#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xgy s VAL 2 N 0.00 4.11 0.02 5.09 1.01 -1.26 -3.67 120.40 125.70 1xgy s VAL 2 Ca 0.00 1.11 0.04 0.00 0.00 0.00 0.00 61.98 63.13 1xgy s VAL 2 Cb 0.00 -4.55 -0.02 0.00 0.00 0.00 0.00 36.38 31.82 1xgy s VAL 2 CO 0.00 -1.02 -0.12 -1.10 0.00 0.00 0.00 175.10 172.86 1xgy s GLN 3 N 4.65 0.88 -0.16 2.72 -0.21 0.41 -4.98 119.66 122.97 1xgy s GLN 3 Ca 0.50 -0.62 0.01 0.00 0.02 0.00 0.00 55.36 55.26 1xgy s GLN 3 Cb -0.08 -0.86 0.02 0.00 1.00 0.00 0.00 33.01 33.09 1xgy s GLN 3 CO 0.31 0.22 -0.15 -0.51 -2.12 0.00 0.00 175.29 173.04 1xgy s LEU 4 N -0.85 1.86 -0.33 2.90 1.43 -1.26 -1.12 118.68 121.31 1xgy s LEU 4 Ca 0.02 -0.57 -0.03 0.00 -1.03 0.00 0.00 54.13 52.52 1xgy s LEU 4 Cb -0.07 -1.26 0.06 0.00 0.03 0.00 0.00 46.19 44.95 1xgy s LEU 4 CO 0.01 -0.05 0.07 -1.58 0.23 0.00 0.00 176.35 175.02 1xgy s GLN 5 N 1.43 2.37 0.53 1.70 2.00 0.19 -4.23 119.66 123.65 1xgy s GLN 5 Ca 0.04 -1.37 -0.11 0.00 -2.00 0.00 0.00 55.36 51.92 1xgy s GLN 5 Cb -0.13 -3.33 -0.05 0.00 0.80 0.00 0.00 33.01 30.29 1xgy s GLN 5 CO -0.11 -0.73 0.93 -0.65 -0.50 0.00 0.00 175.29 174.23 1xgy s GLN 6 N 1.26 3.71 0.87 1.67 -0.21 -1.26 -0.67 119.66 125.03 1xgy s GLN 6 Ca -0.01 0.66 -0.15 0.00 0.02 0.00 0.00 55.36 55.88 1xgy s GLN 6 Cb -0.20 -2.20 0.23 0.00 1.00 0.00 0.00 33.01 31.83 1xgy s GLN 6 CO -0.01 -0.34 0.55 -1.13 -2.12 0.00 0.00 175.29 172.23 1xgy n SER 7 N -2.13 -3.09 -3.81 5.90 3.41 -0.31 -4.92 113.62 108.67 1xgy n SER 7 Ca 0.05 -0.59 -0.16 0.00 -0.26 0.00 0.00 58.87 57.91 1xgy n SER 7 Cb 0.54 -0.60 0.08 0.00 -0.26 0.00 0.00 64.21 63.97 1xgy n SER 7 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xgy n GLY 8 N -3.27 0.89 3.77 5.00 0.00 -1.26 -4.72 105.19 105.59 1xgy n GLY 8 Ca 0.08 -2.04 -0.39 0.00 0.00 0.00 0.00 46.02 43.67 1xgy n GLY 8 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1xgy s PRO 9 N -4.20 3.80 -0.01 1.61 0.02 -1.26 -4.71 135.00 130.25 1xgy s PRO 9 Ca 0.45 2.25 0.03 0.00 0.02 0.00 0.00 61.00 63.75 1xgy s PRO 9 Cb -0.03 -2.67 -0.01 0.00 0.02 0.00 0.00 34.50 31.81 1xgy s PRO 9 CO 0.30 -0.66 -0.10 -1.21 -0.33 0.00 0.00 177.00 175.00 1xgy s GLU 10 N -2.38 0.85 -0.24 5.54 2.02 -1.15 -4.97 118.70 118.37 1xgy s GLU 10 Ca 0.60 -0.35 -0.03 0.00 0.02 0.00 0.00 54.97 55.21 1xgy s GLU 10 Cb -0.40 -0.81 0.01 0.00 0.10 0.00 0.00 34.13 33.03 1xgy s GLU 10 CO 0.51 0.20 -0.05 -1.17 0.02 0.00 0.00 175.26 174.77 1xgy s LEU 11 N -0.16 3.13 0.18 1.80 2.96 -1.26 -1.38 118.68 123.94 1xgy s LEU 11 Ca 0.03 -0.70 0.08 0.00 -0.22 0.00 0.00 54.13 53.31 1xgy s LEU 11 Cb -0.05 -1.70 -0.04 0.00 0.50 0.00 0.00 46.19 44.90 1xgy s LEU 11 CO -0.00 -0.10 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.08 1xgy s VAL 12 N 1.39 1.74 0.23 1.68 1.01 0.90 -4.97 120.40 122.38 1xgy s VAL 12 Ca 0.02 -2.03 -0.12 0.00 0.00 0.00 0.00 61.98 59.86 1xgy s VAL 12 Cb -0.16 -1.90 -0.07 0.00 0.00 0.00 0.00 36.38 34.24 1xgy s VAL 12 CO -0.04 -0.45 0.58 -0.13 0.00 0.00 0.00 175.10 175.06 1xgy s ARG 13 N -3.16 3.88 0.34 2.72 1.81 -1.26 -1.00 118.95 122.27 1xgy s ARG 13 Ca 0.18 0.39 -0.29 0.00 -1.72 0.00 0.00 55.73 54.29 1xgy s ARG 13 Cb -0.03 -2.67 -0.11 0.00 -0.45 0.00 0.00 34.95 31.69 1xgy s ARG 13 CO 0.06 0.32 1.54 -0.35 -0.68 0.00 0.00 175.30 176.20 1xgy n PRO 14 N 0.01 2.69 0.00 3.54 -0.04 -1.26 -2.01 135.00 137.93 1xgy n PRO 14 Ca -0.00 0.95 0.00 0.00 -0.04 0.00 0.00 63.50 64.41 1xgy n PRO 14 Cb 0.52 -2.71 0.00 0.00 -0.04 0.00 0.00 33.50 31.28 1xgy n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1xgy n GLY 15 N 1.29 3.08 3.39 0.55 0.00 -0.11 -4.96 105.19 108.43 1xgy n GLY 15 Ca 0.05 -0.95 -0.31 0.00 0.00 0.00 0.00 46.02 44.82 1xgy n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xgy s ALA 16 N -0.73 -0.27 0.05 4.61 0.00 -0.85 -3.63 121.76 120.95 1xgy s ALA 16 Ca 0.00 -0.98 0.01 0.00 0.00 0.00 0.00 51.96 50.99 1xgy s ALA 16 Cb 0.00 -2.87 -0.03 0.00 0.00 0.00 0.00 23.12 20.22 1xgy s ALA 16 CO 0.00 -4.36 -0.05 -1.54 0.00 0.00 0.00 175.76 169.81 1xgy s SER 17 N -3.53 0.71 0.07 0.00 1.04 -1.26 -0.19 113.70 110.54 1xgy s SER 17 Ca 0.70 -0.77 0.04 0.00 0.48 0.00 0.00 55.95 56.40 1xgy s SER 17 Cb -0.10 0.10 -0.03 0.00 0.10 0.00 0.00 66.02 66.10 1xgy s SER 17 CO 0.56 -0.39 -0.12 0.68 0.98 0.00 0.00 173.24 174.95 1xgy s VAL 18 N -2.61 0.98 -0.19 5.02 -7.23 0.01 -5.00 120.40 111.38 1xgy s VAL 18 Ca -0.01 -1.33 0.01 0.00 -1.81 0.00 0.00 61.98 58.84 1xgy s VAL 18 Cb -0.02 -1.04 0.04 0.00 0.56 0.00 0.00 36.38 35.92 1xgy s VAL 18 CO -0.04 -0.31 -0.12 -0.75 -0.31 0.00 0.00 175.10 173.57 1xgy s LYS 19 N -1.91 2.13 -0.19 4.82 2.20 -1.26 -1.63 119.74 123.91 1xgy s LYS 19 Ca -0.02 -0.78 -0.09 0.00 -0.36 0.00 0.00 55.97 54.72 1xgy s LYS 19 Cb -0.09 -2.35 -0.05 0.00 -1.51 0.00 0.00 37.83 33.83 1xgy s LYS 19 CO 0.02 -0.37 0.12 0.42 -0.36 0.00 0.00 175.35 175.17 1xgy s ILE 20 N 1.41 5.30 0.37 5.43 1.01 0.20 -4.92 121.20 130.00 1xgy s ILE 20 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.81 1xgy s ILE 20 Cb -0.15 -3.41 -0.03 0.00 0.01 0.00 0.00 42.46 38.88 1xgy s ILE 20 CO -0.09 0.45 0.58 -0.94 0.00 0.00 0.00 174.94 174.95 1xgy s SER 21 N 0.29 6.22 -0.46 3.58 1.04 -1.26 -1.45 113.70 121.66 1xgy s SER 21 Ca 0.07 0.44 0.06 0.00 0.48 0.00 0.00 55.95 57.01 1xgy s SER 21 Cb -0.11 -1.95 0.20 0.00 0.10 0.00 0.00 66.02 64.25 1xgy s SER 21 CO -0.01 -0.38 0.59 0.00 0.98 0.00 0.00 173.24 174.41 1xgy s LYS 23 N 0.24 4.30 0.21 0.00 1.02 0.16 -2.41 119.74 123.26 1xgy s LYS 23 Ca 0.32 2.02 0.08 0.00 0.02 0.00 0.00 55.97 58.41 1xgy s LYS 23 Cb 0.08 -3.44 -0.04 0.00 -0.52 0.00 0.00 37.83 33.91 1xgy s LYS 23 CO -0.14 -0.51 0.05 0.00 -0.92 0.00 0.00 175.35 173.82 1xgy s ALA 24 N 1.84 3.30 -0.01 5.17 0.00 0.71 0.55 121.76 133.31 1xgy s ALA 24 Ca 0.64 -1.44 -0.29 0.00 0.00 0.00 0.00 51.96 50.87 1xgy s ALA 24 Cb -0.34 -1.02 0.08 0.00 0.00 0.00 0.00 23.12 21.84 1xgy s ALA 24 CO 0.28 0.38 0.71 -1.54 0.00 0.00 0.00 175.76 175.59 1xgy s SER 25 N -3.33 -0.60 0.00 0.00 1.04 -0.28 -4.80 113.70 105.73 1xgy s SER 25 Ca 0.30 0.50 0.00 0.00 0.48 0.00 0.00 55.95 57.23 1xgy s SER 25 Cb -0.08 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.56 1xgy s SER 25 CO 0.21 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.38 1xgy n GLY 26 N 0.56 0.34 3.66 7.32 0.00 -1.24 -0.45 105.19 115.39 1xgy n GLY 26 Ca -0.17 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.76 1xgy n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xgy s TYR 27 N -2.00 0.04 -0.83 1.61 -0.85 -1.26 -4.51 117.35 109.54 1xgy s TYR 27 Ca 0.00 -0.43 -0.25 0.00 -0.52 0.00 0.00 57.07 55.87 1xgy s TYR 27 Cb 0.00 0.43 -0.01 0.00 0.38 0.00 0.00 41.96 42.76 1xgy s TYR 27 CO 0.00 -1.06 1.71 0.99 -1.52 0.00 0.00 175.55 175.67 1xgy s THR 28 N -3.94 3.58 0.22 -3.49 2.01 -1.26 -4.87 115.64 107.89 1xgy s THR 28 Ca 0.15 -0.20 -0.16 0.00 0.31 0.00 0.00 61.69 61.78 1xgy s THR 28 Cb -0.03 -4.38 0.24 0.00 0.01 0.00 0.00 72.50 68.34 1xgy s THR 28 CO 0.05 -1.31 1.47 0.33 -0.69 0.00 0.00 174.62 174.47 1xgy n PHE 29 N 11.77 0.04 0.33 4.92 7.35 -1.26 -1.93 117.46 138.69 1xgy n PHE 29 Ca 0.28 1.17 0.18 0.00 -0.76 0.00 0.00 57.45 58.31 1xgy n PHE 29 Cb 0.49 -0.86 0.95 0.00 0.35 0.00 0.00 39.48 40.41 1xgy n PHE 29 CO 0.00 0.00 0.00 1.79 -0.76 0.00 0.00 176.76 177.79 1xgy h THR 30 N 0.00 0.00 -0.58 -2.13 1.35 -1.92 -3.12 112.91 106.52 1xgy h THR 30 Ca 0.33 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.19 1xgy h THR 30 Cb 0.57 0.77 0.00 0.00 -1.73 0.00 0.00 68.15 67.76 1xgy h THR 30 CO -0.94 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 174.80 1xgy n ASP 31 N -2.93 3.59 -3.94 5.36 8.00 -0.81 -1.18 116.55 124.64 1xgy n ASP 31 Ca -0.02 -1.98 -0.20 0.00 0.71 0.00 0.00 54.79 53.29 1xgy n ASP 31 Cb 0.27 -0.38 -0.16 0.00 -0.02 0.00 0.00 41.12 40.83 1xgy n ASP 31 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1xgy s TYR 32 N -1.07 0.84 0.49 1.24 1.51 -1.18 -5.06 117.35 114.12 1xgy s TYR 32 Ca 0.40 -0.23 -0.23 0.00 -1.01 0.00 0.00 57.07 56.00 1xgy s TYR 32 Cb 0.22 -0.67 -0.07 0.00 -0.11 0.00 0.00 41.96 41.33 1xgy s TYR 32 CO 0.28 -0.15 1.28 0.66 -1.11 0.00 0.00 175.55 176.51 1xgy n TYR 33 N 3.69 2.08 -4.63 2.71 4.02 -1.26 -4.49 117.16 119.29 1xgy n TYR 33 Ca -0.22 0.46 -0.33 0.00 -0.01 0.00 0.00 57.90 57.81 1xgy n TYR 33 Cb 0.52 -2.35 -0.16 0.00 -0.02 0.00 0.00 39.34 37.33 1xgy n TYR 33 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1xgy s ILE 34 N -1.27 2.10 0.11 -0.72 1.09 -0.85 -1.45 121.20 120.21 1xgy s ILE 34 Ca 0.66 -0.96 0.02 0.00 -1.10 0.00 0.00 60.65 59.27 1xgy s ILE 34 Cb -0.46 -1.84 -0.04 0.00 -1.06 0.00 0.00 42.46 39.06 1xgy s ILE 34 CO 0.54 0.55 0.18 0.20 -0.10 0.00 0.00 174.94 176.30 1xgy s ASN 35 N 0.84 5.98 -0.12 3.58 0.01 0.11 -1.81 114.94 123.54 1xgy s ASN 35 Ca -0.06 0.10 0.02 0.00 -0.71 0.00 0.00 52.86 52.21 1xgy s ASN 35 Cb -0.15 -1.73 0.01 0.00 0.41 0.00 0.00 41.25 39.79 1xgy s ASN 35 CO -0.03 0.12 -0.18 0.26 -1.51 0.00 0.00 177.10 175.77 1xgy s TRP 36 N -1.58 2.25 0.02 2.20 0.52 0.14 -0.55 118.94 121.94 1xgy s TRP 36 Ca 0.33 -1.07 0.08 0.00 0.02 0.00 0.00 56.10 55.45 1xgy s TRP 36 Cb -0.12 -1.57 -0.02 0.00 -1.15 0.00 0.00 33.47 30.61 1xgy s TRP 36 CO 0.26 -0.52 -0.25 0.08 0.02 0.00 0.00 176.95 176.55 1xgy s VAL 37 N 0.87 1.96 -0.11 4.03 1.01 -0.04 -0.32 120.40 127.80 1xgy s VAL 37 Ca -0.08 -1.20 0.00 0.00 0.00 0.00 0.00 61.98 60.71 1xgy s VAL 37 Cb -0.15 -1.66 -0.02 0.00 0.00 0.00 0.00 36.38 34.55 1xgy s VAL 37 CO -0.01 0.42 -0.12 -0.75 0.00 0.00 0.00 175.10 174.64 1xgy s LYS 38 N -0.92 3.20 -0.20 2.72 2.20 0.89 -0.45 119.74 127.17 1xgy s LYS 38 Ca 0.10 -0.66 -0.00 0.00 -0.36 0.00 0.00 55.97 55.05 1xgy s LYS 38 Cb -0.09 -2.61 0.05 0.00 -1.51 0.00 0.00 37.83 33.67 1xgy s LYS 38 CO 0.01 0.33 -0.05 -1.14 -0.36 0.00 0.00 175.35 174.13 1xgy s GLN 39 N 0.06 1.51 -0.01 4.03 0.74 -0.20 -0.93 119.66 124.86 1xgy s GLN 39 Ca -0.04 -0.76 -0.05 0.00 0.05 0.00 0.00 55.36 54.56 1xgy s GLN 39 Cb -0.14 -2.33 -0.04 0.00 1.10 0.00 0.00 33.01 31.59 1xgy s GLN 39 CO 0.04 -0.53 0.22 1.03 -0.55 0.00 0.00 175.29 175.51 1xgy s ARG 40 N 1.52 3.51 0.53 1.67 0.52 -1.26 -1.16 118.95 124.29 1xgy s ARG 40 Ca -0.03 -0.18 0.45 0.00 -0.52 0.00 0.00 55.73 55.45 1xgy s ARG 40 Cb -0.17 -3.09 1.66 0.00 0.52 0.00 0.00 34.95 33.87 1xgy s ARG 40 CO -0.07 0.67 1.59 -1.35 0.02 0.00 0.00 175.30 176.16 1xgy h PRO 41 N 4.00 0.01 -0.00 3.54 0.11 -1.91 -2.17 132.00 135.57 1xgy h PRO 41 Ca -0.50 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1xgy h PRO 41 Cb 1.20 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1xgy h PRO 41 CO 0.67 0.01 -0.10 0.41 -0.21 0.00 0.00 178.00 178.77 1xgy n GLY 42 N -1.81 0.35 2.66 -0.55 0.00 -1.26 -4.86 105.19 99.71 1xgy n GLY 42 Ca 0.42 -0.08 -0.29 0.00 0.00 0.00 0.00 46.02 46.07 1xgy n GLY 42 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1xgy n GLN 43 N -0.81 2.49 0.00 1.61 6.02 -0.82 -5.09 117.38 120.78 1xgy n GLN 43 Ca 0.01 -4.60 0.00 0.00 -0.01 0.00 0.00 57.00 52.40 1xgy n GLN 43 Cb 0.05 -2.30 0.00 0.00 1.02 0.00 0.00 30.24 29.01 1xgy n GLN 43 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xgy n GLY 44 N 1.31 0.42 3.43 1.08 0.00 -1.26 -4.31 105.19 105.85 1xgy n GLY 44 Ca 0.26 0.01 -0.28 0.00 0.00 0.00 0.00 46.02 46.01 1xgy n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xgy s LEU 45 N 0.00 2.46 -0.06 0.99 1.43 -1.26 -4.07 118.68 118.16 1xgy s LEU 45 Ca 0.00 -0.77 -0.03 0.00 -1.03 0.00 0.00 54.13 52.30 1xgy s LEU 45 Cb 0.00 -1.27 0.03 0.00 0.03 0.00 0.00 46.19 44.99 1xgy s LEU 45 CO 0.00 0.15 0.14 -0.70 0.23 0.00 0.00 176.35 176.17 1xgy s GLU 46 N -2.39 0.10 -0.28 1.70 2.12 -0.11 -4.98 118.70 114.86 1xgy s GLU 46 Ca 0.18 0.35 -0.21 0.00 0.36 0.00 0.00 54.97 55.65 1xgy s GLU 46 Cb -0.09 -0.14 -0.01 0.00 0.26 0.00 0.00 34.13 34.15 1xgy s GLU 46 CO 0.09 -0.14 0.66 -0.46 -0.54 0.00 0.00 175.26 174.86 1xgy s TRP 47 N 1.02 3.24 -0.13 5.30 -0.00 -1.26 -0.08 118.94 127.03 1xgy s TRP 47 Ca -0.08 0.72 -0.28 0.00 -0.00 0.00 0.00 56.10 56.47 1xgy s TRP 47 Cb -0.10 -2.97 -0.25 0.00 -0.00 0.00 0.00 33.47 30.16 1xgy s TRP 47 CO -0.05 -0.43 0.79 0.82 -0.00 0.00 0.00 176.95 178.08 1xgy h ILE 48 N 5.50 1.70 0.00 5.86 1.08 -1.03 -3.41 117.51 127.21 1xgy h ILE 48 Ca -0.26 -2.19 0.00 0.00 -0.39 0.00 0.00 64.86 62.02 1xgy h ILE 48 Cb 1.12 3.17 0.00 0.00 -3.07 0.00 0.00 36.82 38.03 1xgy h ILE 48 CO 0.80 0.56 0.00 0.61 -0.69 0.00 0.00 178.15 179.43 1xgy n GLY 49 N 1.48 -2.27 3.25 5.37 0.00 -1.18 -0.48 105.19 111.36 1xgy n GLY 49 Ca -0.10 -1.34 -0.14 0.00 0.00 0.00 0.00 46.02 44.44 1xgy n GLY 49 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1xgy s TRP 50 N -2.22 1.26 0.00 1.61 1.48 -0.17 -0.68 118.94 120.22 1xgy s TRP 50 Ca 0.00 -1.18 0.00 0.00 -1.06 0.00 0.00 56.10 53.86 1xgy s TRP 50 Cb 0.00 -0.71 -0.00 0.00 -1.16 0.00 0.00 33.47 31.60 1xgy s TRP 50 CO 0.00 -0.39 -0.01 -1.50 -4.06 0.00 0.00 176.95 170.99 1xgy s ILE 51 N -3.85 0.02 -0.46 0.66 -1.16 -0.75 -1.33 121.20 114.34 1xgy s ILE 51 Ca 0.32 -0.16 -0.14 0.00 -0.51 0.00 0.00 60.65 60.16 1xgy s ILE 51 Cb 0.07 -0.06 0.07 0.00 0.61 0.00 0.00 42.46 43.15 1xgy s ILE 51 CO 0.09 -0.09 0.36 0.12 -2.81 0.00 0.00 174.94 172.61 1xgy s PHE 52 N -0.26 3.26 0.24 3.50 5.36 0.11 -2.01 117.98 128.18 1xgy s PHE 52 Ca -0.03 -1.04 -0.15 0.00 -0.96 0.00 0.00 56.93 54.76 1xgy s PHE 52 Cb -0.02 -3.08 0.29 0.00 -0.34 0.00 0.00 43.02 39.87 1xgy s PHE 52 CO -0.00 -0.80 1.57 -1.35 -1.46 0.00 0.00 175.22 173.18 1xgy h PRO 52 N 8.67 -0.03 0.00 10.12 0.11 -1.79 0.30 132.00 149.39 1xgy h PRO 52 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1xgy h PRO 52 Cb 1.10 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1xgy h PRO 52 CO 0.84 -0.02 0.00 -2.13 -0.21 0.00 0.00 178.00 176.49 1xgy n ARG 53 N -5.51 0.00 -0.46 1.05 0.63 -0.33 -2.93 116.66 109.11 1xgy n ARG 53 Ca 0.11 0.72 0.09 0.00 -0.92 0.00 0.00 57.85 57.85 1xgy n ARG 53 Cb 0.42 -1.36 0.30 0.00 0.45 0.00 0.00 32.46 32.27 1xgy n ARG 53 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 1xgy n ASN 54 N -2.21 3.92 -1.67 6.15 0.23 -1.18 -4.96 115.26 115.55 1xgy n ASN 54 Ca 0.00 -2.23 -0.18 0.00 -0.53 0.00 0.00 54.58 51.64 1xgy n ASN 54 Cb 0.00 -0.50 -0.07 0.00 -2.08 0.00 0.00 39.78 37.14 1xgy n ASN 54 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1xgy n GLY 55 N 1.24 1.36 3.78 4.83 0.00 0.11 -4.96 105.19 111.54 1xgy n GLY 55 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 1xgy n GLY 55 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1xgy s ASN 56 N -2.45 4.76 -0.21 1.61 0.01 -1.22 -4.75 114.94 112.70 1xgy s ASN 56 Ca 0.00 1.79 -0.25 0.00 -0.71 0.00 0.00 52.86 53.69 1xgy s ASN 56 Cb 0.00 -2.52 0.07 0.00 0.41 0.00 0.00 41.25 39.21 1xgy s ASN 56 CO 0.00 -1.86 0.68 0.42 -1.51 0.00 0.00 177.10 174.83 1xgy s THR 57 N -2.88 0.00 -0.05 1.60 -4.23 -1.26 -0.71 115.64 108.10 1xgy s THR 57 Ca 0.61 -0.01 0.05 0.00 -1.18 0.00 0.00 61.69 61.16 1xgy s THR 57 Cb -0.17 -0.96 -0.01 0.00 1.34 0.00 0.00 72.50 72.70 1xgy s THR 57 CO 0.54 -0.00 -0.21 -0.75 -0.54 0.00 0.00 174.62 173.66 1xgy s LYS 58 N -0.01 2.13 0.21 3.99 2.20 -0.44 -4.99 119.74 122.83 1xgy s LYS 58 Ca -0.03 -0.74 0.09 0.00 -0.36 0.00 0.00 55.97 54.93 1xgy s LYS 58 Cb -0.04 -1.82 -0.04 0.00 -1.51 0.00 0.00 37.83 34.42 1xgy s LYS 58 CO 0.03 0.31 -0.08 0.71 -0.36 0.00 0.00 175.35 175.96 1xgy s TYR 59 N -0.06 2.63 -0.10 4.03 1.51 -1.26 -1.00 117.35 123.10 1xgy s TYR 59 Ca -0.04 -0.23 -0.28 0.00 -1.01 0.00 0.00 57.07 55.52 1xgy s TYR 59 Cb -0.12 -1.24 -0.02 0.00 -0.11 0.00 0.00 41.96 40.47 1xgy s TYR 59 CO 0.03 0.56 0.92 1.21 -1.11 0.00 0.00 175.55 177.15 1xgy s ASN 60 N -3.13 7.16 0.32 2.29 3.84 0.37 -4.93 114.94 120.86 1xgy s ASN 60 Ca 0.27 1.41 0.17 0.00 0.21 0.00 0.00 52.86 54.93 1xgy s ASN 60 Cb -0.08 -2.51 1.15 0.00 -0.55 0.00 0.00 41.25 39.26 1xgy s ASN 60 CO 0.17 -0.36 1.40 -0.62 -2.79 0.00 0.00 177.10 174.89 1xgy n GLU 61 N 4.70 -0.05 0.31 0.43 -0.58 -1.26 -0.10 120.64 124.09 1xgy n GLU 61 Ca 0.06 1.23 0.21 0.00 -0.42 0.00 0.00 57.16 58.24 1xgy n GLU 61 Cb 0.49 -2.19 1.08 0.00 -0.57 0.00 0.00 31.44 30.26 1xgy n GLU 61 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 1xgy h LYS 62 N 0.00 0.00 -0.48 3.49 1.57 -1.94 -1.90 116.57 117.30 1xgy h LYS 62 Ca 0.73 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 59.28 1xgy h LYS 62 Cb 1.92 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 34.09 1xgy h LYS 62 CO -0.69 0.00 0.08 1.19 -0.57 0.00 0.00 179.45 179.45 1xgy n PHE 63 N -3.00 1.51 0.00 -1.35 3.01 0.86 -4.90 117.46 113.59 1xgy n PHE 63 Ca -0.02 -1.59 0.00 0.00 1.01 0.00 0.00 57.45 56.84 1xgy n PHE 63 Cb 0.10 -0.58 0.00 0.00 -0.01 0.00 0.00 39.48 39.00 1xgy n PHE 63 CO 0.00 0.00 0.00 0.36 1.01 0.00 0.00 176.76 178.13 1xgy n LYS 64 N -1.06 0.00 -0.91 -1.08 0.00 -0.72 -2.60 118.16 111.79 1xgy n LYS 64 Ca 0.38 0.00 -0.01 0.00 -0.00 0.00 0.00 58.31 58.68 1xgy n LYS 64 Cb 1.16 -0.25 0.33 0.00 -0.00 0.00 0.00 35.03 36.26 1xgy n LYS 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1xgy n GLY 65 N 0.00 3.23 0.04 2.58 0.00 -1.26 -4.48 105.19 105.30 1xgy n GLY 65 Ca 0.00 -0.89 -0.03 0.00 0.00 0.00 0.00 46.02 45.10 1xgy n GLY 65 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1xgy h LYS 66 N 3.03 0.00 -5.79 1.61 1.63 -1.85 -3.48 116.57 111.72 1xgy h LYS 66 Ca 0.14 0.00 -0.64 0.00 -0.85 0.00 0.00 60.65 59.30 1xgy h LYS 66 Cb 2.09 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 33.66 1xgy h LYS 66 CO 0.60 0.00 -0.45 0.00 -3.45 0.00 0.00 179.45 176.15 1xgy s ALA 67 N -2.84 3.90 -0.15 5.00 0.00 -1.17 -4.03 121.76 122.46 1xgy s ALA 67 Ca -0.08 -0.66 -0.01 0.00 0.00 0.00 0.00 51.96 51.21 1xgy s ALA 67 Cb 0.01 -1.98 0.04 0.00 0.00 0.00 0.00 23.12 21.20 1xgy s ALA 67 CO 0.12 0.67 -0.01 0.99 0.00 0.00 0.00 175.76 177.53 1xgy s THR 68 N -1.22 0.76 0.03 0.00 2.01 0.01 -4.90 115.64 112.34 1xgy s THR 68 Ca 0.23 -0.42 -0.17 0.00 0.31 0.00 0.00 61.69 61.65 1xgy s THR 68 Cb -0.13 -1.02 -0.06 0.00 0.01 0.00 0.00 72.50 71.30 1xgy s THR 68 CO 0.13 0.07 0.48 -0.76 -0.69 0.00 0.00 174.62 173.85 1xgy s LEU 69 N 1.78 4.50 0.18 4.42 1.43 -1.26 -1.43 118.68 128.30 1xgy s LEU 69 Ca 0.01 1.10 -0.06 0.00 -1.03 0.00 0.00 54.13 54.16 1xgy s LEU 69 Cb -0.15 -2.73 -0.02 0.00 0.03 0.00 0.00 46.19 43.32 1xgy s LEU 69 CO -0.07 0.30 0.23 0.42 0.23 0.00 0.00 176.35 177.46 1xgy s THR 70 N -1.08 0.05 -0.05 5.49 -4.23 -0.85 -5.02 115.64 109.94 1xgy s THR 70 Ca 0.26 -1.65 -0.06 0.00 -1.18 0.00 0.00 61.69 59.06 1xgy s THR 70 Cb -0.18 -2.10 0.01 0.00 1.34 0.00 0.00 72.50 71.57 1xgy s THR 70 CO 0.16 -0.22 0.15 -0.69 -0.54 0.00 0.00 174.62 173.49 1xgy s VAL 71 N -4.04 0.02 -0.47 2.29 1.01 -1.26 -1.57 120.40 116.38 1xgy s VAL 71 Ca 0.25 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.09 1xgy s VAL 71 Cb 0.04 -0.27 0.12 0.00 0.00 0.00 0.00 36.38 36.28 1xgy s VAL 71 CO 0.05 -0.08 0.23 -0.62 0.00 0.00 0.00 175.10 174.69 1xgy s ASP 72 N -0.20 4.92 0.35 3.32 -1.08 -0.10 -4.96 116.67 118.93 1xgy s ASP 72 Ca -0.03 -2.48 0.09 0.00 -0.52 0.00 0.00 52.55 49.61 1xgy s ASP 72 Cb -0.02 -1.74 0.82 0.00 -1.46 0.00 0.00 42.92 40.51 1xgy s ASP 72 CO 0.00 -0.39 1.87 0.11 0.52 0.00 0.00 175.17 177.28 1xgy h LYS 73 N 7.35 0.67 0.00 4.34 1.57 -1.91 -0.19 116.57 128.40 1xgy h LYS 73 Ca -0.07 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1xgy h LYS 73 Cb 0.98 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.14 1xgy h LYS 73 CO 0.66 0.44 0.00 -1.13 -0.57 0.00 0.00 179.45 178.85 1xgy n SER 74 N -4.57 0.00 0.00 0.86 3.41 -1.26 -2.48 113.62 109.58 1xgy n SER 74 Ca 0.18 0.42 0.00 0.00 -0.26 0.00 0.00 58.87 59.21 1xgy n SER 74 Cb 0.47 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 1xgy n SER 74 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1xgy n SER 75 N -1.45 0.18 -3.44 4.04 7.64 -0.20 -4.97 113.62 115.42 1xgy n SER 75 Ca 0.03 -0.54 -0.24 0.00 1.01 0.00 0.00 58.87 59.13 1xgy n SER 75 Cb 0.11 0.61 0.05 0.00 -1.01 0.00 0.00 64.21 63.97 1xgy n SER 75 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1xgy n SER 76 N -0.61 -6.00 -4.35 6.43 7.64 -0.54 -4.63 113.62 111.56 1xgy n SER 76 Ca 0.00 -0.48 -0.32 0.00 1.01 0.00 0.00 58.87 59.08 1xgy n SER 76 Cb 0.01 -4.77 -0.15 0.00 -1.01 0.00 0.00 64.21 58.29 1xgy n SER 76 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1xgy s THR 77 N -3.25 2.37 0.02 0.44 2.01 -1.04 -0.21 115.64 115.98 1xgy s THR 77 Ca 0.50 -0.98 0.06 0.00 0.31 0.00 0.00 61.69 61.58 1xgy s THR 77 Cb -0.23 -1.86 -0.03 0.00 0.01 0.00 0.00 72.50 70.39 1xgy s THR 77 CO 0.62 0.58 -0.16 0.00 -0.69 0.00 0.00 174.62 174.96 1xgy s ALA 78 N -0.55 2.65 0.10 7.40 0.00 -1.01 -0.92 121.76 129.42 1xgy s ALA 78 Ca 0.08 -1.14 0.07 0.00 0.00 0.00 0.00 51.96 50.96 1xgy s ALA 78 Cb -0.11 -0.81 -0.03 0.00 0.00 0.00 0.00 23.12 22.17 1xgy s ALA 78 CO 0.00 0.58 -0.18 -0.06 0.00 0.00 0.00 175.76 176.10 1xgy s PHE 79 N -0.91 1.58 -0.06 0.00 0.40 -0.61 0.07 117.98 118.46 1xgy s PHE 79 Ca 0.15 -0.45 0.02 0.00 -0.60 0.00 0.00 56.93 56.05 1xgy s PHE 79 Cb -0.11 -0.86 0.01 0.00 0.51 0.00 0.00 43.02 42.58 1xgy s PHE 79 CO 0.05 0.16 -0.11 1.41 0.70 0.00 0.00 175.22 177.43 1xgy s MET 80 N -2.00 1.50 -0.20 0.44 1.75 -0.53 -2.01 119.30 118.25 1xgy s MET 80 Ca 0.05 -0.36 0.01 0.00 -1.25 0.00 0.00 55.69 54.14 1xgy s MET 80 Cb -0.09 -1.27 0.04 0.00 2.84 0.00 0.00 34.83 36.34 1xgy s MET 80 CO 0.04 0.02 -0.13 -1.14 -0.65 0.00 0.00 175.02 173.16 1xgy s GLN 81 N 0.65 2.31 0.42 4.11 0.74 -0.51 -0.63 119.66 126.74 1xgy s GLN 81 Ca -0.13 -0.93 0.06 0.00 0.05 0.00 0.00 55.36 54.42 1xgy s GLN 81 Cb -0.15 -2.53 0.01 0.00 1.10 0.00 0.00 33.01 31.44 1xgy s GLN 81 CO 0.03 -0.40 0.58 -0.51 -0.55 0.00 0.00 175.29 174.44 1xgy s LEU 82 N 1.32 3.68 0.00 3.68 1.43 -0.64 -0.81 118.68 127.33 1xgy s LEU 82 Ca -0.01 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 52.80 1xgy s LEU 82 Cb -0.16 -2.73 0.00 0.00 0.03 0.00 0.00 46.19 43.33 1xgy s LEU 82 CO -0.09 -0.74 0.00 -0.24 0.23 0.00 0.00 176.35 175.52 1xgy n SER 82 N -1.88 0.00 -4.59 2.29 2.88 -0.99 -0.81 113.62 110.51 1xgy n SER 82 Ca 0.06 0.00 -0.46 0.00 -1.33 0.00 0.00 58.87 57.14 1xgy n SER 82 Cb 0.59 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.03 1xgy n SER 82 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1xgy n LEU 82 N -0.72 1.83 -4.54 2.46 4.77 0.73 -4.57 117.00 116.96 1xgy n LEU 82 Ca 0.00 1.17 -0.26 0.00 -0.03 0.00 0.00 56.01 56.89 1xgy n LEU 82 Cb 0.00 -1.28 -0.09 0.00 -2.33 0.00 0.00 43.42 39.72 1xgy n LEU 82 CO 0.00 -1.31 -0.22 0.42 -1.33 0.00 0.00 177.39 174.96 1xgy s THR 83 N -0.77 0.81 -1.43 -5.08 -4.23 -1.26 -0.94 115.64 102.73 1xgy s THR 83 Ca 0.63 -2.00 0.22 0.00 -1.18 0.00 0.00 61.69 59.36 1xgy s THR 83 Cb -0.73 -2.42 0.39 0.00 1.34 0.00 0.00 72.50 71.08 1xgy s THR 83 CO 0.57 0.00 1.71 -1.54 -0.54 0.00 0.00 174.62 174.83 1xgy n SER 84 N -1.18 0.00 -0.31 3.99 3.41 -1.26 -1.95 113.62 116.32 1xgy n SER 84 Ca -0.07 -0.03 0.13 0.00 -0.26 0.00 0.00 58.87 58.64 1xgy n SER 84 Cb 0.66 -0.28 0.41 0.00 -0.26 0.00 0.00 64.21 64.73 1xgy n SER 84 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1xgy n GLU 85 N -1.28 1.06 0.01 4.33 2.13 -1.26 -3.44 120.64 122.19 1xgy n GLU 85 Ca 0.10 -0.63 0.11 0.00 0.66 0.00 0.00 57.16 57.41 1xgy n GLU 85 Cb 0.17 -1.49 0.07 0.00 0.27 0.00 0.00 31.44 30.47 1xgy n GLU 85 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1xgy n ASP 86 N -0.42 0.69 -4.64 4.31 8.00 -0.82 -4.87 116.55 118.79 1xgy n ASP 86 Ca 0.14 -0.48 -0.42 0.00 0.71 0.00 0.00 54.79 54.74 1xgy n ASP 86 Cb 0.35 0.64 -0.03 0.00 -0.02 0.00 0.00 41.12 42.07 1xgy n ASP 86 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1xgy s SER 87 N -3.25 6.28 0.00 -2.24 0.01 -1.22 -4.84 113.70 108.43 1xgy s SER 87 Ca 0.08 2.31 -0.08 0.00 1.31 0.00 0.00 55.95 59.56 1xgy s SER 87 Cb 0.16 -2.53 0.03 0.00 0.21 0.00 0.00 66.02 63.89 1xgy s SER 87 CO 0.78 -1.24 0.39 0.00 0.41 0.00 0.00 173.24 173.58 1xgy n ALA 88 N 8.41 -1.08 -2.79 1.44 0.00 -0.68 -4.84 120.51 120.97 1xgy n ALA 88 Ca 0.21 -0.26 -0.35 0.00 0.00 0.00 0.00 53.44 53.04 1xgy n ALA 88 Cb 0.43 0.07 -0.09 0.00 0.00 0.00 0.00 19.45 19.85 1xgy n ALA 88 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1xgy s VAL 89 N -2.16 4.69 -0.30 0.00 1.01 -0.31 -1.15 120.40 122.19 1xgy s VAL 89 Ca 0.09 -0.09 -0.00 0.00 0.00 0.00 0.00 61.98 61.98 1xgy s VAL 89 Cb -0.00 -3.05 0.06 0.00 0.00 0.00 0.00 36.38 33.39 1xgy s VAL 89 CO 0.00 0.55 -0.01 -0.31 0.00 0.00 0.00 175.10 175.33 1xgy s TYR 90 N -0.36 3.31 0.24 5.22 1.51 0.26 -1.03 117.35 126.50 1xgy s TYR 90 Ca 0.09 -2.06 -0.05 0.00 -1.01 0.00 0.00 57.07 54.03 1xgy s TYR 90 Cb -0.12 -2.18 -0.05 0.00 -0.11 0.00 0.00 41.96 39.50 1xgy s TYR 90 CO 0.02 -0.84 0.49 -0.06 -1.11 0.00 0.00 175.55 174.05 1xgy s PHE 91 N 1.19 3.47 -0.13 2.71 0.40 0.40 -3.23 117.98 122.80 1xgy s PHE 91 Ca -0.05 0.60 -0.00 0.00 -0.60 0.00 0.00 56.93 56.88 1xgy s PHE 91 Cb -0.20 -2.06 0.03 0.00 0.51 0.00 0.00 43.02 41.30 1xgy s PHE 91 CO -0.02 0.27 -0.10 0.00 0.70 0.00 0.00 175.22 176.06 1xgy s ALA 93 N 1.62 1.21 0.44 0.00 0.00 0.29 0.27 121.76 125.58 1xgy s ALA 93 Ca 0.05 -0.44 -0.03 0.00 0.00 0.00 0.00 51.96 51.54 1xgy s ALA 93 Cb -0.13 -0.76 -0.03 0.00 0.00 0.00 0.00 23.12 22.19 1xgy s ALA 93 CO -0.09 -0.24 0.70 -0.08 0.00 0.00 0.00 175.76 176.05 1xgy s THR 94 N 1.38 4.92 -0.43 0.00 -1.32 -0.63 0.05 115.64 119.61 1xgy s THR 94 Ca -0.02 -0.05 -0.05 0.00 -1.21 0.00 0.00 61.69 60.36 1xgy s THR 94 Cb -0.14 -3.84 0.11 0.00 -1.51 0.00 0.00 72.50 67.12 1xgy s THR 94 CO -0.04 -0.73 0.24 -0.89 -2.21 0.00 0.00 174.62 170.99 1xgy s THR 95 N -2.60 3.57 -0.14 5.08 2.01 -0.53 -2.54 115.64 120.49 1xgy s THR 95 Ca 0.45 -1.95 -0.08 0.00 0.31 0.00 0.00 61.69 60.41 1xgy s THR 95 Cb -0.10 -3.40 -0.03 0.00 0.01 0.00 0.00 72.50 68.97 1xgy s THR 95 CO 0.42 -0.70 -0.15 0.58 -0.69 0.00 0.00 174.62 174.08 1xgy h VAL 96 N 6.29 0.02 0.00 3.82 2.07 -1.96 -3.37 116.25 123.12 1xgy h VAL 96 Ca -0.16 -1.03 -0.30 0.00 0.82 0.00 0.00 66.70 66.04 1xgy h VAL 96 Cb 1.06 0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 1xgy h VAL 96 CO 0.74 0.01 -2.00 -1.20 0.02 0.00 0.00 177.57 175.14 1xgy n SER 97 N -4.63 1.26 -4.18 0.57 7.64 -1.26 -5.04 113.62 107.99 1xgy n SER 97 Ca -0.07 0.22 -0.19 0.00 1.01 0.00 0.00 58.87 59.84 1xgy n SER 97 Cb 0.24 -0.52 -0.12 0.00 -1.01 0.00 0.00 64.21 62.80 1xgy n SER 97 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1xgy s TYR 98 N -2.33 1.25 -0.39 1.43 1.51 -1.26 -5.07 117.35 112.49 1xgy s TYR 98 Ca -0.25 -0.44 -0.36 0.00 -1.01 0.00 0.00 57.07 55.00 1xgy s TYR 98 Cb 0.10 -0.71 -0.16 0.00 -0.11 0.00 0.00 41.96 41.08 1xgy s TYR 98 CO 0.31 0.06 1.31 0.28 -1.11 0.00 0.00 175.55 176.40 1xgy n VAL 99 N 1.34 0.00 -3.94 0.71 0.31 -1.26 -1.80 118.33 113.69 1xgy n VAL 99 Ca -0.21 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.72 1xgy n VAL 99 Cb 0.54 -0.39 0.03 0.00 -0.91 0.00 0.00 33.84 33.11 1xgy n VAL 99 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 1xgy n MET 100 N 3.48 -0.67 0.00 5.55 2.81 -1.22 -4.87 117.12 122.21 1xgy n MET 100 Ca 0.27 0.22 0.12 0.00 -1.81 0.00 0.00 57.70 56.50 1xgy n MET 100 Cb -0.04 -3.16 0.31 0.00 -0.71 0.00 0.00 33.22 29.61 1xgy n MET 100 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1xgy n ASP 101 N -2.37 0.71 -3.75 7.83 5.75 -0.74 -4.75 116.55 119.22 1xgy n ASP 101 Ca -0.11 -0.51 -0.23 0.00 -0.01 0.00 0.00 54.79 53.93 1xgy n ASP 101 Cb 0.58 0.20 -0.18 0.00 -1.03 0.00 0.00 41.12 40.69 1xgy n ASP 101 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1xgy s TYR 102 N -2.79 0.58 0.08 2.11 1.51 -1.20 -5.02 117.35 112.61 1xgy s TYR 102 Ca 0.17 -0.13 0.04 0.00 -1.01 0.00 0.00 57.07 56.14 1xgy s TYR 102 Cb 0.18 -0.76 -0.04 0.00 -0.11 0.00 0.00 41.96 41.24 1xgy s TYR 102 CO 0.62 -0.32 0.01 -1.58 -1.11 0.00 0.00 175.55 173.17 1xgy s TRP 103 N 2.00 3.02 1.12 2.71 0.52 -1.26 -1.60 118.94 125.45 1xgy s TRP 103 Ca 0.05 -0.00 -0.19 0.00 0.02 0.00 0.00 56.10 55.98 1xgy s TRP 103 Cb -0.12 -1.56 0.26 0.00 -1.15 0.00 0.00 33.47 30.90 1xgy s TRP 103 CO -0.05 0.48 1.23 0.20 0.02 0.00 0.00 176.95 178.83 1xgy s GLY 104 N -2.24 1.70 0.51 0.98 0.00 0.14 -4.71 107.32 103.70 1xgy s GLY 104 Ca 0.26 -1.19 0.30 0.00 0.00 0.00 0.00 44.72 44.09 1xgy s GLY 104 CO 0.18 -0.30 1.87 0.06 0.00 0.00 0.00 173.10 174.90 1xgy h GLN 105 N -2.24 0.00 -1.99 2.90 3.07 -1.88 -3.45 115.11 111.52 1xgy h GLN 105 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.31 1xgy h GLN 105 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.81 1xgy h GLN 105 CO 0.31 0.01 0.00 0.41 0.09 0.00 0.00 178.83 179.65 1xgy n GLY 106 N 0.35 0.21 3.70 0.06 0.00 -1.26 -5.04 105.19 103.21 1xgy n GLY 106 Ca 0.02 -0.40 -0.35 0.00 0.00 0.00 0.00 46.02 45.29 1xgy n GLY 106 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xgy n THR 107 N -0.71 3.10 -3.98 2.61 -1.04 -1.20 -4.68 114.28 108.38 1xgy n THR 107 Ca 0.00 -0.31 -0.31 0.00 -2.04 0.00 0.00 64.05 61.39 1xgy n THR 107 Cb 0.33 -1.30 -0.15 0.00 -1.82 0.00 0.00 70.33 67.39 1xgy n THR 107 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1xgy s THR 108 N -1.85 1.94 -0.22 12.58 -1.32 -1.26 -0.57 115.64 124.93 1xgy s THR 108 Ca 0.77 -1.88 -0.20 0.00 -1.21 0.00 0.00 61.69 59.17 1xgy s THR 108 Cb -0.32 -2.31 -0.02 0.00 -1.51 0.00 0.00 72.50 68.33 1xgy s THR 108 CO 0.47 -0.41 0.59 -0.69 -2.21 0.00 0.00 174.62 172.38 1xgy s VAL 109 N 1.12 5.03 -0.24 5.08 1.01 -0.30 -2.93 120.40 129.18 1xgy s VAL 109 Ca 0.04 1.09 -0.02 0.00 0.00 0.00 0.00 61.98 63.09 1xgy s VAL 109 Cb -0.19 -3.91 0.02 0.00 0.00 0.00 0.00 36.38 32.31 1xgy s VAL 109 CO -0.09 0.09 -0.07 -0.89 0.00 0.00 0.00 175.10 174.14 1xgy s THR 110 N 2.10 2.84 -0.25 3.92 2.01 -0.48 -1.69 115.64 124.09 1xgy s THR 110 Ca 0.26 -0.99 -0.09 0.00 0.31 0.00 0.00 61.69 61.19 1xgy s THR 110 Cb -0.16 -2.42 -0.04 0.00 0.01 0.00 0.00 72.50 69.90 1xgy s THR 110 CO 0.09 0.24 0.11 0.68 -0.69 0.00 0.00 174.62 175.05 1xgy s VAL 111 N 1.33 4.75 -0.16 3.82 -7.23 -1.25 -0.07 120.40 121.60 1xgy s VAL 111 Ca 0.01 -0.03 -0.23 0.00 -1.81 0.00 0.00 61.98 59.92 1xgy s VAL 111 Cb -0.16 -3.22 0.06 0.00 0.56 0.00 0.00 36.38 33.62 1xgy s VAL 111 CO -0.05 0.34 0.60 -0.55 -0.31 0.00 0.00 175.10 175.12 1xgy s SER 112 N 1.39 -0.60 0.00 4.85 0.15 -0.17 -4.67 113.70 114.66 1xgy s SER 112 Ca 0.06 0.97 0.22 0.00 0.70 0.00 0.00 55.95 57.90 1xgy s SER 112 Cb -0.15 0.95 0.64 0.00 -1.71 0.00 0.00 66.02 65.75 1xgy s SER 112 CO 0.05 -0.35 1.50 -1.54 1.20 0.00 0.00 173.24 174.10 1xgy n SER 113 N 2.08 2.27 -4.11 5.45 3.41 -1.26 -4.18 113.62 117.27 1xgy n SER 113 Ca -0.16 -1.80 -0.29 0.00 -0.26 0.00 0.00 58.87 56.36 1xgy n SER 113 Cb 0.56 -0.13 0.21 0.00 -0.26 0.00 0.00 64.21 64.59 1xgy n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xgy n ALA 114 N 0.73 -3.58 -2.70 7.33 0.00 -1.26 -5.05 120.51 115.98 1xgy n ALA 114 Ca 0.17 -1.33 -0.18 0.00 0.00 0.00 0.00 53.44 52.10 1xgy n ALA 114 Cb 0.43 -1.53 -0.12 0.00 0.00 0.00 0.00 19.45 18.23 1xgy n ALA 114 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1xgy s LYS 115 N -3.83 0.81 0.10 0.00 0.00 -1.26 -5.09 119.74 110.47 1xgy s LYS 115 Ca 0.57 -0.96 -0.31 0.00 0.00 0.00 0.00 55.97 55.27 1xgy s LYS 115 Cb -0.14 -0.79 -0.10 0.00 0.00 0.00 0.00 37.83 36.80 1xgy s LYS 115 CO 0.60 0.17 1.89 2.41 0.00 0.00 0.00 175.35 180.43 1xgy n THR 116 N 1.23 0.51 -3.84 3.79 -1.04 -1.26 -4.68 114.28 108.99 1xgy n THR 116 Ca -0.21 -0.09 -0.12 0.00 -2.04 0.00 0.00 64.05 61.59 1xgy n THR 116 Cb 0.54 -2.21 -0.13 0.00 -1.82 0.00 0.00 70.33 66.71 1xgy n THR 116 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1xgy s THR 117 N 3.34 -0.00 0.33 12.58 -4.23 0.86 -4.95 115.64 123.56 1xgy s THR 117 Ca 0.84 0.02 -0.29 0.00 -1.18 0.00 0.00 61.69 61.08 1xgy s THR 117 Cb -0.46 -0.11 -0.10 0.00 1.34 0.00 0.00 72.50 73.17 1xgy s THR 117 CO 0.39 0.01 1.32 -2.84 -0.54 0.00 0.00 174.62 172.96 1xgy s PRO 118 N 0.13 4.34 0.73 3.99 0.02 -1.26 -1.50 135.00 141.45 1xgy s PRO 118 Ca -0.01 2.24 -0.11 0.00 0.02 0.00 0.00 61.00 63.14 1xgy s PRO 118 Cb -0.01 -3.07 0.03 0.00 0.02 0.00 0.00 34.50 31.46 1xgy s PRO 118 CO -0.00 -0.22 1.07 -2.14 -0.33 0.00 0.00 177.00 175.38 1xgy s PRO 119 N -1.69 2.65 -0.44 5.54 0.01 -1.26 -4.46 135.00 135.35 1xgy s PRO 119 Ca 0.50 0.98 -0.01 0.00 0.01 0.00 0.00 61.00 62.47 1xgy s PRO 119 Cb -0.40 -1.96 0.12 0.00 0.01 0.00 0.00 34.50 32.27 1xgy s PRO 119 CO 0.53 -1.31 0.22 -1.12 0.01 0.00 0.00 177.00 175.33 1xgy s SER 120 N -3.69 5.12 -0.40 2.53 0.01 -0.36 -4.88 113.70 112.02 1xgy s SER 120 Ca 0.59 -2.25 -0.25 0.00 1.31 0.00 0.00 55.95 55.35 1xgy s SER 120 Cb -0.15 -1.79 0.02 0.00 0.21 0.00 0.00 66.02 64.31 1xgy s SER 120 CO 0.55 -0.47 0.91 -0.69 0.41 0.00 0.00 173.24 173.95 1xgy s VAL 121 N 0.82 4.56 -0.09 3.43 1.01 -1.26 -2.22 120.40 126.65 1xgy s VAL 121 Ca 0.11 0.98 -0.00 0.00 0.00 0.00 0.00 61.98 63.06 1xgy s VAL 121 Cb -0.22 -4.36 -0.03 0.00 0.00 0.00 0.00 36.38 31.77 1xgy s VAL 121 CO -0.04 -0.64 -0.06 -0.31 0.00 0.00 0.00 175.10 174.04 1xgy s TYR 122 N 3.54 2.97 0.39 5.22 2.02 -0.73 -4.94 117.35 125.81 1xgy s TYR 122 Ca 0.37 -0.05 -0.24 0.00 -0.37 0.00 0.00 57.07 56.78 1xgy s TYR 122 Cb -0.11 -1.77 -0.09 0.00 -0.40 0.00 0.00 41.96 39.58 1xgy s TYR 122 CO 0.21 0.25 1.01 -1.25 -1.57 0.00 0.00 175.55 174.21 1xgy s PRO 123 N -0.55 4.24 -0.42 -1.71 0.04 -1.26 -1.09 135.00 134.25 1xgy s PRO 123 Ca 0.08 1.40 0.02 0.00 0.04 0.00 0.00 61.00 62.55 1xgy s PRO 123 Cb -0.12 -2.52 0.11 0.00 0.04 0.00 0.00 34.50 32.02 1xgy s PRO 123 CO 0.02 -0.05 0.16 -0.51 0.04 0.00 0.00 177.00 176.66 1xgy s LEU 124 N -2.64 4.79 0.00 -3.56 1.43 0.14 -4.87 118.68 113.97 1xgy s LEU 124 Ca 0.57 -2.40 0.03 0.00 -1.03 0.00 0.00 54.13 51.29 1xgy s LEU 124 Cb -0.19 -1.69 -0.03 0.00 0.03 0.00 0.00 46.19 44.31 1xgy s LEU 124 CO 0.24 -0.37 -0.05 0.00 0.23 0.00 0.00 176.35 176.40 1xgy s ALA 125 N 0.57 3.09 0.07 4.21 0.00 -1.26 -1.92 121.76 126.52 1xgy s ALA 125 Ca 0.12 -1.00 -0.37 0.00 0.00 0.00 0.00 51.96 50.71 1xgy s ALA 125 Cb -0.21 -1.19 -0.18 0.00 0.00 0.00 0.00 23.12 21.54 1xgy s ALA 125 CO -0.05 0.62 1.14 -2.30 0.00 0.00 0.00 175.76 175.18 1xgy n PRO 126 N 1.52 0.57 0.00 0.00 -0.01 -1.26 -4.79 135.00 131.02 1xgy n PRO 126 Ca -0.15 0.20 0.00 0.00 -0.01 0.00 0.00 63.50 63.54 1xgy n PRO 126 Cb 0.53 -1.72 0.00 0.00 -0.01 0.00 0.00 33.50 32.29 1xgy n PRO 126 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1xgy n GLY 127 N 1.97 -1.50 3.42 -1.23 0.00 -1.26 -4.32 105.19 102.26 1xgy n GLY 127 Ca 0.19 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.76 1xgy n GLY 127 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xgy s SER 128 N -1.84 6.96 0.23 1.61 0.15 -1.26 -4.77 113.70 114.78 1xgy s SER 128 Ca 0.00 -2.81 -0.14 0.00 0.70 0.00 0.00 55.95 53.70 1xgy s SER 128 Cb 0.00 -2.34 -0.08 0.00 -1.71 0.00 0.00 66.02 61.90 1xgy s SER 128 CO 0.00 -0.72 0.63 0.00 1.20 0.00 0.00 173.24 174.35 1xgy s ALA 129 N 1.13 3.48 0.00 5.45 0.00 -1.26 -5.25 121.76 125.30 1xgy s ALA 129 Ca 0.34 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.23 1xgy s ALA 129 Cb -0.06 -2.62 0.00 0.00 0.00 0.00 0.00 23.12 20.44 1xgy s ALA 129 CO -0.05 0.41 0.00 0.09 0.00 0.00 0.00 175.76 176.21 1xgy n ASN 133 N 0.23 0.00 0.04 0.00 3.02 -1.26 -5.21 115.26 112.08 1xgy n ASN 133 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.54 1xgy n ASN 133 Cb 0.52 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.69 1xgy n ASN 133 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1xgy n SER 134 N 0.00 0.31 -4.72 6.41 2.88 -1.26 -4.86 113.62 112.38 1xgy n SER 134 Ca 0.00 0.14 -0.37 0.00 -1.33 0.00 0.00 58.87 57.31 1xgy n SER 134 Cb 0.00 -0.03 -0.07 0.00 -0.75 0.00 0.00 64.21 63.37 1xgy n SER 134 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 1xgy s MET 135 N -1.49 4.28 0.06 -1.46 -1.94 -1.26 0.44 119.30 117.92 1xgy s MET 135 Ca 0.00 0.19 0.02 0.00 -1.71 0.00 0.00 55.69 54.19 1xgy s MET 135 Cb 0.00 -3.44 -0.04 0.00 2.01 0.00 0.00 34.83 33.36 1xgy s MET 135 CO 0.00 0.20 0.09 0.08 -0.01 0.00 0.00 175.02 175.38 1xgy s VAL 136 N 0.56 4.64 -0.22 -6.03 1.01 0.57 -4.82 120.40 116.11 1xgy s VAL 136 Ca 0.19 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.51 1xgy s VAL 136 Cb -0.14 -3.22 0.04 0.00 0.00 0.00 0.00 36.38 33.06 1xgy s VAL 136 CO 0.06 0.17 -0.15 -0.89 0.00 0.00 0.00 175.10 174.28 1xgy s THR 137 N -1.36 2.18 0.35 3.92 2.01 -1.26 0.39 115.64 121.86 1xgy s THR 137 Ca 0.29 -1.22 0.09 0.00 0.31 0.00 0.00 61.69 61.15 1xgy s THR 137 Cb -0.12 -2.08 -0.05 0.00 0.01 0.00 0.00 72.50 70.26 1xgy s THR 137 CO 0.21 0.28 0.06 -0.76 -0.69 0.00 0.00 174.62 173.73 1xgy s LEU 138 N 1.22 3.06 0.20 4.42 1.43 0.51 -4.63 118.68 124.90 1xgy s LEU 138 Ca -0.01 -0.95 -0.23 0.00 -1.03 0.00 0.00 54.13 51.91 1xgy s LEU 138 Cb -0.16 -1.45 0.06 0.00 0.03 0.00 0.00 46.19 44.67 1xgy s LEU 138 CO -0.09 -0.29 0.92 -0.83 0.23 0.00 0.00 176.35 176.29 1xgy s GLY 139 N -3.77 -0.09 0.10 -3.19 0.00 -0.81 0.33 107.32 99.90 1xgy s GLY 139 Ca 0.36 -0.12 0.06 0.00 0.00 0.00 0.00 44.72 45.02 1xgy s GLY 139 CO 0.20 0.37 -0.15 0.00 0.00 0.00 0.00 173.10 173.52 1xgy s LEU 141 N -2.10 3.70 -0.62 0.00 2.96 -0.25 -1.39 118.68 120.98 1xgy s LEU 141 Ca 0.04 -1.39 -0.19 0.00 -0.22 0.00 0.00 54.13 52.38 1xgy s LEU 141 Cb -0.08 -1.62 0.11 0.00 0.50 0.00 0.00 46.19 45.10 1xgy s LEU 141 CO 0.03 -0.23 0.73 -0.69 -1.32 0.00 0.00 176.35 174.87 1xgy s VAL 142 N 1.15 4.85 0.02 1.68 1.01 0.36 -1.77 120.40 127.70 1xgy s VAL 142 Ca -0.07 -1.10 0.00 0.00 0.00 0.00 0.00 61.98 60.82 1xgy s VAL 142 Cb -0.20 -4.51 -0.04 0.00 0.00 0.00 0.00 36.38 31.63 1xgy s VAL 142 CO -0.04 -1.15 0.08 -0.75 0.00 0.00 0.00 175.10 173.24 1xgy s LYS 143 N 2.57 3.01 -1.27 2.72 2.20 -0.94 -1.74 119.74 126.29 1xgy s LYS 143 Ca 0.13 -0.54 -0.04 0.00 -0.36 0.00 0.00 55.97 55.17 1xgy s LYS 143 Cb -0.22 -2.82 -0.01 0.00 -1.51 0.00 0.00 37.83 33.27 1xgy s LYS 143 CO 0.05 0.63 0.70 0.41 -0.36 0.00 0.00 175.35 176.77 1xgy n GLY 144 N 1.03 -0.45 3.67 5.54 0.00 -0.99 -1.23 105.19 112.76 1xgy n GLY 144 Ca -0.12 0.21 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 1xgy n GLY 144 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xgy s TYR 145 N -3.65 2.67 -0.28 1.61 -0.85 -0.47 -4.60 117.35 111.77 1xgy s TYR 145 Ca 0.10 -0.32 -0.24 0.00 -0.52 0.00 0.00 57.07 56.10 1xgy s TYR 145 Cb -0.03 -1.40 0.13 0.00 0.38 0.00 0.00 41.96 41.03 1xgy s TYR 145 CO 0.82 0.50 1.02 0.12 -1.52 0.00 0.00 175.55 176.49 1xgy s PHE 146 N -2.39 -0.49 0.00 -3.49 5.36 -0.56 -0.19 117.98 116.21 1xgy s PHE 146 Ca 0.34 1.16 0.00 0.00 -0.96 0.00 0.00 56.93 57.47 1xgy s PHE 146 Cb -0.04 0.37 0.00 0.00 -0.34 0.00 0.00 43.02 43.01 1xgy s PHE 146 CO 0.21 -0.24 0.00 -0.35 -1.46 0.00 0.00 175.22 173.38 1xgy n PRO 147 N 2.46 1.13 -1.89 10.12 -0.04 -1.26 -0.10 135.00 145.43 1xgy n PRO 147 Ca -0.13 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.02 1xgy n PRO 147 Cb 0.56 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.03 1xgy n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1xgy s GLU 148 N -0.98 3.61 0.19 0.54 2.02 -1.26 -4.80 118.70 118.01 1xgy s GLU 148 Ca 0.00 0.75 0.01 0.00 0.02 0.00 0.00 54.97 55.75 1xgy s GLU 148 Cb 0.00 -2.08 0.01 0.00 0.10 0.00 0.00 34.13 32.16 1xgy s GLU 148 CO 0.00 -0.56 0.09 -0.35 0.02 0.00 0.00 175.26 174.46 1xgy n PRO 149 N -2.72 1.33 -4.31 0.39 -0.04 -1.26 -4.97 135.00 123.42 1xgy n PRO 149 Ca 0.06 -1.24 -0.17 0.00 -0.04 0.00 0.00 63.50 62.12 1xgy n PRO 149 Cb 0.54 0.20 -0.10 0.00 -0.04 0.00 0.00 33.50 34.10 1xgy n PRO 149 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1xgy s VAL 150 N -1.19 1.47 -0.12 0.52 -7.23 -1.26 -4.38 120.40 108.22 1xgy s VAL 150 Ca 0.07 -2.14 0.01 0.00 -1.81 0.00 0.00 61.98 58.11 1xgy s VAL 150 Cb -0.01 -1.99 0.02 0.00 0.56 0.00 0.00 36.38 34.97 1xgy s VAL 150 CO 0.05 -0.64 -0.14 -0.89 -0.31 0.00 0.00 175.10 173.16 1xgy s THR 151 N -3.14 1.45 -0.04 5.32 2.01 0.99 -4.94 115.64 117.29 1xgy s THR 151 Ca 0.20 -0.60 0.04 0.00 0.31 0.00 0.00 61.69 61.65 1xgy s THR 151 Cb 0.01 -1.35 -0.03 0.00 0.01 0.00 0.00 72.50 71.14 1xgy s THR 151 CO 0.04 0.43 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.57 1xgy s VAL 152 N 1.18 2.99 0.07 3.82 1.01 -1.26 -0.72 120.40 127.49 1xgy s VAL 152 Ca -0.03 -0.77 -0.12 0.00 0.00 0.00 0.00 61.98 61.06 1xgy s VAL 152 Cb -0.14 -2.17 0.02 0.00 0.00 0.00 0.00 36.38 34.09 1xgy s VAL 152 CO -0.04 0.58 0.28 0.42 0.00 0.00 0.00 175.10 176.33 1xgy s THR 153 N -0.74 0.10 -0.10 3.92 -4.23 -0.78 -4.96 115.64 108.86 1xgy s THR 153 Ca 0.12 -0.81 0.02 0.00 -1.18 0.00 0.00 61.69 59.83 1xgy s THR 153 Cb -0.11 -1.08 -0.01 0.00 1.34 0.00 0.00 72.50 72.64 1xgy s THR 153 CO 0.01 -0.45 -0.16 0.26 -0.54 0.00 0.00 174.62 173.74 1xgy s TRP 154 N -3.09 2.71 -1.36 3.99 0.52 -1.26 0.11 118.94 120.56 1xgy s TRP 154 Ca -0.01 -0.61 -0.00 0.00 0.02 0.00 0.00 56.10 55.50 1xgy s TRP 154 Cb 0.01 -1.76 -0.00 0.00 -1.15 0.00 0.00 33.47 30.58 1xgy s TRP 154 CO -0.07 -0.16 0.53 0.09 0.02 0.00 0.00 176.95 177.37 1xgy n ASN 155 N 3.22 -0.66 -1.62 2.95 3.02 0.77 -0.84 115.26 122.11 1xgy n ASN 155 Ca -0.18 -0.93 -0.17 0.00 -0.03 0.00 0.00 54.58 53.27 1xgy n ASN 155 Cb 0.53 -3.48 -0.07 0.00 -0.61 0.00 0.00 39.78 36.15 1xgy n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1xgy n SER 156 N -3.02 -4.59 0.00 6.41 7.64 -1.26 -1.32 113.62 117.48 1xgy n SER 156 Ca -0.31 0.38 0.00 0.00 1.01 0.00 0.00 58.87 59.95 1xgy n SER 156 Cb 0.68 -4.10 0.00 0.00 -1.01 0.00 0.00 64.21 59.78 1xgy n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xgy n GLY 157 N -0.40 2.89 0.01 0.23 0.00 -0.02 -4.97 105.19 102.94 1xgy n GLY 157 Ca -0.18 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.84 1xgy n GLY 157 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1xgy h SER 158 N 0.00 -0.02 -0.64 1.61 0.02 -1.18 -3.25 113.55 110.08 1xgy h SER 158 Ca 0.00 0.00 -0.35 0.00 -0.84 0.00 0.00 61.79 60.60 1xgy h SER 158 Cb 0.00 0.01 -0.05 0.00 0.14 0.00 0.00 62.40 62.50 1xgy h SER 158 CO 0.00 -0.01 1.00 -0.22 -1.14 0.00 0.00 176.83 176.46 1xgy s LEU 159 N -4.73 3.18 -0.05 5.07 2.96 -1.17 -4.62 118.68 119.31 1xgy s LEU 159 Ca -0.00 -1.24 0.15 0.00 -0.22 0.00 0.00 54.13 52.82 1xgy s LEU 159 Cb 0.00 -2.57 -0.23 0.00 0.50 0.00 0.00 46.19 43.89 1xgy s LEU 159 CO 0.01 -2.72 0.28 -1.54 -1.32 0.00 0.00 176.35 171.05 1xgy n SER 160 N 13.52 1.37 -4.79 3.68 3.41 -1.23 -4.21 113.62 125.38 1xgy n SER 160 Ca 0.42 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.67 1xgy n SER 160 Cb 0.47 1.51 -0.06 0.00 -0.26 0.00 0.00 64.21 65.87 1xgy n SER 160 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1xgy s SER 161 N -4.07 7.16 0.00 4.04 0.15 -1.26 -3.44 113.70 116.29 1xgy s SER 161 Ca -0.06 1.83 0.00 0.00 0.70 0.00 0.00 55.95 58.42 1xgy s SER 161 Cb 0.09 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.83 1xgy s SER 161 CO 0.65 -0.20 0.00 0.61 1.20 0.00 0.00 173.24 175.50 1xgy n GLY 162 N 0.26 1.76 3.75 9.45 0.00 -1.26 -4.68 105.19 114.47 1xgy n GLY 162 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1xgy n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xgy s VAL 163 N -3.25 3.61 -0.22 1.61 1.01 -1.22 -3.57 120.40 118.37 1xgy s VAL 163 Ca 0.00 1.51 -0.01 0.00 0.00 0.00 0.00 61.98 63.47 1xgy s VAL 163 Cb 0.00 -3.96 0.06 0.00 0.00 0.00 0.00 36.38 32.48 1xgy s VAL 163 CO 0.00 0.31 0.01 -1.00 0.00 0.00 0.00 175.10 174.42 1xgy s HIS 164 N -0.72 1.59 -0.27 5.22 3.76 0.12 -4.99 115.29 119.99 1xgy s HIS 164 Ca 0.47 -1.26 -0.06 0.00 -0.15 0.00 0.00 55.06 54.06 1xgy s HIS 164 Cb -0.31 -1.28 0.00 0.00 1.11 0.00 0.00 32.58 32.09 1xgy s HIS 164 CO 0.39 -0.69 0.05 0.99 -0.85 0.00 0.00 174.74 174.62 1xgy s THR 165 N 1.67 3.85 0.43 1.30 2.01 -1.26 -0.29 115.64 123.34 1xgy s THR 165 Ca -0.02 -0.59 -0.13 0.00 0.31 0.00 0.00 61.69 61.26 1xgy s THR 165 Cb -0.18 -2.91 -0.07 0.00 0.01 0.00 0.00 72.50 69.35 1xgy s THR 165 CO -0.08 0.19 0.83 -0.36 -0.69 0.00 0.00 174.62 174.51 1xgy s PHE 166 N 1.50 3.45 0.51 4.92 0.40 -0.74 -5.02 117.98 123.01 1xgy s PHE 166 Ca 0.04 1.19 -0.23 0.00 -0.60 0.00 0.00 56.93 57.33 1xgy s PHE 166 Cb -0.16 -2.56 -0.06 0.00 0.51 0.00 0.00 43.02 40.75 1xgy s PHE 166 CO 0.01 -0.16 1.37 -2.14 0.70 0.00 0.00 175.22 175.00 1xgy s PRO 167 N -3.81 3.32 0.69 0.24 0.02 -1.26 -4.41 135.00 129.80 1xgy s PRO 167 Ca 0.54 2.27 -0.11 0.00 0.02 0.00 0.00 61.00 63.72 1xgy s PRO 167 Cb -0.10 -2.38 0.01 0.00 0.02 0.00 0.00 34.50 32.04 1xgy s PRO 167 CO 0.29 -1.06 1.06 0.00 -0.33 0.00 0.00 177.00 176.97 1xgy s ALA 168 N -1.28 2.69 0.19 -1.55 0.00 -1.26 -4.77 121.76 115.77 1xgy s ALA 168 Ca 0.68 0.09 0.09 0.00 0.00 0.00 0.00 51.96 52.82 1xgy s ALA 168 Cb -0.41 -3.18 -0.04 0.00 0.00 0.00 0.00 23.12 19.49 1xgy s ALA 168 CO 0.50 -1.21 -0.19 0.14 0.00 0.00 0.00 175.76 175.00 1xgy s VAL 169 N -3.04 1.98 -0.38 0.00 -7.23 -0.85 -4.88 120.40 106.00 1xgy s VAL 169 Ca 0.58 -2.04 -0.10 0.00 -1.81 0.00 0.00 61.98 58.61 1xgy s VAL 169 Cb -0.14 -1.98 0.05 0.00 0.56 0.00 0.00 36.38 34.87 1xgy s VAL 169 CO 0.55 -0.33 0.21 -0.22 -0.31 0.00 0.00 175.10 175.00 1xgy s LEU 170 N -2.86 4.81 -0.24 1.32 2.96 -1.26 -0.52 118.68 122.88 1xgy s LEU 170 Ca 0.19 -1.18 -0.02 0.00 -0.22 0.00 0.00 54.13 52.91 1xgy s LEU 170 Cb -0.05 -1.99 0.02 0.00 0.50 0.00 0.00 46.19 44.67 1xgy s LEU 170 CO 0.08 -0.43 -0.06 -1.58 -1.32 0.00 0.00 176.35 173.04 1xgy s GLN 171 N 1.50 2.88 -1.32 1.98 0.74 0.42 -4.70 119.66 121.15 1xgy s GLN 171 Ca 0.02 -0.95 -0.02 0.00 0.05 0.00 0.00 55.36 54.46 1xgy s GLN 171 Cb -0.20 -2.98 0.01 0.00 1.10 0.00 0.00 33.01 30.94 1xgy s GLN 171 CO 0.05 -0.38 0.76 0.43 -0.55 0.00 0.00 175.29 175.60 1xgy n SER 172 N 4.68 -1.71 0.00 6.67 7.64 -1.26 -2.19 113.62 127.45 1xgy n SER 172 Ca -0.17 -0.79 0.00 0.00 1.01 0.00 0.00 58.87 58.92 1xgy n SER 172 Cb 0.47 -4.14 0.00 0.00 -1.01 0.00 0.00 64.21 59.53 1xgy n SER 172 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1xgy n ASP 173 N -3.04 0.00 -4.41 6.43 8.00 -1.26 -5.00 116.55 117.27 1xgy n ASP 173 Ca -0.26 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 54.94 1xgy n ASP 173 Cb 0.66 -0.67 -0.13 0.00 -0.02 0.00 0.00 41.12 40.96 1xgy n ASP 173 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xgy s LEU 174 N 0.00 2.40 0.32 0.64 1.43 -0.93 -4.85 118.68 117.69 1xgy s LEU 174 Ca 0.00 -0.60 -0.06 0.00 -1.03 0.00 0.00 54.13 52.44 1xgy s LEU 174 Cb 0.00 -1.36 -0.05 0.00 0.03 0.00 0.00 46.19 44.81 1xgy s LEU 174 CO 0.00 0.22 0.60 -0.31 0.23 0.00 0.00 176.35 177.09 1xgy s TYR 175 N -0.97 3.48 -0.18 0.29 2.02 0.73 -0.44 117.35 122.28 1xgy s TYR 175 Ca 0.14 0.73 -0.05 0.00 -0.37 0.00 0.00 57.07 57.52 1xgy s TYR 175 Cb -0.10 -2.18 0.09 0.00 -0.40 0.00 0.00 41.96 39.37 1xgy s TYR 175 CO 0.05 0.11 0.34 0.99 -1.57 0.00 0.00 175.55 175.47 1xgy s THR 176 N -2.15 -0.53 0.19 -0.71 2.01 0.32 -1.37 115.64 113.40 1xgy s THR 176 Ca 0.45 0.14 0.06 0.00 0.31 0.00 0.00 61.69 62.66 1xgy s THR 176 Cb -0.11 -0.61 -0.05 0.00 0.01 0.00 0.00 72.50 71.75 1xgy s THR 176 CO 0.30 0.03 -0.11 -1.48 -0.69 0.00 0.00 174.62 172.68 1xgy s LEU 177 N 2.50 2.51 0.13 4.42 -0.00 -0.71 -2.00 118.68 125.53 1xgy s LEU 177 Ca 0.03 -1.05 0.06 0.00 -0.00 0.00 0.00 54.13 53.17 1xgy s LEU 177 Cb -0.13 -0.51 -0.04 0.00 -0.00 0.00 0.00 46.19 45.52 1xgy s LEU 177 CO -0.12 -0.28 -0.14 -0.94 -0.00 0.00 0.00 176.35 174.88 1xgy s SER 178 N -3.27 2.02 -0.02 1.48 1.04 -1.26 -0.48 113.70 113.20 1xgy s SER 178 Ca 0.21 -0.83 0.02 0.00 0.48 0.00 0.00 55.95 55.83 1xgy s SER 178 Cb 0.01 -0.07 0.01 0.00 0.10 0.00 0.00 66.02 66.07 1xgy s SER 178 CO 0.05 -0.16 -0.06 -0.55 0.98 0.00 0.00 173.24 173.50 1xgy s SER 179 N -2.54 0.91 0.04 7.02 0.15 -0.49 -1.79 113.70 117.01 1xgy s SER 179 Ca 0.10 -0.13 0.08 0.00 0.70 0.00 0.00 55.95 56.69 1xgy s SER 179 Cb -0.04 -0.26 -0.03 0.00 -1.71 0.00 0.00 66.02 63.98 1xgy s SER 179 CO 0.03 0.03 -0.21 -0.94 1.20 0.00 0.00 173.24 173.35 1xgy s SER 180 N 0.28 3.55 -0.03 5.45 1.04 0.60 -0.40 113.70 124.20 1xgy s SER 180 Ca -0.04 -0.49 0.03 0.00 0.48 0.00 0.00 55.95 55.93 1xgy s SER 180 Cb -0.08 -0.48 0.00 0.00 0.10 0.00 0.00 66.02 65.56 1xgy s SER 180 CO 0.00 0.26 -0.10 0.54 0.98 0.00 0.00 173.24 174.92 1xgy s VAL 181 N -0.87 0.82 -0.20 5.02 0.11 0.15 0.12 120.40 125.55 1xgy s VAL 181 Ca 0.13 -0.38 -0.01 0.00 -2.93 0.00 0.00 61.98 58.78 1xgy s VAL 181 Cb -0.10 -0.73 0.00 0.00 -1.53 0.00 0.00 36.38 34.02 1xgy s VAL 181 CO 0.04 0.25 -0.12 -0.89 -3.33 0.00 0.00 175.10 171.06 1xgy s THR 182 N 0.16 2.79 0.21 5.04 2.01 -1.23 -0.36 115.64 124.25 1xgy s THR 182 Ca -0.03 -0.70 0.05 0.00 0.31 0.00 0.00 61.69 61.32 1xgy s THR 182 Cb -0.08 -2.23 -0.05 0.00 0.01 0.00 0.00 72.50 70.15 1xgy s THR 182 CO 0.01 0.48 -0.06 0.68 -0.69 0.00 0.00 174.62 175.03 1xgy s VAL 183 N 1.30 1.27 0.52 3.82 -7.23 0.16 -4.81 120.40 115.43 1xgy s VAL 183 Ca 0.04 -2.08 -0.22 0.00 -1.81 0.00 0.00 61.98 57.91 1xgy s VAL 183 Cb -0.14 -2.15 -0.06 0.00 0.56 0.00 0.00 36.38 34.60 1xgy s VAL 183 CO -0.06 -0.50 1.24 -2.16 -0.31 0.00 0.00 175.10 173.31 1xgy s PRO 184 N -3.77 3.37 0.23 4.82 0.04 -1.26 0.21 135.00 138.63 1xgy s PRO 184 Ca 0.24 1.95 -0.06 0.00 0.04 0.00 0.00 61.00 63.17 1xgy s PRO 184 Cb 0.03 -2.25 0.21 0.00 0.04 0.00 0.00 34.50 32.53 1xgy s PRO 184 CO 0.06 -0.92 1.77 0.77 0.04 0.00 0.00 177.00 178.72 1xgy h SER 185 N 1.59 1.01 0.00 6.66 0.02 0.88 -1.87 113.55 121.85 1xgy h SER 185 Ca -0.50 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.27 1xgy h SER 185 Cb 1.28 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.55 1xgy h SER 185 CO 0.58 0.94 0.04 0.77 -1.14 0.00 0.00 176.83 178.03 1xgy h SER 186 N 1.05 0.00 -0.34 3.07 4.64 -1.92 -1.79 113.55 118.25 1xgy h SER 186 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1xgy h SER 186 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1xgy h SER 186 CO -0.01 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.30 1xgy n THR 187 N -2.33 1.90 -3.64 2.95 -2.24 -0.70 -4.63 114.28 105.58 1xgy n THR 187 Ca -0.02 -1.53 -0.03 0.00 -2.27 0.00 0.00 64.05 60.20 1xgy n THR 187 Cb 0.08 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.25 1xgy n THR 187 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1xgy s TRP 188 N -2.20 -0.53 -0.19 4.78 -0.00 -0.67 -2.32 118.94 117.81 1xgy s TRP 188 Ca 0.38 1.10 0.23 0.00 -0.00 0.00 0.00 56.10 57.81 1xgy s TRP 188 Cb 0.28 0.34 1.22 0.00 -0.00 0.00 0.00 33.47 35.31 1xgy s TRP 188 CO 0.13 -0.26 1.70 -1.35 -0.00 0.00 0.00 176.95 177.17 1xgy h PRO 189 N 5.66 0.00 0.00 5.86 0.11 -1.93 -3.44 132.00 138.25 1xgy h PRO 189 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1xgy h PRO 189 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1xgy h PRO 189 CO 0.18 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 178.40 1xgy n SER 190 N -2.30 0.00 -4.50 -2.05 7.64 -1.26 -4.10 113.62 107.05 1xgy n SER 190 Ca -0.01 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.61 1xgy n SER 190 Cb 0.06 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.16 1xgy n SER 190 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1xgy s GLU 191 N -3.64 1.81 0.12 1.43 2.02 -0.98 -5.05 118.70 114.40 1xgy s GLU 191 Ca 0.00 -1.46 -0.30 0.00 0.02 0.00 0.00 54.97 53.23 1xgy s GLU 191 Cb 0.00 -1.98 -0.06 0.00 0.10 0.00 0.00 34.13 32.19 1xgy s GLU 191 CO 0.00 0.40 1.13 0.95 0.02 0.00 0.00 175.26 177.75 1xgy s THR 192 N -1.85 4.03 -0.18 3.63 -4.23 -1.26 -4.42 115.64 111.36 1xgy s THR 192 Ca 0.24 1.60 -0.03 0.00 -1.18 0.00 0.00 61.69 62.32 1xgy s THR 192 Cb -0.08 -4.02 -0.02 0.00 1.34 0.00 0.00 72.50 69.73 1xgy s THR 192 CO 0.13 0.20 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.67 1xgy s VAL 193 N 0.36 3.45 -0.01 2.29 1.01 -1.26 -5.01 120.40 121.24 1xgy s VAL 193 Ca 0.53 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 62.05 1xgy s VAL 193 Cb -0.29 -2.53 -0.01 0.00 0.00 0.00 0.00 36.38 33.56 1xgy s VAL 193 CO 0.32 0.47 -0.11 -0.89 0.00 0.00 0.00 175.10 174.89 1xgy s THR 194 N 0.88 0.89 -0.16 3.92 2.01 -1.26 -1.32 115.64 120.60 1xgy s THR 194 Ca -0.01 -0.47 -0.05 0.00 0.31 0.00 0.00 61.69 61.46 1xgy s THR 194 Cb -0.15 -0.74 -0.03 0.00 0.01 0.00 0.00 72.50 71.59 1xgy s THR 194 CO 0.01 0.25 -0.00 0.00 -0.69 0.00 0.00 174.62 174.19 1xgy s ASN 196 N 0.25 5.93 -0.21 0.00 -0.87 0.30 -1.87 114.94 118.47 1xgy s ASN 196 Ca -0.00 -1.14 -0.09 0.00 -1.57 0.00 0.00 52.86 50.06 1xgy s ASN 196 Cb -0.13 -2.09 -0.04 0.00 -0.02 0.00 0.00 41.25 38.96 1xgy s ASN 196 CO 0.02 -0.50 0.10 -0.69 -2.57 0.00 0.00 177.10 173.46 1xgy s VAL 197 N 1.59 4.93 -0.04 1.60 1.01 -0.56 -1.87 120.40 127.05 1xgy s VAL 197 Ca 0.03 0.02 0.05 0.00 0.00 0.00 0.00 61.98 62.09 1xgy s VAL 197 Cb -0.21 -3.26 -0.01 0.00 0.00 0.00 0.00 36.38 32.90 1xgy s VAL 197 CO 0.07 0.40 -0.21 0.00 0.00 0.00 0.00 175.10 175.37 1xgy s ALA 198 N 0.78 1.79 -0.35 5.51 0.00 0.11 -1.42 121.76 128.18 1xgy s ALA 198 Ca 0.05 -0.85 -0.00 0.00 0.00 0.00 0.00 51.96 51.16 1xgy s ALA 198 Cb -0.13 -0.56 0.12 0.00 0.00 0.00 0.00 23.12 22.55 1xgy s ALA 198 CO 0.02 0.35 0.17 -1.58 0.00 0.00 0.00 175.76 174.72 1xgy s HIS 199 N -0.10 1.29 0.13 0.00 2.46 -0.62 -0.01 115.29 118.44 1xgy s HIS 199 Ca -0.02 -1.73 -0.32 0.00 0.47 0.00 0.00 55.06 53.45 1xgy s HIS 199 Cb -0.12 -1.42 -0.10 0.00 -0.13 0.00 0.00 32.58 30.81 1xgy s HIS 199 CO 0.02 -0.83 1.56 -1.00 -2.47 0.00 0.00 174.74 172.02 1xgy h PRO 200 N 7.54 -0.47 -0.88 2.88 0.13 -1.82 -2.07 132.00 137.31 1xgy h PRO 200 Ca -0.07 0.03 0.15 0.00 -0.87 0.00 0.00 66.00 65.24 1xgy h PRO 200 Cb 0.98 0.11 -0.15 0.00 0.13 0.00 0.00 31.00 32.07 1xgy h PRO 200 CO 0.42 -0.31 -0.31 0.00 -0.23 0.00 0.00 178.00 177.57 1xgy n ALA 201 N -3.03 -0.01 -0.26 -0.56 0.00 -1.26 0.11 120.51 115.50 1xgy n ALA 201 Ca -0.04 0.91 0.08 0.00 0.00 0.00 0.00 53.44 54.38 1xgy n ALA 201 Cb 0.36 -0.45 0.30 0.00 0.00 0.00 0.00 19.45 19.66 1xgy n ALA 201 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1xgy n SER 202 N -5.34 4.11 -1.70 0.00 3.41 -1.08 -4.93 113.62 108.08 1xgy n SER 202 Ca 0.11 -2.40 -0.07 0.00 -0.26 0.00 0.00 58.87 56.25 1xgy n SER 202 Cb 0.38 -0.54 -0.02 0.00 -0.26 0.00 0.00 64.21 63.78 1xgy n SER 202 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1xgy n SER 203 N 0.87 -2.04 -4.90 4.04 3.41 0.30 -4.91 113.62 110.39 1xgy n SER 203 Ca 0.22 0.23 -0.33 0.00 -0.26 0.00 0.00 58.87 58.72 1xgy n SER 203 Cb 0.78 -2.00 -0.05 0.00 -0.26 0.00 0.00 64.21 62.68 1xgy n SER 203 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1xgy s THR 204 N -1.86 5.35 -0.07 6.66 -4.23 -1.06 -4.98 115.64 115.44 1xgy s THR 204 Ca 0.00 -0.02 -0.03 0.00 -1.18 0.00 0.00 61.69 60.46 1xgy s THR 204 Cb 0.00 -3.57 0.04 0.00 1.34 0.00 0.00 72.50 70.31 1xgy s THR 204 CO 0.00 0.30 0.13 -0.75 -0.54 0.00 0.00 174.62 173.76 1xgy s LYS 205 N -1.99 0.01 0.12 3.99 2.47 -1.26 -1.58 119.74 121.49 1xgy s LYS 205 Ca 0.29 0.50 0.10 0.00 -1.56 0.00 0.00 55.97 55.30 1xgy s LYS 205 Cb -0.13 -0.32 -0.04 0.00 -1.46 0.00 0.00 37.83 35.88 1xgy s LYS 205 CO 0.19 -0.30 -0.24 0.08 0.16 0.00 0.00 175.35 175.24 1xgy s VAL 206 N 2.16 2.00 -0.25 4.02 1.01 -0.51 -5.00 120.40 123.83 1xgy s VAL 206 Ca 0.02 -1.65 0.01 0.00 0.00 0.00 0.00 61.98 60.36 1xgy s VAL 206 Cb -0.12 -1.79 0.07 0.00 0.00 0.00 0.00 36.38 34.54 1xgy s VAL 206 CO -0.05 0.02 -0.03 -1.81 0.00 0.00 0.00 175.10 173.24 1xgy s ASP 207 N -1.98 3.98 -0.21 3.32 1.01 -1.26 -1.50 116.67 120.03 1xgy s ASP 207 Ca 0.10 -1.34 -0.12 0.00 0.71 0.00 0.00 52.55 51.90 1xgy s ASP 207 Cb -0.10 -1.20 -0.05 0.00 1.01 0.00 0.00 42.92 42.58 1xgy s ASP 207 CO 0.05 -0.27 0.23 -0.54 0.21 0.00 0.00 175.17 174.85 1xgy s LYS 208 N 1.36 4.14 -0.29 8.23 -0.14 -0.78 -4.94 119.74 127.32 1xgy s LYS 208 Ca -0.02 -0.10 -0.19 0.00 -1.36 0.00 0.00 55.97 54.30 1xgy s LYS 208 Cb -0.19 -3.50 -0.02 0.00 -1.68 0.00 0.00 37.83 32.45 1xgy s LYS 208 CO -0.08 0.11 0.57 0.21 -0.76 0.00 0.00 175.35 175.39 1xgy s LYS 209 N 0.90 3.96 -0.56 1.68 2.20 -1.26 -1.87 119.74 124.78 1xgy s LYS 209 Ca 0.12 0.28 -0.27 0.00 -0.36 0.00 0.00 55.97 55.73 1xgy s LYS 209 Cb -0.13 -3.70 -0.01 0.00 -1.51 0.00 0.00 37.83 32.48 1xgy s LYS 209 CO 0.04 -0.47 1.73 0.42 -0.36 0.00 0.00 175.35 176.70 1xgy s ILE 210 N 2.45 3.49 0.13 5.43 1.09 -0.43 -4.97 121.20 128.39 1xgy s ILE 210 Ca 0.23 0.36 -0.14 0.00 -1.10 0.00 0.00 60.65 60.00 1xgy s ILE 210 Cb -0.15 -4.04 -0.07 0.00 -1.06 0.00 0.00 42.46 37.13 1xgy s ILE 210 CO 0.11 -0.93 0.53 -0.69 -0.10 0.00 0.00 174.94 173.86 1xgy s VAL 211 N 7.89 4.88 0.19 2.92 1.01 -1.26 -4.65 120.40 131.38 1xgy s VAL 211 Ca 0.65 0.81 -0.32 0.00 0.00 0.00 0.00 61.98 63.12 1xgy s VAL 211 Cb -0.14 -3.73 -0.11 0.00 0.00 0.00 0.00 36.38 32.40 1xgy s VAL 211 CO 0.24 0.27 1.66 -2.84 0.00 0.00 0.00 175.10 174.42 1xgy s PRO 212 N -1.90 4.16 0.15 2.72 0.02 -1.26 -4.73 135.00 134.15 1xgy s PRO 212 Ca 0.37 2.51 -0.31 0.00 0.02 0.00 0.00 61.00 63.58 1xgy s PRO 212 Cb -0.15 -3.11 -0.11 0.00 0.02 0.00 0.00 34.50 31.15 1xgy s PRO 212 CO 0.19 -0.69 1.81 0.50 -0.33 0.00 0.00 177.00 178.48 1xgy s ARG 213 N 1.13 4.13 0.00 5.54 3.52 -1.26 -5.12 118.95 126.89 1xgy s ARG 213 Ca 0.73 2.61 0.00 0.00 -0.13 0.00 0.00 55.73 58.94 1xgy s ARG 213 Cb -0.47 -3.47 0.00 0.00 -1.56 0.00 0.00 34.95 29.45 1xgy s ARG 213 CO 0.32 -0.83 0.00 -3.47 -0.81 0.00 0.00 175.30 170.51