#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g0t h ASP 2 N 0.00 0.96 -0.91 -1.12 3.32 -2.00 -2.31 116.42 114.36 1g0t h ASP 2 Ca 0.00 0.03 0.08 0.00 0.02 0.00 0.00 57.03 57.16 1g0t h ASP 2 Cb 0.00 -0.17 -0.06 0.00 0.22 0.00 0.00 39.33 39.32 1g0t h ASP 2 CO 0.00 0.57 0.59 0.00 -1.72 0.00 0.00 179.24 178.68 1g0t h ALA 3 N 1.49 1.56 -0.23 3.45 0.00 -1.99 -0.33 119.26 123.20 1g0t h ALA 3 Ca 0.45 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.31 1g0t h ALA 3 Cb 0.32 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1g0t h ALA 3 CO -0.22 0.28 -0.01 0.00 0.00 0.00 0.00 179.25 179.30 1g0t h ALA 4 N 1.53 0.31 -0.70 0.00 0.00 -1.69 -1.55 119.26 117.17 1g0t h ALA 4 Ca 0.41 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1g0t h ALA 4 Cb 0.30 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1g0t h ALA 4 CO -0.17 0.05 0.35 0.82 0.00 0.00 0.00 179.25 180.31 1g0t h ILE 5 N 0.18 1.23 -0.15 0.00 2.04 -1.30 -2.08 117.51 117.43 1g0t h ILE 5 Ca 0.06 -0.61 -0.08 0.00 1.00 0.00 0.00 64.86 65.23 1g0t h ILE 5 Cb 0.43 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 1g0t h ILE 5 CO 0.01 0.26 -0.28 1.56 0.00 0.00 0.00 178.15 179.70 1g0t h GLN 6 N 0.97 0.28 -0.49 2.37 1.08 -0.99 -1.28 115.11 117.04 1g0t h GLN 6 Ca 0.24 -0.10 -0.13 0.00 -1.45 0.00 0.00 58.65 57.21 1g0t h GLN 6 Cb 0.09 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.49 1g0t h GLN 6 CO -0.03 0.54 -0.20 1.96 -0.95 0.00 0.00 178.83 180.15 1g0t h GLN 7 N 0.25 1.01 -0.09 1.46 4.20 -0.90 -0.45 115.11 120.59 1g0t h GLN 7 Ca 0.04 -0.42 -0.01 0.00 0.06 0.00 0.00 58.65 58.31 1g0t h GLN 7 Cb 0.63 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.37 1g0t h GLN 7 CO 0.05 1.10 0.01 1.15 -0.67 0.00 0.00 178.83 180.47 1g0t h THR 8 N 0.87 1.21 -0.64 -0.54 2.02 -1.01 -1.89 112.91 112.93 1g0t h THR 8 Ca 0.12 -0.67 -0.04 0.00 0.77 0.00 0.00 66.41 66.59 1g0t h THR 8 Cb 0.78 1.49 -0.03 0.00 -1.74 0.00 0.00 68.15 68.65 1g0t h THR 8 CO 0.06 0.19 0.23 -0.07 0.37 0.00 0.00 175.52 176.30 1g0t h LEU 9 N -0.09 0.90 -1.29 2.58 3.38 -1.21 -2.38 115.31 117.20 1g0t h LEU 9 Ca 0.03 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 1g0t h LEU 9 Cb 0.28 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 1g0t h LEU 9 CO 0.00 0.85 0.31 0.00 0.09 0.00 0.00 178.44 179.69 1g0t h ALA 10 N 1.09 1.46 -0.26 1.53 0.00 -1.02 -0.27 119.26 121.79 1g0t h ALA 10 Ca 0.21 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.07 1g0t h ALA 10 Cb 0.24 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1g0t h ALA 10 CO -0.01 0.45 0.18 0.87 0.00 0.00 0.00 179.25 180.73 1g0t h LYS 11 N 0.81 0.14 -0.55 0.00 1.57 -0.80 -1.39 116.57 116.34 1g0t h LYS 11 Ca 0.21 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1g0t h LYS 11 Cb 0.03 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1g0t h LYS 11 CO -0.03 0.09 0.00 -1.33 -0.57 0.00 0.00 179.45 177.61 1g0t n MET 12 N -4.49 2.63 -3.00 3.15 2.81 -0.82 -4.97 117.12 112.43 1g0t n MET 12 Ca 0.02 -2.40 -0.12 0.00 -1.81 0.00 0.00 57.70 53.39 1g0t n MET 12 Cb 0.23 -1.48 0.06 0.00 -0.71 0.00 0.00 33.22 31.32 1g0t n MET 12 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1g0t n GLY 13 N 1.35 -0.22 3.14 3.03 0.00 -0.52 -5.02 105.19 106.95 1g0t n GLY 13 Ca 0.20 0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 1g0t n GLY 13 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1g0t s ILE 14 N -3.27 1.88 -0.47 -0.61 1.01 -0.17 -5.02 121.20 114.56 1g0t s ILE 14 Ca 0.05 -0.88 -0.22 0.00 0.00 0.00 0.00 60.65 59.60 1g0t s ILE 14 Cb -0.01 -1.67 0.03 0.00 0.01 0.00 0.00 42.46 40.83 1g0t s ILE 14 CO 0.53 0.52 0.74 -1.59 0.00 0.00 0.00 174.94 175.14 1g0t s LYS 15 N 0.77 3.32 -0.03 2.79 -2.85 -1.26 -4.16 119.74 118.31 1g0t s LYS 15 Ca -0.09 -0.31 -0.33 0.00 -1.00 0.00 0.00 55.97 54.24 1g0t s LYS 15 Cb -0.16 -3.98 -0.11 0.00 -2.06 0.00 0.00 37.83 31.52 1g0t s LYS 15 CO 0.00 -1.15 1.90 0.45 0.10 0.00 0.00 175.35 176.66 1g0t n SER 16 N 6.61 3.71 0.03 0.03 2.88 -1.26 -3.50 113.62 122.12 1g0t n SER 16 Ca -0.00 0.95 -0.08 0.00 -1.33 0.00 0.00 58.87 58.41 1g0t n SER 16 Cb 0.48 -1.43 -0.13 0.00 -0.75 0.00 0.00 64.21 62.38 1g0t n SER 16 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1g0t h SER 17 N 9.53 0.02 0.00 -3.46 0.87 -1.06 -3.48 113.55 115.98 1g0t h SER 17 Ca -0.49 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.04 1g0t h SER 17 Cb 1.26 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.21 1g0t h SER 17 CO 0.94 1.02 0.00 -0.67 -0.53 0.00 0.00 176.83 177.60 1g0t n ASP 18 N -3.25 0.00 -4.28 6.23 2.03 -0.61 -4.98 116.55 111.69 1g0t n ASP 18 Ca -0.07 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.81 1g0t n ASP 18 Cb 0.98 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 41.31 1g0t n ASP 18 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1g0t s ILE 19 N -0.65 4.70 0.37 5.18 1.01 -1.26 -1.34 121.20 129.21 1g0t s ILE 19 Ca 0.00 -1.50 0.07 0.00 0.00 0.00 0.00 60.65 59.22 1g0t s ILE 19 Cb 0.00 -3.98 -0.01 0.00 0.01 0.00 0.00 42.46 38.48 1g0t s ILE 19 CO 0.00 -0.72 0.45 -1.10 0.00 0.00 0.00 174.94 173.57 1g0t s GLN 20 N 1.50 2.88 0.80 2.79 -1.52 0.33 -4.97 119.66 121.46 1g0t s GLN 20 Ca 0.04 -1.21 -0.11 0.00 -1.95 0.00 0.00 55.36 52.13 1g0t s GLN 20 Cb -0.26 -2.67 0.07 0.00 -0.22 0.00 0.00 33.01 29.93 1g0t s GLN 20 CO 0.02 -0.06 1.09 -2.14 -0.25 0.00 0.00 175.29 173.95 1g0t s PRO 21 N -4.18 2.05 0.08 2.91 0.02 -1.26 -0.62 135.00 133.99 1g0t s PRO 21 Ca 0.47 0.81 0.06 0.00 0.02 0.00 0.00 61.00 62.37 1g0t s PRO 21 Cb -0.08 -1.90 -0.03 0.00 0.02 0.00 0.00 34.50 32.51 1g0t s PRO 21 CO 0.30 -1.69 -0.17 0.00 -0.33 0.00 0.00 177.00 175.11 1g0t s ALA 22 N -3.05 1.48 -2.00 -1.55 0.00 -1.25 -3.68 121.76 111.71 1g0t s ALA 22 Ca 0.61 -1.07 0.15 0.00 0.00 0.00 0.00 51.96 51.65 1g0t s ALA 22 Cb -0.16 -0.19 0.92 0.00 0.00 0.00 0.00 23.12 23.69 1g0t s ALA 22 CO 0.55 0.27 1.34 -0.35 0.00 0.00 0.00 175.76 177.58 1g0t n PRO 23 N 1.36 0.56 -4.72 0.00 -0.04 -1.26 -4.56 135.00 126.33 1g0t n PRO 23 Ca -0.20 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.93 1g0t n PRO 23 Cb 0.54 -1.43 -0.15 0.00 -0.04 0.00 0.00 33.50 32.42 1g0t n PRO 23 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1g0t s VAL 24 N -2.00 2.85 0.60 0.52 1.01 -1.26 -5.11 120.40 117.01 1g0t s VAL 24 Ca 0.23 -0.72 -0.19 0.00 0.00 0.00 0.00 61.98 61.30 1g0t s VAL 24 Cb 0.11 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.26 1g0t s VAL 24 CO 0.18 0.52 1.26 0.00 0.00 0.00 0.00 175.10 177.06 1g0t s ALA 25 N 0.52 2.55 0.00 5.51 0.00 -1.26 -3.10 121.76 125.98 1g0t s ALA 25 Ca -0.10 1.13 0.00 0.00 0.00 0.00 0.00 51.96 53.00 1g0t s ALA 25 Cb -0.16 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.46 1g0t s ALA 25 CO 0.04 -1.32 0.00 0.41 0.00 0.00 0.00 175.76 174.89 1g0t n GLY 26 N 0.68 1.39 3.16 0.00 0.00 -1.26 -5.00 105.19 104.16 1g0t n GLY 26 Ca 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.06 1g0t n GLY 26 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1g0t s MET 27 N -0.03 0.89 0.09 1.61 0.00 -1.18 0.17 119.30 120.86 1g0t s MET 27 Ca 0.00 -1.36 0.08 0.00 0.00 0.00 0.00 55.69 54.41 1g0t s MET 27 Cb 0.00 0.25 -0.03 0.00 0.00 0.00 0.00 34.83 35.05 1g0t s MET 27 CO 0.00 -0.25 -0.21 0.15 0.00 0.00 0.00 175.02 174.71 1g0t s LYS 28 N -4.01 1.20 -0.05 3.16 -0.14 -0.39 -3.76 119.74 115.75 1g0t s LYS 28 Ca 0.20 -1.14 -0.25 0.00 -1.36 0.00 0.00 55.97 53.42 1g0t s LYS 28 Cb 0.07 -1.46 -0.03 0.00 -1.68 0.00 0.00 37.83 34.73 1g0t s LYS 28 CO -0.01 0.35 0.77 0.99 -0.76 0.00 0.00 175.35 176.69 1g0t s THR 29 N -1.09 5.00 -0.23 2.17 2.01 0.21 -2.28 115.64 121.45 1g0t s THR 29 Ca 0.07 1.60 0.01 0.00 0.31 0.00 0.00 61.69 63.67 1g0t s THR 29 Cb -0.10 -4.11 0.06 0.00 0.01 0.00 0.00 72.50 68.36 1g0t s THR 29 CO 0.04 0.22 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.45 1g0t s VAL 30 N 0.88 1.50 -0.25 3.82 1.01 0.17 -0.51 120.40 127.01 1g0t s VAL 30 Ca 0.41 -1.15 -0.25 0.00 0.00 0.00 0.00 61.98 60.99 1g0t s VAL 30 Cb -0.18 -1.74 -0.00 0.00 0.00 0.00 0.00 36.38 34.45 1g0t s VAL 30 CO 0.20 -0.06 0.86 -0.22 0.00 0.00 0.00 175.10 175.88 1g0t s LEU 31 N 1.42 4.08 0.34 3.92 2.96 -0.45 -1.50 118.68 129.44 1g0t s LEU 31 Ca -0.05 1.02 0.03 0.00 -0.22 0.00 0.00 54.13 54.92 1g0t s LEU 31 Cb -0.18 -3.23 -0.04 0.00 0.50 0.00 0.00 46.19 43.24 1g0t s LEU 31 CO -0.06 -0.56 0.11 0.42 -1.32 0.00 0.00 176.35 174.93 1g0t s THR 32 N 2.93 0.71 0.60 3.68 -4.23 0.48 -0.40 115.64 119.41 1g0t s THR 32 Ca 0.36 -2.00 0.30 0.00 -1.18 0.00 0.00 61.69 59.17 1g0t s THR 32 Cb -0.15 -2.56 0.36 0.00 1.34 0.00 0.00 72.50 71.49 1g0t s THR 32 CO 0.08 0.00 2.12 -0.55 -0.54 0.00 0.00 174.62 175.74 1g0t h ASN 33 N 2.07 0.00 0.07 3.99 -1.07 -1.94 1.00 115.58 119.69 1g0t h ASN 33 Ca -0.37 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.00 1g0t h ASN 33 Cb 1.26 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.51 1g0t h ASN 33 CO 0.60 0.00 -0.14 -1.20 0.07 0.00 0.00 177.43 176.76 1g0t n SER 34 N -3.74 1.63 0.00 6.14 7.64 -1.26 -5.06 113.62 118.97 1g0t n SER 34 Ca 0.01 -1.38 0.00 0.00 1.01 0.00 0.00 58.87 58.51 1g0t n SER 34 Cb 0.29 0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.59 1g0t n SER 34 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1g0t n GLY 35 N 1.28 0.14 3.68 0.23 0.00 0.35 -4.98 105.19 105.89 1g0t n GLY 35 Ca 0.15 -1.96 -0.36 0.00 0.00 0.00 0.00 46.02 43.84 1g0t n GLY 35 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g0t s VAL 36 N 0.00 5.34 0.19 1.61 1.01 -1.26 0.18 120.40 127.47 1g0t s VAL 36 Ca 0.00 0.29 0.05 0.00 0.00 0.00 0.00 61.98 62.31 1g0t s VAL 36 Cb 0.00 -3.54 -0.05 0.00 0.00 0.00 0.00 36.38 32.79 1g0t s VAL 36 CO 0.00 0.35 -0.08 -0.76 0.00 0.00 0.00 175.10 174.61 1g0t s LEU 37 N 0.93 2.43 -0.15 3.92 1.43 -0.56 -3.93 118.68 122.75 1g0t s LEU 37 Ca 0.10 -1.09 0.00 0.00 -1.03 0.00 0.00 54.13 52.12 1g0t s LEU 37 Cb -0.13 -0.40 -0.00 0.00 0.03 0.00 0.00 46.19 45.68 1g0t s LEU 37 CO 0.04 -0.36 -0.16 -0.31 0.23 0.00 0.00 176.35 175.80 1g0t s TYR 38 N -3.27 2.77 -0.05 0.29 1.51 -0.41 -0.66 117.35 117.53 1g0t s TYR 38 Ca 0.22 -0.98 0.03 0.00 -1.01 0.00 0.00 57.07 55.33 1g0t s TYR 38 Cb 0.03 -1.87 0.00 0.00 -0.11 0.00 0.00 41.96 40.01 1g0t s TYR 38 CO 0.05 -0.43 -0.15 0.42 -1.11 0.00 0.00 175.55 174.33 1g0t s ILE 39 N 0.72 1.27 0.81 2.71 1.01 -0.96 -0.56 121.20 126.19 1g0t s ILE 39 Ca -0.07 -0.60 -0.12 0.00 0.00 0.00 0.00 60.65 59.86 1g0t s ILE 39 Cb -0.16 -1.11 0.09 0.00 0.01 0.00 0.00 42.46 41.29 1g0t s ILE 39 CO 0.01 0.37 1.16 0.42 0.00 0.00 0.00 174.94 176.90 1g0t s THR 40 N 0.25 2.43 0.58 2.92 -4.23 -0.48 -1.26 115.64 115.86 1g0t s THR 40 Ca -0.07 0.17 0.28 0.00 -1.18 0.00 0.00 61.69 60.89 1g0t s THR 40 Cb -0.12 -2.48 0.35 0.00 1.34 0.00 0.00 72.50 71.58 1g0t s THR 40 CO 0.03 -0.16 2.22 0.44 -0.54 0.00 0.00 174.62 176.61 1g0t h ASP 41 N -1.11 0.00 -0.02 3.99 3.32 -0.62 -0.76 116.42 121.22 1g0t h ASP 41 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1g0t h ASP 41 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.82 1g0t h ASP 41 CO 0.47 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.09 1g0t n ASP 42 N -3.90 1.61 0.00 6.45 5.68 -1.26 -0.11 116.55 125.01 1g0t n ASP 42 Ca -0.02 -1.54 0.00 0.00 -0.50 0.00 0.00 54.79 52.73 1g0t n ASP 42 Cb 0.12 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.10 1g0t n ASP 42 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1g0t n GLY 43 N 1.19 0.34 0.12 6.12 0.00 -0.29 -4.71 105.19 107.95 1g0t n GLY 43 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1g0t n GLY 43 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1g0t h LYS 44 N 0.85 0.00 -5.29 1.61 1.57 -1.91 -3.45 116.57 109.94 1g0t h LYS 44 Ca 0.00 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.31 1g0t h LYS 44 Cb 0.33 0.00 -0.28 0.00 0.08 0.00 0.00 32.23 32.36 1g0t h LYS 44 CO 0.00 0.62 -0.81 -1.01 -0.57 0.00 0.00 179.45 177.69 1g0t s HIS 45 N -3.00 1.24 -0.06 -1.35 3.76 -1.26 -5.03 115.29 109.60 1g0t s HIS 45 Ca 0.03 -0.27 0.04 0.00 -0.15 0.00 0.00 55.06 54.71 1g0t s HIS 45 Cb 0.09 -0.78 -0.00 0.00 1.11 0.00 0.00 32.58 33.00 1g0t s HIS 45 CO 0.76 -0.00 -0.18 0.42 -0.85 0.00 0.00 174.74 174.88 1g0t s ILE 46 N -0.49 1.55 -0.10 0.60 1.01 -1.26 -1.38 121.20 121.13 1g0t s ILE 46 Ca 0.04 -0.76 -0.01 0.00 0.00 0.00 0.00 60.65 59.92 1g0t s ILE 46 Cb -0.06 -1.34 0.03 0.00 0.01 0.00 0.00 42.46 41.10 1g0t s ILE 46 CO 0.00 0.44 -0.05 -0.63 0.00 0.00 0.00 174.94 174.70 1g0t s ILE 47 N 0.15 0.81 0.19 2.92 1.01 0.27 -4.99 121.20 121.57 1g0t s ILE 47 Ca -0.07 -0.15 -0.30 0.00 0.00 0.00 0.00 60.65 60.12 1g0t s ILE 47 Cb -0.13 -0.88 -0.08 0.00 0.01 0.00 0.00 42.46 41.38 1g0t s ILE 47 CO 0.04 0.33 1.04 -1.10 0.00 0.00 0.00 174.94 175.25 1g0t s GLN 48 N 1.80 4.67 0.00 2.79 -0.21 -1.26 -1.29 119.66 126.15 1g0t s GLN 48 Ca 0.05 1.64 0.00 0.00 0.02 0.00 0.00 55.36 57.07 1g0t s GLN 48 Cb -0.12 -3.29 0.00 0.00 1.00 0.00 0.00 33.01 30.60 1g0t s GLN 48 CO -0.07 0.20 0.00 0.41 -2.12 0.00 0.00 175.29 173.71 1g0t n GLY 49 N 1.87 -2.00 3.93 3.09 0.00 -1.25 -4.92 105.19 105.90 1g0t n GLY 49 Ca 0.01 -1.45 -0.27 0.00 0.00 0.00 0.00 46.02 44.31 1g0t n GLY 49 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1g0t s PRO 50 N -0.87 1.95 -0.07 1.61 0.04 -1.26 -5.13 135.00 131.28 1g0t s PRO 50 Ca 0.00 -0.22 -0.00 0.00 0.04 0.00 0.00 61.00 60.82 1g0t s PRO 50 Cb 0.00 -2.09 -0.03 0.00 0.04 0.00 0.00 34.50 32.42 1g0t s PRO 50 CO 0.00 -1.46 -0.03 1.41 0.04 0.00 0.00 177.00 176.96 1g0t s MET 51 N -5.39 2.85 -0.03 4.56 1.75 -1.26 -5.01 119.30 116.77 1g0t s MET 51 Ca 0.62 -0.49 0.07 0.00 -1.25 0.00 0.00 55.69 54.64 1g0t s MET 51 Cb -0.10 -2.69 -0.02 0.00 2.84 0.00 0.00 34.83 34.87 1g0t s MET 51 CO 0.47 0.68 -0.24 0.71 -0.65 0.00 0.00 175.02 175.99 1g0t s TYR 52 N -0.87 2.18 -0.40 4.11 1.51 -1.26 -1.16 117.35 121.46 1g0t s TYR 52 Ca 0.14 -0.47 -0.19 0.00 -1.01 0.00 0.00 57.07 55.53 1g0t s TYR 52 Cb -0.11 -1.41 0.01 0.00 -0.11 0.00 0.00 41.96 40.34 1g0t s TYR 52 CO 0.03 -0.08 0.56 0.34 -1.11 0.00 0.00 175.55 175.29 1g0t s ASP 53 N -0.45 6.31 -0.28 2.29 -1.08 -0.14 -4.89 116.67 118.43 1g0t s ASP 53 Ca 0.06 -0.25 0.09 0.00 -0.52 0.00 0.00 52.55 51.93 1g0t s ASP 53 Cb -0.10 -2.29 0.46 0.00 -1.46 0.00 0.00 42.92 39.53 1g0t s ASP 53 CO 0.00 -0.63 1.32 1.33 0.52 0.00 0.00 175.17 177.72 1g0t n VAL 54 N 5.61 2.46 0.06 1.11 0.24 -1.26 -1.82 118.33 124.73 1g0t n VAL 54 Ca -0.04 -3.34 0.04 0.00 -2.04 0.00 0.00 64.34 58.97 1g0t n VAL 54 Cb 0.48 -0.53 -0.05 0.00 -1.47 0.00 0.00 33.84 32.27 1g0t n VAL 54 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1g0t h SER 55 N 1.34 0.00 -0.14 -1.34 4.64 -1.91 -3.48 113.55 112.66 1g0t h SER 55 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1g0t h SER 55 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 1g0t h SER 55 CO 0.38 0.35 0.00 0.61 -0.87 0.00 0.00 176.83 177.30 1g0t n GLY 56 N 1.31 -0.27 0.16 -0.77 0.00 -1.26 -4.99 105.19 99.37 1g0t n GLY 56 Ca -0.06 -1.64 -0.16 0.00 0.00 0.00 0.00 46.02 44.16 1g0t n GLY 56 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1g0t h THR 57 N 0.00 1.37 -3.90 2.61 2.02 -1.94 -3.46 112.91 109.62 1g0t h THR 57 Ca 0.00 -2.44 -0.37 0.00 0.77 0.00 0.00 66.41 64.37 1g0t h THR 57 Cb 0.00 2.46 -0.21 0.00 -1.74 0.00 0.00 68.15 68.66 1g0t h THR 57 CO 0.00 0.73 -0.76 0.00 0.37 0.00 0.00 175.52 175.86 1g0t s ALA 58 N -3.22 1.05 0.49 6.16 0.00 -1.26 -5.14 121.76 119.84 1g0t s ALA 58 Ca -0.07 -0.99 -0.23 0.00 0.00 0.00 0.00 51.96 50.67 1g0t s ALA 58 Cb 0.08 -0.04 -0.06 0.00 0.00 0.00 0.00 23.12 23.09 1g0t s ALA 58 CO 0.89 0.09 1.32 -1.25 0.00 0.00 0.00 175.76 176.80 1g0t s PRO 59 N -1.92 3.46 -0.10 0.00 0.04 -1.26 -4.84 135.00 130.38 1g0t s PRO 59 Ca -0.02 2.15 0.01 0.00 0.04 0.00 0.00 61.00 63.19 1g0t s PRO 59 Cb -0.09 -2.42 0.02 0.00 0.04 0.00 0.00 34.50 32.05 1g0t s PRO 59 CO 0.02 -0.90 -0.13 0.08 0.04 0.00 0.00 177.00 176.10 1g0t s VAL 60 N -1.33 1.30 -0.97 -0.36 1.01 -0.75 -4.96 120.40 114.33 1g0t s VAL 60 Ca 0.66 -0.52 -0.24 0.00 0.00 0.00 0.00 61.98 61.88 1g0t s VAL 60 Cb -0.38 -1.21 0.03 0.00 0.00 0.00 0.00 36.38 34.82 1g0t s VAL 60 CO 0.46 0.40 1.53 0.21 0.00 0.00 0.00 175.10 177.70 1g0t s ASN 61 N 1.06 6.22 0.54 3.32 3.84 -1.26 -0.96 114.94 127.69 1g0t s ASN 61 Ca -0.06 -1.20 0.24 0.00 0.21 0.00 0.00 52.86 52.06 1g0t s ASN 61 Cb -0.15 -2.57 1.51 0.00 -0.55 0.00 0.00 41.25 39.50 1g0t s ASN 61 CO -0.02 -1.76 2.15 -0.37 -2.79 0.00 0.00 177.10 174.31 1g0t h VAL 62 N 6.81 0.71 -0.49 -5.21 -1.51 -1.50 -0.29 116.25 114.77 1g0t h VAL 62 Ca 0.13 -0.23 -0.07 0.00 -1.23 0.00 0.00 66.70 65.30 1g0t h VAL 62 Cb 1.02 1.14 -0.02 0.00 -2.13 0.00 0.00 31.29 31.29 1g0t h VAL 62 CO 1.38 0.06 0.03 0.74 -1.23 0.00 0.00 177.57 178.54 1g0t h THR 63 N 0.00 1.26 0.00 7.19 2.02 -1.87 -0.24 112.91 121.26 1g0t h THR 63 Ca -0.00 -1.03 -0.09 0.00 0.77 0.00 0.00 66.41 66.06 1g0t h THR 63 Cb 0.13 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 1g0t h THR 63 CO 0.01 0.36 -0.42 0.78 0.37 0.00 0.00 175.52 176.62 1g0t h ASN 64 N 0.72 0.00 -0.42 4.18 4.21 -1.48 -0.00 115.58 122.78 1g0t h ASN 64 Ca 0.14 0.00 -0.12 0.00 1.21 0.00 0.00 56.30 57.54 1g0t h ASN 64 Cb 0.48 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.67 1g0t h ASN 64 CO 0.02 0.42 -0.19 0.50 -1.29 0.00 0.00 177.43 176.88 1g0t h LYS 65 N 0.00 0.87 -0.19 0.81 3.64 -0.60 -2.41 116.57 118.70 1g0t h LYS 65 Ca -0.00 -0.38 -0.04 0.00 -1.27 0.00 0.00 60.65 58.96 1g0t h LYS 65 Cb 0.88 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.67 1g0t h LYS 65 CO 0.05 1.02 -0.03 1.98 -2.27 0.00 0.00 179.45 180.21 1g0t h MET 66 N 0.70 0.35 0.00 1.90 4.05 -0.57 -2.96 114.93 118.39 1g0t h MET 66 Ca 0.10 -0.12 -0.00 0.00 -0.28 0.00 0.00 59.70 59.39 1g0t h MET 66 Cb 0.75 -0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.53 1g0t h MET 66 CO 0.06 0.59 -0.01 -0.07 0.23 0.00 0.00 176.91 177.70 1g0t h LEU 67 N 0.08 0.00 -1.62 3.39 3.38 -0.96 -1.90 115.31 117.68 1g0t h LEU 67 Ca 0.05 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.05 1g0t h LEU 67 Cb 0.45 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 1g0t h LEU 67 CO 0.01 0.01 0.49 -0.07 0.09 0.00 0.00 178.44 178.98 1g0t h LEU 68 N 0.00 0.00 -0.21 1.67 3.38 -1.25 1.39 115.31 120.28 1g0t h LEU 68 Ca -0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1g0t h LEU 68 Cb 0.04 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1g0t h LEU 68 CO 0.00 0.00 -0.18 0.50 0.09 0.00 0.00 178.44 178.85 1g0t h LYS 69 N 0.00 0.50 -0.47 1.13 3.64 -1.53 0.67 116.57 120.51 1g0t h LYS 69 Ca 0.04 -0.25 -0.10 0.00 -1.27 0.00 0.00 60.65 59.06 1g0t h LYS 69 Cb 1.03 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.83 1g0t h LYS 69 CO -0.00 0.83 -0.12 1.96 -2.27 0.00 0.00 179.45 179.84 1g0t h GLN 70 N 0.19 0.87 -0.19 1.90 1.08 0.16 -1.92 115.11 117.20 1g0t h GLN 70 Ca 0.04 -0.31 -0.03 0.00 -1.45 0.00 0.00 58.65 56.90 1g0t h GLN 70 Cb 0.72 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 28.08 1g0t h GLN 70 CO 0.05 0.95 0.01 1.25 -0.95 0.00 0.00 178.83 180.13 1g0t h LEU 71 N 0.78 0.32 -2.08 1.46 6.46 -0.89 -2.42 115.31 118.95 1g0t h LEU 71 Ca 0.13 -0.30 0.00 0.00 -0.12 0.00 0.00 57.88 57.59 1g0t h LEU 71 Cb 0.64 -0.09 0.00 0.00 -0.73 0.00 0.00 40.66 40.48 1g0t h LEU 71 CO 0.04 0.54 0.00 0.78 -0.62 0.00 0.00 178.44 179.19 1g0t h ASN 72 N 0.10 0.00 0.99 1.25 2.35 -0.78 -0.44 115.58 119.05 1g0t h ASN 72 Ca 0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1g0t h ASN 72 Cb 0.37 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.74 1g0t h ASN 72 CO 0.01 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.79 1g0t h ALA 73 N 2.00 1.00 -0.44 -0.83 0.00 -0.83 -2.73 119.26 117.44 1g0t h ALA 73 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1g0t h ALA 73 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1g0t h ALA 73 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.53 1g0t n LEU 74 N -2.41 3.54 -0.32 0.00 4.77 -0.18 -4.62 117.00 117.78 1g0t n LEU 74 Ca 0.03 -1.58 0.22 0.00 -0.03 0.00 0.00 56.01 54.64 1g0t n LEU 74 Cb 0.30 -0.28 0.43 0.00 -2.33 0.00 0.00 43.42 41.53 1g0t n LEU 74 CO 0.24 0.78 1.00 -0.08 -1.33 0.00 0.00 177.39 178.00 1g0t h GLU 75 N 4.42 0.15 0.00 3.23 4.81 -1.51 0.19 114.58 125.87 1g0t h GLU 75 Ca 0.00 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.13 1g0t h GLU 75 Cb 0.99 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.32 1g0t h GLU 75 CO 0.00 0.10 -0.43 0.87 -0.73 0.00 0.00 179.01 178.82 1g0t h LYS 76 N 0.15 0.00 -0.51 1.92 1.79 -1.86 -2.84 116.57 115.23 1g0t h LYS 76 Ca 0.70 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.17 1g0t h LYS 76 Cb 1.62 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.27 1g0t h LYS 76 CO -0.72 0.43 0.00 0.39 -1.08 0.00 0.00 179.45 178.47 1g0t n GLU 77 N -3.61 2.07 -3.68 3.15 1.02 0.66 -4.87 120.64 115.38 1g0t n GLU 77 Ca -0.00 -1.19 -0.33 0.00 -0.02 0.00 0.00 57.16 55.61 1g0t n GLU 77 Cb 0.53 -1.46 -0.05 0.00 -0.02 0.00 0.00 31.44 30.43 1g0t n GLU 77 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1g0t s MET 78 N -1.64 3.64 -0.47 3.49 -1.94 -1.07 -4.88 119.30 116.42 1g0t s MET 78 Ca 0.21 -0.03 -0.15 0.00 -1.71 0.00 0.00 55.69 54.02 1g0t s MET 78 Cb 0.13 -2.96 0.07 0.00 2.01 0.00 0.00 34.83 34.08 1g0t s MET 78 CO 0.11 0.55 0.39 0.42 -0.01 0.00 0.00 175.02 176.48 1g0t s ILE 79 N -1.48 5.15 -0.17 2.53 1.01 -1.08 -4.90 121.20 122.27 1g0t s ILE 79 Ca 0.35 -1.10 -0.12 0.00 0.00 0.00 0.00 60.65 59.77 1g0t s ILE 79 Cb -0.13 -4.09 -0.05 0.00 0.01 0.00 0.00 42.46 38.20 1g0t s ILE 79 CO 0.20 -0.58 0.24 -0.69 0.00 0.00 0.00 174.94 174.11 1g0t s VAL 80 N 1.62 5.34 -0.68 2.92 1.01 -1.26 -0.84 120.40 128.51 1g0t s VAL 80 Ca 0.04 0.42 0.03 0.00 0.00 0.00 0.00 61.98 62.47 1g0t s VAL 80 Cb -0.24 -3.57 0.17 0.00 0.00 0.00 0.00 36.38 32.73 1g0t s VAL 80 CO 0.06 0.42 0.48 -0.31 0.00 0.00 0.00 175.10 175.75 1g0t s TYR 81 N 0.31 3.51 0.29 5.22 2.02 0.27 -4.97 117.35 124.00 1g0t s TYR 81 Ca 0.14 -3.21 -0.30 0.00 -0.37 0.00 0.00 57.07 53.33 1g0t s TYR 81 Cb -0.12 -2.86 -0.11 0.00 -0.40 0.00 0.00 41.96 38.47 1g0t s TYR 81 CO 0.02 -0.64 1.61 0.21 -1.57 0.00 0.00 175.55 175.17 1g0t s LYS 82 N -1.05 4.11 -0.03 -0.62 2.47 -1.26 -2.61 119.74 120.75 1g0t s LYS 82 Ca 0.23 2.59 -0.21 0.00 -1.56 0.00 0.00 55.97 57.02 1g0t s LYS 82 Cb -0.11 -3.02 -0.05 0.00 -1.46 0.00 0.00 37.83 33.19 1g0t s LYS 82 CO -0.11 -0.65 0.60 0.00 0.16 0.00 0.00 175.35 175.35 1g0t s ALA 83 N 0.03 3.46 0.14 3.13 0.00 -1.26 -4.96 121.76 122.30 1g0t s ALA 83 Ca 0.64 0.02 -0.19 0.00 0.00 0.00 0.00 51.96 52.43 1g0t s ALA 83 Cb -0.48 -2.76 0.02 0.00 0.00 0.00 0.00 23.12 19.90 1g0t s ALA 83 CO 0.48 0.10 1.69 -1.35 0.00 0.00 0.00 175.76 176.68 1g0t h PRO 84 N 5.95 0.00 -2.48 0.00 0.11 -1.94 -2.68 132.00 130.96 1g0t h PRO 84 Ca -0.44 -0.00 -0.75 0.00 0.11 0.00 0.00 66.00 64.92 1g0t h PRO 84 Cb 1.20 -0.00 -0.31 0.00 0.11 0.00 0.00 31.00 31.99 1g0t h PRO 84 CO 0.71 0.00 0.50 1.04 -0.21 0.00 0.00 178.00 180.04 1g0t n GLN 85 N -5.24 4.43 -1.61 1.05 1.13 -1.26 -5.03 117.38 110.85 1g0t n GLN 85 Ca -0.01 -4.66 -0.59 0.00 -1.94 0.00 0.00 57.00 49.81 1g0t n GLN 85 Cb 0.16 -2.42 -0.08 0.00 0.11 0.00 0.00 30.24 28.00 1g0t n GLN 85 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 1g0t n GLU 86 N 0.50 0.78 0.00 -1.09 2.13 -1.01 -4.44 120.64 117.51 1g0t n GLU 86 Ca 0.35 0.27 0.00 0.00 0.66 0.00 0.00 57.16 58.44 1g0t n GLU 86 Cb 0.32 -1.98 0.00 0.00 0.27 0.00 0.00 31.44 30.06 1g0t n GLU 86 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1g0t n LYS 87 N 5.90 3.08 -3.80 5.31 5.02 0.23 -5.03 118.16 128.86 1g0t n LYS 87 Ca 0.34 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.50 1g0t n LYS 87 Cb 0.09 -0.68 -0.09 0.00 -0.02 0.00 0.00 35.03 34.33 1g0t n LYS 87 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1g0t s HIS 88 N -1.24 -0.08 -0.05 2.13 3.76 -0.34 -5.00 115.29 114.47 1g0t s HIS 88 Ca 0.00 0.05 -0.00 0.00 -0.15 0.00 0.00 55.06 54.96 1g0t s HIS 88 Cb 0.00 0.04 0.03 0.00 1.11 0.00 0.00 32.58 33.76 1g0t s HIS 88 CO 0.00 -0.38 -0.01 0.08 -0.85 0.00 0.00 174.74 173.58 1g0t s VAL 89 N -1.62 0.31 0.04 -0.90 1.01 -1.26 -0.69 120.40 117.28 1g0t s VAL 89 Ca -0.12 0.06 0.03 0.00 0.00 0.00 0.00 61.98 61.95 1g0t s VAL 89 Cb -0.05 -0.41 -0.02 0.00 0.00 0.00 0.00 36.38 35.90 1g0t s VAL 89 CO 0.02 0.20 -0.09 0.27 0.00 0.00 0.00 175.10 175.50 1g0t s ILE 90 N 1.32 0.69 -0.13 2.22 -4.36 -0.49 -4.47 121.20 115.97 1g0t s ILE 90 Ca -0.05 -0.93 -0.04 0.00 -0.26 0.00 0.00 60.65 59.38 1g0t s ILE 90 Cb -0.13 -0.69 -0.03 0.00 1.25 0.00 0.00 42.46 42.86 1g0t s ILE 90 CO -0.02 -0.20 -0.01 -0.89 0.24 0.00 0.00 174.94 174.06 1g0t s THR 91 N -1.03 4.18 -0.09 8.37 2.01 -1.07 -1.06 115.64 126.95 1g0t s THR 91 Ca -0.05 -0.27 0.02 0.00 0.31 0.00 0.00 61.69 61.70 1g0t s THR 91 Cb -0.08 -2.81 0.01 0.00 0.01 0.00 0.00 72.50 69.63 1g0t s THR 91 CO 0.01 0.53 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.63 1g0t s VAL 92 N -0.10 1.42 -0.25 3.82 1.01 0.97 -0.38 120.40 126.89 1g0t s VAL 92 Ca 0.04 -0.61 -0.25 0.00 0.00 0.00 0.00 61.98 61.16 1g0t s VAL 92 Cb -0.13 -1.29 -0.00 0.00 0.00 0.00 0.00 36.38 34.96 1g0t s VAL 92 CO 0.02 0.42 0.85 -0.36 0.00 0.00 0.00 175.10 176.03 1g0t s PHE 93 N 0.86 3.30 0.33 5.22 0.40 -0.40 -1.86 117.98 125.83 1g0t s PHE 93 Ca -0.10 1.14 0.10 0.00 -0.60 0.00 0.00 56.93 57.46 1g0t s PHE 93 Cb -0.15 -3.09 -0.06 0.00 0.51 0.00 0.00 43.02 40.22 1g0t s PHE 93 CO 0.01 -0.43 -0.11 -0.08 0.70 0.00 0.00 175.22 175.31 1g0t s THR 94 N 2.89 2.20 -0.13 0.64 -1.32 -0.65 -2.63 115.64 116.65 1g0t s THR 94 Ca 0.36 -2.23 -0.03 0.00 -1.21 0.00 0.00 61.69 58.58 1g0t s THR 94 Cb -0.15 -2.57 0.05 0.00 -1.51 0.00 0.00 72.50 68.32 1g0t s THR 94 CO 0.08 -0.25 0.04 -0.62 -2.21 0.00 0.00 174.62 171.66 1g0t s ASP 95 N -3.57 2.15 0.00 8.08 -1.08 -1.26 -0.88 116.67 120.10 1g0t s ASP 95 Ca 0.32 -0.43 0.01 0.00 -0.52 0.00 0.00 52.55 51.92 1g0t s ASP 95 Cb 0.01 -0.43 0.03 0.00 -1.46 0.00 0.00 42.92 41.08 1g0t s ASP 95 CO 0.16 -0.27 0.91 2.30 0.52 0.00 0.00 175.17 178.79 1g0t n ILE 96 N 5.15 1.53 0.43 4.11 -6.64 -1.26 -0.20 119.36 122.48 1g0t n ILE 96 Ca -0.07 0.38 0.10 0.00 -1.77 0.00 0.00 62.75 61.39 1g0t n ILE 96 Cb 0.49 -1.37 0.14 0.00 -1.44 0.00 0.00 39.64 37.46 1g0t n ILE 96 CO 0.00 0.00 0.00 0.35 -1.77 0.00 0.00 176.55 175.13 1g0t n THR 97 N -1.39 0.34 -3.35 7.28 -2.24 -1.26 -4.88 114.28 108.78 1g0t n THR 97 Ca 0.00 -0.67 -0.39 0.00 -2.27 0.00 0.00 64.05 60.73 1g0t n THR 97 Cb 0.01 1.10 -0.07 0.00 -2.10 0.00 0.00 70.33 69.26 1g0t n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1g0t h GLY 99 N 7.85 0.62 2.00 0.00 0.00 -1.92 -2.02 103.07 109.60 1g0t h GLY 99 Ca -0.35 -0.09 -0.06 0.00 0.00 0.00 0.00 47.33 46.83 1g0t h GLY 99 CO 0.72 0.01 -0.30 -0.97 0.00 0.00 0.00 176.54 175.99 1g0t h TYR 100 N 0.33 0.00 0.00 5.60 0.05 -1.94 -2.20 116.97 118.81 1g0t h TYR 100 Ca 0.23 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.90 1g0t h TYR 100 Cb 0.23 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.96 1g0t h TYR 100 CO -0.16 0.30 -0.50 0.77 -1.05 0.00 0.00 178.16 177.52 1g0t h SER 101 N 0.00 0.00 -0.08 3.88 0.02 -1.66 -1.93 113.55 113.78 1g0t h SER 101 Ca -0.00 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.77 1g0t h SER 101 Cb 0.61 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.16 1g0t h SER 101 CO 0.04 0.50 -0.63 -0.74 -1.14 0.00 0.00 176.83 174.86 1g0t h HIS 102 N 0.00 0.78 -0.19 3.45 -0.00 -0.88 -2.13 115.15 116.19 1g0t h HIS 102 Ca -0.00 -0.37 -0.08 0.00 -0.00 0.00 0.00 60.37 59.92 1g0t h HIS 102 Cb 1.01 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 28.30 1g0t h HIS 102 CO 0.00 1.17 -0.22 -0.22 -0.00 0.00 0.00 177.93 178.66 1g0t h LYS 103 N 0.17 0.34 0.13 5.26 3.64 -1.31 -0.71 116.57 124.09 1g0t h LYS 103 Ca -0.06 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.21 1g0t h LYS 103 Cb 1.29 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 1g0t h LYS 103 CO 0.13 0.54 -0.06 1.25 -2.27 0.00 0.00 179.45 179.04 1g0t h LEU 104 N 0.31 -0.15 -1.33 5.20 6.46 -1.34 -3.22 115.31 121.24 1g0t h LEU 104 Ca 0.05 -0.35 0.04 0.00 -0.12 0.00 0.00 57.88 57.50 1g0t h LEU 104 Cb 0.56 0.04 -0.04 0.00 -0.73 0.00 0.00 40.66 40.49 1g0t h LEU 104 CO 0.04 0.31 0.48 -0.74 -0.62 0.00 0.00 178.44 177.91 1g0t h HIS 105 N -0.64 0.84 -0.07 1.25 2.76 -1.26 -1.10 115.15 116.94 1g0t h HIS 105 Ca -0.02 0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.19 1g0t h HIS 105 Cb 0.49 -0.28 -0.00 0.00 1.55 0.00 0.00 27.41 29.17 1g0t h HIS 105 CO 0.07 0.48 0.10 1.49 -1.30 0.00 0.00 177.93 178.76 1g0t h GLU 106 N 0.86 0.00 -0.47 5.26 4.81 -1.14 -0.89 114.58 123.01 1g0t h GLU 106 Ca 0.30 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.53 1g0t h GLU 106 Cb 0.10 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.48 1g0t h GLU 106 CO -0.09 0.00 0.00 1.04 -0.73 0.00 0.00 179.01 179.23 1g0t n GLN 107 N -3.61 3.21 -0.30 1.92 6.02 -0.42 -4.73 117.38 119.47 1g0t n GLN 107 Ca -0.01 -2.59 0.09 0.00 -0.01 0.00 0.00 57.00 54.48 1g0t n GLN 107 Cb 0.19 -1.66 0.21 0.00 1.02 0.00 0.00 30.24 30.01 1g0t n GLN 107 CO 0.00 0.00 0.00 1.98 -1.01 0.00 0.00 177.06 178.03 1g0t h MET 108 N 2.91 0.06 -0.92 -1.09 4.05 -1.09 0.15 114.93 118.99 1g0t h MET 108 Ca 0.00 -0.00 0.01 0.00 -0.28 0.00 0.00 59.70 59.43 1g0t h MET 108 Cb 1.18 -0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 31.92 1g0t h MET 108 CO 0.14 0.04 0.61 0.00 0.23 0.00 0.00 176.91 177.92 1g0t h ALA 109 N 1.85 1.35 -0.07 0.39 0.00 -1.84 0.50 119.26 121.44 1g0t h ALA 109 Ca 0.50 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.34 1g0t h ALA 109 Cb 0.94 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1g0t h ALA 109 CO -0.81 0.61 0.03 -0.44 0.00 0.00 0.00 179.25 178.64 1g0t h ASP 110 N 1.24 0.08 -0.30 0.00 3.32 -1.08 0.46 116.42 120.14 1g0t h ASP 110 Ca 0.34 -0.09 0.05 0.00 0.02 0.00 0.00 57.03 57.34 1g0t h ASP 110 Cb -0.14 -0.02 -0.04 0.00 0.22 0.00 0.00 39.33 39.35 1g0t h ASP 110 CO -0.07 0.15 0.03 1.88 -1.72 0.00 0.00 179.24 179.50 1g0t h TYR 111 N 0.01 0.04 0.00 4.55 0.05 -1.03 -0.16 116.97 120.43 1g0t h TYR 111 Ca 0.02 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.80 1g0t h TYR 111 Cb 0.09 0.03 -0.00 0.00 1.01 0.00 0.00 36.73 37.85 1g0t h TYR 111 CO -0.04 -0.02 -0.11 -0.91 -1.05 0.00 0.00 178.16 176.03 1g0t h ASN 112 N 0.12 0.00 0.93 3.88 -0.26 -0.55 -0.88 115.58 118.82 1g0t h ASN 112 Ca 0.14 0.00 -0.11 0.00 -0.56 0.00 0.00 56.30 55.77 1g0t h ASN 112 Cb 0.17 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.42 1g0t h ASN 112 CO -0.21 0.11 -0.54 0.00 -1.06 0.00 0.00 177.43 175.72 1g0t h ALA 113 N 1.89 0.84 -0.25 -0.83 0.00 0.16 -2.63 119.26 118.44 1g0t h ALA 113 Ca -0.00 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1g0t h ALA 113 Cb 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1g0t h ALA 113 CO 0.01 0.68 0.00 1.28 0.00 0.00 0.00 179.25 181.22 1g0t n LEU 114 N -3.52 1.82 0.00 0.00 4.77 -0.29 -4.88 117.00 114.91 1g0t n LEU 114 Ca -0.00 -0.91 0.00 0.00 -0.03 0.00 0.00 56.01 55.06 1g0t n LEU 114 Cb 0.64 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 1g0t n LEU 114 CO 0.40 0.37 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 1g0t n GLY 115 N 0.72 0.41 3.55 -0.72 0.00 -0.99 -4.87 105.19 103.29 1g0t n GLY 115 Ca 0.09 -1.02 -0.36 0.00 0.00 0.00 0.00 46.02 44.73 1g0t n GLY 115 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1g0t s ILE 116 N -2.00 4.58 -0.20 -0.61 1.01 -0.45 0.74 121.20 124.27 1g0t s ILE 116 Ca 0.00 -0.09 -0.14 0.00 0.00 0.00 0.00 60.65 60.41 1g0t s ILE 116 Cb 0.00 -3.10 -0.04 0.00 0.01 0.00 0.00 42.46 39.33 1g0t s ILE 116 CO 0.00 0.40 0.33 -0.89 0.00 0.00 0.00 174.94 174.78 1g0t s THR 117 N 0.99 5.25 -0.18 2.92 2.01 0.13 -3.55 115.64 123.22 1g0t s THR 117 Ca 0.04 0.57 -0.05 0.00 0.31 0.00 0.00 61.69 62.57 1g0t s THR 117 Cb -0.14 -3.67 -0.03 0.00 0.01 0.00 0.00 72.50 68.68 1g0t s THR 117 CO 0.03 0.29 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.55 1g0t s VAL 118 N 1.11 4.04 -0.21 3.82 1.01 -1.07 -1.40 120.40 127.70 1g0t s VAL 118 Ca 0.16 -0.30 -0.00 0.00 0.00 0.00 0.00 61.98 61.84 1g0t s VAL 118 Cb -0.14 -2.80 0.02 0.00 0.00 0.00 0.00 36.38 33.46 1g0t s VAL 118 CO 0.07 0.46 -0.13 -0.13 0.00 0.00 0.00 175.10 175.37 1g0t s ARG 119 N 0.62 2.96 0.07 2.72 0.52 -0.22 -0.57 118.95 125.05 1g0t s ARG 119 Ca -0.01 -0.87 -0.11 0.00 -0.52 0.00 0.00 55.73 54.22 1g0t s ARG 119 Cb -0.14 -2.79 -0.06 0.00 0.52 0.00 0.00 34.95 32.48 1g0t s ARG 119 CO 0.02 -0.29 0.41 0.71 0.02 0.00 0.00 175.30 176.18 1g0t s TYR 120 N 1.32 3.61 0.08 -0.53 2.02 -0.02 -0.02 117.35 123.81 1g0t s TYR 120 Ca 0.03 0.85 0.05 0.00 -0.37 0.00 0.00 57.07 57.63 1g0t s TYR 120 Cb -0.15 -2.20 -0.03 0.00 -0.40 0.00 0.00 41.96 39.18 1g0t s TYR 120 CO -0.08 0.54 -0.14 -0.51 -1.57 0.00 0.00 175.55 173.78 1g0t s LEU 121 N -1.76 2.29 0.06 -1.29 1.43 -0.78 -2.63 118.68 116.01 1g0t s LEU 121 Ca 0.32 -0.63 -0.26 0.00 -1.03 0.00 0.00 54.13 52.52 1g0t s LEU 121 Cb -0.14 -0.53 -0.06 0.00 0.03 0.00 0.00 46.19 45.49 1g0t s LEU 121 CO 0.17 -0.08 0.82 0.00 0.23 0.00 0.00 176.35 177.50 1g0t s ALA 122 N -1.34 3.33 -0.33 4.21 0.00 -1.26 -1.63 121.76 124.73 1g0t s ALA 122 Ca -0.01 0.37 -0.01 0.00 0.00 0.00 0.00 51.96 52.31 1g0t s ALA 122 Cb -0.10 -3.08 0.12 0.00 0.00 0.00 0.00 23.12 20.07 1g0t s ALA 122 CO 0.02 0.04 0.18 0.12 0.00 0.00 0.00 175.76 176.12 1g0t s PHE 123 N -0.04 0.58 -0.70 0.00 5.36 -0.06 -3.58 117.98 119.52 1g0t s PHE 123 Ca 0.41 -1.34 -0.27 0.00 -0.96 0.00 0.00 56.93 54.76 1g0t s PHE 123 Cb -0.21 -0.92 0.03 0.00 -0.34 0.00 0.00 43.02 41.58 1g0t s PHE 123 CO 0.25 -0.83 1.26 -1.25 -1.46 0.00 0.00 175.22 173.19 1g0t s PRO 124 N 1.46 3.26 0.42 10.12 0.04 -1.26 -4.21 135.00 144.83 1g0t s PRO 124 Ca 0.15 -0.14 0.21 0.00 0.04 0.00 0.00 61.00 61.25 1g0t s PRO 124 Cb -0.20 -4.14 1.17 0.00 0.04 0.00 0.00 34.50 31.36 1g0t s PRO 124 CO -0.14 -2.04 1.77 0.00 0.04 0.00 0.00 177.00 176.63 1g0t h ARG 125 N 9.92 0.32 0.00 4.56 3.08 -1.93 -0.35 114.38 129.97 1g0t h ARG 125 Ca -0.27 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.76 1g0t h ARG 125 Cb 1.05 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.03 1g0t h ARG 125 CO 1.26 0.21 0.00 1.04 -1.07 0.00 0.00 179.97 181.41 1g0t n GLN 126 N -4.59 1.00 0.00 0.04 1.13 -1.26 -5.03 117.38 108.67 1g0t n GLN 126 Ca 0.26 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.32 1g0t n GLN 126 Cb 0.94 -1.35 0.00 0.00 0.11 0.00 0.00 30.24 29.94 1g0t n GLN 126 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1g0t n GLY 127 N 0.85 -3.18 0.12 1.08 0.00 -0.14 -4.73 105.19 99.19 1g0t n GLY 127 Ca 0.17 -2.11 -0.01 0.00 0.00 0.00 0.00 46.02 44.07 1g0t n GLY 127 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1g0t h LEU 128 N 0.00 0.00 -7.57 0.99 3.38 -1.96 -3.37 115.31 106.79 1g0t h LEU 128 Ca 0.00 0.00 -0.75 0.00 0.09 0.00 0.00 57.88 57.22 1g0t h LEU 128 Cb 0.00 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 40.44 1g0t h LEU 128 CO 0.00 0.66 0.04 -1.81 0.09 0.00 0.00 178.44 177.42 1g0t s ASP 129 N -6.60 6.39 0.25 -0.43 1.01 -1.26 -4.77 116.67 111.24 1g0t s ASP 129 Ca 0.01 -3.24 -0.14 0.00 0.71 0.00 0.00 52.55 49.89 1g0t s ASP 129 Cb 0.10 -2.06 0.00 0.00 1.01 0.00 0.00 42.92 41.97 1g0t s ASP 129 CO 0.76 -0.35 0.51 -0.94 0.21 0.00 0.00 175.17 175.36 1g0t s SER 130 N 1.01 -0.13 0.12 0.27 1.04 -1.26 -5.03 113.70 109.73 1g0t s SER 130 Ca 0.24 -0.84 -0.13 0.00 0.48 0.00 0.00 55.95 55.70 1g0t s SER 130 Cb -0.11 0.60 -0.06 0.00 0.10 0.00 0.00 66.02 66.55 1g0t s SER 130 CO -0.09 -1.16 1.45 0.44 0.98 0.00 0.00 173.24 174.86 1g0t h ASP 131 N 2.22 0.90 -0.78 7.02 3.32 -1.94 -1.44 116.42 125.71 1g0t h ASP 131 Ca -0.25 -0.47 0.08 0.00 0.02 0.00 0.00 57.03 56.41 1g0t h ASP 131 Cb 1.25 -0.25 -0.07 0.00 0.22 0.00 0.00 39.33 40.48 1g0t h ASP 131 CO 0.34 1.19 0.45 0.00 -1.72 0.00 0.00 179.24 179.49 1g0t h ALA 132 N 0.74 1.09 -0.32 3.45 0.00 -1.96 0.53 119.26 122.78 1g0t h ALA 132 Ca 0.05 0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.83 1g0t h ALA 132 Cb 0.94 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1g0t h ALA 132 CO 0.09 0.10 -0.42 1.49 0.00 0.00 0.00 179.25 180.51 1g0t h GLU 133 N 0.77 0.85 -0.45 0.00 4.22 -1.76 -1.99 114.58 116.23 1g0t h GLU 133 Ca 0.37 -0.49 -0.10 0.00 0.08 0.00 0.00 59.36 59.22 1g0t h GLU 133 Cb 0.30 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1g0t h GLU 133 CO -0.22 1.13 -0.10 0.87 -2.18 0.00 0.00 179.01 178.50 1g0t h LYS 134 N 0.64 0.86 -0.33 1.92 1.57 -0.40 -2.35 116.57 118.48 1g0t h LYS 134 Ca 0.04 -0.33 -0.10 0.00 -1.87 0.00 0.00 60.65 58.40 1g0t h LYS 134 Cb 1.01 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.26 1g0t h LYS 134 CO 0.10 0.96 -0.17 0.93 -0.57 0.00 0.00 179.45 180.70 1g0t h GLU 135 N 0.69 0.69 0.00 3.15 4.39 0.03 -2.89 114.58 120.64 1g0t h GLU 135 Ca 0.11 -0.31 -0.06 0.00 0.34 0.00 0.00 59.36 59.45 1g0t h GLU 135 Cb 0.64 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.26 1g0t h GLU 135 CO 0.04 0.90 -0.27 0.52 -1.16 0.00 0.00 179.01 179.05 1g0t h MET 136 N 0.46 0.00 -0.56 2.33 2.86 -1.38 -1.65 114.93 116.99 1g0t h MET 136 Ca 0.07 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.61 1g0t h MET 136 Cb 0.70 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.34 1g0t h MET 136 CO 0.05 0.27 -0.05 -0.22 1.06 0.00 0.00 176.91 178.01 1g0t h LYS 137 N 0.00 1.02 -0.26 1.72 1.63 -1.34 0.39 116.57 119.73 1g0t h LYS 137 Ca -0.00 -0.35 -0.08 0.00 -0.85 0.00 0.00 60.65 59.37 1g0t h LYS 137 Cb 0.76 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 32.31 1g0t h LYS 137 CO 0.03 1.04 -0.13 0.00 -3.45 0.00 0.00 179.45 176.94 1g0t h ALA 138 N 0.95 0.37 -0.08 5.00 0.00 -1.22 -2.31 119.26 121.95 1g0t h ALA 138 Ca 0.15 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1g0t h ALA 138 Cb 0.61 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1g0t h ALA 138 CO 0.04 0.24 0.01 0.82 0.00 0.00 0.00 179.25 180.37 1g0t h ILE 139 N 0.28 0.96 0.00 0.00 2.04 -1.15 -1.69 117.51 117.96 1g0t h ILE 139 Ca 0.06 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.90 1g0t h ILE 139 Cb 0.64 0.91 0.00 0.00 -0.74 0.00 0.00 36.82 37.63 1g0t h ILE 139 CO 0.04 0.01 0.00 0.79 0.00 0.00 0.00 178.15 178.99 1g0t n TRP 140 N -5.09 0.21 0.84 1.37 8.01 0.11 -1.97 117.44 120.92 1g0t n TRP 140 Ca -0.05 0.09 0.09 0.00 -1.31 0.00 0.00 57.50 56.31 1g0t n TRP 140 Cb 0.05 -0.64 -0.07 0.00 -2.01 0.00 0.00 31.31 28.65 1g0t n TRP 140 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1g0t n ALA 142 N -0.95 -1.31 0.17 0.00 0.00 -0.70 -4.73 120.51 112.99 1g0t n ALA 142 Ca 0.05 -0.60 -0.14 0.00 0.00 0.00 0.00 53.44 52.75 1g0t n ALA 142 Cb 0.32 -2.10 -0.08 0.00 0.00 0.00 0.00 19.45 17.59 1g0t n ALA 142 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1g0t h LYS 143 N -1.86 -0.37 -4.32 0.00 1.63 -1.92 -3.36 116.57 106.38 1g0t h LYS 143 Ca -0.44 0.03 -0.71 0.00 -0.85 0.00 0.00 60.65 58.67 1g0t h LYS 143 Cb 1.28 0.08 -0.32 0.00 -0.60 0.00 0.00 32.23 32.67 1g0t h LYS 143 CO 0.40 -0.16 -0.44 0.34 -3.45 0.00 0.00 179.45 176.14 1g0t s ASP 144 N -4.96 5.53 0.08 4.20 -1.08 -1.26 -4.99 116.67 114.19 1g0t s ASP 144 Ca -0.15 -2.03 -0.29 0.00 -0.52 0.00 0.00 52.55 49.56 1g0t s ASP 144 Cb 0.04 -1.94 -0.16 0.00 -1.46 0.00 0.00 42.92 39.41 1g0t s ASP 144 CO 0.62 -0.62 1.65 0.11 0.52 0.00 0.00 175.17 177.45 1g0t h LYS 145 N 8.20 -0.58 -0.70 4.34 1.57 -1.81 -0.12 116.57 127.48 1g0t h LYS 145 Ca -0.16 0.04 0.12 0.00 -1.87 0.00 0.00 60.65 58.78 1g0t h LYS 145 Cb 1.06 0.13 -0.09 0.00 0.08 0.00 0.00 32.23 33.41 1g0t h LYS 145 CO 0.79 -0.39 0.27 -0.91 -0.57 0.00 0.00 179.45 178.64 1g0t h ASN 146 N -0.61 0.25 -0.33 0.86 4.21 -1.93 0.30 115.58 118.33 1g0t h ASN 146 Ca -0.04 0.10 -0.05 0.00 1.21 0.00 0.00 56.30 57.51 1g0t h ASN 146 Cb 0.50 0.08 -0.01 0.00 -1.12 0.00 0.00 38.32 37.76 1g0t h ASN 146 CO 0.04 0.12 0.01 0.50 -1.29 0.00 0.00 177.43 176.81 1g0t h LYS 147 N 0.43 0.59 0.15 0.81 3.11 -1.95 -1.67 116.57 118.04 1g0t h LYS 147 Ca 0.37 -0.18 -0.01 0.00 -2.81 0.00 0.00 60.65 58.02 1g0t h LYS 147 Cb 0.52 -0.05 -0.00 0.00 -1.00 0.00 0.00 32.23 31.70 1g0t h LYS 147 CO -0.37 0.71 -0.08 0.00 -2.81 0.00 0.00 179.45 176.90 1g0t h ALA 148 N 0.86 -0.21 -0.61 5.00 0.00 0.06 -1.06 119.26 123.30 1g0t h ALA 148 Ca 0.10 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.02 1g0t h ALA 148 Cb 0.44 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 1g0t h ALA 148 CO 0.02 -0.62 0.32 0.35 0.00 0.00 0.00 179.25 179.31 1g0t h PHE 149 N -0.22 0.58 -0.37 0.00 3.04 -0.40 -0.91 116.94 118.66 1g0t h PHE 149 Ca -0.02 0.02 0.01 0.00 3.98 0.00 0.00 57.97 61.97 1g0t h PHE 149 Cb 0.18 -0.17 -0.02 0.00 2.56 0.00 0.00 35.95 38.49 1g0t h PHE 149 CO -0.08 0.27 0.23 -0.44 -2.02 0.00 0.00 178.31 176.27 1g0t h ASP 150 N 0.60 0.37 -0.04 0.41 5.19 -1.05 -1.01 116.42 120.89 1g0t h ASP 150 Ca 0.27 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.68 1g0t h ASP 150 Cb 0.19 -0.08 -0.00 0.00 0.18 0.00 0.00 39.33 39.61 1g0t h ASP 150 CO -0.18 0.27 0.03 0.44 -3.12 0.00 0.00 179.24 176.67 1g0t h ASP 151 N 0.46 0.05 -0.51 6.45 3.32 -0.63 -2.43 116.42 123.13 1g0t h ASP 151 Ca 0.15 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1g0t h ASP 151 Cb -0.01 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 1g0t h ASP 151 CO -0.06 0.04 0.33 0.58 -1.72 0.00 0.00 179.24 178.41 1g0t h VAL 152 N 0.06 1.13 -0.16 -1.35 2.07 -0.99 0.15 116.25 117.16 1g0t h VAL 152 Ca 0.02 -0.25 0.04 0.00 0.82 0.00 0.00 66.70 67.33 1g0t h VAL 152 Cb -0.00 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 1g0t h VAL 152 CO -0.00 0.13 0.12 0.24 0.02 0.00 0.00 177.57 178.08 1g0t h MET 153 N 0.69 0.00 -0.64 1.57 2.86 -1.02 0.26 114.93 118.65 1g0t h MET 153 Ca 0.19 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 1g0t h MET 153 Cb -0.07 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.59 1g0t h MET 153 CO -0.04 0.00 0.00 0.00 1.06 0.00 0.00 176.91 177.93 1g0t n ALA 154 N -2.50 3.12 -2.29 6.32 0.00 -0.71 -4.93 120.51 119.50 1g0t n ALA 154 Ca 0.01 -1.31 -0.16 0.00 0.00 0.00 0.00 53.44 51.97 1g0t n ALA 154 Cb 0.25 -1.04 -0.01 0.00 0.00 0.00 0.00 19.45 18.65 1g0t n ALA 154 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1g0t n GLY 155 N 0.87 -0.26 3.70 0.00 0.00 0.91 -5.02 105.19 105.39 1g0t n GLY 155 Ca 0.21 -0.19 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 1g0t n GLY 155 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1g0t n LYS 156 N -2.58 -0.31 -1.54 1.61 5.02 0.43 -4.96 118.16 115.83 1g0t n LYS 156 Ca -0.20 -2.47 -0.35 0.00 -2.02 0.00 0.00 58.31 53.27 1g0t n LYS 156 Cb 0.65 -0.77 -0.06 0.00 -0.02 0.00 0.00 35.03 34.83 1g0t n LYS 156 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1g0t n SER 157 N -3.09 1.83 -4.57 4.39 7.64 -1.26 -4.57 113.62 113.98 1g0t n SER 157 Ca 0.16 -0.46 -0.31 0.00 1.01 0.00 0.00 58.87 59.27 1g0t n SER 157 Cb 0.56 -1.45 -0.04 0.00 -1.01 0.00 0.00 64.21 62.27 1g0t n SER 157 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1g0t s VAL 158 N 11.63 3.62 0.25 0.44 0.11 -1.26 -4.91 120.40 130.28 1g0t s VAL 158 Ca 1.05 -0.72 -0.29 0.00 -2.93 0.00 0.00 61.98 59.09 1g0t s VAL 158 Cb -0.39 -4.45 -0.15 0.00 -1.53 0.00 0.00 36.38 29.87 1g0t s VAL 158 CO 0.30 -1.24 1.02 0.00 -3.33 0.00 0.00 175.10 171.85 1g0t n ALA 159 N 12.66 -0.55 -1.93 1.54 0.00 -1.26 -4.91 120.51 126.06 1g0t n ALA 159 Ca 0.41 0.41 -0.41 0.00 0.00 0.00 0.00 53.44 53.85 1g0t n ALA 159 Cb 0.47 -1.99 -0.03 0.00 0.00 0.00 0.00 19.45 17.90 1g0t n ALA 159 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1g0t s PRO 160 N -1.18 4.43 -0.29 0.00 0.02 -1.26 -4.82 135.00 131.91 1g0t s PRO 160 Ca 0.63 2.03 -0.23 0.00 0.02 0.00 0.00 61.00 63.45 1g0t s PRO 160 Cb -0.76 -3.17 0.14 0.00 0.02 0.00 0.00 34.50 30.73 1g0t s PRO 160 CO 0.57 -0.15 1.07 0.00 -0.33 0.00 0.00 177.00 178.16 1g0t s ALA 161 N -0.34 -2.08 0.22 -1.55 0.00 -1.26 -5.04 121.76 111.71 1g0t s ALA 161 Ca 0.53 1.93 0.07 0.00 0.00 0.00 0.00 51.96 54.48 1g0t s ALA 161 Cb -0.36 -1.55 -0.05 0.00 0.00 0.00 0.00 23.12 21.16 1g0t s ALA 161 CO 0.41 -0.24 -0.10 0.45 0.00 0.00 0.00 175.76 176.28 1g0t s SER 162 N 0.46 2.50 0.02 0.00 0.15 -1.26 -4.31 113.70 111.25 1g0t s SER 162 Ca 0.01 -1.09 -0.18 0.00 0.70 0.00 0.00 55.95 55.39 1g0t s SER 162 Cb -0.05 -0.12 0.06 0.00 -1.71 0.00 0.00 66.02 64.20 1g0t s SER 162 CO -0.09 -0.26 0.83 0.00 1.20 0.00 0.00 173.24 174.92 1g0t n ASP 164 N -0.85 2.59 -4.69 0.00 9.92 -1.26 -4.89 116.55 117.38 1g0t n ASP 164 Ca 0.02 -2.25 -0.42 0.00 -0.53 0.00 0.00 54.79 51.61 1g0t n ASP 164 Cb 0.39 -0.43 -0.03 0.00 -0.64 0.00 0.00 41.12 40.41 1g0t n ASP 164 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1g0t s VAL 165 N -1.70 4.20 -0.42 2.53 1.01 -1.26 -4.99 120.40 119.77 1g0t s VAL 165 Ca 0.24 1.54 -0.11 0.00 0.00 0.00 0.00 61.98 63.65 1g0t s VAL 165 Cb 0.16 -3.99 0.07 0.00 0.00 0.00 0.00 36.38 32.62 1g0t s VAL 165 CO 0.11 0.03 0.27 -0.62 0.00 0.00 0.00 175.10 174.89 1g0t s ASP 166 N 1.40 5.74 0.54 3.32 -1.08 -1.26 -4.94 116.67 120.39 1g0t s ASP 166 Ca 0.57 -1.38 0.23 0.00 -0.52 0.00 0.00 52.55 51.45 1g0t s ASP 166 Cb -0.26 -2.03 1.43 0.00 -1.46 0.00 0.00 42.92 40.61 1g0t s ASP 166 CO 0.24 -0.53 2.07 0.40 0.52 0.00 0.00 175.17 177.88 1g0t h ILE 167 N 5.99 0.75 -0.33 4.11 1.08 -1.94 0.12 117.51 127.28 1g0t h ILE 167 Ca -0.24 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.26 1g0t h ILE 167 Cb 1.09 0.85 -0.02 0.00 -3.07 0.00 0.00 36.82 35.67 1g0t h ILE 167 CO 0.76 0.00 0.23 0.00 -0.69 0.00 0.00 178.15 178.45 1g0t h ALA 168 N 1.83 1.94 -0.28 1.87 0.00 -1.94 -0.36 119.26 122.32 1g0t h ALA 168 Ca 0.13 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1g0t h ALA 168 Cb 0.55 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1g0t h ALA 168 CO -0.00 0.01 0.03 -0.44 0.00 0.00 0.00 179.25 178.85 1g0t h ASP 169 N 0.30 0.46 -0.28 0.00 3.32 -1.37 0.20 116.42 119.04 1g0t h ASP 169 Ca 0.14 -0.28 -0.03 0.00 0.02 0.00 0.00 57.03 56.88 1g0t h ASP 169 Cb 0.19 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1g0t h ASP 169 CO -0.03 0.62 0.06 0.45 -1.72 0.00 0.00 179.24 178.62 1g0t h HIS 170 N 0.28 0.49 -0.87 4.55 3.86 -1.41 -1.69 115.15 120.35 1g0t h HIS 170 Ca 0.08 -0.06 0.03 0.00 -1.16 0.00 0.00 60.37 59.26 1g0t h HIS 170 Cb 0.37 -0.13 -0.05 0.00 1.06 0.00 0.00 27.41 28.65 1g0t h HIS 170 CO 0.03 0.55 0.56 -0.92 0.86 0.00 0.00 177.93 179.00 1g0t h TYR 171 N 0.29 1.05 -0.23 2.45 3.20 -0.97 -1.00 116.97 121.76 1g0t h TYR 171 Ca 0.09 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.92 1g0t h TYR 171 Cb 0.31 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.23 1g0t h TYR 171 CO 0.02 0.60 -0.11 0.00 -1.64 0.00 0.00 178.16 177.03 1g0t h ALA 172 N 1.36 0.32 -0.73 1.82 0.00 -0.43 -1.68 119.26 119.93 1g0t h ALA 172 Ca 0.35 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1g0t h ALA 172 Cb 0.01 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1g0t h ALA 172 CO -0.12 0.18 0.30 1.25 0.00 0.00 0.00 179.25 180.86 1g0t h LEU 173 N 0.20 0.98 -0.57 0.00 5.85 -1.07 -1.60 115.31 119.10 1g0t h LEU 173 Ca 0.05 -0.14 -0.11 0.00 0.84 0.00 0.00 57.88 58.52 1g0t h LEU 173 Cb 0.61 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 1g0t h LEU 173 CO 0.03 0.87 -0.08 1.23 -0.34 0.00 0.00 178.44 180.15 1g0t h GLY 174 N 1.10 1.14 1.02 3.75 0.00 -1.12 -0.22 103.07 108.75 1g0t h GLY 174 Ca 0.25 -0.90 -0.07 0.00 0.00 0.00 0.00 47.33 46.61 1g0t h GLY 174 CO -0.02 0.83 0.11 -2.08 0.00 0.00 0.00 176.54 175.38 1g0t h VAL 175 N 0.94 1.25 -0.15 4.60 2.07 -1.06 0.50 116.25 124.41 1g0t h VAL 175 Ca 0.15 -0.96 -0.09 0.00 0.82 0.00 0.00 66.70 66.62 1g0t h VAL 175 Cb 0.65 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 1g0t h VAL 175 CO 0.05 0.35 -0.32 1.56 0.02 0.00 0.00 177.57 179.23 1g0t h GLN 176 N 0.86 0.30 0.00 1.57 4.20 -1.12 -2.34 115.11 118.58 1g0t h GLN 176 Ca 0.18 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1g0t h GLN 176 Cb 0.40 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.16 1g0t h GLN 176 CO 0.01 0.59 0.00 1.28 -0.67 0.00 0.00 178.83 180.04 1g0t n LEU 177 N -4.10 0.12 0.00 1.46 4.77 -0.11 -4.89 117.00 114.26 1g0t n LEU 177 Ca -0.01 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 1g0t n LEU 177 Cb 0.42 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1g0t n LEU 177 CO 0.41 -0.11 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 1g0t n GLY 178 N 1.03 0.94 3.75 -0.72 0.00 -0.85 -4.81 105.19 104.52 1g0t n GLY 178 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 1g0t n GLY 178 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g0t s VAL 179 N -2.00 2.59 0.07 1.61 1.01 0.17 -4.91 120.40 118.93 1g0t s VAL 179 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.48 1g0t s VAL 179 Cb 0.00 -3.32 0.00 0.00 0.00 0.00 0.00 36.38 33.06 1g0t s VAL 179 CO 0.00 0.08 0.00 -1.54 0.00 0.00 0.00 175.10 173.64 1g0t n SER 180 N 2.25 0.38 -4.73 3.32 3.41 -1.26 -4.46 113.62 112.52 1g0t n SER 180 Ca 0.07 0.10 -0.23 0.00 -0.26 0.00 0.00 58.87 58.55 1g0t n SER 180 Cb 0.40 -0.08 -0.06 0.00 -0.26 0.00 0.00 64.21 64.21 1g0t n SER 180 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1g0t s GLY 181 N -3.69 1.84 0.18 5.00 0.00 -1.26 -4.92 107.32 104.47 1g0t s GLY 181 Ca 0.00 -1.75 0.08 0.00 0.00 0.00 0.00 44.72 43.05 1g0t s GLY 181 CO 0.00 -1.71 -0.06 -0.51 0.00 0.00 0.00 173.10 170.82 1g0t s THR 182 N -2.38 3.41 0.42 0.90 -4.23 -1.26 -4.00 115.64 108.50 1g0t s THR 182 Ca 0.36 -1.55 -0.22 0.00 -1.18 0.00 0.00 61.69 59.10 1g0t s THR 182 Cb -0.04 -2.70 -0.10 0.00 1.34 0.00 0.00 72.50 71.00 1g0t s THR 182 CO 0.23 -0.10 0.96 -2.16 -0.54 0.00 0.00 174.62 173.00 1g0t s PRO 183 N -2.86 4.25 -0.10 3.99 0.04 -1.26 -4.71 135.00 134.34 1g0t s PRO 183 Ca 0.26 1.19 0.01 0.00 0.04 0.00 0.00 61.00 62.50 1g0t s PRO 183 Cb -0.09 -2.29 0.02 0.00 0.04 0.00 0.00 34.50 32.17 1g0t s PRO 183 CO 0.16 -0.02 -0.11 0.00 0.04 0.00 0.00 177.00 177.08 1g0t s ALA 184 N -2.04 1.43 -0.04 8.56 0.00 -1.08 -0.92 121.76 127.67 1g0t s ALA 184 Ca 0.60 -0.59 -0.15 0.00 0.00 0.00 0.00 51.96 51.82 1g0t s ALA 184 Cb -0.12 -0.83 -0.05 0.00 0.00 0.00 0.00 23.12 22.12 1g0t s ALA 184 CO 0.16 -0.22 0.41 0.08 0.00 0.00 0.00 175.76 176.19 1g0t s VAL 185 N 1.29 5.09 -0.14 0.00 1.01 -0.75 -1.27 120.40 125.63 1g0t s VAL 185 Ca -0.02 0.84 0.01 0.00 0.00 0.00 0.00 61.98 62.80 1g0t s VAL 185 Cb -0.14 -3.73 -0.00 0.00 0.00 0.00 0.00 36.38 32.51 1g0t s VAL 185 CO -0.04 0.50 -0.16 -0.69 0.00 0.00 0.00 175.10 174.71 1g0t s VAL 186 N -0.52 2.67 0.52 2.92 1.01 0.49 0.47 120.40 127.95 1g0t s VAL 186 Ca 0.23 -0.78 -0.06 0.00 0.00 0.00 0.00 61.98 61.38 1g0t s VAL 186 Cb -0.16 -2.11 -0.02 0.00 0.00 0.00 0.00 36.38 34.08 1g0t s VAL 186 CO 0.12 0.52 0.83 -0.76 0.00 0.00 0.00 175.10 175.81 1g0t s LEU 187 N 0.68 3.50 0.00 3.92 1.43 0.16 -2.61 118.68 125.76 1g0t s LEU 187 Ca -0.08 0.89 0.03 0.00 -1.03 0.00 0.00 54.13 53.94 1g0t s LEU 187 Cb -0.16 -3.81 0.14 0.00 0.03 0.00 0.00 46.19 42.39 1g0t s LEU 187 CO 0.02 -0.73 0.99 -1.54 0.23 0.00 0.00 176.35 175.32 1g0t n SER 188 N -2.37 0.00 -0.83 2.29 3.41 -1.26 -0.26 113.62 114.59 1g0t n SER 188 Ca 0.02 0.36 0.08 0.00 -0.26 0.00 0.00 58.87 59.07 1g0t n SER 188 Cb 0.56 -0.38 0.16 0.00 -0.26 0.00 0.00 64.21 64.29 1g0t n SER 188 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1g0t n ASN 189 N -1.38 2.98 0.00 4.04 6.94 -1.26 -4.95 115.26 121.63 1g0t n ASN 189 Ca 0.01 -1.88 0.00 0.00 -0.02 0.00 0.00 54.58 52.70 1g0t n ASN 189 Cb 0.03 -0.21 0.00 0.00 -2.36 0.00 0.00 39.78 37.24 1g0t n ASN 189 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1g0t n GLY 190 N 0.97 0.98 3.71 4.83 0.00 0.64 -4.37 105.19 111.96 1g0t n GLY 190 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1g0t n GLY 190 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1g0t s THR 191 N -2.63 3.13 -0.15 2.61 2.01 -1.25 -4.67 115.64 114.69 1g0t s THR 191 Ca 0.00 0.79 -0.15 0.00 0.31 0.00 0.00 61.69 62.64 1g0t s THR 191 Cb 0.00 -3.51 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 1g0t s THR 191 CO 0.00 0.05 0.35 -0.22 -0.69 0.00 0.00 174.62 174.12 1g0t s LEU 192 N 1.26 4.25 -0.44 4.42 2.96 -1.26 0.39 118.68 130.27 1g0t s LEU 192 Ca 0.66 0.60 0.02 0.00 -0.22 0.00 0.00 54.13 55.20 1g0t s LEU 192 Cb -0.39 -2.48 0.14 0.00 0.50 0.00 0.00 46.19 43.96 1g0t s LEU 192 CO 0.30 0.06 0.24 -0.69 -1.32 0.00 0.00 176.35 174.95 1g0t s VAL 193 N 0.54 1.37 0.57 1.68 1.01 0.18 -5.00 120.40 120.75 1g0t s VAL 193 Ca 0.20 -2.55 -0.20 0.00 0.00 0.00 0.00 61.98 59.42 1g0t s VAL 193 Cb -0.14 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 1g0t s VAL 193 CO 0.06 -0.90 1.26 -2.84 0.00 0.00 0.00 175.10 172.68 1g0t s PRO 194 N 0.35 3.04 0.00 2.72 0.02 -1.26 -1.81 135.00 138.06 1g0t s PRO 194 Ca 0.18 1.99 0.00 0.00 0.02 0.00 0.00 61.00 63.19 1g0t s PRO 194 Cb -0.24 -2.07 0.00 0.00 0.02 0.00 0.00 34.50 32.21 1g0t s PRO 194 CO -0.00 -1.19 0.00 0.41 -0.33 0.00 0.00 177.00 175.88 1g0t n GLY 195 N 0.64 2.16 3.90 0.52 0.00 -0.09 -4.89 105.19 107.43 1g0t n GLY 195 Ca 0.12 -1.98 -0.32 0.00 0.00 0.00 0.00 46.02 43.84 1g0t n GLY 195 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1g0t s TYR 196 N -2.54 3.52 -0.15 1.61 5.04 -1.26 -4.60 117.35 118.97 1g0t s TYR 196 Ca 0.00 0.46 -0.08 0.00 -2.44 0.00 0.00 57.07 55.02 1g0t s TYR 196 Cb 0.00 -1.92 0.06 0.00 0.35 0.00 0.00 41.96 40.45 1g0t s TYR 196 CO 0.00 0.54 0.35 -0.65 -1.34 0.00 0.00 175.55 174.45 1g0t s GLN 197 N -2.33 0.31 0.75 4.97 -0.21 -1.26 -5.08 119.66 116.81 1g0t s GLN 197 Ca 0.35 0.73 -0.14 0.00 0.02 0.00 0.00 55.36 56.32 1g0t s GLN 197 Cb -0.13 -0.02 0.05 0.00 1.00 0.00 0.00 33.01 33.91 1g0t s GLN 197 CO 0.23 -0.18 1.20 -2.14 -2.12 0.00 0.00 175.29 172.29 1g0t s PRO 198 N 1.54 2.00 0.25 2.91 0.02 -1.26 -4.47 135.00 135.98 1g0t s PRO 198 Ca -0.08 1.75 0.01 0.00 0.02 0.00 0.00 61.00 62.70 1g0t s PRO 198 Cb -0.10 -1.82 0.60 0.00 0.02 0.00 0.00 34.50 33.20 1g0t s PRO 198 CO -0.11 -1.94 1.28 -2.30 -0.33 0.00 0.00 177.00 173.59 1g0t n PRO 199 N -2.90 -0.07 0.24 5.54 -0.02 -1.26 -0.75 135.00 135.79 1g0t n PRO 199 Ca 0.13 1.23 -0.10 0.00 -2.02 0.00 0.00 63.50 62.74 1g0t n PRO 199 Cb 0.50 -1.93 -0.05 0.00 -0.02 0.00 0.00 33.50 32.00 1g0t n PRO 199 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1g0t h LYS 200 N 0.00 -0.61 -0.77 -0.52 1.57 -1.95 -1.18 116.57 113.10 1g0t h LYS 200 Ca 0.48 0.04 0.17 0.00 -1.87 0.00 0.00 60.65 59.48 1g0t h LYS 200 Cb 0.97 0.14 -0.14 0.00 0.08 0.00 0.00 32.23 33.28 1g0t h LYS 200 CO -0.77 -0.41 -0.08 0.93 -0.57 0.00 0.00 179.45 178.55 1g0t h GLU 201 N -0.89 0.05 0.42 3.15 3.07 -1.70 -0.98 114.58 117.70 1g0t h GLU 201 Ca -0.06 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.78 1g0t h GLU 201 Cb 0.49 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.36 1g0t h GLU 201 CO 0.11 0.03 -0.51 1.98 -1.40 0.00 0.00 179.01 179.22 1g0t h MET 202 N 0.05 -0.91 -0.46 2.33 4.05 -0.96 -0.55 114.93 118.47 1g0t h MET 202 Ca 0.41 0.06 0.09 0.00 -0.28 0.00 0.00 59.70 59.98 1g0t h MET 202 Cb 0.69 0.21 -0.09 0.00 -0.80 0.00 0.00 31.60 31.60 1g0t h MET 202 CO -0.73 -0.61 -0.18 -0.22 0.23 0.00 0.00 176.91 175.40 1g0t h LYS 203 N -0.95 -0.07 -0.56 0.39 1.63 0.02 0.32 116.57 117.35 1g0t h LYS 203 Ca -0.05 0.00 0.04 0.00 -0.85 0.00 0.00 60.65 59.79 1g0t h LYS 203 Cb 0.85 0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 32.45 1g0t h LYS 203 CO -0.11 -0.05 0.32 0.93 -3.45 0.00 0.00 179.45 177.09 1g0t h GLU 204 N -0.07 0.60 -0.26 1.90 3.07 -1.09 -1.26 114.58 117.46 1g0t h GLU 204 Ca 0.22 -0.04 0.03 0.00 -0.50 0.00 0.00 59.36 59.08 1g0t h GLU 204 Cb 0.42 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 28.16 1g0t h GLU 204 CO -0.52 0.40 0.07 0.35 -1.40 0.00 0.00 179.01 177.91 1g0t h PHE 205 N 0.62 0.12 -0.87 4.33 3.57 0.49 -0.16 116.94 125.05 1g0t h PHE 205 Ca 0.23 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.77 1g0t h PHE 205 Cb 0.08 -0.02 -0.05 0.00 2.79 0.00 0.00 35.95 38.75 1g0t h PHE 205 CO -0.08 0.05 0.57 -0.07 -2.23 0.00 0.00 178.31 176.55 1g0t h LEU 206 N 0.18 0.96 -0.36 0.59 3.38 -0.62 0.10 115.31 119.55 1g0t h LEU 206 Ca 0.12 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 1g0t h LEU 206 Cb 0.10 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1g0t h LEU 206 CO -0.14 0.67 0.08 0.44 0.09 0.00 0.00 178.44 179.58 1g0t h ASP 207 N 1.12 0.55 -0.52 -0.43 3.32 -0.55 -0.91 116.42 119.01 1g0t h ASP 207 Ca 0.33 -0.24 -0.12 0.00 0.02 0.00 0.00 57.03 57.03 1g0t h ASP 207 Cb -0.05 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 1g0t h ASP 207 CO -0.10 0.65 -0.12 -0.33 -1.72 0.00 0.00 179.24 177.62 1g0t h GLU 208 N 0.43 1.01 0.27 3.56 4.39 -0.77 -0.33 114.58 123.14 1g0t h GLU 208 Ca 0.11 -0.38 -0.01 0.00 0.34 0.00 0.00 59.36 59.42 1g0t h GLU 208 Cb 0.32 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 1g0t h GLU 208 CO 0.00 1.06 -0.13 1.25 -1.16 0.00 0.00 179.01 180.04 1g0t h HIS 209 N 0.90 -0.33 -0.29 4.33 2.76 -0.87 0.32 115.15 121.96 1g0t h HIS 209 Ca 0.14 -0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.31 1g0t h HIS 209 Cb 0.69 0.11 -0.02 0.00 1.55 0.00 0.00 27.41 29.74 1g0t h HIS 209 CO 0.05 -0.18 0.17 0.37 -1.30 0.00 0.00 177.93 177.04 1g0t h GLN 210 N -0.40 0.34 0.27 5.26 4.15 -1.10 -3.03 115.11 120.60 1g0t h GLN 210 Ca -0.04 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1g0t h GLN 210 Cb 0.30 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 27.89 1g0t h GLN 210 CO 0.06 0.22 -0.31 0.87 -1.93 0.00 0.00 178.83 177.74 1g0t h LYS 211 N 0.35 -0.60 -2.33 1.69 1.57 -0.90 -2.98 116.57 113.37 1g0t h LYS 211 Ca 0.11 0.04 -0.42 0.00 -1.87 0.00 0.00 60.65 58.51 1g0t h LYS 211 Cb -0.00 0.14 -0.07 0.00 0.08 0.00 0.00 32.23 32.38 1g0t h LYS 211 CO -0.05 -0.40 1.15 -1.33 -0.57 0.00 0.00 179.45 178.25 1g0t n MET 212 N -5.42 2.78 0.00 3.15 2.81 0.09 -3.69 117.12 116.83 1g0t n MET 212 Ca -0.09 -1.79 0.00 0.00 -1.81 0.00 0.00 57.70 54.02 1g0t n MET 212 Cb 0.33 -2.30 0.00 0.00 -0.71 0.00 0.00 33.22 30.54 1g0t n MET 212 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1g0t n THR 213 N 2.44 0.00 0.16 2.03 -1.04 -1.13 -4.88 114.28 111.85 1g0t n THR 213 Ca 0.56 0.00 0.08 0.00 -2.04 0.00 0.00 64.05 62.64 1g0t n THR 213 Cb 0.61 0.00 0.40 0.00 -1.82 0.00 0.00 70.33 69.52 1g0t n THR 213 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1g0t n SER 214 N -1.66 0.38 0.00 8.00 2.88 -1.18 -4.99 113.62 117.05 1g0t n SER 214 Ca 0.00 0.60 0.00 0.00 -1.33 0.00 0.00 58.87 58.14 1g0t n SER 214 Cb 0.00 -0.58 0.00 0.00 -0.75 0.00 0.00 64.21 62.88 1g0t n SER 214 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42