1.43 -0.20 2.63 1.01 -1.26 -2.85 120.40 118.97 3g1f s VAL 120 Ca 0.41 -0.60 -0.06 0.00 0.00 0.00 0.00 61.98 61.74 3g1f s VAL 120 Cb -0.10 -1.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 3g1f s VAL 120 CO 0.33 0.43 0.01 -0.36 0.00 0.00 0.00 175.10 175.51 3g1f s PHE 121 N 1.02 3.07 -0.32 5.22 0.40 -0.48 -4.29 117.98 122.59 3g1f s PHE 121 Ca -0.06 -0.38 -0.16 0.00 -0.60 0.00 0.00 56.93 55.73 3g1f s PHE 121 Cb -0.15 -2.10 -0.02 0.00 0.51 0.00 0.00 43.02 41.27 3g1f s PHE 121 CO -0.02 -0.20 0.41 -1.17 0.70 0.00 0.00 175.22 174.95 3g1f s LEU 122 N 0.97 4.30 -0.37 -0.37 2.96 -0.85 0.57 118.68 125.89 3g1f s LEU 122 Ca 0.02 -0.02 -0.29 0.00 -0.22 0.00 0.00 54.13 53.62 3g1f s LEU 122 Cb -0.14 -2.44 -0.01 0.00 0.50 0.00 0.00 46.19 44.10 3g1f s LEU 122 CO 0.02 -0.34 1.62 -0.22 -1.32 0.00 0.00 176.35 176.11 3g1f s LEU 123 N 2.15 3.54 0.03 -0.68 2.96 0.56 -2.30 118.68 124.94 3g1f s LEU 123 Ca 0.15 1.08 -0.10 0.00 -0.22 0.00 0.00 54.13 55.03 3g1f s LEU 123 Cb -0.16 -3.52 -0.32 0.00 0.50 0.00 0.00 46.19 42.69 3g1f s LEU 123 CO 0.12 -1.59 0.97 0.71 -1.32 0.00 0.00 176.35 175.25 3g1f h THR 124 N 6.65 1.28 -1.78 3.68 1.35 -0.63 -3.35 112.91 120.11 3g1f h THR 124 Ca -0.31 -2.79 0.02 0.00 -0.55 0.00 0.00 66.41 62.78 3g1f h THR 124 Cb 1.14 2.94 -0.24 0.00 -1.73 0.00 0.00 68.15 70.26 3g1f h THR 124 CO 1.06 0.84 0.30 -0.70 -0.25 0.00 0.00 175.52 176.77 3g1f s GLU 125 N -2.62 0.65 0.33 4.72 2.12 -1.24 -4.21 118.70 118.46 3g1f s GLU 125 Ca -0.09 0.79 -0.03 0.00 0.36 0.00 0.00 54.97 56.01 3g1f s GLU 125 Cb 0.05 0.31 -0.04 0.00 0.26 0.00 0.00 34.13 34.71 3g1f s GLU 125 CO 0.90 -0.08 0.57 -1.64 -0.54 0.00 0.00 175.26 174.48 3g1f s MET 126 N 0.35 3.56 -0.08 4.30 -1.94 -1.26 -2.45 119.30 121.78 3g1f s MET 126 Ca 0.01 -0.11 -0.18 0.00 -1.71 0.00 0.00 55.69 53.71 3g1f s MET 126 Cb -0.05 -2.63 -0.29 0.00 2.01 0.00 0.00 34.83 33.87 3g1f s MET 126 CO -0.04 0.15 0.70 1.03 -0.01 0.00 0.00 175.02 176.85 3g1f h SER 127 N 1.17 0.44 -2.74 3.03 0.87 -1.95 -3.44 113.55 110.94 3g1f h SER 127 Ca -0.48 -0.89 -0.59 0.00 -1.23 0.00 0.00 61.79 58.59 3g1f h SER 127 Cb 1.20 -0.14 0.16 0.00 -0.44 0.00 0.00 62.40 63.18 3g1f h SER 127 CO 0.64 1.55 -0.38 0.00 -0.53 0.00 0.00 176.83 178.11 3g1f n HIS 128 N -3.97 -0.56 -0.10 2.24 1.44 -1.26 -4.85 115.22 108.15 3g1f n HIS 128 Ca -0.21 0.50 0.11 0.00 -2.01 0.00 0.00 57.72 56.12 3g1f n HIS 128 Cb 0.89 -1.98 0.48 0.00 0.12 0.00 0.00 29.99 29.50 3g1f n HIS 128 CO 0.00 0.00 0.00 -1.00 -2.81 0.00 0.00 176.34 172.53 3g1f h PRO 129 N 0.51 0.45 0.00 -1.40 0.13 -2.02 -1.69 132.00 127.98 3g1f h PRO 129 Ca -0.44 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3g1f h PRO 129 Cb 1.40 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.42 3g1f h PRO 129 CO 0.49 0.30 0.00 0.41 -0.23 0.00 0.00 178.00 178.97 3g1f n GLY 130 N -1.51 -0.40 0.13 1.56 0.00 -1.26 -2.24 105.19 101.48 3g1f n GLY 130 Ca 0.10 -0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.23 3g1f n GLY 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1f n ALA 131 N -0.51 4.04 1.21 4.61 0.00 -0.64 -4.11 120.51 125.11 3g1f n ALA 131 Ca 0.00 -0.53 0.13 0.00 0.00 0.00 0.00 53.44 53.04 3g1f n ALA 131 Cb 0.00 -0.90 0.28 0.00 0.00 0.00 0.00 19.45 18.83 3g1f n ALA 131 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3g1f n GLU 132 N -1.10 1.26 0.03 0.00 1.02 -0.95 -0.47 120.64 120.43 3g1f n GLU 132 Ca 0.06 -0.87 -0.19 0.00 -0.02 0.00 0.00 57.16 56.14 3g1f n GLU 132 Cb 0.36 -1.48 -0.14 0.00 -0.02 0.00 0.00 31.44 30.16 3g1f n GLU 132 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 3g1f h MET 133 N 2.12 0.26 0.00 3.49 2.86 -1.78 -3.44 114.93 118.44 3g1f h MET 133 Ca 0.00 -0.44 0.00 0.00 -2.06 0.00 0.00 59.70 57.20 3g1f h MET 133 Cb 0.62 0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.44 3g1f h MET 133 CO 0.00 1.20 -0.38 1.19 1.06 0.00 0.00 176.91 179.99 3g1f n PHE 134 N -4.20 -0.39 0.19 -0.22 3.01 -1.26 -4.88 117.46 109.71 3g1f n PHE 134 Ca -0.13 0.07 -0.15 0.00 1.01 0.00 0.00 57.45 58.25 3g1f n PHE 134 Cb 0.77 0.19 -0.08 0.00 -0.01 0.00 0.00 39.48 40.35 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 0.00 -0.88 4.37 2.04 -1.86 -2.66 117.51 118.52 3g1f h ILE 135 Ca 0.00 0.00 0.26 0.00 1.00 0.00 0.00 64.86 66.12 3g1f h ILE 135 Cb 0.38 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.42 3g1f h ILE 135 CO 0.00 0.00 0.86 -0.61 0.00 0.00 0.00 178.15 178.40 3g1f h GLN 136 N -0.78 0.00 0.00 2.37 4.15 -1.07 0.12 115.11 119.90 3g1f h GLN 136 Ca -0.04 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.38 3g1f h GLN 136 Cb 0.71 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.40 3g1f h GLN 136 CO -0.13 0.00 0.00 0.41 -1.93 0.00 0.00 178.83 177.18 3g1f n GLY 137 N -1.65 -0.52 0.00 2.39 0.00 -1.00 -2.74 105.19 101.67 3g1f n GLY 137 Ca 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3g1f n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1f n ALA 138 N -1.14 0.55 0.00 4.61 0.00 0.38 -4.80 120.51 120.11 3g1f n ALA 138 Ca 0.07 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.27 3g1f n ALA 138 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.52 3g1f n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g1f n ALA 139 N 0.00 0.74 -0.03 0.00 0.00 -1.09 0.16 120.51 120.29 3g1f n ALA 139 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 3g1f n ALA 139 Cb 0.39 -0.70 -0.06 0.00 0.00 0.00 0.00 19.45 19.08 3g1f n ALA 139 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3g1f n ASP 140 N -1.30 3.17 0.07 0.00 8.00 -1.26 -4.05 116.55 121.18 3g1f n ASP 140 Ca 0.00 0.00 -0.03 0.00 0.71 0.00 0.00 54.79 55.47 3g1f n ASP 140 Cb 0.13 0.86 -0.01 0.00 -0.02 0.00 0.00 41.12 42.08 3g1f n ASP 140 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 3g1f h GLU 141 N 0.00 -0.18 -0.95 -1.24 4.57 0.13 -2.95 114.58 113.96 3g1f h GLU 141 Ca -0.15 0.01 0.14 0.00 -1.18 0.00 0.00 59.36 58.19 3g1f h GLU 141 Cb 1.17 0.04 -0.09 0.00 -0.16 0.00 0.00 28.75 29.70 3g1f h GLU 141 CO 0.01 -0.12 0.57 0.82 -1.18 0.00 0.00 179.01 179.11 3g1f h ILE 142 N -0.36 0.81 -0.71 2.32 2.04 -0.40 -0.23 117.51 120.99 3g1f h ILE 142 Ca -0.02 -0.28 0.13 0.00 1.00 0.00 0.00 64.86 65.69 3g1f h ILE 142 Cb 0.14 -0.09 -0.09 0.00 -0.74 0.00 0.00 36.82 36.05 3g1f h ILE 142 CO 0.03 0.15 0.25 0.00 0.00 0.00 0.00 178.15 178.58 3g1f h ALA 143 N 1.57 0.95 -0.17 1.87 0.00 -1.68 0.36 119.26 122.15 3g1f h ALA 143 Ca 0.51 0.12 -0.10 0.00 0.00 0.00 0.00 54.91 55.43 3g1f h ALA 143 Cb 0.64 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3g1f h ALA 143 CO -0.32 -0.23 -0.34 0.00 0.00 0.00 0.00 179.25 178.35 3g1f h ARG 144 N 0.39 0.36 -0.93 0.00 3.08 -0.88 -2.72 114.38 113.68 3g1f h ARG 144 Ca 0.38 -0.15 0.13 0.00 0.07 0.00 0.00 59.98 60.41 3g1f h ARG 144 Cb 0.57 -0.01 -0.09 0.00 0.08 0.00 0.00 29.97 30.52 3g1f h ARG 144 CO -0.40 0.66 0.56 1.98 -1.07 0.00 0.00 179.97 181.70 3g1f h MET 145 N 0.31 0.83 0.00 0.04 4.05 0.52 0.35 114.93 121.02 3g1f h MET 145 Ca 0.04 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 59.41 3g1f h MET 145 Cb 0.75 -0.19 -0.00 0.00 -0.80 0.00 0.00 31.60 31.36 3g1f h MET 145 CO 0.06 0.55 -0.01 0.78 0.23 0.00 0.00 176.91 178.52 3g1f h GLY 146 N 0.85 0.00 1.71 1.39 0.00 -1.02 -1.26 103.07 104.74 3g1f h GLY 146 Ca 0.48 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.58 3g1f h GLY 146 CO -0.29 0.00 -1.01 -2.08 0.00 0.00 0.00 176.54 173.16 3g1f h VAL 147 N 0.00 1.50 0.02 4.60 2.07 -0.33 1.16 116.25 125.26 3g1f h VAL 147 Ca -0.00 -2.79 -0.19 0.00 0.82 0.00 0.00 66.70 64.53 3g1f h VAL 147 Cb 0.31 2.64 0.02 0.00 -1.52 0.00 0.00 31.29 32.73 3g1f h VAL 147 CO 0.00 0.82 -0.77 0.44 0.02 0.00 0.00 177.57 178.08 3g1f h ASP 148 N 0.11 0.64 -0.55 0.57 3.45 -1.06 -3.26 116.42 116.33 3g1f h ASP 148 Ca -0.08 -0.77 -0.04 0.00 0.43 0.00 0.00 57.03 56.57 3g1f h ASP 148 Cb 1.68 -0.20 -0.02 0.00 -0.56 0.00 0.00 39.33 40.23 3g1f h ASP 148 CO 0.16 1.34 0.18 -0.07 -1.57 0.00 0.00 179.24 179.28 3g1f h LEU 149 N 0.02 0.78 0.00 1.55 3.38 -1.30 -3.47 115.31 116.28 3g1f h LEU 149 Ca -0.10 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.67 3g1f h LEU 149 Cb 1.47 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 42.02 3g1f h LEU 149 CO 0.15 0.77 0.00 0.61 0.09 0.00 0.00 178.44 180.06 3g1f n GLY 150 N -0.73 1.97 3.81 0.83 0.00 0.29 -5.09 105.19 106.28 3g1f n GLY 150 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 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 4.20 -0.00 1.61 1.01 0.38 -4.95 120.40 120.64 3g1f s VAL 151 Ca 0.00 1.46 0.01 0.00 0.00 0.00 0.00 61.98 63.45 3g1f s VAL 151 Cb 0.00 -3.64 0.01 0.00 0.00 0.00 0.00 36.38 32.74 3g1f s VAL 151 CO 0.00 -0.21 0.80 0.29 0.00 0.00 0.00 175.10 175.98 3g1f n LYS 152 N -0.46 0.10 -3.79 2.72 5.02 -1.26 -4.68 118.16 115.81 3g1f n LYS 152 Ca 0.06 -0.85 -0.24 0.00 -2.02 0.00 0.00 58.31 55.27 3g1f n LYS 152 Cb 0.53 -0.54 -0.17 0.00 -0.02 0.00 0.00 35.03 34.83 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 -0.64 1.74 0.20 4.39 0.01 -1.24 0.12 114.94 119.53 3g1f s ASN 153 Ca 0.01 -0.15 0.04 0.00 -0.71 0.00 0.00 52.86 52.05 3g1f s ASN 153 Cb 0.01 -0.50 -0.05 0.00 0.41 0.00 0.00 41.25 41.12 3g1f s ASN 153 CO 0.00 -0.19 -0.05 -0.31 -1.51 0.00 0.00 177.10 175.04 3g1f s TYR 154 N 1.93 1.50 -0.03 2.20 1.51 0.42 -2.01 117.35 122.87 3g1f s TYR 154 Ca 0.05 -0.83 -0.00 0.00 -1.01 0.00 0.00 57.07 55.27 3g1f s TYR 154 Cb -0.13 -0.82 0.03 0.00 -0.11 0.00 0.00 41.96 40.93 3g1f s TYR 154 CO -0.06 0.05 0.02 0.08 -1.11 0.00 0.00 175.55 174.53 3g1f s VAL 155 N -3.33 0.04 0.25 0.71 1.01 -0.97 -1.24 120.40 116.86 3g1f s VAL 155 Ca 0.24 0.19 0.04 0.00 0.00 0.00 0.00 61.98 62.45 3g1f s VAL 155 Cb 0.04 -0.18 -0.02 0.00 0.00 0.00 0.00 36.38 36.23 3g1f s VAL 155 CO 0.06 0.13 0.15 0.61 0.00 0.00 0.00 175.10 176.05 3g1f n GLY 156 N 4.34 3.39 3.67 4.51 0.00 -1.16 0.14 105.19 120.07 3g1f n GLY 156 Ca -0.24 -1.92 -0.43 0.00 0.00 0.00 0.00 46.02 43.43 3g1f n GLY 156 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3g1f s PRO 157 N -2.97 4.31 0.00 1.61 0.04 -1.03 -4.21 135.00 132.75 3g1f s PRO 157 Ca 0.21 1.37 0.29 0.00 0.04 0.00 0.00 61.00 62.91 3g1f s PRO 157 Cb 0.01 -3.61 1.32 0.00 0.04 0.00 0.00 34.50 32.25 3g1f s PRO 157 CO 0.15 -0.54 1.93 0.45 0.04 0.00 0.00 177.00 179.03 3g1f n SER 158 N 5.94 0.20 0.11 6.66 2.88 -1.26 -3.53 113.62 124.62 3g1f n SER 158 Ca 0.11 -0.21 0.06 0.00 -1.33 0.00 0.00 58.87 57.51 3g1f n SER 158 Cb 0.47 -0.21 0.01 0.00 -0.75 0.00 0.00 64.21 63.73 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 0.20 0.33 -2.83 2.46 1.35 -1.90 -3.41 112.91 109.10 3g1f h THR 159 Ca 0.00 -1.55 -0.65 0.00 -0.55 0.00 0.00 66.41 63.66 3g1f h THR 159 Cb 0.36 1.94 -0.39 0.00 -1.73 0.00 0.00 68.15 68.32 3g1f h THR 159 CO 0.00 0.19 -0.34 0.54 -0.25 0.00 0.00 175.52 175.66 3g1f n ARG 160 N -2.93 2.51 -0.18 4.72 1.74 -1.23 -4.95 116.66 116.33 3g1f n ARG 160 Ca -0.02 -4.56 -0.06 0.00 -0.77 0.00 0.00 57.85 52.44 3g1f n ARG 160 Cb 0.67 -2.33 -0.00 0.00 -1.02 0.00 0.00 32.46 29.78 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 5.13 -0.18 0.00 5.56 0.11 -1.81 0.26 132.00 141.07 3g1f h PRO 161 Ca 0.17 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.30 3g1f h PRO 161 Cb 0.72 0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.87 3g1f h PRO 161 CO 0.85 -0.12 0.10 -0.85 -0.21 0.00 0.00 178.00 177.77 3g1f n GLU 162 N -5.43 0.05 -0.13 1.05 0.00 -1.26 -0.24 120.64 114.68 3g1f n GLU 162 Ca 0.03 0.50 -0.21 0.00 0.00 0.00 0.00 57.16 57.48 3g1f n GLU 162 Cb 0.35 -1.77 -0.11 0.00 0.00 0.00 0.00 31.44 29.91 3g1f n GLU 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 3g1f n ARG 163 N -1.73 0.63 0.18 3.44 5.12 0.60 -4.00 116.66 120.89 3g1f n ARG 163 Ca -0.01 0.18 -0.15 0.00 -1.93 0.00 0.00 57.85 55.95 3g1f n ARG 163 Cb 0.11 -1.51 -0.08 0.00 -1.16 0.00 0.00 32.46 29.83 3g1f n ARG 163 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 3g1f h LEU 164 N -0.25 -0.33 -1.81 0.55 5.85 0.21 -1.92 115.31 117.61 3g1f h LEU 164 Ca -0.61 0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.19 3g1f h LEU 164 Cb 1.82 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.91 3g1f h LEU 164 CO -0.17 -0.23 0.28 -1.28 -0.34 0.00 0.00 178.44 176.69 3g1f h SER 165 N -0.40 0.20 0.48 1.25 0.87 -0.86 0.23 113.55 115.33 3g1f h SER 165 Ca -0.04 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.47 3g1f h SER 165 Cb 0.30 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 3g1f h SER 165 CO 0.07 0.13 -0.22 -0.09 -0.53 0.00 0.00 176.83 176.18 3g1f h ARG 166 N 0.23 0.00 0.14 2.24 2.43 -1.50 -3.00 114.38 114.92 3g1f h ARG 166 Ca 0.18 0.00 -0.23 0.00 -0.81 0.00 0.00 59.98 59.13 3g1f h ARG 166 Cb 0.43 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.99 3g1f h ARG 166 CO -0.03 0.22 -1.06 -0.07 -1.51 0.00 0.00 179.97 177.52 3g1f h LEU 167 N 0.00 0.46 -1.21 3.80 3.38 0.03 -3.22 115.31 118.56 3g1f h LEU 167 Ca -0.00 -0.92 0.30 0.00 0.09 0.00 0.00 57.88 57.35 3g1f h LEU 167 Cb 0.52 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 3g1f h LEU 167 CO 0.03 1.49 1.15 -0.09 0.09 0.00 0.00 178.44 181.11 3g1f h ARG 168 N -0.32 0.00 0.00 1.13 9.65 -1.15 -1.33 114.38 122.37 3g1f h ARG 168 Ca -0.20 0.00 -0.44 0.00 -1.10 0.00 0.00 59.98 58.23 3g1f h ARG 168 Cb 1.72 0.00 -0.07 0.00 -1.39 0.00 0.00 29.97 30.23 3g1f h ARG 168 CO 0.13 0.00 -2.45 -0.85 2.80 0.00 0.00 179.97 179.60 3g1f n GLU 169 N -3.34 0.59 0.05 0.20 0.28 -1.24 -2.44 120.64 114.73 3g1f n GLU 169 Ca 0.23 0.28 0.20 0.00 -0.16 0.00 0.00 57.16 57.71 3g1f n GLU 169 Cb 1.47 -1.51 0.56 0.00 1.43 0.00 0.00 31.44 33.38 3g1f n GLU 169 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 3g1f h ILE 170 N -0.92 0.14 0.00 3.84 2.04 -1.25 0.63 117.51 121.99 3g1f h ILE 170 Ca -0.67 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.08 3g1f h ILE 170 Cb 1.62 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 38.02 3g1f h ILE 170 CO -0.38 0.00 -1.61 2.30 0.00 0.00 0.00 178.15 178.46 3g1f n ILE 171 N -3.28 0.43 0.00 -0.67 -5.35 -1.08 -4.81 119.36 104.60 3g1f n ILE 171 Ca 0.11 -0.35 0.00 0.00 -0.27 0.00 0.00 62.75 62.23 3g1f n ILE 171 Cb 0.96 -0.38 0.00 0.00 -1.74 0.00 0.00 39.64 38.47 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 2.22 -3.86 0.02 3.28 0.00 0.22 -4.49 105.19 102.57 3g1f n GLY 172 Ca -0.11 -2.12 0.11 0.00 0.00 0.00 0.00 46.02 43.90 3g1f n GLY 172 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3g1f n GLN 173 N -0.03 0.20 0.00 1.61 1.13 -1.25 -3.94 117.38 115.10 3g1f n GLN 173 Ca 0.00 -0.02 0.12 0.00 -1.94 0.00 0.00 57.00 55.17 3g1f n GLN 173 Cb 0.00 -1.55 0.65 0.00 0.11 0.00 0.00 30.24 29.46 3g1f n GLN 173 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 3g1f n ASP 174 N -1.79 0.00 -4.99 1.08 5.75 -1.26 -4.80 116.55 110.54 3g1f n ASP 174 Ca 0.03 -0.22 -0.21 0.00 -0.01 0.00 0.00 54.79 54.37 3g1f n ASP 174 Cb 0.40 -0.23 0.03 0.00 -1.03 0.00 0.00 41.12 40.30 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 -2.45 5.03 -0.11 -1.12 0.01 -1.25 -5.06 113.70 108.75 3g1f s SER 175 Ca 0.27 -0.90 0.01 0.00 1.31 0.00 0.00 55.95 56.64 3g1f s SER 175 Cb 0.17 0.16 0.02 0.00 0.21 0.00 0.00 66.02 66.57 3g1f s SER 175 CO 0.36 -1.16 -0.13 0.12 0.41 0.00 0.00 173.24 172.84 3g1f s PHE 176 N -2.64 1.78 0.06 2.43 5.36 0.12 -5.01 117.98 120.08 3g1f s PHE 176 Ca 0.53 -0.85 0.01 0.00 -0.96 0.00 0.00 56.93 55.66 3g1f s PHE 176 Cb -0.05 -1.34 -0.03 0.00 -0.34 0.00 0.00 43.02 41.26 3g1f s PHE 176 CO 0.33 -0.48 -0.06 -0.48 -1.46 0.00 0.00 175.22 173.07 3g1f s LEU 177 N 1.18 2.39 0.08 6.12 0.05 -1.26 -0.44 118.68 126.80 3g1f s LEU 177 Ca -0.03 -0.80 0.04 0.00 0.05 0.00 0.00 54.13 53.39 3g1f s LEU 177 Cb -0.14 -0.02 -0.03 0.00 -2.05 0.00 0.00 46.19 43.95 3g1f s LEU 177 CO -0.04 -0.39 -0.11 0.27 -0.55 0.00 0.00 176.35 175.53 3g1f s ILE 178 N -2.71 0.94 -0.11 1.48 -4.36 -0.37 -1.67 121.20 114.39 3g1f s ILE 178 Ca 0.00 -1.40 -0.01 0.00 -0.26 0.00 0.00 60.65 58.99 3g1f s ILE 178 Cb -0.01 -1.10 0.03 0.00 1.25 0.00 0.00 42.46 42.63 3g1f s ILE 178 CO -0.04 -0.39 -0.06 -0.44 0.24 0.00 0.00 174.94 174.25 3g1f s SER 179 N -2.00 2.09 0.00 4.36 0.01 -0.60 -2.98 113.70 114.57 3g1f s SER 179 Ca -0.00 -0.28 0.00 0.00 1.31 0.00 0.00 55.95 56.98 3g1f s SER 179 Cb -0.07 -0.76 0.00 0.00 0.21 0.00 0.00 66.02 65.40 3g1f s SER 179 CO 0.01 -0.14 0.00 -0.81 0.41 0.00 0.00 173.24 172.71 3g1f n PRO 180 N 4.99 0.00 0.00 12.44 -0.04 -1.26 -2.14 135.00 148.98 3g1f n PRO 180 Ca -0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 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 2.39 0.09 3.43 0.55 0.00 -1.26 -4.22 105.19 106.17 3g1f n GLY 181 Ca 0.00 0.30 -0.47 0.00 0.00 0.00 0.00 46.02 45.85 3g1f n GLY 181 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3g1f n VAL 182 N 0.00 0.03 0.00 1.61 0.31 -0.52 -3.25 118.33 116.51 3g1f n VAL 182 Ca 0.00 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 3g1f n VAL 182 Cb 0.00 -1.08 0.00 0.00 -0.91 0.00 0.00 33.84 31.85 3g1f n VAL 182 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3g1f n GLY 183 N 6.70 0.00 0.00 2.92 0.00 -1.25 -3.99 105.19 109.56 3g1f n GLY 183 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.56 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 0.00 0.00 0.27 4.61 0.00 -1.20 0.20 120.51 124.39 3g1f n ALA 184 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3g1f n ALA 184 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3g1f n ALA 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g1f n GLN 185 N 0.00 0.16 0.00 0.00 10.64 -1.24 -4.88 117.38 122.05 3g1f n GLN 185 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 3g1f n GLN 185 Cb 0.00 -1.02 0.00 0.00 -0.86 0.00 0.00 30.24 28.36 3g1f n GLN 185 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3g1f n GLY 186 N -0.12 1.29 0.00 2.61 0.00 -1.26 -4.94 105.19 102.78 3g1f n GLY 186 Ca 0.00 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 43.88 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 0.09 0.90 3.52 -0.02 0.00 -1.26 -1.44 105.19 106.98 3g1f n GLY 187 Ca 0.00 -1.32 -0.28 0.00 0.00 0.00 0.00 46.02 44.43 3g1f n GLY 187 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3g1f s ASP 188 N -0.16 4.02 0.00 1.61 3.84 -1.26 -4.31 116.67 120.41 3g1f s ASP 188 Ca 0.00 -0.60 0.00 0.00 -0.00 0.00 0.00 52.55 51.95 3g1f s ASP 188 Cb 0.00 -0.60 0.00 0.00 -1.38 0.00 0.00 42.92 40.94 3g1f s ASP 188 CO 0.00 0.14 0.00 -2.65 -0.00 0.00 0.00 175.17 172.66 3g1f n PRO 189 N 0.38 0.00 -0.17 2.11 -0.02 -1.26 -2.45 135.00 133.60 3g1f n PRO 189 Ca -0.13 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.31 3g1f n PRO 189 Cb 0.54 -0.49 -0.04 0.00 -0.02 0.00 0.00 33.50 33.50 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 0.00 -1.04 0.28 -1.23 0.00 -1.22 -0.09 105.19 101.87 3g1f n GLY 190 Ca 0.00 0.48 0.08 0.00 0.00 0.00 0.00 46.02 46.58 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 0.10 0.03 1.61 4.39 -1.95 -1.08 114.58 117.69 3g1f h GLU 191 Ca 0.07 -0.01 -0.23 0.00 0.34 0.00 0.00 59.36 59.54 3g1f h GLU 191 Cb 0.17 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.78 3g1f h GLU 191 CO -0.39 0.07 -1.09 1.15 -1.16 0.00 0.00 179.01 177.59 3g1f h THR 192 N 0.11 1.63 0.00 1.13 2.02 -0.16 -3.37 112.91 114.27 3g1f h THR 192 Ca 0.04 -3.31 -0.19 0.00 0.77 0.00 0.00 66.41 63.73 3g1f h THR 192 Cb 0.04 2.86 -0.01 0.00 -1.74 0.00 0.00 68.15 69.29 3g1f h THR 192 CO -0.01 0.94 1.11 0.18 0.37 0.00 0.00 175.52 178.11 3g1f n LEU 193 N -3.39 3.16 0.07 2.58 4.77 -0.41 -3.04 117.00 120.75 3g1f n LEU 193 Ca -0.03 -2.11 0.00 0.00 -0.03 0.00 0.00 56.01 53.84 3g1f n LEU 193 Cb 0.97 -0.81 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 3g1f n LEU 193 CO 0.49 0.41 -0.02 0.54 -1.33 0.00 0.00 177.39 177.47 3g1f n ARG 194 N 3.49 0.00 0.00 3.23 1.74 -1.26 -4.90 116.66 118.96 3g1f n ARG 194 Ca 0.27 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 57.44 3g1f n ARG 194 Cb 0.28 -0.04 -0.00 0.00 -1.02 0.00 0.00 32.46 31.67 3g1f n ARG 194 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3g1f n PHE 195 N -3.04 0.00 -4.22 -1.55 3.01 -1.21 -4.89 117.46 105.56 3g1f n PHE 195 Ca 0.00 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 58.13 3g1f n PHE 195 Cb 0.02 0.00 -0.16 0.00 -0.01 0.00 0.00 39.48 39.34 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 -2.03 2.44 0.24 4.37 0.00 -1.17 -4.73 121.76 120.88 3g1f s ALA 196 Ca 0.15 -1.16 -0.05 0.00 0.00 0.00 0.00 51.96 50.89 3g1f s ALA 196 Cb 0.14 -1.26 0.35 0.00 0.00 0.00 0.00 23.12 22.34 3g1f s ALA 196 CO 0.44 -0.27 1.84 -0.44 0.00 0.00 0.00 175.76 177.34 3g1f h ASP 197 N 7.79 0.81 -5.12 0.00 3.32 -1.65 -3.42 116.42 118.15 3g1f h ASP 197 Ca -0.41 0.02 -0.11 0.00 0.02 0.00 0.00 57.03 56.55 3g1f h ASP 197 Cb 1.16 -0.15 -0.16 0.00 0.22 0.00 0.00 39.33 40.40 3g1f h ASP 197 CO 0.61 0.51 -0.43 0.00 -1.72 0.00 0.00 179.24 178.21 3g1f s ALA 198 N -6.06 -0.18 0.20 3.45 0.00 -1.22 -4.80 121.76 113.15 3g1f s ALA 198 Ca -0.13 -0.53 0.10 0.00 0.00 0.00 0.00 51.96 51.40 3g1f s ALA 198 Cb 0.19 0.35 -0.04 0.00 0.00 0.00 0.00 23.12 23.61 3g1f s ALA 198 CO 0.79 -0.40 -0.11 0.96 0.00 0.00 0.00 175.76 176.99 3g1f s ILE 199 N -3.13 3.03 -0.06 0.00 -4.36 -0.74 -1.56 121.20 114.39 3g1f s ILE 199 Ca -0.01 -1.81 0.00 0.00 -0.26 0.00 0.00 60.65 58.57 3g1f s ILE 199 Cb 0.02 -2.52 -0.03 0.00 1.25 0.00 0.00 42.46 41.17 3g1f s ILE 199 CO -0.07 -0.17 -0.03 -0.63 0.24 0.00 0.00 174.94 174.28 3g1f s ILE 200 N -1.85 4.04 -0.02 8.37 1.01 -0.91 -0.11 121.20 131.73 3g1f s ILE 200 Ca 0.25 -0.43 0.01 0.00 0.00 0.00 0.00 60.65 60.48 3g1f s ILE 200 Cb -0.08 -2.71 0.01 0.00 0.01 0.00 0.00 42.46 39.69 3g1f s ILE 200 CO 0.15 0.54 -0.04 -0.69 0.00 0.00 0.00 174.94 174.90 3g1f s VAL 201 N -0.91 0.38 0.00 2.92 1.01 0.04 -4.33 120.40 119.51 3g1f s VAL 201 Ca 0.15 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.02 3g1f s VAL 201 Cb -0.11 -0.39 0.00 0.00 0.00 0.00 0.00 36.38 35.88 3g1f s VAL 201 CO 0.04 0.16 0.00 0.61 0.00 0.00 0.00 175.10 175.91 3g1f n GLY 202 N 3.62 0.63 0.34 4.51 0.00 -1.26 0.34 105.19 113.36 3g1f n GLY 202 Ca -0.21 -0.01 0.01 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.03 0.00 1.61 3.08 -1.84 0.46 114.38 117.66 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 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.06 3g1f h ARG 203 CO 0.00 -0.02 0.39 0.45 -1.07 0.00 0.00 179.97 179.71 3g1f n SER 204 N -5.51 0.05 0.09 7.04 2.88 0.54 -2.67 113.62 116.03 3g1f n SER 204 Ca 0.11 0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.88 3g1f n SER 204 Cb 0.41 -0.19 0.00 0.00 -0.75 0.00 0.00 64.21 63.68 3g1f n SER 204 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 3g1f n ILE 205 N -1.37 0.45 0.21 2.46 5.41 0.15 -4.75 119.36 121.92 3g1f n ILE 205 Ca -0.00 0.15 0.10 0.00 1.00 0.00 0.00 62.75 64.00 3g1f n ILE 205 Cb 0.39 -0.98 0.50 0.00 -0.71 0.00 0.00 39.64 38.84 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 -3.35 0.66 0.19 1.39 0.18 -0.63 -2.53 117.16 113.07 3g1f n TYR 206 Ca 0.00 0.32 0.11 0.00 1.88 0.00 0.00 57.90 60.21 3g1f n TYR 206 Cb 0.04 -1.01 -0.14 0.00 -0.38 0.00 0.00 39.34 37.85 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 -2.16 0.24 -4.84 -3.48 4.77 -1.09 -4.98 117.00 105.47 3g1f n LEU 207 Ca -0.00 -0.06 -0.32 0.00 -0.03 0.00 0.00 56.01 55.59 3g1f n LEU 207 Cb 0.08 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.10 3g1f n LEU 207 CO 0.11 0.03 0.53 0.00 -1.33 0.00 0.00 177.39 176.73 3g1f s ALA 208 N -3.41 3.20 0.01 -1.18 0.00 -1.05 -5.01 121.76 114.32 3g1f s ALA 208 Ca -0.04 0.18 -0.03 0.00 0.00 0.00 0.00 51.96 52.06 3g1f s ALA 208 Cb 0.14 -2.94 -0.01 0.00 0.00 0.00 0.00 23.12 20.32 3g1f s ALA 208 CO 0.89 0.19 1.05 -0.44 0.00 0.00 0.00 175.76 177.46 3g1f h ASP 209 N 1.97 -0.19 -3.75 0.00 5.19 -1.94 -3.23 116.42 114.47 3g1f h ASP 209 Ca -0.48 0.03 -0.77 0.00 -0.62 0.00 0.00 57.03 55.19 3g1f h ASP 209 Cb 1.18 0.08 -0.29 0.00 0.18 0.00 0.00 39.33 40.48 3g1f h ASP 209 CO 0.63 -0.03 0.10 0.21 -3.12 0.00 0.00 179.24 177.04 3g1f s ASN 210 N -3.15 6.59 0.35 6.45 3.84 -1.26 -4.90 114.94 122.86 3g1f s ASN 210 Ca -0.01 -3.10 0.08 0.00 0.21 0.00 0.00 52.86 50.04 3g1f s ASN 210 Cb 0.01 -2.12 0.80 0.00 -0.55 0.00 0.00 41.25 39.39 3g1f s ASN 210 CO 0.06 -0.41 1.86 1.55 -2.79 0.00 0.00 177.10 177.36 3g1f h PRO 211 N 7.14 0.70 -0.31 0.43 0.13 -1.75 0.69 132.00 139.02 3g1f h PRO 211 Ca 0.12 -0.04 0.02 0.00 -0.87 0.00 0.00 66.00 65.22 3g1f h PRO 211 Cb 0.95 -0.16 -0.02 0.00 0.13 0.00 0.00 31.00 31.90 3g1f h PRO 211 CO 0.83 0.46 0.17 0.00 -0.23 0.00 0.00 178.00 179.23 3g1f h ALA 212 N 1.60 0.39 -0.23 -0.56 0.00 -1.91 0.49 119.26 119.03 3g1f h ALA 212 Ca 0.46 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 55.18 3g1f h ALA 212 Cb 0.73 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.45 3g1f h ALA 212 CO -0.22 -0.20 -0.64 0.00 0.00 0.00 0.00 179.25 178.18 3g1f h ALA 213 N 1.15 0.42 -0.85 0.00 0.00 -1.49 0.55 119.26 119.04 3g1f h ALA 213 Ca 0.13 -0.55 0.13 0.00 0.00 0.00 0.00 54.91 54.61 3g1f h ALA 213 Cb 0.02 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 17.68 3g1f h ALA 213 CO -0.08 0.68 0.46 0.00 0.00 0.00 0.00 179.25 180.32 3g1f h ALA 214 N 0.66 1.25 0.08 0.00 0.00 0.93 0.45 119.26 122.64 3g1f h ALA 214 Ca -0.01 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3g1f h ALA 214 Cb 1.26 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3g1f h ALA 214 CO 0.14 -0.00 -0.04 0.00 0.00 0.00 0.00 179.25 179.35 3g1f h ALA 215 N 1.52 -0.11 -0.68 0.00 0.00 0.21 -2.76 119.26 117.44 3g1f h ALA 215 Ca 0.44 -0.28 0.13 0.00 0.00 0.00 0.00 54.91 55.20 3g1f h ALA 215 Cb 0.54 0.04 -0.13 0.00 0.00 0.00 0.00 17.79 18.24 3g1f h ALA 215 CO -0.31 -0.20 -0.20 0.00 0.00 0.00 0.00 179.25 178.53 3g1f h ALA 216 N -0.12 0.37 0.10 0.00 0.00 0.69 0.86 119.26 121.15 3g1f h ALA 216 Ca -0.01 0.25 0.02 0.00 0.00 0.00 0.00 54.91 55.17 3g1f h ALA 216 Cb 0.60 0.58 -0.04 0.00 0.00 0.00 0.00 17.79 18.93 3g1f h ALA 216 CO 0.02 -0.46 -0.27 0.78 0.00 0.00 0.00 179.25 179.31 3g1f h GLY 217 N -0.03 -0.49 1.17 0.00 0.00 -0.18 0.11 103.07 103.65 3g1f h GLY 217 Ca 0.32 0.32 0.01 0.00 0.00 0.00 0.00 47.33 47.97 3g1f h GLY 217 CO -0.71 -0.22 0.41 -2.22 0.00 0.00 0.00 176.54 173.79 3g1f h ILE 218 N -0.47 0.01 0.09 2.60 2.04 -0.59 0.42 117.51 121.60 3g1f h ILE 218 Ca 0.04 0.00 -0.28 0.00 1.00 0.00 0.00 64.86 65.62 3g1f h ILE 218 Cb 0.51 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 3g1f h ILE 218 CO -0.17 0.00 -1.37 0.40 0.00 0.00 0.00 178.15 177.01 3g1f h ILE 219 N 0.00 1.33 0.00 -0.67 2.04 0.80 -3.23 117.51 117.78 3g1f h ILE 219 Ca 0.01 -2.98 -0.05 0.00 1.00 0.00 0.00 64.86 62.84 3g1f h ILE 219 Cb 0.83 2.80 -0.01 0.00 -0.74 0.00 0.00 36.82 39.70 3g1f h ILE 219 CO -0.00 0.84 -0.23 -0.33 0.00 0.00 0.00 178.15 178.43 3g1f h GLU 220 N 0.05 0.00 -0.68 2.37 4.39 0.35 0.22 114.58 121.28 3g1f h GLU 220 Ca -0.17 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.53 3g1f h GLU 220 Cb 1.95 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.60 3g1f h GLU 220 CO 0.16 0.23 0.00 -1.13 -1.16 0.00 0.00 179.01 177.11 3g1f n SER 221 N -3.72 1.41 0.00 1.42 3.41 -0.98 -2.47 113.62 112.69 3g1f n SER 221 Ca -0.01 -2.10 0.00 0.00 -0.26 0.00 0.00 58.87 56.49 3g1f n SER 221 Cb 0.34 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 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 0.02 0.00 0.28 -1.33 5.41 0.67 -3.46 119.36 120.95 3g1f n ILE 222 Ca 0.04 -0.14 0.15 0.00 1.00 0.00 0.00 62.75 63.80 3g1f n ILE 222 Cb 0.31 0.69 0.82 0.00 -0.71 0.00 0.00 39.64 40.74 3g1f n ILE 222 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 3g1f h LYS 223 N 0.00 0.00 -0.16 0.38 1.79 -1.00 -1.29 116.57 116.30 3g1f h LYS 223 Ca 0.00 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.38 3g1f h LYS 223 Cb 0.00 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 3g1f h LYS 223 CO 0.00 0.07 -0.30 -0.44 -1.08 0.00 0.00 179.45 177.71 3g1f h ASP 224 N 0.00 0.30 0.00 0.86 5.19 -1.84 -3.52 116.42 117.41 3g1f h ASP 224 Ca -0.00 -0.10 0.00 0.00 -0.62 0.00 0.00 57.03 56.31 3g1f h ASP 224 Cb 0.28 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.71 3g1f h ASP 224 CO 0.01 0.60 0.00 0.00 -3.12 0.00 0.00 179.24 176.73