#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g1x n MET 12 N 0.00 2.32 -1.43 5.55 0.00 -1.26 -1.60 117.12 120.71 3g1x n MET 12 Ca 0.00 0.84 -0.15 0.00 -0.00 0.00 0.00 57.70 58.39 3g1x n MET 12 Cb 0.00 -2.65 -0.07 0.00 0.00 0.00 0.00 33.22 30.50 3g1x n MET 12 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 3g1x n ASN 13 N 4.39 -4.98 -2.19 6.12 3.02 -1.26 -2.36 115.26 117.99 3g1x n ASN 13 Ca 0.18 0.38 -0.13 0.00 -0.03 0.00 0.00 54.58 54.98 3g1x n ASN 13 Cb 0.31 -4.17 -0.02 0.00 -0.61 0.00 0.00 39.78 35.29 3g1x n ASN 13 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3g1x n ARG 14 N -1.68 -1.99 -4.01 3.52 1.74 -0.63 -4.93 116.66 108.69 3g1x n ARG 14 Ca -0.15 0.64 -0.30 0.00 -0.77 0.00 0.00 57.85 57.27 3g1x n ARG 14 Cb 0.58 -5.16 -0.16 0.00 -1.02 0.00 0.00 32.46 26.70 3g1x n ARG 14 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3g1x s LEU 15 N -5.17 1.84 -0.20 0.55 2.96 -1.00 -1.10 118.68 116.57 3g1x s LEU 15 Ca 0.00 -0.60 -0.05 0.00 -0.22 0.00 0.00 54.13 53.26 3g1x s LEU 15 Cb 0.00 -1.18 -0.02 0.00 0.50 0.00 0.00 46.19 45.48 3g1x s LEU 15 CO 0.00 -0.08 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.30 3g1x s ILE 16 N 1.47 3.86 -0.13 6.68 1.01 0.18 -4.64 121.20 129.63 3g1x s ILE 16 Ca 0.03 -0.35 -0.26 0.00 0.00 0.00 0.00 60.65 60.08 3g1x s ILE 16 Cb -0.14 -2.74 -0.02 0.00 0.01 0.00 0.00 42.46 39.57 3g1x s ILE 16 CO -0.10 0.44 0.85 -0.22 0.00 0.00 0.00 174.94 175.91 3g1x s LEU 17 N 0.97 4.23 -0.61 2.97 2.96 -1.04 -0.86 118.68 127.29 3g1x s LEU 17 Ca 0.01 1.27 -0.19 0.00 -0.22 0.00 0.00 54.13 55.00 3g1x s LEU 17 Cb -0.14 -3.29 0.10 0.00 0.50 0.00 0.00 46.19 43.36 3g1x s LEU 17 CO 0.02 -0.35 0.74 0.00 -1.32 0.00 0.00 176.35 175.44 3g1x s ALA 18 N 1.80 3.39 -1.01 5.97 0.00 -0.13 -0.14 121.76 131.64 3g1x s ALA 18 Ca 0.41 -2.21 -0.18 0.00 0.00 0.00 0.00 51.96 49.98 3g1x s ALA 18 Cb -0.17 -3.58 0.13 0.00 0.00 0.00 0.00 23.12 19.50 3g1x s ALA 18 CO 0.15 -2.41 1.26 1.41 0.00 0.00 0.00 175.76 176.17 3g1x s MET 19 N 2.82 3.72 -0.18 0.00 1.75 -0.53 -4.36 119.30 122.51 3g1x s MET 19 Ca 0.13 -1.85 0.16 0.00 -1.25 0.00 0.00 55.69 52.87 3g1x s MET 19 Cb -0.23 -5.03 0.68 0.00 2.84 0.00 0.00 34.83 33.09 3g1x s MET 19 CO 0.06 -1.85 1.60 -0.25 -0.65 0.00 0.00 175.02 173.92 3g1x n ASP 20 N 6.76 4.80 -4.77 1.11 8.00 -1.26 -4.38 116.55 126.81 3g1x n ASP 20 Ca 0.29 -2.82 -0.32 0.00 0.71 0.00 0.00 54.79 52.65 3g1x n ASP 20 Cb 0.48 -0.59 0.06 0.00 -0.02 0.00 0.00 41.12 41.05 3g1x n ASP 20 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3g1x s LEU 21 N -2.51 3.26 -0.10 0.64 1.43 -1.26 -4.65 118.68 115.49 3g1x s LEU 21 Ca 0.48 1.93 0.14 0.00 -1.03 0.00 0.00 54.13 55.66 3g1x s LEU 21 Cb 0.36 -4.54 0.47 0.00 0.03 0.00 0.00 46.19 42.51 3g1x s LEU 21 CO 0.15 -1.77 1.39 0.23 0.23 0.00 0.00 176.35 176.58 3g1x n MET 22 N -2.81 3.06 -4.07 1.70 2.81 -1.26 -3.98 117.12 112.57 3g1x n MET 22 Ca 0.10 -2.53 -0.14 0.00 -1.81 0.00 0.00 57.70 53.32 3g1x n MET 22 Cb 0.52 -1.62 -0.14 0.00 -0.71 0.00 0.00 33.22 31.27 3g1x n MET 22 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3g1x s ASN 23 N -1.38 0.47 0.19 7.83 2.20 -1.26 -4.69 114.94 118.29 3g1x s ASN 23 Ca 0.36 -0.13 -0.12 0.00 -0.94 0.00 0.00 52.86 52.03 3g1x s ASN 23 Cb 0.25 -0.03 0.18 0.00 -2.00 0.00 0.00 41.25 39.64 3g1x s ASN 23 CO 0.14 0.01 1.77 0.08 -2.94 0.00 0.00 177.10 176.16 3g1x h ARG 24 N 5.85 0.43 -0.08 3.55 0.11 -1.94 -1.29 114.38 121.01 3g1x h ARG 24 Ca -0.28 -0.03 0.03 0.00 0.10 0.00 0.00 59.98 59.81 3g1x h ARG 24 Cb 1.20 -0.10 -0.03 0.00 1.11 0.00 0.00 29.97 32.15 3g1x h ARG 24 CO 0.49 0.29 -0.10 -0.44 0.10 0.00 0.00 179.97 180.31 3g1x h ASP 25 N 0.45 -0.31 -0.41 0.08 3.32 -1.99 0.50 116.42 118.06 3g1x h ASP 25 Ca 0.25 0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.31 3g1x h ASP 25 Cb 0.21 0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.90 3g1x h ASP 25 CO -0.21 -0.14 0.10 0.44 -1.72 0.00 0.00 179.24 177.72 3g1x h ASP 26 N -0.13 0.62 -0.33 6.45 3.45 -1.96 0.29 116.42 124.81 3g1x h ASP 26 Ca 0.07 -0.23 -0.00 0.00 0.43 0.00 0.00 57.03 57.30 3g1x h ASP 26 Cb 0.23 -0.16 -0.02 0.00 -0.56 0.00 0.00 39.33 38.82 3g1x h ASP 26 CO -0.16 0.69 0.21 0.00 -1.57 0.00 0.00 179.24 178.40 3g1x h ALA 27 N 0.96 0.42 -0.41 3.45 0.00 -1.00 -0.66 119.26 122.02 3g1x h ALA 27 Ca 0.13 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 3g1x h ALA 27 Cb 0.31 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3g1x h ALA 27 CO 0.00 -0.09 -0.33 -0.07 0.00 0.00 0.00 179.25 178.76 3g1x h LEU 28 N 0.44 1.00 0.07 0.00 3.38 -0.84 -2.00 115.31 117.36 3g1x h LEU 28 Ca 0.12 -0.43 -0.00 0.00 0.09 0.00 0.00 57.88 57.66 3g1x h LEU 28 Cb -0.01 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.46 3g1x h LEU 28 CO -0.02 1.23 -0.04 -0.09 0.09 0.00 0.00 178.44 179.61 3g1x h ARG 29 N 0.79 -0.10 -0.60 1.13 2.43 -0.72 -0.44 114.38 116.87 3g1x h ARG 29 Ca 0.08 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.21 3g1x h ARG 29 Cb 0.92 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.46 3g1x h ARG 29 CO 0.09 0.02 0.20 0.28 -1.51 0.00 0.00 179.97 179.04 3g1x h VAL 30 N -0.19 1.24 -0.80 0.20 2.07 -1.16 -1.27 116.25 116.35 3g1x h VAL 30 Ca -0.01 -0.81 -0.03 0.00 0.82 0.00 0.00 66.70 66.67 3g1x h VAL 30 Cb 0.16 0.63 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 3g1x h VAL 30 CO 0.02 0.31 0.38 0.74 0.02 0.00 0.00 177.57 179.04 3g1x h THR 31 N 0.85 1.25 -0.57 2.57 2.02 -1.27 -1.80 112.91 115.96 3g1x h THR 31 Ca 0.20 -0.70 -0.04 0.00 0.77 0.00 0.00 66.41 66.63 3g1x h THR 31 Cb 0.28 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 66.89 3g1x h THR 31 CO -0.01 0.30 0.18 1.23 0.37 0.00 0.00 175.52 177.59 3g1x h GLY 32 N 1.16 0.92 2.00 2.16 0.00 -0.60 -0.59 103.07 108.13 3g1x h GLY 32 Ca 0.28 -0.51 -0.02 0.00 0.00 0.00 0.00 47.33 47.08 3g1x h GLY 32 CO -0.03 0.48 -0.12 0.83 0.00 0.00 0.00 176.54 177.69 3g1x h GLU 33 N 0.84 0.00 -0.17 4.80 5.08 -0.37 -2.96 114.58 121.80 3g1x h GLU 33 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 3g1x h GLU 33 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 3g1x h GLU 33 CO -0.01 0.12 0.00 1.33 -1.00 0.00 0.00 179.01 179.45 3g1x n VAL 34 N -4.07 1.31 0.25 3.13 0.24 -0.92 -4.41 118.33 113.85 3g1x n VAL 34 Ca -0.02 -1.30 0.12 0.00 -2.04 0.00 0.00 64.34 61.10 3g1x n VAL 34 Cb 0.20 0.29 0.77 0.00 -1.47 0.00 0.00 33.84 33.63 3g1x n VAL 34 CO 0.00 0.00 0.00 0.08 -2.14 0.00 0.00 176.83 174.77 3g1x h ARG 35 N 1.02 0.00 0.00 7.34 0.11 -0.94 -1.60 114.38 120.30 3g1x h ARG 35 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3g1x h ARG 35 Cb 0.79 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.87 3g1x h ARG 35 CO 0.03 0.00 0.00 1.05 0.10 0.00 0.00 179.97 181.15 3g1x h GLU 36 N 0.00 0.00 0.00 0.08 4.11 -1.84 -3.14 114.58 113.79 3g1x h GLU 36 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.45 3g1x h GLU 36 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 3g1x h GLU 36 CO -0.00 0.00 -1.06 0.66 0.07 0.00 0.00 179.01 178.68 3g1x n TYR 37 N -2.54 0.00 -4.23 2.06 4.02 -0.61 -5.02 117.16 110.85 3g1x n TYR 37 Ca 0.02 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.78 3g1x n TYR 37 Cb 0.28 -0.08 -0.10 0.00 -0.02 0.00 0.00 39.34 39.42 3g1x n TYR 37 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 3g1x s ILE 38 N -2.87 0.55 0.00 -0.72 -4.36 -1.19 -4.52 121.20 108.08 3g1x s ILE 38 Ca 0.05 -1.97 0.00 0.00 -0.26 0.00 0.00 60.65 58.47 3g1x s ILE 38 Cb 0.14 -2.14 0.00 0.00 1.25 0.00 0.00 42.46 41.71 3g1x s ILE 38 CO 0.78 -0.44 0.40 -0.90 0.24 0.00 0.00 174.94 175.02 3g1x n ASP 39 N -0.23 0.00 -3.73 4.36 5.75 -1.26 -4.83 116.55 116.61 3g1x n ASP 39 Ca -0.06 -1.00 -0.17 0.00 -0.01 0.00 0.00 54.79 53.55 3g1x n ASP 39 Cb 0.64 0.00 -0.17 0.00 -1.03 0.00 0.00 41.12 40.56 3g1x n ASP 39 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3g1x s THR 40 N 0.00 -0.08 -0.04 2.12 2.01 -1.26 -0.39 115.64 117.99 3g1x s THR 40 Ca 0.00 0.30 0.04 0.00 0.31 0.00 0.00 61.69 62.34 3g1x s THR 40 Cb 0.00 -0.11 -0.00 0.00 0.01 0.00 0.00 72.50 72.40 3g1x s THR 40 CO 0.00 0.12 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.20 3g1x s VAL 41 N 1.49 1.39 -0.28 3.82 1.01 -0.44 -2.51 120.40 124.88 3g1x s VAL 41 Ca -0.04 -0.69 -0.12 0.00 0.00 0.00 0.00 61.98 61.14 3g1x s VAL 41 Cb -0.13 -1.20 -0.05 0.00 0.00 0.00 0.00 36.38 35.01 3g1x s VAL 41 CO -0.03 0.40 0.21 -0.75 0.00 0.00 0.00 175.10 174.93 3g1x s LYS 42 N 0.10 3.91 -0.15 2.72 2.20 0.81 -1.39 119.74 127.93 3g1x s LYS 42 Ca -0.05 -0.31 -0.03 0.00 -0.36 0.00 0.00 55.97 55.22 3g1x s LYS 42 Cb -0.12 -3.67 -0.03 0.00 -1.51 0.00 0.00 37.83 32.50 3g1x s LYS 42 CO 0.02 -0.21 -0.05 0.42 -0.36 0.00 0.00 175.35 175.17 3g1x s ILE 43 N 1.79 3.78 0.00 5.43 1.01 -0.25 -1.46 121.20 131.51 3g1x s ILE 43 Ca 0.08 -0.40 0.00 0.00 0.00 0.00 0.00 60.65 60.33 3g1x s ILE 43 Cb -0.16 -2.65 0.00 0.00 0.01 0.00 0.00 42.46 39.66 3g1x s ILE 43 CO 0.11 0.50 0.00 0.61 0.00 0.00 0.00 174.94 176.16 3g1x n GLY 44 N 3.48 5.10 0.23 6.18 0.00 -1.26 -0.91 105.19 118.02 3g1x n GLY 44 Ca -0.17 -2.14 0.01 0.00 0.00 0.00 0.00 46.02 43.71 3g1x n GLY 44 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3g1x h TYR 45 N 0.59 0.31 -0.75 1.61 0.99 -1.96 -2.00 116.97 115.77 3g1x h TYR 45 Ca 0.00 -0.05 0.10 0.00 2.00 0.00 0.00 58.73 60.78 3g1x h TYR 45 Cb 0.00 -0.08 -0.07 0.00 1.00 0.00 0.00 36.73 37.57 3g1x h TYR 45 CO 0.00 0.47 0.38 -1.35 -0.00 0.00 0.00 178.16 177.66 3g1x h PRO 46 N 0.27 0.62 0.13 4.88 0.11 -1.92 0.14 132.00 136.23 3g1x h PRO 46 Ca 0.05 -0.04 -0.19 0.00 0.11 0.00 0.00 66.00 65.94 3g1x h PRO 46 Cb 0.48 -0.14 0.02 0.00 0.11 0.00 0.00 31.00 31.47 3g1x h PRO 46 CO 0.03 0.41 -0.85 1.25 -0.21 0.00 0.00 178.00 178.63 3g1x h LEU 47 N 0.63 0.43 -0.73 2.35 5.85 -1.66 -3.19 115.31 118.99 3g1x h LEU 47 Ca 0.37 -0.94 -0.05 0.00 0.84 0.00 0.00 57.88 58.10 3g1x h LEU 47 Cb 0.40 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 3g1x h LEU 47 CO -0.28 1.40 0.24 0.58 -0.34 0.00 0.00 178.44 180.05 3g1x h VAL 48 N -0.41 1.26 0.00 1.05 2.07 -1.20 0.27 116.25 119.29 3g1x h VAL 48 Ca -0.16 -0.88 -0.09 0.00 0.82 0.00 0.00 66.70 66.39 3g1x h VAL 48 Cb 1.62 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 3g1x h VAL 48 CO 0.13 0.35 -0.44 -0.07 0.02 0.00 0.00 177.57 177.55 3g1x h LEU 49 N 1.07 0.00 0.13 2.57 3.38 -0.88 0.27 115.31 121.85 3g1x h LEU 49 Ca 0.24 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.91 3g1x h LEU 49 Cb 0.29 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 3g1x h LEU 49 CO -0.01 0.44 -1.46 0.28 0.09 0.00 0.00 178.44 177.78 3g1x h SER 50 N 0.00 0.42 -0.00 -0.43 0.02 -1.47 -3.40 113.55 108.69 3g1x h SER 50 Ca -0.00 -0.54 0.00 0.00 -0.84 0.00 0.00 61.79 60.41 3g1x h SER 50 Cb 0.97 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.37 3g1x h SER 50 CO 0.06 1.44 -0.19 -0.62 -1.14 0.00 0.00 176.83 176.38 3g1x n GLU 51 N -3.48 5.07 0.00 3.45 -0.58 0.06 -5.02 120.64 120.13 3g1x n GLU 51 Ca -0.15 -0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.53 3g1x n GLU 51 Cb 1.04 -0.74 0.00 0.00 -0.57 0.00 0.00 31.44 31.17 3g1x n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3g1x n GLY 52 N 1.03 1.82 0.26 0.62 0.00 0.94 -4.64 105.19 105.23 3g1x n GLY 52 Ca 0.01 -1.76 0.18 0.00 0.00 0.00 0.00 46.02 44.45 3g1x n GLY 52 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3g1x h MET 53 N 0.00 0.00 0.00 1.61 2.86 -1.94 -2.10 114.93 115.36 3g1x h MET 53 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3g1x h MET 53 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 3g1x h MET 53 CO 0.00 0.00 0.00 -0.44 1.06 0.00 0.00 176.91 177.53 3g1x h ASP 54 N 0.00 0.00 0.10 1.22 3.32 -1.93 -2.18 116.42 116.96 3g1x h ASP 54 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3g1x h ASP 54 Cb 0.15 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.70 3g1x h ASP 54 CO 0.00 0.00 -0.09 -0.29 -1.72 0.00 0.00 179.24 177.14 3g1x h ILE 55 N 0.00 1.03 -0.12 0.35 6.09 -1.64 -2.30 117.51 120.92 3g1x h ILE 55 Ca 0.00 -0.33 -0.01 0.00 -1.37 0.00 0.00 64.86 63.16 3g1x h ILE 55 Cb 0.16 1.18 -0.01 0.00 0.47 0.00 0.00 36.82 38.62 3g1x h ILE 55 CO 0.00 0.09 0.06 0.40 -3.07 0.00 0.00 178.15 175.63 3g1x h ILE 56 N 0.00 1.13 -0.39 2.19 2.04 -1.63 -1.48 117.51 119.36 3g1x h ILE 56 Ca -0.00 -0.37 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 3g1x h ILE 56 Cb 0.17 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 3g1x h ILE 56 CO 0.01 0.11 0.11 0.00 0.00 0.00 0.00 178.15 178.39 3g1x h ALA 57 N 0.92 1.46 -0.38 1.87 0.00 -1.53 -1.98 119.26 119.62 3g1x h ALA 57 Ca 0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3g1x h ALA 57 Cb 0.13 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3g1x h ALA 57 CO -0.00 0.40 0.20 0.93 0.00 0.00 0.00 179.25 180.78 3g1x h GLU 58 N 0.57 0.54 -0.38 0.00 4.39 -1.00 -1.51 114.58 117.19 3g1x h GLU 58 Ca 0.13 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.75 3g1x h GLU 58 Cb 0.19 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.72 3g1x h GLU 58 CO -0.01 0.46 0.18 0.74 -1.16 0.00 0.00 179.01 179.22 3g1x h PHE 59 N 0.49 0.55 -0.78 4.33 -1.00 -0.78 -0.78 116.94 118.98 3g1x h PHE 59 Ca 0.13 -0.03 -0.00 0.00 2.81 0.00 0.00 57.97 60.88 3g1x h PHE 59 Cb 0.08 -0.17 -0.04 0.00 3.61 0.00 0.00 35.95 39.43 3g1x h PHE 59 CO -0.02 0.46 0.47 0.00 -1.61 0.00 0.00 178.31 177.62 3g1x h ARG 60 N 0.48 1.05 -0.13 1.51 3.08 -1.19 -0.08 114.38 119.09 3g1x h ARG 60 Ca 0.13 -0.09 -0.21 0.00 0.07 0.00 0.00 59.98 59.88 3g1x h ARG 60 Cb 0.12 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 29.95 3g1x h ARG 60 CO -0.02 0.73 -0.76 -0.22 -1.07 0.00 0.00 179.97 178.64 3g1x h LYS 61 N 1.06 0.67 0.04 0.04 3.64 -1.15 0.18 116.57 121.04 3g1x h LYS 61 Ca 0.28 -0.54 -0.22 0.00 -1.27 0.00 0.00 60.65 58.90 3g1x h LYS 61 Cb -0.05 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 3g1x h LYS 61 CO -0.05 1.16 -1.00 0.00 -2.27 0.00 0.00 179.45 177.28 3g1x h ARG 62 N 0.46 0.19 0.00 1.90 3.08 -0.99 -3.38 114.38 115.64 3g1x h ARG 62 Ca -0.04 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.75 3g1x h ARG 62 Cb 1.37 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.50 3g1x h ARG 62 CO 0.15 1.04 -0.31 1.19 -1.07 0.00 0.00 179.97 180.97 3g1x n PHE 63 N -3.57 0.00 -2.84 3.04 3.01 -0.06 -5.00 117.46 112.04 3g1x n PHE 63 Ca -0.04 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.20 3g1x n PHE 63 Cb 0.89 -0.01 0.02 0.00 -0.01 0.00 0.00 39.48 40.37 3g1x n PHE 63 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3g1x n GLY 64 N 1.26 -0.51 3.97 1.37 0.00 0.62 -4.96 105.19 106.93 3g1x n GLY 64 Ca 0.00 0.08 -0.21 0.00 0.00 0.00 0.00 46.02 45.90 3g1x n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1x s ARG 66 N -4.27 4.73 -0.14 0.00 3.52 0.47 -4.68 118.95 118.57 3g1x s ARG 66 Ca 0.43 1.39 0.02 0.00 -0.13 0.00 0.00 55.73 57.44 3g1x s ARG 66 Cb -0.10 -3.10 0.01 0.00 -1.56 0.00 0.00 34.95 30.21 3g1x s ARG 66 CO 0.33 0.44 -0.20 0.42 -0.81 0.00 0.00 175.30 175.48 3g1x s ILE 67 N -1.34 1.94 -0.22 4.11 -1.09 -1.26 -1.33 121.20 122.02 3g1x s ILE 67 Ca 0.44 -0.90 -0.06 0.00 -2.23 0.00 0.00 60.65 57.90 3g1x s ILE 67 Cb -0.23 -1.74 -0.02 0.00 -1.58 0.00 0.00 42.46 38.89 3g1x s ILE 67 CO 0.28 0.53 0.02 -0.63 -1.23 0.00 0.00 174.94 173.91 3g1x s ILE 68 N 0.97 4.00 -0.51 2.92 1.01 -0.49 -1.01 121.20 128.09 3g1x s ILE 68 Ca -0.04 -0.29 -0.25 0.00 0.00 0.00 0.00 60.65 60.07 3g1x s ILE 68 Cb -0.15 -2.83 0.03 0.00 0.01 0.00 0.00 42.46 39.53 3g1x s ILE 68 CO -0.05 0.40 0.97 0.00 0.00 0.00 0.00 174.94 176.26 3g1x s ALA 69 N 1.27 3.17 -1.42 9.38 0.00 0.16 -1.08 121.76 133.24 3g1x s ALA 69 Ca 0.04 -0.98 -0.08 0.00 0.00 0.00 0.00 51.96 50.94 3g1x s ALA 69 Cb -0.15 -3.73 -0.03 0.00 0.00 0.00 0.00 23.12 19.22 3g1x s ALA 69 CO 0.02 -2.27 2.80 0.41 0.00 0.00 0.00 175.76 176.72 3g1x n GLY 70 N 5.03 4.51 0.12 0.00 0.00 -0.09 -1.33 105.19 113.43 3g1x n GLY 70 Ca 0.05 -1.68 0.12 0.00 0.00 0.00 0.00 46.02 44.51 3g1x n GLY 70 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3g1x h PHE 71 N 4.72 0.00 -6.62 1.61 0.05 -1.81 -3.41 116.94 111.47 3g1x h PHE 71 Ca 0.78 0.00 -0.52 0.00 3.82 0.00 0.00 57.97 62.04 3g1x h PHE 71 Cb 0.36 0.00 -0.02 0.00 2.00 0.00 0.00 35.95 38.29 3g1x h PHE 71 CO 1.78 0.00 -0.95 1.63 -0.18 0.00 0.00 178.31 180.59 3g1x n LYS 72 N -2.50 -1.46 -1.61 1.51 5.02 0.32 -4.77 118.16 114.66 3g1x n LYS 72 Ca 0.03 0.28 -0.52 0.00 -2.02 0.00 0.00 58.31 56.08 3g1x n LYS 72 Cb 0.49 -3.70 -0.06 0.00 -0.02 0.00 0.00 35.03 31.74 3g1x n LYS 72 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3g1x n VAL 73 N -4.55 0.04 -2.69 -0.18 0.31 -0.84 -4.13 118.33 106.30 3g1x n VAL 73 Ca -0.19 -0.01 -0.08 0.00 -0.01 0.00 0.00 64.34 64.05 3g1x n VAL 73 Cb 0.62 -0.93 0.06 0.00 -0.91 0.00 0.00 33.84 32.68 3g1x n VAL 73 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3g1x n ALA 74 N 2.91 2.55 -3.95 3.52 0.00 -1.26 -0.77 120.51 123.51 3g1x n ALA 74 Ca 0.19 -2.45 -0.06 0.00 0.00 0.00 0.00 53.44 51.12 3g1x n ALA 74 Cb 0.19 -0.96 -0.01 0.00 0.00 0.00 0.00 19.45 18.67 3g1x n ALA 74 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3g1x n ASP 75 N -0.24 1.96 -4.80 0.00 4.64 -1.26 -4.98 116.55 111.87 3g1x n ASP 75 Ca 0.05 -1.43 -0.31 0.00 -1.38 0.00 0.00 54.79 51.73 3g1x n ASP 75 Cb 0.83 0.04 0.08 0.00 -1.04 0.00 0.00 41.12 41.03 3g1x n ASP 75 CO 0.00 0.00 0.00 0.27 -0.82 0.00 0.00 177.20 176.65 3g1x s ILE 76 N -1.08 3.49 0.19 5.18 -4.36 -1.26 -4.73 121.20 118.63 3g1x s ILE 76 Ca 0.02 0.48 -0.18 0.00 -0.26 0.00 0.00 60.65 60.71 3g1x s ILE 76 Cb -0.00 -3.17 0.16 0.00 1.25 0.00 0.00 42.46 40.70 3g1x s ILE 76 CO 0.01 -0.63 1.60 -0.65 0.24 0.00 0.00 174.94 175.52 3g1x h PRO 77 N -0.97 -0.12 -0.61 0.37 0.11 -1.88 -0.21 132.00 128.69 3g1x h PRO 77 Ca -0.45 0.01 0.07 0.00 0.11 0.00 0.00 66.00 65.74 3g1x h PRO 77 Cb 1.24 0.03 -0.06 0.00 0.11 0.00 0.00 31.00 32.32 3g1x h PRO 77 CO 0.57 -0.08 0.29 1.49 -0.21 0.00 0.00 178.00 180.06 3g1x h GLU 78 N -0.12 0.51 -0.06 1.05 4.57 -1.94 -1.24 114.58 117.35 3g1x h GLU 78 Ca 0.25 -0.03 -0.20 0.00 -1.18 0.00 0.00 59.36 58.20 3g1x h GLU 78 Cb 0.52 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 28.99 3g1x h GLU 78 CO -0.65 0.34 -0.79 1.15 -1.18 0.00 0.00 179.01 177.88 3g1x h THR 79 N 0.53 1.38 -0.95 0.32 2.02 -1.82 -3.04 112.91 111.36 3g1x h THR 79 Ca 0.29 -2.23 0.03 0.00 0.77 0.00 0.00 66.41 65.27 3g1x h THR 79 Cb 0.27 2.20 -0.05 0.00 -1.74 0.00 0.00 68.15 68.82 3g1x h THR 79 CO -0.23 0.67 0.62 0.78 0.37 0.00 0.00 175.52 177.73 3g1x h ASN 80 N 0.27 1.04 -0.70 4.18 4.21 -0.53 -0.53 115.58 123.52 3g1x h ASN 80 Ca -0.05 -0.01 -0.01 0.00 1.21 0.00 0.00 56.30 57.45 3g1x h ASN 80 Cb 1.39 -0.24 -0.03 0.00 -1.12 0.00 0.00 38.32 38.32 3g1x h ASN 80 CO 0.14 0.71 0.41 -0.33 -1.29 0.00 0.00 177.43 177.07 3g1x h GLU 81 N 1.21 0.96 -0.47 0.81 5.08 -1.16 -0.78 114.58 120.23 3g1x h GLU 81 Ca 0.38 -0.10 -0.06 0.00 -1.00 0.00 0.00 59.36 58.58 3g1x h GLU 81 Cb -0.01 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.02 3g1x h GLU 81 CO -0.12 0.70 0.06 0.87 -1.00 0.00 0.00 179.01 179.53 3g1x h LYS 82 N 0.96 0.79 -0.43 2.33 1.57 -1.26 -0.44 116.57 120.09 3g1x h LYS 82 Ca 0.25 -0.22 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 3g1x h LYS 82 Cb -0.00 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.20 3g1x h LYS 82 CO -0.04 0.80 0.15 0.82 -0.57 0.00 0.00 179.45 180.61 3g1x h ILE 83 N 0.65 1.21 -0.48 1.86 2.04 -0.85 -0.84 117.51 121.10 3g1x h ILE 83 Ca 0.14 -0.69 -0.04 0.00 1.00 0.00 0.00 64.86 65.27 3g1x h ILE 83 Cb 0.41 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 3g1x h ILE 83 CO 0.01 0.25 0.14 0.00 0.00 0.00 0.00 178.15 178.55 3g1x h ARG 85 N 0.65 -0.07 -0.93 0.00 3.08 -0.86 0.60 114.38 116.85 3g1x h ARG 85 Ca 0.15 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.21 3g1x h ARG 85 Cb 0.29 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.31 3g1x h ARG 85 CO -0.00 -0.05 0.57 0.00 -1.07 0.00 0.00 179.97 179.42 3g1x h ALA 86 N 0.96 1.18 -0.33 0.04 0.00 -1.03 -0.88 119.26 119.21 3g1x h ALA 86 Ca 0.04 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 3g1x h ALA 86 Cb 0.12 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3g1x h ALA 86 CO -0.08 0.63 -0.06 1.15 0.00 0.00 0.00 179.25 180.89 3g1x h THR 87 N 1.28 1.27 -0.09 0.00 2.02 -0.78 -2.27 112.91 114.34 3g1x h THR 87 Ca 0.34 -1.08 -0.14 0.00 0.77 0.00 0.00 66.41 66.29 3g1x h THR 87 Cb -0.07 1.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 3g1x h THR 87 CO -0.06 0.35 -0.57 -0.26 0.37 0.00 0.00 175.52 175.35 3g1x h PHE 88 N 0.40 0.36 0.00 3.16 0.04 -0.74 -2.56 116.94 117.60 3g1x h PHE 88 Ca 0.09 -0.13 -0.05 0.00 2.80 0.00 0.00 57.97 60.68 3g1x h PHE 88 Cb 0.54 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.61 3g1x h PHE 88 CO 0.05 0.79 -0.23 0.87 -0.60 0.00 0.00 178.31 179.19 3g1x h LYS 89 N 0.22 0.00 0.00 1.51 1.57 -1.07 -0.94 116.57 117.86 3g1x h LYS 89 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3g1x h LYS 89 Cb 1.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.37 3g1x h LYS 89 CO 0.09 0.23 0.00 0.00 -0.57 0.00 0.00 179.45 179.20 3g1x n ALA 90 N -2.48 2.10 0.00 3.86 0.00 -0.86 -4.89 120.51 118.23 3g1x n ALA 90 Ca -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.32 3g1x n ALA 90 Cb 0.29 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.37 3g1x n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g1x n GLY 91 N 0.70 0.71 3.75 0.00 0.00 -0.36 -3.79 105.19 106.20 3g1x n GLY 91 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 3g1x n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1x s ALA 92 N -2.00 3.73 -0.02 4.61 0.00 -1.10 -4.85 121.76 122.12 3g1x s ALA 92 Ca 0.00 1.57 0.11 0.00 0.00 0.00 0.00 51.96 53.64 3g1x s ALA 92 Cb 0.00 -3.64 -0.09 0.00 0.00 0.00 0.00 23.12 19.39 3g1x s ALA 92 CO 0.00 -0.98 1.28 -0.44 0.00 0.00 0.00 175.76 175.62 3g1x h ASP 93 N 4.74 0.00 -5.14 0.00 3.32 -1.43 -3.42 116.42 114.48 3g1x h ASP 93 Ca -0.47 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.52 3g1x h ASP 93 Cb 1.22 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.65 3g1x h ASP 93 CO 0.78 0.76 -0.13 0.00 -1.72 0.00 0.00 179.24 178.93 3g1x s ALA 94 N -2.82 -0.60 0.00 3.45 0.00 -1.08 -1.71 121.76 119.00 3g1x s ALA 94 Ca 0.02 -0.40 0.01 0.00 0.00 0.00 0.00 51.96 51.58 3g1x s ALA 94 Cb 0.09 0.78 -0.01 0.00 0.00 0.00 0.00 23.12 23.98 3g1x s ALA 94 CO 0.79 -0.69 -0.03 -1.50 0.00 0.00 0.00 175.76 174.33 3g1x s ILE 95 N -3.88 0.24 -0.12 0.00 2.07 -0.49 -0.67 121.20 118.35 3g1x s ILE 95 Ca 0.09 -0.28 -0.16 0.00 -1.41 0.00 0.00 60.65 58.89 3g1x s ILE 95 Cb 0.02 -0.24 -0.05 0.00 0.13 0.00 0.00 42.46 42.32 3g1x s ILE 95 CO -0.05 -0.03 0.40 -0.63 -1.91 0.00 0.00 174.94 172.72 3g1x s ILE 96 N -0.31 5.22 -0.04 2.00 1.01 -0.44 -1.02 121.20 127.62 3g1x s ILE 96 Ca -0.01 0.78 0.06 0.00 0.00 0.00 0.00 60.65 61.48 3g1x s ILE 96 Cb -0.03 -3.73 -0.01 0.00 0.01 0.00 0.00 42.46 38.70 3g1x s ILE 96 CO -0.00 0.38 -0.22 -0.69 0.00 0.00 0.00 174.94 174.40 3g1x s VAL 97 N 0.38 1.80 0.27 2.92 1.01 0.30 -0.52 120.40 126.56 3g1x s VAL 97 Ca 0.22 -0.94 -0.29 0.00 0.00 0.00 0.00 61.98 60.97 3g1x s VAL 97 Cb -0.14 -1.52 -0.09 0.00 0.00 0.00 0.00 36.38 34.62 3g1x s VAL 97 CO 0.08 0.51 1.14 -1.00 0.00 0.00 0.00 175.10 175.83 3g1x s HIS 98 N -0.21 3.48 -0.17 5.22 3.76 0.05 -0.62 115.29 126.80 3g1x s HIS 98 Ca -0.00 1.61 0.22 0.00 -0.15 0.00 0.00 55.06 56.75 3g1x s HIS 98 Cb -0.12 -3.36 -0.11 0.00 1.11 0.00 0.00 32.58 30.10 3g1x s HIS 98 CO 0.02 -0.84 0.85 0.41 -0.85 0.00 0.00 174.74 174.33 3g1x n GLY 99 N 1.31 -1.31 0.38 -2.22 0.00 -1.00 -4.38 105.19 97.97 3g1x n GLY 99 Ca -0.00 -0.33 0.15 0.00 0.00 0.00 0.00 46.02 45.83 3g1x n GLY 99 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3g1x h PHE 100 N 0.00 0.55 0.00 1.61 3.57 -1.90 -1.72 116.94 119.05 3g1x h PHE 100 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3g1x h PHE 100 Cb 0.99 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.56 3g1x h PHE 100 CO 0.00 0.21 0.00 -2.30 -2.23 0.00 0.00 178.31 173.99 3g1x n PRO 101 N -4.49 0.07 0.00 6.41 -0.02 -1.26 -4.98 135.00 130.72 3g1x n PRO 101 Ca 0.15 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 3g1x n PRO 101 Cb 0.51 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.49 3g1x n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g1x n GLY 102 N -0.20 1.90 0.32 -1.23 0.00 -0.65 -4.68 105.19 100.66 3g1x n GLY 102 Ca 0.04 -2.09 -0.07 0.00 0.00 0.00 0.00 46.02 43.90 3g1x n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1x h ALA 103 N 0.00 0.92 -0.74 4.61 0.00 -1.94 -2.66 119.26 119.45 3g1x h ALA 103 Ca 0.00 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.62 3g1x h ALA 103 Cb 0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 3g1x h ALA 103 CO 0.00 0.62 0.25 0.38 0.00 0.00 0.00 179.25 180.50 3g1x h ASP 104 N 1.04 1.07 -0.08 0.00 2.03 -1.99 0.93 116.42 119.41 3g1x h ASP 104 Ca 0.22 -0.20 -0.07 0.00 -0.73 0.00 0.00 57.03 56.25 3g1x h ASP 104 Cb 0.34 -0.28 -0.01 0.00 -0.83 0.00 0.00 39.33 38.54 3g1x h ASP 104 CO -0.00 0.98 -0.16 0.28 -1.03 0.00 0.00 179.24 179.31 3g1x h SER 105 N 1.09 0.42 -0.10 4.15 0.02 -1.81 -1.73 113.55 115.60 3g1x h SER 105 Ca 0.24 -0.11 -0.10 0.00 -0.84 0.00 0.00 61.79 60.97 3g1x h SER 105 Cb 0.28 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.71 3g1x h SER 105 CO -0.01 0.61 -0.35 0.58 -1.14 0.00 0.00 176.83 176.52 3g1x h VAL 106 N 0.40 1.40 -0.75 2.27 2.07 -1.08 -3.22 116.25 117.34 3g1x h VAL 106 Ca 0.07 -1.70 0.05 0.00 0.82 0.00 0.00 66.70 65.94 3g1x h VAL 106 Cb 0.51 2.21 -0.04 0.00 -1.52 0.00 0.00 31.29 32.45 3g1x h VAL 106 CO 0.03 0.50 0.49 -0.09 0.02 0.00 0.00 177.57 178.52 3g1x h ARG 107 N -0.04 0.84 -0.99 1.57 2.43 -0.61 -0.87 114.38 116.70 3g1x h ARG 107 Ca -0.02 -0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.14 3g1x h ARG 107 Cb 0.98 -0.19 -0.06 0.00 -0.42 0.00 0.00 29.97 30.28 3g1x h ARG 107 CO 0.07 0.55 0.65 0.00 -1.51 0.00 0.00 179.97 179.74 3g1x h ALA 108 N 1.58 1.36 -0.31 2.80 0.00 -1.33 0.14 119.26 123.49 3g1x h ALA 108 Ca 0.31 -0.05 -0.17 0.00 0.00 0.00 0.00 54.91 55.00 3g1x h ALA 108 Cb 0.13 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 3g1x h ALA 108 CO -0.09 0.54 -0.47 0.00 0.00 0.00 0.00 179.25 179.22 3g1x h LEU 110 N 0.65 0.97 -0.24 0.00 3.38 -0.37 -1.10 115.31 118.59 3g1x h LEU 110 Ca 0.03 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 57.90 3g1x h LEU 110 Cb 1.08 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 3g1x h LEU 110 CO 0.11 0.81 0.14 0.78 0.09 0.00 0.00 178.44 180.37 3g1x h ASN 111 N 1.07 0.24 -0.43 -0.43 2.35 -0.66 -0.45 115.58 117.26 3g1x h ASN 111 Ca 0.26 -0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.89 3g1x h ASN 111 Cb 0.09 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.39 3g1x h ASN 111 CO -0.04 0.18 -0.18 0.58 -1.65 0.00 0.00 177.43 176.32 3g1x h VAL 112 N 0.30 1.27 -0.80 2.81 2.07 -1.31 -1.97 116.25 118.61 3g1x h VAL 112 Ca 0.09 -1.32 -0.03 0.00 0.82 0.00 0.00 66.70 66.27 3g1x h VAL 112 Cb -0.02 1.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 3g1x h VAL 112 CO -0.03 0.45 0.40 0.00 0.02 0.00 0.00 177.57 178.41 3g1x h ALA 113 N 0.98 1.03 -0.28 1.67 0.00 -0.94 -1.06 119.26 120.67 3g1x h ALA 113 Ca 0.12 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3g1x h ALA 113 Cb 0.73 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3g1x h ALA 113 CO 0.06 0.58 -0.01 1.49 0.00 0.00 0.00 179.25 181.36 3g1x h GLU 114 N 1.13 0.50 -0.90 0.00 4.81 -0.94 0.20 114.58 119.38 3g1x h GLU 114 Ca 0.28 -0.16 0.02 0.00 -0.13 0.00 0.00 59.36 59.36 3g1x h GLU 114 Cb 0.10 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.39 3g1x h GLU 114 CO -0.04 0.66 0.59 1.49 -0.73 0.00 0.00 179.01 180.98 3g1x h GLU 115 N 0.27 1.14 -0.23 1.92 4.81 -1.07 -2.90 114.58 118.53 3g1x h GLU 115 Ca 0.08 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 3g1x h GLU 115 Cb 0.45 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.57 3g1x h GLU 115 CO 0.02 0.75 0.00 -1.33 -0.73 0.00 0.00 179.01 177.72 3g1x n MET 116 N -4.49 2.26 -2.96 1.92 2.81 -0.43 -4.97 117.12 111.26 3g1x n MET 116 Ca 0.11 -1.87 -0.15 0.00 -1.81 0.00 0.00 57.70 53.97 3g1x n MET 116 Cb 0.05 -1.48 0.04 0.00 -0.71 0.00 0.00 33.22 31.12 3g1x n MET 116 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g1x n GLY 117 N 1.37 -0.08 3.25 3.03 0.00 0.06 -5.03 105.19 107.78 3g1x n GLY 117 Ca 0.17 -0.12 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 3g1x n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g1x n ARG 118 N -3.18 0.86 -4.31 1.61 5.12 0.48 -5.03 116.66 112.22 3g1x n ARG 118 Ca -0.04 -3.16 -0.28 0.00 -1.93 0.00 0.00 57.85 52.44 3g1x n ARG 118 Cb 0.56 0.65 -0.11 0.00 -1.16 0.00 0.00 32.46 32.41 3g1x n ARG 118 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 3g1x s GLU 119 N -3.76 1.85 -0.07 5.56 0.41 -0.70 -4.49 118.70 117.51 3g1x s GLU 119 Ca 0.11 -1.26 0.05 0.00 -0.41 0.00 0.00 54.97 53.46 3g1x s GLU 119 Cb -0.01 -2.09 -0.01 0.00 -1.78 0.00 0.00 34.13 30.24 3g1x s GLU 119 CO 0.07 0.45 -0.24 0.08 -0.49 0.00 0.00 175.26 175.13 3g1x s VAL 120 N -1.43 2.10 -0.16 2.63 1.01 -1.26 -1.39 120.40 121.89 3g1x s VAL 120 Ca 0.21 -1.04 -0.02 0.00 0.00 0.00 0.00 61.98 61.13 3g1x s VAL 120 Cb -0.10 -1.77 -0.01 0.00 0.00 0.00 0.00 36.38 34.50 3g1x s VAL 120 CO 0.12 0.57 -0.09 -0.36 0.00 0.00 0.00 175.10 175.34 3g1x s PHE 121 N -0.04 2.89 -0.28 5.22 0.40 -0.19 -4.15 117.98 121.84 3g1x s PHE 121 Ca -0.07 -0.70 -0.16 0.00 -0.60 0.00 0.00 56.93 55.40 3g1x s PHE 121 Cb -0.15 -1.94 -0.03 0.00 0.51 0.00 0.00 43.02 41.41 3g1x s PHE 121 CO 0.05 -0.30 0.43 -1.17 0.70 0.00 0.00 175.22 174.93 3g1x s LEU 122 N 0.71 4.09 -0.27 -0.37 2.96 0.18 -0.54 118.68 125.44 3g1x s LEU 122 Ca -0.04 0.30 -0.25 0.00 -0.22 0.00 0.00 54.13 53.91 3g1x s LEU 122 Cb -0.15 -2.50 0.00 0.00 0.50 0.00 0.00 46.19 44.04 3g1x s LEU 122 CO 0.02 -0.25 0.87 -0.22 -1.32 0.00 0.00 176.35 175.45 3g1x s LEU 123 N 2.17 4.06 0.00 -0.68 2.96 0.21 -1.15 118.68 126.25 3g1x s LEU 123 Ca 0.17 0.96 0.00 0.00 -0.22 0.00 0.00 54.13 55.03 3g1x s LEU 123 Cb -0.16 -3.24 0.00 0.00 0.50 0.00 0.00 46.19 43.29 3g1x s LEU 123 CO 0.10 -0.61 0.00 0.35 -1.32 0.00 0.00 176.35 174.87 3g1x n THR 124 N 5.44 0.00 -3.72 3.68 -2.24 -0.88 -2.36 114.28 114.19 3g1x n THR 124 Ca 0.07 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.48 3g1x n THR 124 Cb 0.47 -0.34 -0.06 0.00 -2.10 0.00 0.00 70.33 68.30 3g1x n THR 124 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3g1x s GLU 125 N 0.00 3.63 0.45 -0.78 2.12 -1.26 -4.83 118.70 118.04 3g1x s GLU 125 Ca 0.00 0.06 -0.03 0.00 0.36 0.00 0.00 54.97 55.35 3g1x s GLU 125 Cb 0.00 -3.16 -0.03 0.00 0.26 0.00 0.00 34.13 31.20 3g1x s GLU 125 CO 0.00 0.71 0.72 -1.64 -0.54 0.00 0.00 175.26 174.51 3g1x s MET 126 N -1.29 3.49 0.30 4.30 -1.94 -1.26 -3.55 119.30 119.34 3g1x s MET 126 Ca 0.22 0.02 0.23 0.00 -1.71 0.00 0.00 55.69 54.45 3g1x s MET 126 Cb -0.14 -2.46 0.24 0.00 2.01 0.00 0.00 34.83 34.48 3g1x s MET 126 CO 0.11 -0.13 1.36 0.66 -0.01 0.00 0.00 175.02 177.01 3g1x h SER 127 N 0.36 0.00 -4.38 3.03 4.64 -1.92 -3.44 113.55 111.83 3g1x h SER 127 Ca -0.48 -0.02 -0.51 0.00 -0.47 0.00 0.00 61.79 60.32 3g1x h SER 127 Cb 1.21 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.37 3g1x h SER 127 CO 0.61 0.01 0.42 -1.38 -0.87 0.00 0.00 176.83 175.62 3g1x s HIS 128 N -3.26 3.55 0.23 4.77 -3.43 -1.26 -4.73 115.29 111.16 3g1x s HIS 128 Ca 0.04 1.24 -0.06 0.00 -0.80 0.00 0.00 55.06 55.48 3g1x s HIS 128 Cb 0.08 -2.80 0.39 0.00 -1.43 0.00 0.00 32.58 28.82 3g1x s HIS 128 CO 0.72 -0.82 1.72 -1.35 -2.00 0.00 0.00 174.74 173.01 3g1x h PRO 129 N -0.41 0.35 0.00 -0.38 0.11 -2.00 -1.68 132.00 127.98 3g1x h PRO 129 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3g1x h PRO 129 Cb 1.20 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3g1x h PRO 129 CO 0.62 0.23 0.08 0.78 -0.21 0.00 0.00 178.00 179.50 3g1x h GLY 130 N 0.36 0.00 2.00 -0.55 0.00 -1.97 -1.73 103.07 101.18 3g1x h GLY 130 Ca 0.37 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.70 3g1x h GLY 130 CO -0.41 0.00 -0.01 0.00 0.00 0.00 0.00 176.54 176.12 3g1x h ALA 131 N 1.83 1.06 0.00 3.60 0.00 -1.61 -1.87 119.26 122.27 3g1x h ALA 131 Ca 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3g1x h ALA 131 Cb 0.16 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3g1x h ALA 131 CO 0.00 0.01 -0.21 0.93 0.00 0.00 0.00 179.25 179.98 3g1x h GLU 132 N 0.00 0.00 0.11 0.00 5.08 -1.50 0.35 114.58 118.61 3g1x h GLU 132 Ca -0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 3g1x h GLU 132 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3g1x h GLU 132 CO 0.00 0.21 -0.05 0.52 -1.00 0.00 0.00 179.01 178.68 3g1x h MET 133 N 0.00 -0.14 0.00 2.33 2.86 -1.55 -3.41 114.93 115.02 3g1x h MET 133 Ca -0.00 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 3g1x h MET 133 Cb 0.74 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.44 3g1x h MET 133 CO 0.03 0.07 -0.48 1.19 1.06 0.00 0.00 176.91 178.78 3g1x n PHE 134 N -5.06 0.00 -0.08 -0.22 3.01 -1.25 -4.88 117.46 108.98 3g1x n PHE 134 Ca -0.08 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.27 3g1x n PHE 134 Cb 0.16 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.59 3g1x n PHE 134 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 3g1x h ILE 135 N 0.00 1.23 -0.74 4.37 2.04 -1.78 -3.25 117.51 119.37 3g1x h ILE 135 Ca 0.00 -0.76 0.10 0.00 1.00 0.00 0.00 64.86 65.20 3g1x h ILE 135 Cb 0.48 1.24 -0.08 0.00 -0.74 0.00 0.00 36.82 37.73 3g1x h ILE 135 CO 0.00 0.24 0.37 -0.61 0.00 0.00 0.00 178.15 178.15 3g1x h GLN 136 N 0.23 0.60 0.00 2.37 4.15 -1.16 0.74 115.11 122.03 3g1x h GLN 136 Ca 0.08 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.46 3g1x h GLN 136 Cb 0.32 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.88 3g1x h GLN 136 CO 0.00 0.40 0.00 0.78 -1.93 0.00 0.00 178.83 178.08 3g1x h GLY 137 N 0.62 0.00 0.00 2.39 0.00 -1.82 -2.81 103.07 101.44 3g1x h GLY 137 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.70 3g1x h GLY 137 CO -0.28 0.00 -0.95 0.00 0.00 0.00 0.00 176.54 175.31 3g1x n ALA 138 N -2.06 3.64 -0.23 3.60 0.00 -0.38 -4.71 120.51 120.37 3g1x n ALA 138 Ca -0.01 -0.41 0.03 0.00 0.00 0.00 0.00 53.44 53.05 3g1x n ALA 138 Cb 0.20 -0.54 0.15 0.00 0.00 0.00 0.00 19.45 19.26 3g1x n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g1x h ALA 139 N 1.96 0.91 -0.61 0.00 0.00 -0.64 -0.06 119.26 120.82 3g1x h ALA 139 Ca 0.00 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 3g1x h ALA 139 Cb 0.44 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3g1x h ALA 139 CO 0.00 -0.24 0.26 -0.44 0.00 0.00 0.00 179.25 178.83 3g1x h ASP 140 N 0.37 0.83 0.02 0.00 5.19 -1.84 -0.61 116.42 120.39 3g1x h ASP 140 Ca 0.37 -0.16 -0.11 0.00 -0.62 0.00 0.00 57.03 56.51 3g1x h ASP 140 Cb 0.55 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.83 3g1x h ASP 140 CO -0.40 0.76 -0.35 -0.08 -3.12 0.00 0.00 179.24 176.06 3g1x h GLU 141 N 0.85 0.45 -0.66 3.56 4.81 -1.71 -1.27 114.58 120.60 3g1x h GLU 141 Ca 0.21 -0.20 -0.08 0.00 -0.13 0.00 0.00 59.36 59.15 3g1x h GLU 141 Cb 0.18 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.52 3g1x h GLU 141 CO -0.02 0.74 0.10 0.82 -0.73 0.00 0.00 179.01 179.92 3g1x h ILE 142 N 0.38 1.26 -0.43 2.32 2.04 -0.64 -0.00 117.51 122.45 3g1x h ILE 142 Ca 0.04 -1.05 -0.04 0.00 1.00 0.00 0.00 64.86 64.81 3g1x h ILE 142 Cb 0.79 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 3g1x h ILE 142 CO 0.06 0.39 0.10 0.00 0.00 0.00 0.00 178.15 178.71 3g1x h ALA 143 N 1.07 0.56 -0.79 1.87 0.00 -0.76 -1.72 119.26 119.50 3g1x h ALA 143 Ca 0.20 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3g1x h ALA 143 Cb 0.45 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 3g1x h ALA 143 CO 0.01 0.25 0.36 0.00 0.00 0.00 0.00 179.25 179.87 3g1x h ARG 144 N 0.56 1.14 -0.66 0.00 3.08 -0.97 -1.27 114.38 116.25 3g1x h ARG 144 Ca 0.13 -0.17 0.02 0.00 0.07 0.00 0.00 59.98 60.04 3g1x h ARG 144 Cb 0.32 -0.20 -0.04 0.00 0.08 0.00 0.00 29.97 30.13 3g1x h ARG 144 CO 0.00 0.89 0.42 1.98 -1.07 0.00 0.00 179.97 182.19 3g1x h MET 145 N 1.12 0.80 -0.43 0.04 4.05 -0.68 0.40 114.93 120.23 3g1x h MET 145 Ca 0.27 -0.05 -0.01 0.00 -0.28 0.00 0.00 59.70 59.63 3g1x h MET 145 Cb 0.14 -0.18 -0.02 0.00 -0.80 0.00 0.00 31.60 30.74 3g1x h MET 145 CO -0.03 0.53 0.23 0.78 0.23 0.00 0.00 176.91 178.65 3g1x h GLY 146 N 0.83 0.65 1.01 1.39 0.00 -0.62 -2.14 103.07 104.19 3g1x h GLY 146 Ca 0.26 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.29 3g1x h GLY 146 CO -0.09 0.29 0.45 -2.08 0.00 0.00 0.00 176.54 175.11 3g1x h VAL 147 N 0.56 1.20 0.00 4.60 2.07 -0.67 0.24 116.25 124.26 3g1x h VAL 147 Ca 0.15 -0.43 -0.03 0.00 0.82 0.00 0.00 66.70 67.21 3g1x h VAL 147 Cb 0.07 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.01 3g1x h VAL 147 CO -0.02 0.21 -0.14 0.44 0.02 0.00 0.00 177.57 178.07 3g1x h ASP 148 N 1.00 0.00 -0.23 0.57 3.32 -0.63 -2.00 116.42 118.45 3g1x h ASP 148 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 3g1x h ASP 148 Cb -0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.50 3g1x h ASP 148 CO -0.05 0.14 0.00 0.18 -1.72 0.00 0.00 179.24 177.79 3g1x n LEU 149 N -3.78 2.49 0.00 1.55 4.77 -0.83 -4.94 117.00 116.26 3g1x n LEU 149 Ca -0.02 -1.02 0.00 0.00 -0.03 0.00 0.00 56.01 54.94 3g1x n LEU 149 Cb 0.25 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3g1x n LEU 149 CO 0.32 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 3g1x n GLY 150 N 1.30 0.46 3.75 -0.72 0.00 -0.75 -5.01 105.19 104.22 3g1x n GLY 150 Ca 0.17 -0.61 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 3g1x n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1x s VAL 151 N -2.00 2.74 -0.24 1.61 1.01 0.01 -4.91 120.40 118.62 3g1x s VAL 151 Ca 0.00 0.66 0.05 0.00 0.00 0.00 0.00 61.98 62.69 3g1x s VAL 151 Cb 0.00 -3.42 -0.06 0.00 0.00 0.00 0.00 36.38 32.90 3g1x s VAL 151 CO 0.00 0.12 0.22 0.29 0.00 0.00 0.00 175.10 175.74 3g1x n LYS 152 N 1.86 4.76 -5.11 2.72 4.76 -1.26 -4.56 118.16 121.34 3g1x n LYS 152 Ca 0.04 -0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.16 3g1x n LYS 152 Cb 0.41 -0.79 -0.16 0.00 -1.84 0.00 0.00 35.03 32.65 3g1x n LYS 152 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3g1x s ASN 153 N -1.61 3.34 0.14 4.39 0.01 -1.26 -0.09 114.94 119.86 3g1x s ASN 153 Ca 0.02 -0.49 0.02 0.00 -0.71 0.00 0.00 52.86 51.70 3g1x s ASN 153 Cb 0.04 -1.40 -0.04 0.00 0.41 0.00 0.00 41.25 40.26 3g1x s ASN 153 CO 0.23 0.17 -0.04 -0.31 -1.51 0.00 0.00 177.10 175.64 3g1x s TYR 154 N 0.27 1.12 -0.08 2.20 1.51 0.68 -0.65 117.35 122.40 3g1x s TYR 154 Ca -0.15 -0.93 0.02 0.00 -1.01 0.00 0.00 57.07 55.00 3g1x s TYR 154 Cb -0.17 -0.63 0.02 0.00 -0.11 0.00 0.00 41.96 41.07 3g1x s TYR 154 CO 0.08 -0.13 -0.12 0.08 -1.11 0.00 0.00 175.55 174.35 3g1x s VAL 155 N -3.58 1.16 0.14 0.71 1.01 -0.30 -1.02 120.40 118.52 3g1x s VAL 155 Ca 0.18 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.73 3g1x s VAL 155 Cb 0.05 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 3g1x s VAL 155 CO 0.00 0.37 -0.05 -0.83 0.00 0.00 0.00 175.10 174.60 3g1x s GLY 156 N 0.92 1.03 -0.12 4.51 0.00 -0.74 -2.08 107.32 110.84 3g1x s GLY 156 Ca -0.10 -1.49 -0.29 0.00 0.00 0.00 0.00 44.72 42.84 3g1x s GLY 156 CO 0.01 -1.52 1.09 2.56 0.00 0.00 0.00 173.10 175.23 3g1x s PRO 157 N -3.84 4.35 0.36 2.90 0.04 -1.23 -3.60 135.00 133.98 3g1x s PRO 157 Ca 0.18 1.49 0.15 0.00 0.04 0.00 0.00 61.00 62.86 3g1x s PRO 157 Cb 0.05 -3.59 0.68 0.00 0.04 0.00 0.00 34.50 31.69 3g1x s PRO 157 CO 0.00 -0.45 1.77 1.03 0.04 0.00 0.00 177.00 179.39 3g1x h SER 158 N 7.36 0.00 0.56 6.66 0.87 -1.57 -3.03 113.55 124.41 3g1x h SER 158 Ca -0.29 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.27 3g1x h SER 158 Cb 1.13 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.09 3g1x h SER 158 CO 0.90 0.41 0.00 0.35 -0.53 0.00 0.00 176.83 177.96 3g1x n THR 159 N -3.82 0.97 -3.51 2.23 -2.24 -1.26 -3.96 114.28 102.69 3g1x n THR 159 Ca -0.01 0.26 -0.27 0.00 -2.27 0.00 0.00 64.05 61.76 3g1x n THR 159 Cb 0.47 -1.09 -0.10 0.00 -2.10 0.00 0.00 70.33 67.51 3g1x n THR 159 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3g1x n ARG 160 N -1.78 0.63 -0.34 -0.78 1.74 -1.14 -4.97 116.66 110.02 3g1x n ARG 160 Ca 0.03 -3.52 0.14 0.00 -0.77 0.00 0.00 57.85 53.73 3g1x n ARG 160 Cb 0.18 -1.82 0.33 0.00 -1.02 0.00 0.00 32.46 30.14 3g1x n ARG 160 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3g1x h PRO 161 N 5.51 0.61 -0.05 5.56 0.13 -1.76 0.23 132.00 142.23 3g1x h PRO 161 Ca 0.23 -0.04 -0.10 0.00 -0.87 0.00 0.00 66.00 65.23 3g1x h PRO 161 Cb 0.87 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 31.85 3g1x h PRO 161 CO 0.46 0.40 -0.43 0.93 -0.23 0.00 0.00 178.00 179.14 3g1x h GLU 162 N 0.63 0.11 -0.10 0.86 3.07 -1.94 0.11 114.58 117.32 3g1x h GLU 162 Ca 0.59 -0.05 -0.24 0.00 -0.50 0.00 0.00 59.36 59.16 3g1x h GLU 162 Cb 1.02 -0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.95 3g1x h GLU 162 CO -0.44 0.52 -0.87 0.00 -1.40 0.00 0.00 179.01 176.82 3g1x h ARG 163 N 0.09 0.76 -0.65 2.33 2.47 -1.48 -2.05 114.38 115.86 3g1x h ARG 163 Ca 0.01 -0.69 -0.05 0.00 -1.26 0.00 0.00 59.98 57.99 3g1x h ARG 163 Cb 0.80 0.16 -0.03 0.00 -1.65 0.00 0.00 29.97 29.25 3g1x h ARG 163 CO 0.06 1.28 0.22 1.25 0.56 0.00 0.00 179.97 183.34 3g1x h LEU 164 N 0.48 0.90 -0.61 3.04 5.85 -0.71 -0.38 115.31 123.88 3g1x h LEU 164 Ca -0.08 -0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.44 3g1x h LEU 164 Cb 1.51 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 42.28 3g1x h LEU 164 CO 0.18 0.84 0.17 -1.28 -0.34 0.00 0.00 178.44 178.00 3g1x h SER 165 N 0.95 0.90 -0.60 1.25 0.87 -0.72 -0.88 113.55 115.32 3g1x h SER 165 Ca 0.21 -0.22 -0.09 0.00 -1.23 0.00 0.00 61.79 60.46 3g1x h SER 165 Cb 0.25 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 61.95 3g1x h SER 165 CO -0.01 0.89 0.02 -0.09 -0.53 0.00 0.00 176.83 177.11 3g1x h ARG 166 N 0.87 1.04 -0.65 2.24 9.65 -0.92 -1.61 114.38 125.01 3g1x h ARG 166 Ca 0.19 -0.32 -0.00 0.00 -1.10 0.00 0.00 59.98 58.75 3g1x h ARG 166 Cb 0.32 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.77 3g1x h ARG 166 CO -0.00 1.01 0.39 1.25 2.80 0.00 0.00 179.97 185.42 3g1x h LEU 167 N 0.94 0.79 -0.86 3.80 5.85 -0.76 -1.58 115.31 123.49 3g1x h LEU 167 Ca 0.17 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3g1x h LEU 167 Cb 0.53 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 3g1x h LEU 167 CO 0.03 0.62 0.55 -0.09 -0.34 0.00 0.00 178.44 179.20 3g1x h ARG 168 N 0.89 1.15 -0.81 1.25 9.65 -0.83 -1.27 114.38 124.40 3g1x h ARG 168 Ca 0.23 -0.09 0.00 0.00 -1.10 0.00 0.00 59.98 59.03 3g1x h ARG 168 Cb -0.02 -0.25 -0.04 0.00 -1.39 0.00 0.00 29.97 28.27 3g1x h ARG 168 CO -0.04 0.78 0.53 1.49 2.80 0.00 0.00 179.97 185.52 3g1x h GLU 169 N 1.17 1.08 -0.26 0.20 4.81 -0.55 -0.46 114.58 120.57 3g1x h GLU 169 Ca 0.31 -0.07 -0.07 0.00 -0.13 0.00 0.00 59.36 59.39 3g1x h GLU 169 Cb -0.09 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.04 3g1x h GLU 169 CO -0.06 0.73 -0.13 0.82 -0.73 0.00 0.00 179.01 179.64 3g1x h ILE 170 N 1.11 1.30 0.00 2.32 2.04 -0.77 -3.23 117.51 120.27 3g1x h ILE 170 Ca 0.30 -1.21 0.00 0.00 1.00 0.00 0.00 64.86 64.95 3g1x h ILE 170 Cb -0.10 1.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.51 3g1x h ILE 170 CO -0.06 0.38 -0.11 0.16 0.00 0.00 0.00 178.15 178.52 3g1x h ILE 171 N 0.27 0.00 0.00 -0.67 3.07 -1.13 -3.48 117.51 115.57 3g1x h ILE 171 Ca 0.06 -0.64 0.00 0.00 1.55 0.00 0.00 64.86 65.83 3g1x h ILE 171 Cb 0.63 1.57 0.00 0.00 -0.27 0.00 0.00 36.82 38.76 3g1x h ILE 171 CO 0.04 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.75 3g1x n GLY 172 N 1.25 -0.97 0.17 0.16 0.00 -0.19 -4.20 105.19 101.40 3g1x n GLY 172 Ca 0.05 -1.64 0.01 0.00 0.00 0.00 0.00 46.02 44.44 3g1x n GLY 172 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3g1x h GLN 173 N 0.00 0.00 0.00 1.61 1.08 -1.91 -3.17 115.11 112.71 3g1x h GLN 173 Ca 0.00 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.11 3g1x h GLN 173 Cb 0.00 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 3g1x h GLN 173 CO 0.00 0.48 -0.43 0.38 -0.95 0.00 0.00 178.83 178.31 3g1x h ASP 174 N 0.00 0.00 -4.16 1.46 2.03 -1.97 -3.45 116.42 110.34 3g1x h ASP 174 Ca -0.00 0.00 -0.51 0.00 -0.73 0.00 0.00 57.03 55.79 3g1x h ASP 174 Cb 0.87 0.00 0.10 0.00 -0.83 0.00 0.00 39.33 39.47 3g1x h ASP 174 CO 0.06 0.43 0.40 -0.44 -1.03 0.00 0.00 179.24 178.66 3g1x s SER 175 N -6.85 5.25 -0.19 4.15 0.01 -1.20 -5.02 113.70 109.84 3g1x s SER 175 Ca -0.02 2.10 -0.13 0.00 1.31 0.00 0.00 55.95 59.21 3g1x s SER 175 Cb 0.14 -2.57 -0.05 0.00 0.21 0.00 0.00 66.02 63.76 3g1x s SER 175 CO 0.73 -1.54 0.28 0.12 0.41 0.00 0.00 173.24 173.23 3g1x s PHE 176 N -2.09 3.40 -0.10 2.43 5.36 0.87 -4.98 117.98 122.87 3g1x s PHE 176 Ca 0.70 0.49 0.01 0.00 -0.96 0.00 0.00 56.93 57.17 3g1x s PHE 176 Cb -0.23 -2.36 0.02 0.00 -0.34 0.00 0.00 43.02 40.11 3g1x s PHE 176 CO 0.37 0.14 -0.12 -1.17 -1.46 0.00 0.00 175.22 172.97 3g1x s LEU 177 N 0.82 1.57 0.18 6.12 2.96 -1.26 -0.23 118.68 128.83 3g1x s LEU 177 Ca 0.14 -0.37 0.09 0.00 -0.22 0.00 0.00 54.13 53.78 3g1x s LEU 177 Cb -0.13 -0.96 -0.04 0.00 0.50 0.00 0.00 46.19 45.55 3g1x s LEU 177 CO 0.04 -0.02 -0.11 0.27 -1.32 0.00 0.00 176.35 175.21 3g1x s ILE 178 N 1.10 3.09 -0.06 6.68 -4.36 -0.19 -0.21 121.20 127.25 3g1x s ILE 178 Ca -0.05 -1.69 -0.02 0.00 -0.26 0.00 0.00 60.65 58.63 3g1x s ILE 178 Cb -0.14 -2.52 0.04 0.00 1.25 0.00 0.00 42.46 41.08 3g1x s ILE 178 CO -0.02 -0.10 0.11 -0.55 0.24 0.00 0.00 174.94 174.62 3g1x s SER 179 N -2.77 0.64 0.48 4.36 0.15 -0.68 -1.80 113.70 114.08 3g1x s SER 179 Ca 0.24 0.21 0.03 0.00 0.70 0.00 0.00 55.95 57.13 3g1x s SER 179 Cb -0.09 0.09 0.02 0.00 -1.71 0.00 0.00 66.02 64.32 3g1x s SER 179 CO 0.14 -0.22 0.68 -2.16 1.20 0.00 0.00 173.24 172.89 3g1x s PRO 180 N 1.91 2.78 0.00 5.44 0.04 -1.24 -0.87 135.00 143.06 3g1x s PRO 180 Ca 0.00 -0.83 0.00 0.00 0.04 0.00 0.00 61.00 60.21 3g1x s PRO 180 Cb -0.12 -2.59 0.00 0.00 0.04 0.00 0.00 34.50 31.83 3g1x s PRO 180 CO -0.05 -0.44 0.00 0.41 0.04 0.00 0.00 177.00 176.96 3g1x n GLY 181 N -2.11 0.94 3.71 0.56 0.00 -1.26 -1.52 105.19 105.51 3g1x n GLY 181 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 3g1x n GLY 181 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1x s VAL 182 N -2.00 5.00 0.00 1.61 1.01 -1.26 -0.39 120.40 124.38 3g1x s VAL 182 Ca 0.00 1.58 0.00 0.00 0.00 0.00 0.00 61.98 63.56 3g1x s VAL 182 Cb 0.00 -4.10 0.00 0.00 0.00 0.00 0.00 36.38 32.28 3g1x s VAL 182 CO 0.00 0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.93 3g1x n GLY 183 N 3.09 1.12 0.30 4.51 0.00 -0.58 -4.54 105.19 109.10 3g1x n GLY 183 Ca 0.01 -0.71 0.09 0.00 0.00 0.00 0.00 46.02 45.40 3g1x n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1x h ALA 184 N 0.00 1.27 -0.00 4.61 0.00 -1.90 0.17 119.26 123.41 3g1x h ALA 184 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3g1x h ALA 184 Cb 0.00 0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3g1x h ALA 184 CO 0.00 -0.20 -0.05 1.04 0.00 0.00 0.00 179.25 180.05 3g1x n GLN 185 N -4.96 0.77 0.00 0.00 6.02 -1.26 -4.93 117.38 113.03 3g1x n GLN 185 Ca 0.18 -0.17 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 3g1x n GLN 185 Cb 0.50 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.26 3g1x n GLN 185 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3g1x n GLY 186 N 1.20 0.79 3.77 1.08 0.00 0.05 -4.93 105.19 107.16 3g1x n GLY 186 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 3g1x n GLY 186 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g1x s GLY 187 N -2.11 2.74 -0.19 -0.02 0.00 0.48 -4.73 107.32 103.48 3g1x s GLY 187 Ca 0.00 0.94 -0.10 0.00 0.00 0.00 0.00 44.72 45.56 3g1x s GLY 187 CO 0.00 1.36 0.13 -0.35 0.00 0.00 0.00 173.10 174.24 3g1x s ASP 188 N -1.50 6.23 0.11 1.64 2.15 -1.26 -1.52 116.67 122.53 3g1x s ASP 188 Ca 0.69 0.26 -0.31 0.00 0.43 0.00 0.00 52.55 53.62 3g1x s ASP 188 Cb -0.28 -2.09 -0.10 0.00 -0.30 0.00 0.00 42.92 40.15 3g1x s ASP 188 CO 0.33 0.21 1.59 -0.65 -0.17 0.00 0.00 175.17 176.47 3g1x h PRO 189 N 6.46 -0.62 -0.40 4.34 0.11 -1.96 -1.47 132.00 138.45 3g1x h PRO 189 Ca -0.43 0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.72 3g1x h PRO 189 Cb 1.16 0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.39 3g1x h PRO 189 CO 0.74 -0.42 0.25 0.78 -0.21 0.00 0.00 178.00 179.14 3g1x h GLY 190 N -0.65 0.58 1.01 -0.55 0.00 -1.94 -1.79 103.07 99.72 3g1x h GLY 190 Ca 0.02 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 3g1x h GLY 190 CO -0.26 0.23 0.38 0.83 0.00 0.00 0.00 176.54 177.72 3g1x h GLU 191 N 0.53 1.00 -0.62 4.80 4.39 -1.97 -2.65 114.58 120.06 3g1x h GLU 191 Ca 0.14 -0.12 -0.06 0.00 0.34 0.00 0.00 59.36 59.66 3g1x h GLU 191 Cb -0.01 -0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 28.42 3g1x h GLU 191 CO -0.03 0.75 0.13 1.15 -1.16 0.00 0.00 179.01 179.85 3g1x h THR 192 N 0.98 1.25 0.00 1.13 2.02 -1.09 -2.39 112.91 114.81 3g1x h THR 192 Ca 0.25 -0.93 0.00 0.00 0.77 0.00 0.00 66.41 66.50 3g1x h THR 192 Cb 0.05 0.63 0.00 0.00 -1.74 0.00 0.00 68.15 67.09 3g1x h THR 192 CO -0.04 0.35 0.00 0.18 0.37 0.00 0.00 175.52 176.38 3g1x n LEU 193 N -4.24 0.00 0.17 2.58 4.77 -0.69 -0.90 117.00 118.70 3g1x n LEU 193 Ca 0.04 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.07 3g1x n LEU 193 Cb 0.26 0.00 0.26 0.00 -2.33 0.00 0.00 43.42 41.61 3g1x n LEU 193 CO 0.41 0.00 0.62 0.03 -1.33 0.00 0.00 177.39 177.12 3g1x h ARG 194 N 0.00 0.00 0.00 3.23 3.08 -1.32 -3.37 114.38 116.00 3g1x h ARG 194 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 3g1x h ARG 194 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 3g1x h ARG 194 CO 0.00 0.43 -1.02 1.19 -1.07 0.00 0.00 179.97 179.50 3g1x n PHE 195 N -3.49 0.00 -3.18 3.04 3.01 -0.85 -5.05 117.46 110.93 3g1x n PHE 195 Ca 0.00 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.14 3g1x n PHE 195 Cb 0.56 -0.01 -0.05 0.00 -0.01 0.00 0.00 39.48 39.97 3g1x n PHE 195 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3g1x s ALA 196 N -2.01 3.42 -0.11 4.37 0.00 -0.07 -4.89 121.76 122.46 3g1x s ALA 196 Ca -0.00 -0.13 0.14 0.00 0.00 0.00 0.00 51.96 51.97 3g1x s ALA 196 Cb 0.00 -2.63 -0.02 0.00 0.00 0.00 0.00 23.12 20.47 3g1x s ALA 196 CO 0.01 0.32 1.29 -0.44 0.00 0.00 0.00 175.76 176.94 3g1x h ASP 197 N 2.12 0.00 -5.00 0.00 3.32 -0.91 -3.40 116.42 112.55 3g1x h ASP 197 Ca -0.47 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.49 3g1x h ASP 197 Cb 1.18 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.54 3g1x h ASP 197 CO 0.66 0.59 -0.10 0.00 -1.72 0.00 0.00 179.24 178.68 3g1x s ALA 198 N -2.91 -1.13 0.05 3.45 0.00 -1.14 -4.73 121.76 115.35 3g1x s ALA 198 Ca 0.02 0.61 0.04 0.00 0.00 0.00 0.00 51.96 52.63 3g1x s ALA 198 Cb 0.08 0.12 -0.04 0.00 0.00 0.00 0.00 23.12 23.29 3g1x s ALA 198 CO 0.77 -0.34 -0.01 0.96 0.00 0.00 0.00 175.76 177.13 3g1x s ILE 199 N -1.57 3.97 -0.21 0.00 -4.36 -0.26 -1.68 121.20 117.09 3g1x s ILE 199 Ca -0.11 -0.85 -0.08 0.00 -0.26 0.00 0.00 60.65 59.35 3g1x s ILE 199 Cb -0.03 -2.83 -0.04 0.00 1.25 0.00 0.00 42.46 40.81 3g1x s ILE 199 CO 0.04 0.24 0.09 -0.63 0.24 0.00 0.00 174.94 174.92 3g1x s ILE 200 N -1.19 4.85 -0.07 8.37 1.01 -0.05 -0.65 121.20 133.47 3g1x s ILE 200 Ca 0.22 -0.00 0.01 0.00 0.00 0.00 0.00 60.65 60.88 3g1x s ILE 200 Cb -0.12 -3.22 0.02 0.00 0.01 0.00 0.00 42.46 39.16 3g1x s ILE 200 CO 0.14 0.41 -0.07 -0.69 0.00 0.00 0.00 174.94 174.73 3g1x s VAL 201 N 0.77 0.81 0.00 2.92 1.01 -0.04 -4.05 120.40 121.82 3g1x s VAL 201 Ca 0.05 -0.23 0.00 0.00 0.00 0.00 0.00 61.98 61.80 3g1x s VAL 201 Cb -0.13 -0.82 0.00 0.00 0.00 0.00 0.00 36.38 35.43 3g1x s VAL 201 CO 0.02 0.30 0.00 0.61 0.00 0.00 0.00 175.10 176.03 3g1x n GLY 202 N 4.37 0.32 0.33 4.51 0.00 -1.26 -0.95 105.19 112.50 3g1x n GLY 202 Ca -0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.95 3g1x n GLY 202 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3g1x h ARG 203 N 0.00 0.61 -0.15 1.61 3.08 -1.92 0.19 114.38 117.80 3g1x h ARG 203 Ca 0.00 -0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.06 3g1x h ARG 203 Cb 0.00 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 3g1x h ARG 203 CO 0.00 0.40 0.32 0.77 -1.07 0.00 0.00 179.97 180.39 3g1x h SER 204 N 0.63 0.00 0.00 7.04 0.02 -1.90 -1.21 113.55 118.12 3g1x h SER 204 Ca 0.54 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.41 3g1x h SER 204 Cb 0.86 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.39 3g1x h SER 204 CO -0.41 0.00 -1.04 -0.38 -1.14 0.00 0.00 176.83 173.86 3g1x n ILE 205 N -3.29 1.38 0.41 3.27 5.41 -0.09 -4.28 119.36 122.17 3g1x n ILE 205 Ca 0.01 0.11 0.10 0.00 1.00 0.00 0.00 62.75 63.97 3g1x n ILE 205 Cb 0.42 -2.08 0.43 0.00 -0.71 0.00 0.00 39.64 37.70 3g1x n ILE 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3g1x n TYR 206 N -4.16 0.56 0.70 1.39 0.18 -0.35 -2.09 117.16 113.38 3g1x n TYR 206 Ca -0.17 0.22 0.07 0.00 1.88 0.00 0.00 57.90 59.91 3g1x n TYR 206 Cb 0.47 -0.86 -0.04 0.00 -0.38 0.00 0.00 39.34 38.54 3g1x n TYR 206 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3g1x n LEU 207 N -2.01 1.23 -4.74 -3.48 4.77 -0.46 -4.99 117.00 107.31 3g1x n LEU 207 Ca 0.02 -0.66 -0.36 0.00 -0.03 0.00 0.00 56.01 54.98 3g1x n LEU 207 Cb 0.20 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.34 3g1x n LEU 207 CO 0.17 0.25 0.87 0.00 -1.33 0.00 0.00 177.39 177.36 3g1x s ALA 208 N -2.09 2.47 0.24 -1.18 0.00 -0.89 -4.90 121.76 115.42 3g1x s ALA 208 Ca 0.10 1.10 -0.05 0.00 0.00 0.00 0.00 51.96 53.11 3g1x s ALA 208 Cb 0.12 -3.50 0.35 0.00 0.00 0.00 0.00 23.12 20.10 3g1x s ALA 208 CO 0.48 -1.35 1.83 -0.44 0.00 0.00 0.00 175.76 176.29 3g1x h ASP 209 N 0.74 0.77 -3.21 0.00 5.19 -1.94 -3.32 116.42 114.66 3g1x h ASP 209 Ca -0.51 0.03 -0.59 0.00 -0.62 0.00 0.00 57.03 55.34 3g1x h ASP 209 Cb 1.31 -0.13 -0.40 0.00 0.18 0.00 0.00 39.33 40.30 3g1x h ASP 209 CO 0.54 0.47 -0.77 0.21 -3.12 0.00 0.00 179.24 176.58 3g1x s ASN 210 N -5.70 3.63 0.29 6.45 2.47 -1.26 -5.01 114.94 115.81 3g1x s ASN 210 Ca -0.13 -2.21 0.04 0.00 0.42 0.00 0.00 52.86 50.99 3g1x s ASN 210 Cb 0.19 -0.84 0.75 0.00 -1.45 0.00 0.00 41.25 39.90 3g1x s ASN 210 CO 0.79 -0.32 1.69 -0.65 -3.72 0.00 0.00 177.10 174.88 3g1x h PRO 211 N 7.23 0.38 -0.42 0.43 0.11 -1.73 -1.49 132.00 136.52 3g1x h PRO 211 Ca -0.04 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.05 3g1x h PRO 211 Cb 0.96 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.97 3g1x h PRO 211 CO 0.44 0.25 0.26 0.00 -0.21 0.00 0.00 178.00 178.74 3g1x h ALA 212 N 1.72 0.53 -0.48 -0.75 0.00 -1.90 0.15 119.26 118.53 3g1x h ALA 212 Ca 0.57 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.37 3g1x h ALA 212 Cb 1.10 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 3g1x h ALA 212 CO -0.54 0.01 0.05 0.00 0.00 0.00 0.00 179.25 178.77 3g1x h ALA 213 N 1.13 1.17 -0.23 0.00 0.00 -1.68 0.18 119.26 119.82 3g1x h ALA 213 Ca 0.15 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 3g1x h ALA 213 Cb -0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3g1x h ALA 213 CO -0.03 0.55 0.06 0.00 0.00 0.00 0.00 179.25 179.83 3g1x h ALA 214 N 1.32 0.31 -0.54 0.00 0.00 -0.80 0.12 119.26 119.67 3g1x h ALA 214 Ca 0.15 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 3g1x h ALA 214 Cb 0.38 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3g1x h ALA 214 CO 0.01 -0.05 0.08 0.00 0.00 0.00 0.00 179.25 179.29 3g1x h ALA 215 N 0.88 0.71 -0.79 0.00 0.00 -0.74 -2.06 119.26 117.27 3g1x h ALA 215 Ca 0.07 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 3g1x h ALA 215 Cb 0.27 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3g1x h ALA 215 CO 0.00 0.46 0.32 0.00 0.00 0.00 0.00 179.25 180.03 3g1x h ALA 216 N 0.98 1.02 -0.74 0.00 0.00 -0.82 -1.58 119.26 118.13 3g1x h ALA 216 Ca 0.16 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3g1x h ALA 216 Cb 0.42 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3g1x h ALA 216 CO 0.01 0.65 0.33 0.78 0.00 0.00 0.00 179.25 181.02 3g1x h GLY 217 N 1.15 1.16 0.86 0.00 0.00 -0.50 0.15 103.07 105.88 3g1x h GLY 217 Ca 0.26 -0.60 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 3g1x h GLY 217 CO -0.02 0.57 0.05 -2.22 0.00 0.00 0.00 176.54 174.92 3g1x h ILE 218 N 1.05 1.20 -0.53 2.60 2.04 -1.08 -2.02 117.51 120.77 3g1x h ILE 218 Ca 0.25 -0.64 -0.03 0.00 1.00 0.00 0.00 64.86 65.44 3g1x h ILE 218 Cb 0.16 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 3g1x h ILE 218 CO -0.03 0.20 0.19 0.40 0.00 0.00 0.00 178.15 178.91 3g1x h ILE 219 N 0.13 1.20 -0.78 -0.67 2.04 -1.05 -2.46 117.51 115.92 3g1x h ILE 219 Ca 0.06 -0.66 -0.03 0.00 1.00 0.00 0.00 64.86 65.23 3g1x h ILE 219 Cb 0.26 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 36.89 3g1x h ILE 219 CO -0.00 0.26 0.37 -0.08 0.00 0.00 0.00 178.15 178.69 3g1x h GLU 220 N 0.76 1.12 0.00 2.37 4.57 -0.45 -0.20 114.58 122.76 3g1x h GLU 220 Ca 0.18 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 3g1x h GLU 220 Cb 0.19 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.58 3g1x h GLU 220 CO -0.01 0.87 0.00 -1.13 -1.18 0.00 0.00 179.01 177.56 3g1x n SER 221 N -4.37 0.00 -0.14 1.04 3.41 -0.78 -3.07 113.62 109.71 3g1x n SER 221 Ca 0.07 0.37 0.03 0.00 -0.26 0.00 0.00 58.87 59.08 3g1x n SER 221 Cb 0.14 -0.44 0.05 0.00 -0.26 0.00 0.00 64.21 63.69 3g1x n SER 221 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3g1x n ILE 222 N -1.44 0.88 0.00 -1.33 -5.35 -0.80 -4.75 119.36 106.57 3g1x n ILE 222 Ca 0.06 -1.01 0.00 0.00 -0.27 0.00 0.00 62.75 61.53 3g1x n ILE 222 Cb 0.20 0.34 0.00 0.00 -1.74 0.00 0.00 39.64 38.44 3g1x n ILE 222 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08