#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hgg n ASP 2 N 0.00 0.00 0.00 1.69 2.03 -1.26 -5.13 116.55 113.88 1hgg n ASP 2 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1hgg n ASP 2 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1hgg n ASP 2 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1hgg n LEU 3 N 0.00 0.00 -4.57 -2.67 -0.00 -1.26 -4.94 117.00 103.56 1hgg n LEU 3 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 56.01 55.82 1hgg n LEU 3 Cb 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 43.33 1hgg n LEU 3 CO 0.00 0.00 1.23 -2.16 -0.00 0.00 0.00 177.39 176.46 1hgg s PRO 4 N 4.98 1.68 -0.69 1.47 0.04 -1.26 -4.87 135.00 136.35 1hgg s PRO 4 Ca 0.00 -0.43 -0.26 0.00 0.04 0.00 0.00 61.00 60.36 1hgg s PRO 4 Cb 0.00 -5.01 -0.06 0.00 0.04 0.00 0.00 34.50 29.46 1hgg s PRO 4 CO 0.00 -4.78 2.13 0.20 0.04 0.00 0.00 177.00 174.59 1hgg s GLY 5 N 8.43 -0.18 0.00 0.56 0.00 -1.26 -4.80 107.32 110.08 1hgg s GLY 5 Ca 0.79 -0.71 0.18 0.00 0.00 0.00 0.00 44.72 44.98 1hgg s GLY 5 CO 0.13 3.78 0.79 1.16 0.00 0.00 0.00 173.10 178.97 1hgg n ASN 6 N 15.04 0.95 -4.57 1.64 0.23 -1.26 -4.90 115.26 122.40 1hgg n ASN 6 Ca 0.34 -0.98 -0.32 0.00 -0.53 0.00 0.00 54.58 53.09 1hgg n ASN 6 Cb 0.50 0.95 -0.04 0.00 -2.08 0.00 0.00 39.78 39.10 1hgg n ASN 6 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1hgg s ASP 7 N -2.66 5.64 -0.81 0.53 2.15 -1.26 -4.83 116.67 115.43 1hgg s ASP 7 Ca 0.08 -1.28 -0.10 0.00 0.43 0.00 0.00 52.55 51.67 1hgg s ASP 7 Cb 0.14 -2.57 -0.08 0.00 -0.30 0.00 0.00 42.92 40.11 1hgg s ASP 7 CO 0.72 -2.34 1.99 -3.20 -0.17 0.00 0.00 175.17 172.16 1hgg n ASN 8 N 12.20 3.92 -4.90 -0.34 5.15 -1.26 -4.88 115.26 125.15 1hgg n ASN 8 Ca 0.40 -2.41 -0.27 0.00 -0.60 0.00 0.00 54.58 51.71 1hgg n ASN 8 Cb 0.48 -1.06 -0.01 0.00 -0.53 0.00 0.00 39.78 38.66 1hgg n ASN 8 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1hgg s SER 9 N 3.99 4.57 0.34 1.20 1.04 -1.26 -5.15 113.70 118.43 1hgg s SER 9 Ca 0.42 -1.32 0.03 0.00 0.48 0.00 0.00 55.95 55.57 1hgg s SER 9 Cb 0.11 0.53 -0.04 0.00 0.10 0.00 0.00 66.02 66.71 1hgg s SER 9 CO 0.01 -1.14 0.11 0.42 0.98 0.00 0.00 173.24 173.62 1hgg s THR 10 N -2.81 0.74 0.15 2.02 -4.23 -1.26 -5.18 115.64 105.07 1hgg s THR 10 Ca 0.30 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.81 1hgg s THR 10 Cb -0.02 -2.56 -0.04 0.00 1.34 0.00 0.00 72.50 71.21 1hgg s THR 10 CO 0.19 0.00 0.04 0.00 -0.54 0.00 0.00 174.62 174.31 1hgg s ALA 11 N -3.39 1.06 -0.03 3.99 0.00 -1.26 -5.16 121.76 116.97 1hgg s ALA 11 Ca 0.32 -1.53 0.04 0.00 0.00 0.00 0.00 51.96 50.79 1hgg s ALA 11 Cb 0.06 0.76 -0.00 0.00 0.00 0.00 0.00 23.12 23.93 1hgg s ALA 11 CO 0.15 -0.43 -0.15 0.99 0.00 0.00 0.00 175.76 176.32 1hgg s THR 12 N -3.90 1.26 -0.09 0.00 2.01 -1.26 -5.12 115.64 108.54 1hgg s THR 12 Ca 0.24 -0.63 0.02 0.00 0.31 0.00 0.00 61.69 61.63 1hgg s THR 12 Cb 0.07 -1.09 0.01 0.00 0.01 0.00 0.00 72.50 71.50 1hgg s THR 12 CO 0.03 0.37 -0.15 -0.22 -0.69 0.00 0.00 174.62 173.95 1hgg s LEU 13 N 0.01 1.75 -0.05 4.42 2.96 -1.26 -5.13 118.68 121.37 1hgg s LEU 13 Ca -0.02 -0.40 0.06 0.00 -0.22 0.00 0.00 54.13 53.55 1hgg s LEU 13 Cb -0.10 -1.04 -0.01 0.00 0.50 0.00 0.00 46.19 45.53 1hgg s LEU 13 CO 0.01 0.04 -0.25 0.00 -1.32 0.00 0.00 176.35 174.84 1hgg s LEU 15 N -0.22 4.28 0.00 0.00 1.02 -1.26 -5.09 118.68 117.42 1hgg s LEU 15 Ca -0.02 0.46 -0.09 0.00 0.02 0.00 0.00 54.13 54.50 1hgg s LEU 15 Cb -0.13 -3.19 0.04 0.00 0.02 0.00 0.00 46.19 42.93 1hgg s LEU 15 CO 0.03 0.06 0.51 0.61 0.02 0.00 0.00 176.35 177.58 1hgg n GLY 16 N -0.05 1.38 3.17 -3.19 0.00 -1.26 -5.18 105.19 100.07 1hgg n GLY 16 Ca -0.04 -1.19 -0.11 0.00 0.00 0.00 0.00 46.02 44.69 1hgg n GLY 16 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1hgg s HIS 17 N -4.53 0.92 1.13 1.61 -3.43 -1.26 -5.16 115.29 104.57 1hgg s HIS 17 Ca 0.11 -0.97 -0.16 0.00 -0.80 0.00 0.00 55.06 53.23 1hgg s HIS 17 Cb -0.03 -0.54 0.25 0.00 -1.43 0.00 0.00 32.58 30.84 1hgg s HIS 17 CO 0.08 -0.21 1.10 -3.38 -2.00 0.00 0.00 174.74 170.33 1hgg s HIS 18 N -3.69 1.12 -0.03 0.38 -3.43 -1.26 -5.09 115.29 103.30 1hgg s HIS 18 Ca 0.15 0.70 -0.26 0.00 -0.80 0.00 0.00 55.06 54.85 1hgg s HIS 18 Cb 0.06 -3.36 0.06 0.00 -1.43 0.00 0.00 32.58 27.90 1hgg s HIS 18 CO -0.03 -3.53 0.56 0.00 -2.00 0.00 0.00 174.74 169.74 1hgg s ALA 19 N -2.97 -1.45 0.16 -1.38 0.00 -1.26 -4.75 121.76 110.11 1hgg s ALA 19 Ca 0.69 0.96 0.10 0.00 0.00 0.00 0.00 51.96 53.70 1hgg s ALA 19 Cb -0.14 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 1hgg s ALA 19 CO 0.57 -0.36 -0.17 0.14 0.00 0.00 0.00 175.76 175.94 1hgg s VAL 20 N -1.39 2.82 0.12 0.00 -7.23 -1.26 -5.01 120.40 108.45 1hgg s VAL 20 Ca -0.11 -1.70 -0.15 0.00 -1.81 0.00 0.00 61.98 58.22 1hgg s VAL 20 Cb -0.02 -2.34 -0.04 0.00 0.56 0.00 0.00 36.38 34.54 1hgg s VAL 20 CO 0.07 -0.03 1.52 1.55 -0.31 0.00 0.00 175.10 177.91 1hgg h PRO 21 N 3.32 0.72 0.00 4.82 0.13 -1.94 -3.40 132.00 135.66 1hgg h PRO 21 Ca -0.48 -0.27 0.00 0.00 -0.87 0.00 0.00 66.00 64.38 1hgg h PRO 21 Cb 1.19 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1hgg h PRO 21 CO 0.49 0.87 0.00 0.27 -0.23 0.00 0.00 178.00 179.40 1hgg n ASN 22 N -4.38 0.00 0.00 1.44 6.94 -1.26 -4.77 115.26 113.23 1hgg n ASN 22 Ca -0.02 0.10 0.00 0.00 -0.02 0.00 0.00 54.58 54.64 1hgg n ASN 22 Cb 0.35 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.77 1hgg n ASN 22 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1hgg n GLY 23 N 1.88 -1.76 2.95 4.83 0.00 -1.26 -5.03 105.19 106.80 1hgg n GLY 23 Ca 0.00 -1.53 -0.12 0.00 0.00 0.00 0.00 46.02 44.37 1hgg n GLY 23 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hgg s THR 24 N -2.82 0.01 0.08 2.61 2.01 0.12 -4.93 115.64 112.72 1hgg s THR 24 Ca 0.00 -0.07 -0.24 0.00 0.31 0.00 0.00 61.69 61.69 1hgg s THR 24 Cb 0.00 -0.12 -0.06 0.00 0.01 0.00 0.00 72.50 72.33 1hgg s THR 24 CO 0.00 -0.04 0.72 -0.76 -0.69 0.00 0.00 174.62 173.85 1hgg s LEU 25 N -0.09 4.50 0.20 4.42 1.43 -1.26 -0.42 118.68 127.47 1hgg s LEU 25 Ca -0.01 1.45 0.04 0.00 -1.03 0.00 0.00 54.13 54.58 1hgg s LEU 25 Cb -0.01 -3.16 -0.05 0.00 0.03 0.00 0.00 46.19 43.00 1hgg s LEU 25 CO 0.00 0.13 -0.05 0.68 0.23 0.00 0.00 176.35 177.33 1hgg s VAL 26 N -0.58 1.17 0.39 -1.59 -7.23 0.67 -4.87 120.40 108.35 1hgg s VAL 26 Ca 0.35 -2.06 -0.04 0.00 -1.81 0.00 0.00 61.98 58.42 1hgg s VAL 26 Cb -0.21 -2.13 -0.04 0.00 0.56 0.00 0.00 36.38 34.56 1hgg s VAL 26 CO 0.23 -0.51 0.66 -0.54 -0.31 0.00 0.00 175.10 174.63 1hgg s LYS 27 N -3.80 3.58 0.30 4.82 1.02 -1.25 -1.21 119.74 123.20 1hgg s LYS 27 Ca 0.23 0.04 0.03 0.00 0.02 0.00 0.00 55.97 56.29 1hgg s LYS 27 Cb 0.04 -2.52 -0.02 0.00 -0.52 0.00 0.00 37.83 34.80 1hgg s LYS 27 CO 0.05 0.01 0.30 0.99 -0.92 0.00 0.00 175.35 175.78 1hgg s THR 28 N -2.42 0.00 0.08 2.17 2.01 0.12 -4.94 115.64 112.66 1hgg s THR 28 Ca 0.45 -1.89 -0.18 0.00 0.31 0.00 0.00 61.69 60.39 1hgg s THR 28 Cb -0.10 -2.52 -0.10 0.00 0.01 0.00 0.00 72.50 69.79 1hgg s THR 28 CO 0.37 0.00 1.44 0.40 -0.69 0.00 0.00 174.62 176.14 1hgg h ILE 29 N 2.25 1.30 0.00 1.82 1.08 -2.02 -3.36 117.51 118.58 1hgg h ILE 29 Ca -0.28 -1.22 0.00 0.00 -0.39 0.00 0.00 64.86 62.97 1hgg h ILE 29 Cb 1.24 1.57 0.00 0.00 -3.07 0.00 0.00 36.82 36.56 1hgg h ILE 29 CO 0.41 0.38 -1.30 0.35 -0.69 0.00 0.00 178.15 177.29 1hgg n THR 30 N -4.48 0.07 -4.09 -0.27 -2.24 -1.26 -4.97 114.28 97.04 1hgg n THR 30 Ca -0.04 -0.24 -0.08 0.00 -2.27 0.00 0.00 64.05 61.42 1hgg n THR 30 Cb 0.35 0.41 -0.10 0.00 -2.10 0.00 0.00 70.33 68.89 1hgg n THR 30 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1hgg s ASP 31 N -3.80 0.55 0.00 3.42 1.11 -1.26 -5.07 116.67 111.62 1hgg s ASP 31 Ca 0.02 -0.93 0.03 0.00 0.18 0.00 0.00 52.55 51.85 1hgg s ASP 31 Cb 0.15 0.17 0.01 0.00 1.07 0.00 0.00 42.92 44.32 1hgg s ASP 31 CO 0.86 -0.54 0.50 -0.90 1.18 0.00 0.00 175.17 176.27 1hgg n ASP 32 N 0.30 1.02 -3.64 0.27 5.75 -1.26 0.15 116.55 119.15 1hgg n ASP 32 Ca -0.15 -1.01 -0.28 0.00 -0.01 0.00 0.00 54.79 53.33 1hgg n ASP 32 Cb 0.60 0.20 -0.16 0.00 -1.03 0.00 0.00 41.12 40.73 1hgg n ASP 32 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1hgg s GLN 33 N -0.45 0.40 -0.00 0.11 -0.21 -1.24 -3.91 119.66 114.35 1hgg s GLN 33 Ca 0.03 -0.56 0.07 0.00 0.02 0.00 0.00 55.36 54.92 1hgg s GLN 33 Cb 0.02 -1.69 -0.02 0.00 1.00 0.00 0.00 33.01 32.33 1hgg s GLN 33 CO 0.05 -0.87 -0.22 -1.50 -2.12 0.00 0.00 175.29 170.63 1hgg s ILE 34 N 1.94 1.75 -0.12 1.08 1.10 -0.35 -4.88 121.20 121.73 1hgg s ILE 34 Ca 0.06 -1.02 -0.15 0.00 -0.51 0.00 0.00 60.65 59.03 1hgg s ILE 34 Cb -0.17 -1.47 -0.05 0.00 0.15 0.00 0.00 42.46 40.93 1hgg s ILE 34 CO -0.23 0.43 0.36 -0.70 -2.11 0.00 0.00 174.94 172.70 1hgg s GLU 35 N -0.68 4.19 0.27 3.50 2.12 -1.26 -0.24 118.70 126.60 1hgg s GLU 35 Ca 0.09 0.24 0.10 0.00 0.36 0.00 0.00 54.97 55.76 1hgg s GLU 35 Cb -0.09 -3.38 -0.05 0.00 0.26 0.00 0.00 34.13 30.87 1hgg s GLU 35 CO -0.00 0.32 -0.16 0.14 -0.54 0.00 0.00 175.26 175.02 1hgg s VAL 36 N 0.18 2.20 0.32 3.70 -7.23 0.44 -1.72 120.40 118.30 1hgg s VAL 36 Ca 0.20 -2.31 0.09 0.00 -1.81 0.00 0.00 61.98 58.15 1hgg s VAL 36 Cb -0.14 -2.31 0.32 0.00 0.56 0.00 0.00 36.38 34.81 1hgg s VAL 36 CO 0.07 -0.41 1.76 0.74 -0.31 0.00 0.00 175.10 176.96 1hgg h THR 37 N 2.30 0.62 -1.83 5.32 2.02 -1.27 0.36 112.91 120.44 1hgg h THR 37 Ca -0.40 -0.22 0.05 0.00 0.77 0.00 0.00 66.41 66.61 1hgg h THR 37 Cb 1.25 -0.08 -0.20 0.00 -1.74 0.00 0.00 68.15 67.37 1hgg h THR 37 CO 0.63 0.12 0.45 0.21 0.37 0.00 0.00 175.52 177.30 1hgg s ASN 38 N -5.33 -0.43 0.26 4.18 2.47 -1.26 -4.42 114.94 110.40 1hgg s ASN 38 Ca -0.11 0.38 -0.05 0.00 0.42 0.00 0.00 52.86 53.51 1hgg s ASN 38 Cb 0.26 0.37 -0.02 0.00 -1.45 0.00 0.00 41.25 40.42 1hgg s ASN 38 CO 0.80 -0.47 0.34 0.00 -3.72 0.00 0.00 177.10 174.06 1hgg s ALA 39 N -1.58 0.66 0.02 1.71 0.00 -1.26 -1.02 121.76 120.29 1hgg s ALA 39 Ca -0.02 -1.41 0.01 0.00 0.00 0.00 0.00 51.96 50.54 1hgg s ALA 39 Cb -0.00 1.23 -0.02 0.00 0.00 0.00 0.00 23.12 24.33 1hgg s ALA 39 CO 0.01 -0.73 -0.05 -0.08 0.00 0.00 0.00 175.76 174.91 1hgg s THR 40 N -3.78 0.31 -0.04 0.00 -1.32 0.37 -4.77 115.64 106.41 1hgg s THR 40 Ca 0.32 -0.78 -0.22 0.00 -1.21 0.00 0.00 61.69 59.80 1hgg s THR 40 Cb 0.02 -0.38 -0.05 0.00 -1.51 0.00 0.00 72.50 70.58 1hgg s THR 40 CO 0.14 -0.31 0.63 -0.70 -2.21 0.00 0.00 174.62 172.17 1hgg s GLU 41 N -1.16 4.38 0.00 7.08 2.56 -1.26 -0.26 118.70 130.04 1hgg s GLU 41 Ca -0.09 0.78 0.15 0.00 0.00 0.00 0.00 54.97 55.80 1hgg s GLU 41 Cb -0.08 -3.39 -0.03 0.00 2.00 0.00 0.00 34.13 32.63 1hgg s GLU 41 CO -0.00 0.23 0.77 1.28 -0.56 0.00 0.00 175.26 176.97 1hgg n LEU 42 N 3.22 1.37 -4.35 2.70 4.77 0.01 -4.89 117.00 119.84 1hgg n LEU 42 Ca -0.04 -0.72 -0.38 0.00 -0.03 0.00 0.00 56.01 54.84 1hgg n LEU 42 Cb 0.51 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.48 1hgg n LEU 42 CO 0.45 0.27 -0.26 -0.69 -1.33 0.00 0.00 177.39 175.83 1hgg s VAL 43 N -1.87 4.03 -0.15 4.08 1.01 -1.26 -1.92 120.40 124.32 1hgg s VAL 43 Ca 0.11 -0.71 -0.29 0.00 0.00 0.00 0.00 61.98 61.09 1hgg s VAL 43 Cb 0.12 -3.10 -0.01 0.00 0.00 0.00 0.00 36.38 33.38 1hgg s VAL 43 CO 0.40 0.05 1.21 -1.58 0.00 0.00 0.00 175.10 175.18 1hgg s GLN 44 N 1.50 4.27 -0.11 2.72 2.00 0.32 -4.86 119.66 125.50 1hgg s GLN 44 Ca 0.02 1.61 0.15 0.00 -2.00 0.00 0.00 55.36 55.14 1hgg s GLN 44 Cb -0.17 -3.70 0.32 0.00 0.80 0.00 0.00 33.01 30.26 1hgg s GLN 44 CO 0.03 -0.63 1.16 -1.13 -0.50 0.00 0.00 175.29 174.22 1hgg n SER 45 N 6.22 1.44 -3.64 6.67 3.41 -1.26 -0.94 113.62 125.52 1hgg n SER 45 Ca 0.13 -2.96 -0.10 0.00 -0.26 0.00 0.00 58.87 55.67 1hgg n SER 45 Cb 0.45 -0.40 -0.07 0.00 -0.26 0.00 0.00 64.21 63.93 1hgg n SER 45 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1hgg s SER 46 N -2.51 -0.85 0.31 4.04 1.04 -1.26 -4.77 113.70 109.70 1hgg s SER 46 Ca 0.29 1.47 0.03 0.00 0.48 0.00 0.00 55.95 58.23 1hgg s SER 46 Cb 0.29 1.42 -0.02 0.00 0.10 0.00 0.00 66.02 67.80 1hgg s SER 46 CO -0.06 -0.24 0.47 -0.55 0.98 0.00 0.00 173.24 173.84 1hgg s SER 47 N 1.04 6.19 0.51 7.02 0.15 -1.26 -4.81 113.70 122.53 1hgg s SER 47 Ca -0.05 0.16 0.30 0.00 0.70 0.00 0.00 55.95 57.05 1hgg s SER 47 Cb -0.05 -1.75 1.02 0.00 -1.71 0.00 0.00 66.02 63.53 1hgg s SER 47 CO -0.10 -0.28 1.86 0.71 1.20 0.00 0.00 173.24 176.63 1hgg h THR 48 N 0.90 0.02 0.00 6.45 1.35 -1.71 -3.47 112.91 116.46 1hgg h THR 48 Ca -0.49 -0.70 0.00 0.00 -0.55 0.00 0.00 66.41 64.67 1hgg h THR 48 Cb 1.23 1.68 0.00 0.00 -1.73 0.00 0.00 68.15 69.33 1hgg h THR 48 CO 0.59 0.01 0.00 0.61 -0.25 0.00 0.00 175.52 176.48 1hgg n GLY 49 N 0.38 0.77 3.00 5.82 0.00 -1.23 -4.99 105.19 108.95 1hgg n GLY 49 Ca 0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.89 1hgg n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hgg s LYS 50 N -0.35 0.45 -0.35 1.61 1.02 -1.26 -4.18 119.74 116.67 1hgg s LYS 50 Ca 0.00 -0.41 -0.21 0.00 0.02 0.00 0.00 55.97 55.37 1hgg s LYS 50 Cb 0.00 -0.34 0.00 0.00 -0.52 0.00 0.00 37.83 36.98 1hgg s LYS 50 CO 0.00 0.08 0.65 0.42 -0.92 0.00 0.00 175.35 175.58 1hgg s ILE 51 N -0.64 4.87 0.20 2.17 1.01 0.72 -0.81 121.20 128.71 1hgg s ILE 51 Ca -0.03 0.64 -0.30 0.00 0.00 0.00 0.00 60.65 60.96 1hgg s ILE 51 Cb -0.05 -4.09 -0.09 0.00 0.01 0.00 0.00 42.46 38.24 1hgg s ILE 51 CO 0.00 -0.32 1.31 0.00 0.00 0.00 0.00 174.94 175.93 1hgg n ASN 53 N 2.64 3.00 -3.63 0.00 0.23 0.62 -4.78 115.26 113.34 1hgg n ASN 53 Ca 0.06 -2.45 -0.15 0.00 -0.53 0.00 0.00 54.58 51.52 1hgg n ASN 53 Cb 0.43 -0.59 -0.07 0.00 -2.08 0.00 0.00 39.78 37.46 1hgg n ASN 53 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 1hgg s ASN 54 N 0.07 -0.67 0.00 0.53 3.84 -1.16 -4.59 114.94 112.95 1hgg s ASN 54 Ca 0.18 1.19 0.30 0.00 0.21 0.00 0.00 52.86 54.74 1hgg s ASN 54 Cb 0.15 1.18 1.44 0.00 -0.55 0.00 0.00 41.25 43.47 1hgg s ASN 54 CO 0.04 -0.30 1.99 -0.81 -2.79 0.00 0.00 177.10 175.23 1hgg n PRO 55 N 2.37 0.75 -2.84 0.43 -0.04 -1.26 -0.38 135.00 134.03 1hgg n PRO 55 Ca -0.15 -0.17 -0.24 0.00 -0.04 0.00 0.00 63.50 62.90 1hgg n PRO 55 Cb 0.56 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.53 1hgg n PRO 55 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1hgg s HIS 56 N -2.37 3.30 -0.67 0.54 3.76 -1.26 -5.01 115.29 113.59 1hgg s HIS 56 Ca 0.34 0.41 -0.24 0.00 -0.15 0.00 0.00 55.06 55.42 1hgg s HIS 56 Cb 0.21 -2.37 0.06 0.00 1.11 0.00 0.00 32.58 31.59 1hgg s HIS 56 CO 0.44 -0.41 1.03 0.50 -0.85 0.00 0.00 174.74 175.45 1hgg s ARG 57 N -4.66 3.14 -0.13 1.40 3.52 -1.26 -4.87 118.95 116.09 1hgg s ARG 57 Ca 0.49 -0.68 -0.20 0.00 -0.13 0.00 0.00 55.73 55.21 1hgg s ARG 57 Cb -0.10 -4.21 -0.04 0.00 -1.56 0.00 0.00 34.95 29.04 1hgg s ARG 57 CO 0.40 -1.87 0.56 0.42 -0.81 0.00 0.00 175.30 174.01 1hgg s ILE 58 N 4.40 5.12 -0.30 4.11 -1.09 -1.26 -0.79 121.20 131.39 1hgg s ILE 58 Ca 0.25 1.11 -0.06 0.00 -2.23 0.00 0.00 60.65 59.72 1hgg s ILE 58 Cb -0.15 -3.89 0.01 0.00 -1.58 0.00 0.00 42.46 36.85 1hgg s ILE 58 CO 0.12 0.25 0.07 -0.22 -1.23 0.00 0.00 174.94 173.93 1hgg s LEU 59 N 1.02 3.83 -0.13 2.97 2.96 -0.34 -4.97 118.68 124.03 1hgg s LEU 59 Ca 0.29 -0.77 -0.28 0.00 -0.22 0.00 0.00 54.13 53.15 1hgg s LEU 59 Cb -0.16 -1.86 -0.01 0.00 0.50 0.00 0.00 46.19 44.66 1hgg s LEU 59 CO 0.12 -0.20 0.92 -0.62 -1.32 0.00 0.00 176.35 175.25 1hgg s ASP 60 N 1.47 7.12 0.00 3.68 -1.08 -1.26 -1.24 116.67 125.36 1hgg s ASP 60 Ca 0.02 1.37 0.24 0.00 -0.52 0.00 0.00 52.55 53.66 1hgg s ASP 60 Cb -0.17 -2.51 1.09 0.00 -1.46 0.00 0.00 42.92 39.87 1hgg s ASP 60 CO 0.02 -0.41 1.78 0.61 0.52 0.00 0.00 175.17 177.69 1hgg n GLY 61 N 3.23 -1.25 7.00 2.66 0.00 -0.53 -4.93 105.19 111.37 1hgg n GLY 61 Ca 0.06 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1hgg n GLY 61 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1hgg n ILE 62 N -1.43 0.00 -1.26 -0.61 2.08 -1.26 -1.18 119.36 115.69 1hgg n ILE 62 Ca 0.08 0.00 -0.15 0.00 0.56 0.00 0.00 62.75 63.23 1hgg n ILE 62 Cb 0.25 0.00 0.20 0.00 -0.75 0.00 0.00 39.64 39.35 1hgg n ILE 62 CO 0.00 0.00 0.00 -0.90 0.56 0.00 0.00 176.55 176.21 1hgg n ASP 63 N 4.11 3.55 -4.45 4.38 5.68 -1.26 -4.26 116.55 124.30 1hgg n ASP 63 Ca 0.00 -3.59 -0.33 0.00 -0.50 0.00 0.00 54.79 50.37 1hgg n ASP 63 Cb 0.00 -0.76 -0.13 0.00 -1.14 0.00 0.00 41.12 39.08 1hgg n ASP 63 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1hgg s THR 65 N -0.50 3.37 0.19 0.00 -4.23 -1.26 -4.66 115.64 108.55 1hgg s THR 65 Ca 0.06 0.04 -0.11 0.00 -1.18 0.00 0.00 61.69 60.51 1hgg s THR 65 Cb -0.12 -3.37 0.11 0.00 1.34 0.00 0.00 72.50 70.46 1hgg s THR 65 CO 0.02 -0.41 1.78 0.25 -0.54 0.00 0.00 174.62 175.72 1hgg h LEU 66 N -0.35 0.87 -0.77 4.79 5.85 -1.96 -1.75 115.31 122.00 1hgg h LEU 66 Ca -0.45 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.14 1hgg h LEU 66 Cb 1.27 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 42.03 1hgg h LEU 66 CO 0.61 0.76 0.50 0.40 -0.34 0.00 0.00 178.44 180.37 1hgg h ILE 67 N 0.93 1.20 -0.57 4.05 1.08 -1.95 0.57 117.51 122.81 1hgg h ILE 67 Ca 0.23 -0.39 -0.05 0.00 -0.39 0.00 0.00 64.86 64.26 1hgg h ILE 67 Cb 0.11 0.08 -0.03 0.00 -3.07 0.00 0.00 36.82 33.92 1hgg h ILE 67 CO -0.03 0.20 0.17 0.44 -0.69 0.00 0.00 178.15 178.24 1hgg h ASP 68 N 1.05 0.80 -0.77 1.72 3.32 -1.91 0.91 116.42 121.54 1hgg h ASP 68 Ca 0.28 -0.13 -0.04 0.00 0.02 0.00 0.00 57.03 57.16 1hgg h ASP 68 Cb -0.10 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.21 1hgg h ASP 68 CO -0.06 0.77 0.33 0.00 -1.72 0.00 0.00 179.24 178.55 1hgg h ALA 69 N 1.34 1.10 0.34 3.45 0.00 -0.33 0.63 119.26 125.80 1hgg h ALA 69 Ca 0.19 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1hgg h ALA 69 Cb 0.26 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1hgg h ALA 69 CO -0.01 0.65 -0.16 1.25 0.00 0.00 0.00 179.25 180.98 1hgg h LEU 70 N 1.13 -0.38 -1.15 0.00 5.85 -0.01 -3.15 115.31 117.60 1hgg h LEU 70 Ca 0.26 -0.13 -0.06 0.00 0.84 0.00 0.00 57.88 58.80 1hgg h LEU 70 Cb 0.19 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 1hgg h LEU 70 CO -0.02 -0.07 -0.03 -0.07 -0.34 0.00 0.00 178.44 177.90 1hgg h LEU 71 N -0.71 0.52 -0.22 2.25 3.38 -0.75 -3.44 115.31 116.34 1hgg h LEU 71 Ca -0.05 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.81 1hgg h LEU 71 Cb 0.49 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1hgg h LEU 71 CO 0.08 0.62 0.00 0.61 0.09 0.00 0.00 178.44 179.84 1hgg n GLY 72 N -0.78 0.86 3.63 0.83 0.00 0.17 -2.06 105.19 107.84 1hgg n GLY 72 Ca 0.01 -0.11 -0.48 0.00 0.00 0.00 0.00 46.02 45.44 1hgg n GLY 72 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1hgg n ASP 73 N 0.14 2.36 -0.34 1.61 -0.08 -0.93 -0.99 116.55 118.32 1hgg n ASP 73 Ca 0.00 1.11 0.05 0.00 -1.51 0.00 0.00 54.79 54.44 1hgg n ASP 73 Cb 0.09 -1.33 0.13 0.00 2.34 0.00 0.00 41.12 42.35 1hgg n ASP 73 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1hgg n PRO 74 N 2.71 -0.09 0.00 -0.67 -0.02 -1.26 0.01 135.00 135.67 1hgg n PRO 74 Ca 0.16 1.49 0.08 0.00 -2.02 0.00 0.00 63.50 63.21 1hgg n PRO 74 Cb 0.26 -2.22 0.37 0.00 -0.02 0.00 0.00 33.50 31.89 1hgg n PRO 74 CO 0.00 0.00 0.00 -2.39 1.98 0.00 0.00 175.50 175.09 1hgg n HIS 75 N -5.54 0.00 -0.55 6.00 1.44 -1.26 -1.10 115.22 114.21 1hgg n HIS 75 Ca 0.15 0.00 0.09 0.00 -2.01 0.00 0.00 57.72 55.95 1hgg n HIS 75 Cb 0.47 -0.47 0.29 0.00 0.12 0.00 0.00 29.99 30.40 1hgg n HIS 75 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1hgg h ASP 77 N 3.27 0.00 -0.96 0.00 3.32 -1.07 -1.38 116.42 119.60 1hgg h ASP 77 Ca 0.00 0.00 0.15 0.00 0.02 0.00 0.00 57.03 57.20 1hgg h ASP 77 Cb 1.24 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.70 1hgg h ASP 77 CO 0.15 0.00 0.61 0.58 -1.72 0.00 0.00 179.24 178.86 1hgg h VAL 78 N 0.00 0.84 -0.06 -1.35 2.07 -1.83 -3.01 116.25 112.91 1hgg h VAL 78 Ca 0.00 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.24 1hgg h VAL 78 Cb 0.08 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 29.81 1hgg h VAL 78 CO 0.00 0.15 0.00 0.49 0.02 0.00 0.00 177.57 178.23 1hgg n PHE 79 N -4.62 0.08 -1.99 1.57 3.72 -0.52 -4.91 117.46 110.80 1hgg n PHE 79 Ca 0.19 -0.04 -0.41 0.00 -0.05 0.00 0.00 57.45 57.14 1hgg n PHE 79 Cb 0.45 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.97 1hgg n PHE 79 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1hgg s GLN 80 N -1.92 4.25 -1.74 -1.08 -0.21 -1.14 -1.47 119.66 116.36 1hgg s GLN 80 Ca 0.18 2.34 0.00 0.00 0.02 0.00 0.00 55.36 57.90 1hgg s GLN 80 Cb 0.09 -3.09 0.00 0.00 1.00 0.00 0.00 33.01 31.01 1hgg s GLN 80 CO 0.14 -0.42 0.00 0.09 -2.12 0.00 0.00 175.29 172.98 1hgg n ASN 81 N 2.00 -5.61 -4.88 5.90 4.13 -1.18 -4.97 115.26 110.65 1hgg n ASN 81 Ca 0.06 0.41 -0.29 0.00 1.68 0.00 0.00 54.58 56.43 1hgg n ASN 81 Cb 0.40 -4.56 0.07 0.00 -1.54 0.00 0.00 39.78 34.15 1hgg n ASN 81 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 1hgg s GLU 82 N -3.39 2.29 0.14 3.52 2.56 -0.54 -4.48 118.70 118.80 1hgg s GLU 82 Ca 0.00 0.30 -0.02 0.00 0.00 0.00 0.00 54.97 55.24 1hgg s GLU 82 Cb 0.00 -1.97 -0.03 0.00 2.00 0.00 0.00 34.13 34.12 1hgg s GLU 82 CO 0.00 -1.40 0.10 0.95 -0.56 0.00 0.00 175.26 174.34 1hgg s THR 83 N -3.45 0.10 -0.03 -1.70 -4.23 -1.26 -1.52 115.64 103.54 1hgg s THR 83 Ca 0.60 -1.82 -0.29 0.00 -1.18 0.00 0.00 61.69 59.01 1hgg s THR 83 Cb -0.11 -2.00 0.10 0.00 1.34 0.00 0.00 72.50 71.83 1hgg s THR 83 CO 0.51 -0.44 0.87 -1.66 -0.54 0.00 0.00 174.62 173.36 1hgg s TRP 84 N -4.03 -0.39 -0.11 3.99 -2.14 -1.01 -4.81 118.94 110.44 1hgg s TRP 84 Ca 0.23 0.39 0.15 0.00 2.66 0.00 0.00 56.10 59.53 1hgg s TRP 84 Cb 0.07 0.51 -0.23 0.00 -3.10 0.00 0.00 33.47 30.71 1hgg s TRP 84 CO 0.01 -0.53 0.45 -0.25 -2.66 0.00 0.00 176.95 173.97 1hgg n ASP 85 N 0.06 0.53 -3.45 -2.66 8.00 0.03 -4.67 116.55 114.39 1hgg n ASP 85 Ca -0.11 0.25 -0.10 0.00 0.71 0.00 0.00 54.79 55.54 1hgg n ASP 85 Cb 0.61 0.39 -0.09 0.00 -0.02 0.00 0.00 41.12 42.01 1hgg n ASP 85 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1hgg s LEU 86 N -5.81 -0.57 -0.15 0.64 2.96 -0.96 -1.83 118.68 112.96 1hgg s LEU 86 Ca -0.07 0.38 -0.23 0.00 -0.22 0.00 0.00 54.13 54.00 1hgg s LEU 86 Cb 0.07 1.08 -0.02 0.00 0.50 0.00 0.00 46.19 47.82 1hgg s LEU 86 CO 0.83 -0.28 0.73 0.12 -1.32 0.00 0.00 176.35 176.42 1hgg s PHE 87 N 2.53 3.45 -0.24 5.38 2.19 -0.48 -1.20 117.98 129.62 1hgg s PHE 87 Ca 0.08 1.14 -0.13 0.00 0.33 0.00 0.00 56.93 58.35 1hgg s PHE 87 Cb -0.14 -2.88 -0.04 0.00 -1.31 0.00 0.00 43.02 38.64 1hgg s PHE 87 CO -0.14 -0.13 0.28 0.08 1.83 0.00 0.00 175.22 177.14 1hgg s VAL 88 N 1.70 5.27 -0.16 3.12 1.01 -0.37 -0.74 120.40 130.21 1hgg s VAL 88 Ca 0.35 0.43 -0.10 0.00 0.00 0.00 0.00 61.98 62.66 1hgg s VAL 88 Cb -0.17 -3.62 -0.05 0.00 0.00 0.00 0.00 36.38 32.55 1hgg s VAL 88 CO 0.13 0.27 0.17 -1.61 0.00 0.00 0.00 175.10 174.06 1hgg s GLU 89 N 1.40 3.98 0.10 2.72 2.02 0.44 -1.45 118.70 127.92 1hgg s GLU 89 Ca 0.13 -0.12 0.01 0.00 0.02 0.00 0.00 54.97 55.00 1hgg s GLU 89 Cb -0.15 -3.35 -0.04 0.00 0.10 0.00 0.00 34.13 30.70 1hgg s GLU 89 CO 0.07 0.44 0.25 1.03 0.02 0.00 0.00 175.26 177.07 1hgg s ARG 90 N -0.06 3.45 0.57 1.61 1.81 -1.26 -2.09 118.95 122.99 1hgg s ARG 90 Ca 0.12 -0.48 0.31 0.00 -1.72 0.00 0.00 55.73 53.96 1hgg s ARG 90 Cb -0.12 -3.00 1.76 0.00 -0.45 0.00 0.00 34.95 33.14 1hgg s ARG 90 CO 0.01 0.57 2.19 0.66 -0.68 0.00 0.00 175.30 178.05 1hgg h SER 91 N 2.70 0.00 0.63 0.23 4.64 -1.91 -2.43 113.55 117.41 1hgg h SER 91 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1hgg h SER 91 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1hgg h SER 91 CO 0.73 0.05 -0.07 0.29 -0.87 0.00 0.00 176.83 176.96 1hgg n LYS 92 N -3.60 0.34 -1.75 4.77 4.76 -1.26 -4.94 118.16 116.47 1hgg n LYS 92 Ca -0.02 -0.06 -0.38 0.00 -2.87 0.00 0.00 58.31 54.97 1hgg n LYS 92 Cb 0.15 -1.50 0.05 0.00 -1.84 0.00 0.00 35.03 31.89 1hgg n LYS 92 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1hgg s ALA 93 N -2.70 2.78 0.03 7.82 0.00 -0.92 -4.88 121.76 123.90 1hgg s ALA 93 Ca 0.23 1.35 -0.04 0.00 0.00 0.00 0.00 51.96 53.50 1hgg s ALA 93 Cb 0.20 -3.58 -0.01 0.00 0.00 0.00 0.00 23.12 19.72 1hgg s ALA 93 CO 0.50 -1.43 0.06 -0.59 0.00 0.00 0.00 175.76 174.30 1hgg s PHE 94 N -1.30 0.23 0.12 0.00 -0.71 -0.54 -4.94 117.98 110.83 1hgg s PHE 94 Ca 0.73 -0.51 0.02 0.00 -1.04 0.00 0.00 56.93 56.12 1hgg s PHE 94 Cb -0.41 -0.17 -0.04 0.00 -1.21 0.00 0.00 43.02 41.20 1hgg s PHE 94 CO 0.48 -0.31 0.23 -1.12 -1.34 0.00 0.00 175.22 173.16 1hgg s SER 95 N -1.92 6.21 -0.38 1.98 0.01 -1.26 -4.69 113.70 113.66 1hgg s SER 95 Ca -0.08 0.16 0.11 0.00 1.31 0.00 0.00 55.95 57.45 1hgg s SER 95 Cb -0.04 -1.85 0.41 0.00 0.21 0.00 0.00 66.02 64.75 1hgg s SER 95 CO -0.03 0.10 1.31 -3.20 0.41 0.00 0.00 173.24 171.83 1hgg n ASN 96 N -0.18 -1.23 0.00 2.44 5.15 -1.26 -5.11 115.26 115.07 1hgg n ASN 96 Ca -0.07 -2.45 0.00 0.00 -0.60 0.00 0.00 54.58 51.46 1hgg n ASN 96 Cb 0.53 0.69 0.00 0.00 -0.53 0.00 0.00 39.78 40.47 1hgg n ASN 96 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1hgg n TYR 98 N 0.00 2.51 -1.67 0.00 4.19 -1.26 -4.60 117.16 116.33 1hgg n TYR 98 Ca 0.00 0.25 -0.45 0.00 3.31 0.00 0.00 57.90 61.01 1hgg n TYR 98 Cb 0.00 -2.57 -0.04 0.00 0.49 0.00 0.00 39.34 37.22 1hgg n TYR 98 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 1hgg n PRO 99 N 2.91 2.56 -4.30 2.98 -0.04 -1.26 -4.93 135.00 132.92 1hgg n PRO 99 Ca 0.13 0.94 -0.16 0.00 -0.04 0.00 0.00 63.50 64.37 1hgg n PRO 99 Cb 0.33 -2.83 -0.10 0.00 -0.04 0.00 0.00 33.50 30.86 1hgg n PRO 99 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1hgg s TYR 100 N 3.85 1.45 0.08 0.54 1.13 -1.26 -1.66 117.35 121.48 1hgg s TYR 100 Ca 0.89 -0.83 0.02 0.00 -1.41 0.00 0.00 57.07 55.74 1hgg s TYR 100 Cb -0.55 -0.79 -0.04 0.00 -1.10 0.00 0.00 41.96 39.48 1hgg s TYR 100 CO 0.45 0.04 -0.07 0.16 -2.51 0.00 0.00 175.55 173.62 1hgg s ASP 101 N -3.25 1.01 -0.19 -0.18 -4.77 -0.51 -4.91 116.67 103.86 1hgg s ASP 101 Ca 0.23 -0.89 0.00 0.00 -3.30 0.00 0.00 52.55 48.59 1hgg s ASP 101 Cb 0.04 0.09 0.04 0.00 -1.09 0.00 0.00 42.92 42.00 1hgg s ASP 101 CO 0.05 -0.41 -0.08 -0.69 0.70 0.00 0.00 175.17 174.74 1hgg s VAL 102 N -3.09 1.43 0.14 2.11 1.01 -1.26 -1.11 120.40 119.62 1hgg s VAL 102 Ca 0.06 -0.89 -0.30 0.00 0.00 0.00 0.00 61.98 60.85 1hgg s VAL 102 Cb 0.02 -1.56 -0.06 0.00 0.00 0.00 0.00 36.38 34.77 1hgg s VAL 102 CO -0.04 0.13 1.56 -0.65 0.00 0.00 0.00 175.10 176.10 1hgg h PRO 103 N 8.03 -0.39 -2.44 2.72 0.11 -1.97 -2.59 132.00 135.48 1hgg h PRO 103 Ca -0.25 0.03 -0.69 0.00 0.11 0.00 0.00 66.00 65.20 1hgg h PRO 103 Cb 1.10 0.09 -0.36 0.00 0.11 0.00 0.00 31.00 31.94 1hgg h PRO 103 CO 0.44 -0.26 0.01 -3.47 -0.21 0.00 0.00 178.00 174.51 1hgg n ASP 104 N -5.41 5.09 -0.25 -2.05 -0.08 -1.26 -4.82 116.55 107.78 1hgg n ASP 104 Ca -0.03 -3.50 0.05 0.00 -1.51 0.00 0.00 54.79 49.80 1hgg n ASP 104 Cb 0.35 -0.89 0.16 0.00 2.34 0.00 0.00 41.12 43.08 1hgg n ASP 104 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 1hgg h TYR 105 N 4.39 0.07 -0.97 -0.67 5.03 -1.87 -0.11 116.97 122.85 1hgg h TYR 105 Ca 0.23 0.05 0.09 0.00 2.58 0.00 0.00 58.73 61.68 1hgg h TYR 105 Cb 0.59 0.08 -0.08 0.00 1.55 0.00 0.00 36.73 38.88 1hgg h TYR 105 CO 0.90 -0.18 0.61 0.00 -1.32 0.00 0.00 178.16 178.16 1hgg h ALA 106 N 1.66 1.40 0.14 1.82 0.00 -1.88 0.16 119.26 122.56 1hgg h ALA 106 Ca 0.41 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 55.03 1hgg h ALA 106 Cb 0.71 -0.24 0.02 0.00 0.00 0.00 0.00 17.79 18.28 1hgg h ALA 106 CO -0.60 0.29 -1.27 0.77 0.00 0.00 0.00 179.25 178.45 1hgg h SER 107 N 1.03 0.64 -0.35 0.00 0.02 -1.46 -2.64 113.55 110.79 1hgg h SER 107 Ca 0.45 -0.64 -0.01 0.00 -0.84 0.00 0.00 61.79 60.75 1hgg h SER 107 Cb 0.33 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.65 1hgg h SER 107 CO -0.22 1.48 0.17 0.25 -1.14 0.00 0.00 176.83 177.37 1hgg h LEU 108 N 0.15 0.45 -0.60 5.07 5.85 -0.42 0.13 115.31 125.94 1hgg h LEU 108 Ca -0.17 -0.12 0.07 0.00 0.84 0.00 0.00 57.88 58.50 1hgg h LEU 108 Cb 1.96 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 42.82 1hgg h LEU 108 CO 0.22 0.44 0.29 -0.09 -0.34 0.00 0.00 178.44 178.97 1hgg h ARG 109 N 0.42 0.52 0.16 1.25 2.43 -0.82 -1.80 114.38 116.55 1hgg h ARG 109 Ca 0.12 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 1hgg h ARG 109 Cb 0.11 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1hgg h ARG 109 CO -0.02 0.34 -0.08 1.03 -1.51 0.00 0.00 179.97 179.74 1hgg h SER 110 N 0.53 -0.18 -0.24 -3.80 0.87 -0.85 -0.24 113.55 109.65 1hgg h SER 110 Ca 0.28 -0.03 0.06 0.00 -1.23 0.00 0.00 61.79 60.87 1hgg h SER 110 Cb 0.24 0.05 -0.07 0.00 -0.44 0.00 0.00 62.40 62.17 1hgg h SER 110 CO -0.21 -0.09 -0.32 0.25 -0.53 0.00 0.00 176.83 175.92 1hgg h LEU 111 N -0.25 -1.02 -0.24 2.23 6.46 -0.55 -0.58 115.31 121.36 1hgg h LEU 111 Ca -0.02 0.16 -0.05 0.00 -0.12 0.00 0.00 57.88 57.85 1hgg h LEU 111 Cb 0.20 0.45 -0.01 0.00 -0.73 0.00 0.00 40.66 40.57 1hgg h LEU 111 CO 0.04 -0.34 -0.03 0.58 -0.62 0.00 0.00 178.44 178.06 1hgg h VAL 112 N -0.33 1.27 -0.67 1.05 2.07 -1.31 -2.58 116.25 115.75 1hgg h VAL 112 Ca 0.13 -0.99 0.12 0.00 0.82 0.00 0.00 66.70 66.77 1hgg h VAL 112 Cb 0.54 1.45 -0.08 0.00 -1.52 0.00 0.00 31.29 31.67 1hgg h VAL 112 CO -0.42 0.31 0.24 0.00 0.02 0.00 0.00 177.57 177.71 1hgg h ALA 113 N 0.78 0.88 0.00 1.67 0.00 0.03 -0.36 119.26 122.26 1hgg h ALA 113 Ca 0.06 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1hgg h ALA 113 Cb 0.47 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1hgg h ALA 113 CO 0.02 -0.22 -0.59 -1.13 0.00 0.00 0.00 179.25 177.33 1hgg n SER 114 N -5.02 0.68 -0.21 0.00 3.41 -0.33 -3.19 113.62 108.96 1hgg n SER 114 Ca 0.11 0.12 -0.08 0.00 -0.26 0.00 0.00 58.87 58.76 1hgg n SER 114 Cb 0.34 0.13 0.02 0.00 -0.26 0.00 0.00 64.21 64.44 1hgg n SER 114 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1hgg h SER 115 N 0.00 0.86 0.00 4.04 0.87 -0.67 -3.35 113.55 115.29 1hgg h SER 115 Ca 0.00 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 1hgg h SER 115 Cb 0.73 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1hgg h SER 115 CO 0.00 0.84 0.00 0.61 -0.53 0.00 0.00 176.83 177.75 1hgg n GLY 116 N -0.70 0.55 3.08 5.77 0.00 -0.74 -4.15 105.19 109.00 1hgg n GLY 116 Ca 0.03 -0.15 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 1hgg n GLY 116 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1hgg s THR 117 N -2.00 0.04 -0.34 2.61 -1.32 -1.26 -2.40 115.64 110.97 1hgg s THR 117 Ca 0.00 -0.35 0.15 0.00 -1.21 0.00 0.00 61.69 60.28 1hgg s THR 117 Cb 0.00 -0.34 0.45 0.00 -1.51 0.00 0.00 72.50 71.10 1hgg s THR 117 CO 0.00 -0.19 1.36 0.18 -2.21 0.00 0.00 174.62 173.76 1hgg n LEU 118 N 2.20 3.53 -4.67 9.08 4.77 -0.58 -4.86 117.00 126.47 1hgg n LEU 118 Ca -0.18 -2.76 -0.49 0.00 -0.03 0.00 0.00 56.01 52.54 1hgg n LEU 118 Cb 0.57 -0.45 -0.05 0.00 -2.33 0.00 0.00 43.42 41.16 1hgg n LEU 118 CO 0.21 0.68 1.50 -0.62 -1.33 0.00 0.00 177.39 177.83 1hgg n GLU 119 N -0.33 2.01 -4.85 3.23 1.02 -1.26 -3.08 120.64 117.38 1hgg n GLU 119 Ca 0.18 0.73 -0.33 0.00 -0.02 0.00 0.00 57.16 57.72 1hgg n GLU 119 Cb 0.76 -2.59 -0.13 0.00 -0.02 0.00 0.00 31.44 29.46 1hgg n GLU 119 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 1hgg s PHE 120 N 4.27 2.74 -0.10 -0.32 5.36 -1.26 -1.75 117.98 126.93 1hgg s PHE 120 Ca 0.94 -0.23 0.01 0.00 -0.96 0.00 0.00 56.93 56.69 1hgg s PHE 120 Cb -0.74 -1.68 -0.02 0.00 -0.34 0.00 0.00 43.02 40.24 1hgg s PHE 120 CO 0.53 0.12 -0.12 0.42 -1.46 0.00 0.00 175.22 174.72 1hgg s ILE 121 N -0.53 3.21 -0.05 3.12 -1.09 -0.11 -4.99 121.20 120.76 1hgg s ILE 121 Ca 0.07 -0.63 -0.14 0.00 -2.23 0.00 0.00 60.65 57.72 1hgg s ILE 121 Cb -0.12 -2.32 -0.05 0.00 -1.58 0.00 0.00 42.46 38.39 1hgg s ILE 121 CO 0.02 0.56 0.37 -0.89 -1.23 0.00 0.00 174.94 173.76 1hgg s THR 122 N -0.19 5.14 0.24 2.92 2.01 -1.26 -1.31 115.64 123.20 1hgg s THR 122 Ca 0.01 0.75 0.11 0.00 0.31 0.00 0.00 61.69 62.87 1hgg s THR 122 Cb -0.13 -3.68 -0.05 0.00 0.01 0.00 0.00 72.50 68.65 1hgg s THR 122 CO 0.03 0.52 -0.17 -1.61 -0.69 0.00 0.00 174.62 172.70 1hgg s GLU 123 N -0.61 1.78 -1.45 4.92 2.02 -0.34 -4.91 118.70 120.11 1hgg s GLU 123 Ca 0.22 -1.59 -0.12 0.00 0.02 0.00 0.00 54.97 53.50 1hgg s GLU 123 Cb -0.15 -1.90 0.05 0.00 0.10 0.00 0.00 34.13 32.22 1hgg s GLU 123 CO 0.11 0.37 2.29 0.41 0.02 0.00 0.00 175.26 178.45 1hgg n GLY 124 N -0.36 4.49 3.75 -1.39 0.00 -1.26 -4.65 105.19 105.77 1hgg n GLY 124 Ca -0.08 -1.69 -0.41 0.00 0.00 0.00 0.00 46.02 43.85 1hgg n GLY 124 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hgg s PHE 125 N 2.35 3.27 -0.31 1.61 0.08 -1.26 -5.00 117.98 118.71 1hgg s PHE 125 Ca 0.50 1.40 -0.03 0.00 0.12 0.00 0.00 56.93 58.91 1hgg s PHE 125 Cb 0.14 -3.55 0.05 0.00 -0.57 0.00 0.00 43.02 39.09 1hgg s PHE 125 CO -0.07 -1.55 0.04 0.99 -0.10 0.00 0.00 175.22 174.53 1hgg s THR 126 N -0.56 3.20 -0.49 0.64 2.01 -1.26 -5.06 115.64 114.12 1hgg s THR 126 Ca 0.51 -1.35 -0.18 0.00 0.31 0.00 0.00 61.69 60.98 1hgg s THR 126 Cb -0.36 -2.85 0.06 0.00 0.01 0.00 0.00 72.50 69.36 1hgg s THR 126 CO 0.43 -0.15 0.54 0.26 -0.69 0.00 0.00 174.62 175.01 1hgg s TRP 127 N 1.29 3.12 -0.22 4.92 0.52 -1.26 -4.97 118.94 122.33 1hgg s TRP 127 Ca -0.04 -0.65 -0.14 0.00 0.02 0.00 0.00 56.10 55.30 1hgg s TRP 127 Cb -0.20 -3.38 -0.04 0.00 -1.15 0.00 0.00 33.47 28.70 1hgg s TRP 127 CO -0.00 -0.94 0.30 0.95 0.02 0.00 0.00 176.95 177.28 1hgg s THR 128 N 2.29 5.26 0.00 2.01 -4.23 -1.26 -4.36 115.64 115.35 1hgg s THR 128 Ca 0.11 0.48 0.00 0.00 -1.18 0.00 0.00 61.69 61.11 1hgg s THR 128 Cb -0.21 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.00 1hgg s THR 128 CO 0.10 0.28 0.00 0.61 -0.54 0.00 0.00 174.62 175.08 1hgg n GLY 129 N 4.14 0.65 3.38 3.99 0.00 -1.26 -4.80 105.19 111.28 1hgg n GLY 129 Ca -0.11 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.72 1hgg n GLY 129 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1hgg s VAL 130 N -2.00 1.44 -0.06 1.61 -7.23 -1.26 -3.36 120.40 109.54 1hgg s VAL 130 Ca 0.00 -2.10 -0.17 0.00 -1.81 0.00 0.00 61.98 57.89 1hgg s VAL 130 Cb 0.00 -2.34 -0.05 0.00 0.56 0.00 0.00 36.38 34.55 1hgg s VAL 130 CO 0.00 -0.37 0.47 -0.89 -0.31 0.00 0.00 175.10 174.00 1hgg s THR 131 N -3.15 5.09 0.50 5.32 2.01 0.10 -4.74 115.64 120.78 1hgg s THR 131 Ca 0.28 0.95 0.08 0.00 0.31 0.00 0.00 61.69 63.31 1hgg s THR 131 Cb 0.04 -3.80 0.04 0.00 0.01 0.00 0.00 72.50 68.79 1hgg s THR 131 CO 0.10 0.42 0.60 -1.10 -0.69 0.00 0.00 174.62 173.95 1hgg s GLN 132 N -0.03 2.50 -1.75 4.92 -0.21 -1.26 -1.17 119.66 122.67 1hgg s GLN 132 Ca 0.26 -1.55 0.00 0.00 0.02 0.00 0.00 55.36 54.09 1hgg s GLN 132 Cb -0.16 -2.57 0.00 0.00 1.00 0.00 0.00 33.01 31.28 1hgg s GLN 132 CO 0.12 -0.53 0.00 0.09 -2.12 0.00 0.00 175.29 172.85 1hgg n ASN 133 N -1.94 -5.43 -4.68 5.90 3.02 -1.23 -4.96 115.26 105.94 1hgg n ASN 133 Ca 0.09 0.13 -0.37 0.00 -0.03 0.00 0.00 54.58 54.40 1hgg n ASN 133 Cb 0.61 -4.52 0.06 0.00 -0.61 0.00 0.00 39.78 35.32 1hgg n ASN 133 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1hgg n GLY 134 N -0.90 0.22 0.56 7.41 0.00 -0.87 -4.89 105.19 106.72 1hgg n GLY 134 Ca -0.22 -0.13 -0.03 0.00 0.00 0.00 0.00 46.02 45.65 1hgg n GLY 134 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hgg n GLY 135 N 1.06 3.11 3.31 -0.02 0.00 -1.26 -4.37 105.19 107.01 1hgg n GLY 135 Ca 0.14 -1.46 -0.11 0.00 0.00 0.00 0.00 46.02 44.59 1hgg n GLY 135 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1hgg s SER 136 N -1.37 -0.22 0.18 1.61 0.15 0.78 -4.76 113.70 110.07 1hgg s SER 136 Ca 0.05 -0.27 0.23 0.00 0.70 0.00 0.00 55.95 56.66 1hgg s SER 136 Cb -0.00 0.45 0.90 0.00 -1.71 0.00 0.00 66.02 65.66 1hgg s SER 136 CO 0.04 -0.80 1.70 0.59 1.20 0.00 0.00 173.24 175.97 1hgg n ASN 137 N -0.04 0.53 0.02 5.45 3.02 -1.26 -1.40 115.26 121.58 1hgg n ASN 137 Ca -0.17 0.61 0.14 0.00 -0.03 0.00 0.00 54.58 55.13 1hgg n ASN 137 Cb 0.63 -0.73 0.56 0.00 -0.61 0.00 0.00 39.78 39.63 1hgg n ASN 137 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1hgg n ALA 138 N -1.71 2.37 -3.17 5.41 0.00 -1.26 -3.93 120.51 118.23 1hgg n ALA 138 Ca 0.03 -0.10 -0.25 0.00 0.00 0.00 0.00 53.44 53.13 1hgg n ALA 138 Cb 0.27 -1.45 -0.05 0.00 0.00 0.00 0.00 19.45 18.21 1hgg n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hgg s LYS 140 N -2.69 4.15 -0.37 0.00 2.47 -1.25 -0.64 119.74 121.41 1hgg s LYS 140 Ca 0.43 2.51 -0.07 0.00 -1.56 0.00 0.00 55.97 57.28 1hgg s LYS 140 Cb 0.24 -4.10 0.06 0.00 -1.46 0.00 0.00 37.83 32.57 1hgg s LYS 140 CO -0.09 -0.92 0.17 0.50 0.16 0.00 0.00 175.35 175.17 1hgg s ARG 141 N 4.29 2.54 7.61 4.03 3.52 -0.55 -4.79 118.95 135.59 1hgg s ARG 141 Ca 0.85 -1.35 0.00 0.00 -0.13 0.00 0.00 55.73 55.10 1hgg s ARG 141 Cb -0.41 -3.58 0.00 0.00 -1.56 0.00 0.00 34.95 29.41 1hgg s ARG 141 CO 0.39 -0.81 0.00 0.41 -0.81 0.00 0.00 175.30 174.48 1hgg n GLY 142 N 4.82 2.98 0.18 8.12 0.00 -1.26 -1.99 105.19 118.04 1hgg n GLY 142 Ca -0.10 -0.21 -0.06 0.00 0.00 0.00 0.00 46.02 45.65 1hgg n GLY 142 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hgg h PRO 143 N 0.00 0.32 -7.31 1.61 0.13 -2.02 -3.47 132.00 121.26 1hgg h PRO 143 Ca 0.00 -0.20 -0.46 0.00 -0.87 0.00 0.00 66.00 64.47 1hgg h PRO 143 Cb 0.00 0.02 0.09 0.00 0.13 0.00 0.00 31.00 31.25 1hgg h PRO 143 CO 0.00 0.80 0.21 0.20 -0.23 0.00 0.00 178.00 178.98 1hgg s GLY 144 N -4.27 1.73 0.54 1.56 0.00 -0.84 -5.05 107.32 100.99 1hgg s GLY 144 Ca -0.05 -1.18 -0.19 0.00 0.00 0.00 0.00 44.72 43.30 1hgg s GLY 144 CO 0.80 -0.69 1.08 -0.56 0.00 0.00 0.00 173.10 173.73 1hgg s SER 145 N -4.62 5.95 0.00 1.64 0.01 -1.26 -1.48 113.70 113.94 1hgg s SER 145 Ca 0.64 2.00 0.00 0.00 1.31 0.00 0.00 55.95 59.89 1hgg s SER 145 Cb -0.08 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.59 1hgg s SER 145 CO 0.46 -1.06 0.00 0.61 0.41 0.00 0.00 173.24 173.66 1hgg n GLY 146 N -0.26 2.53 2.62 3.44 0.00 0.19 -4.29 105.19 109.41 1hgg n GLY 146 Ca 0.10 -1.10 -0.09 0.00 0.00 0.00 0.00 46.02 44.93 1hgg n GLY 146 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1hgg n PHE 147 N 0.00 -1.61 -1.77 1.61 7.35 -1.24 -0.16 117.46 121.64 1hgg n PHE 147 Ca 0.00 -1.53 -0.42 0.00 -0.76 0.00 0.00 57.45 54.74 1hgg n PHE 147 Cb 0.00 0.55 -0.02 0.00 0.35 0.00 0.00 39.48 40.36 1hgg n PHE 147 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 1hgg s PHE 148 N -3.78 2.82 0.47 -5.13 0.08 -1.26 -4.67 117.98 106.51 1hgg s PHE 148 Ca 0.16 0.63 0.14 0.00 0.12 0.00 0.00 56.93 57.98 1hgg s PHE 148 Cb -0.02 -4.08 1.10 0.00 -0.57 0.00 0.00 43.02 39.44 1hgg s PHE 148 CO 0.12 -3.81 2.08 0.66 -0.10 0.00 0.00 175.22 174.16 1hgg h SER 149 N 5.57 0.10 -0.39 1.36 4.64 -1.05 -2.87 113.55 120.90 1hgg h SER 149 Ca -0.45 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1hgg h SER 149 Cb 1.21 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1hgg h SER 149 CO 0.85 0.13 0.00 0.54 -0.87 0.00 0.00 176.83 177.48 1hgg n ARG 150 N -4.46 2.10 -4.41 4.77 3.00 -0.87 -4.92 116.66 111.87 1hgg n ARG 150 Ca -0.02 -1.70 -0.21 0.00 -0.01 0.00 0.00 57.85 55.91 1hgg n ARG 150 Cb 0.14 -1.41 -0.10 0.00 0.00 0.00 0.00 32.46 31.09 1hgg n ARG 150 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1hgg s LEU 151 N -1.23 2.57 -0.26 0.55 1.43 -1.09 -2.86 118.68 117.79 1hgg s LEU 151 Ca 0.34 -1.04 -0.02 0.00 -1.03 0.00 0.00 54.13 52.38 1hgg s LEU 151 Cb 0.18 -0.88 0.08 0.00 0.03 0.00 0.00 46.19 45.60 1hgg s LEU 151 CO 0.25 -0.08 0.08 0.21 0.23 0.00 0.00 176.35 177.05 1hgg s ASN 152 N -3.42 3.48 -0.35 2.29 2.47 0.11 -4.77 114.94 114.76 1hgg s ASN 152 Ca 0.27 -1.24 -0.29 0.00 0.42 0.00 0.00 52.86 52.01 1hgg s ASN 152 Cb -0.03 -0.63 0.01 0.00 -1.45 0.00 0.00 41.25 39.16 1hgg s ASN 152 CO 0.11 -0.38 1.20 0.86 -3.72 0.00 0.00 177.10 175.17 1hgg s TRP 153 N 1.83 2.86 -0.07 0.43 -0.11 -1.26 -0.76 118.94 121.86 1hgg s TRP 153 Ca 0.06 0.95 -0.05 0.00 1.22 0.00 0.00 56.10 58.28 1hgg s TRP 153 Cb -0.17 -3.95 -0.04 0.00 -1.50 0.00 0.00 33.47 27.81 1hgg s TRP 153 CO -0.22 -1.31 0.14 -0.51 -4.62 0.00 0.00 176.95 170.43 1hgg s LEU 154 N 4.19 4.29 0.36 5.86 1.43 -1.21 -2.05 118.68 131.55 1hgg s LEU 154 Ca 0.51 0.38 0.04 0.00 -1.03 0.00 0.00 54.13 54.03 1hgg s LEU 154 Cb -0.13 -2.27 -0.04 0.00 0.03 0.00 0.00 46.19 43.79 1hgg s LEU 154 CO 0.22 0.34 0.12 0.42 0.23 0.00 0.00 176.35 177.69 1hgg s THR 155 N -1.14 0.64 0.75 5.49 -4.23 -0.31 -4.72 115.64 112.11 1hgg s THR 155 Ca 0.20 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.58 1hgg s THR 155 Cb -0.12 -2.50 0.05 0.00 1.34 0.00 0.00 72.50 71.27 1hgg s THR 155 CO 0.10 0.00 1.14 -1.59 -0.54 0.00 0.00 174.62 173.72 1hgg s LYS 156 N -3.79 2.21 -0.23 3.99 -2.85 -0.46 0.03 119.74 118.64 1hgg s LYS 156 Ca 0.30 1.45 -0.03 0.00 -1.00 0.00 0.00 55.97 56.70 1hgg s LYS 156 Cb 0.05 -1.87 0.00 0.00 -2.06 0.00 0.00 37.83 33.95 1hgg s LYS 156 CO 0.16 -1.72 -0.05 0.45 0.10 0.00 0.00 175.35 174.29 1hgg s SER 157 N -2.66 4.26 0.65 0.03 0.15 -0.44 -3.81 113.70 111.87 1hgg s SER 157 Ca 0.67 -0.56 0.00 0.00 0.70 0.00 0.00 55.95 56.76 1hgg s SER 157 Cb -0.22 -1.71 0.00 0.00 -1.71 0.00 0.00 66.02 62.38 1hgg s SER 157 CO 0.49 -0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.48 1hgg n GLY 158 N 4.76 0.73 0.11 9.45 0.00 -1.26 -2.02 105.19 116.96 1hgg n GLY 158 Ca -0.18 0.47 0.03 0.00 0.00 0.00 0.00 46.02 46.35 1hgg n GLY 158 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1hgg n SER 159 N 7.19 1.44 -3.81 1.61 3.41 -1.26 -5.04 113.62 117.15 1hgg n SER 159 Ca 0.00 -2.21 -0.12 0.00 -0.26 0.00 0.00 58.87 56.28 1hgg n SER 159 Cb 0.00 -0.18 -0.10 0.00 -0.26 0.00 0.00 64.21 63.67 1hgg n SER 159 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1hgg s THR 160 N -1.30 0.05 -0.26 6.66 -4.23 -0.86 -4.99 115.64 110.71 1hgg s THR 160 Ca 0.11 -0.38 0.02 0.00 -1.18 0.00 0.00 61.69 60.26 1hgg s THR 160 Cb 0.10 -0.46 0.07 0.00 1.34 0.00 0.00 72.50 73.55 1hgg s THR 160 CO 0.01 -0.21 -0.04 -0.47 -0.54 0.00 0.00 174.62 173.37 1hgg s TYR 161 N -0.82 2.79 1.11 3.99 6.14 -1.26 -1.33 117.35 127.97 1hgg s TYR 161 Ca -0.09 -2.09 -0.17 0.00 0.64 0.00 0.00 57.07 55.36 1hgg s TYR 161 Cb -0.05 -1.88 0.25 0.00 0.42 0.00 0.00 41.96 40.70 1hgg s TYR 161 CO 0.02 -0.84 1.14 -1.25 0.64 0.00 0.00 175.55 175.26 1hgg s PRO 162 N 1.26 -0.52 -0.49 4.97 0.04 -1.26 -4.91 135.00 134.08 1hgg s PRO 162 Ca -0.03 0.02 -0.25 0.00 0.04 0.00 0.00 61.00 60.78 1hgg s PRO 162 Cb -0.19 -1.67 0.03 0.00 0.04 0.00 0.00 34.50 32.71 1hgg s PRO 162 CO -0.07 -3.26 0.91 0.08 0.04 0.00 0.00 177.00 174.69 1hgg s VAL 163 N -3.13 4.47 0.25 -0.36 1.01 -1.26 -4.64 120.40 116.74 1hgg s VAL 163 Ca 0.70 0.51 -0.30 0.00 0.00 0.00 0.00 61.98 62.89 1hgg s VAL 163 Cb -0.11 -4.46 -0.09 0.00 0.00 0.00 0.00 36.38 31.72 1hgg s VAL 163 CO 0.56 -0.92 1.23 -0.76 0.00 0.00 0.00 175.10 175.21 1hgg s LEU 164 N 3.75 4.46 -0.40 3.92 1.43 0.17 -4.88 118.68 127.13 1hgg s LEU 164 Ca 0.33 2.41 0.04 0.00 -1.03 0.00 0.00 54.13 55.88 1hgg s LEU 164 Cb -0.11 -3.62 0.16 0.00 0.03 0.00 0.00 46.19 42.65 1hgg s LEU 164 CO 0.23 -0.40 0.42 0.21 0.23 0.00 0.00 176.35 177.04 1hgg s ASN 165 N -0.23 0.81 0.31 2.29 2.47 -1.25 -0.97 114.94 118.37 1hgg s ASN 165 Ca 0.51 -1.82 0.09 0.00 0.42 0.00 0.00 52.86 52.05 1hgg s ASN 165 Cb -0.35 0.61 -0.04 0.00 -1.45 0.00 0.00 41.25 40.01 1hgg s ASN 165 CO 0.43 -0.22 0.08 0.68 -3.72 0.00 0.00 177.10 174.35 1hgg s VAL 166 N 1.14 3.18 0.02 -5.21 -7.23 -0.02 -4.95 120.40 107.33 1hgg s VAL 166 Ca 0.21 -1.79 0.01 0.00 -1.81 0.00 0.00 61.98 58.59 1hgg s VAL 166 Cb -0.10 -2.93 -0.02 0.00 0.56 0.00 0.00 36.38 33.89 1hgg s VAL 166 CO -0.05 -0.26 -0.04 0.28 -0.31 0.00 0.00 175.10 174.72 1hgg s THR 167 N -2.39 0.19 -0.21 5.32 -1.32 -1.26 -1.17 115.64 114.81 1hgg s THR 167 Ca 0.35 -0.75 -0.04 0.00 -1.21 0.00 0.00 61.69 60.04 1hgg s THR 167 Cb -0.04 -0.29 0.08 0.00 -1.51 0.00 0.00 72.50 70.74 1hgg s THR 167 CO 0.21 -0.36 0.15 -0.32 -2.21 0.00 0.00 174.62 172.10 1hgg s MET 168 N -1.16 0.14 0.20 7.08 1.75 -0.12 -4.97 119.30 122.22 1hgg s MET 168 Ca -0.11 -0.06 -0.30 0.00 -1.25 0.00 0.00 55.69 53.97 1hgg s MET 168 Cb -0.08 -1.45 -0.08 0.00 2.84 0.00 0.00 34.83 36.06 1hgg s MET 168 CO -0.01 -0.74 1.16 -2.14 -0.65 0.00 0.00 175.02 172.64 1hgg s PRO 169 N 2.21 4.54 -0.61 4.11 0.02 -1.26 -0.86 135.00 143.15 1hgg s PRO 169 Ca 0.05 1.82 -0.22 0.00 0.02 0.00 0.00 61.00 62.68 1hgg s PRO 169 Cb -0.16 -3.24 0.07 0.00 0.02 0.00 0.00 34.50 31.19 1hgg s PRO 169 CO -0.16 -0.00 0.86 1.21 -0.33 0.00 0.00 177.00 178.58 1hgg s ASN 170 N -0.09 6.20 -0.01 2.53 3.84 -0.21 -4.79 114.94 122.42 1hgg s ASN 170 Ca 0.51 -0.98 0.21 0.00 0.21 0.00 0.00 52.86 52.80 1hgg s ASN 170 Cb -0.32 -2.38 -0.26 0.00 -0.55 0.00 0.00 41.25 37.74 1hgg s ASN 170 CO 0.37 -1.27 0.78 0.59 -2.79 0.00 0.00 177.10 174.78 1hgg n ASN 171 N 7.19 0.71 -4.08 -4.21 5.03 -1.26 -0.74 115.26 117.89 1hgg n ASN 171 Ca -0.05 -0.71 -0.30 0.00 0.87 0.00 0.00 54.58 54.40 1hgg n ASN 171 Cb 0.45 1.29 0.19 0.00 -1.02 0.00 0.00 39.78 40.69 1hgg n ASN 171 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1hgg s ASP 172 N -3.44 2.90 -0.38 6.41 1.11 -1.26 -4.82 116.67 117.19 1hgg s ASP 172 Ca 0.03 0.28 0.07 0.00 0.18 0.00 0.00 52.55 53.12 1hgg s ASP 172 Cb 0.15 -0.32 0.69 0.00 1.07 0.00 0.00 42.92 44.51 1hgg s ASP 172 CO 0.88 -2.87 1.83 -0.46 1.18 0.00 0.00 175.17 175.73 1hgg n ASN 173 N -3.86 4.10 -4.19 0.27 6.94 -1.26 -4.39 115.26 112.88 1hgg n ASN 173 Ca 0.15 -3.45 -0.11 0.00 -0.02 0.00 0.00 54.58 51.15 1hgg n ASN 173 Cb 0.59 -0.78 -0.10 0.00 -2.36 0.00 0.00 39.78 37.14 1hgg n ASN 173 CO 0.00 0.00 0.00 0.72 -1.03 0.00 0.00 177.26 176.95 1hgg s PHE 174 N -3.16 1.04 0.40 -2.53 -0.12 -1.26 -4.92 117.98 107.43 1hgg s PHE 174 Ca 0.55 -1.26 -0.24 0.00 -0.05 0.00 0.00 56.93 55.93 1hgg s PHE 174 Cb 0.46 -0.55 -0.09 0.00 -0.63 0.00 0.00 43.02 42.20 1hgg s PHE 174 CO 0.11 -0.52 1.04 -0.51 -0.05 0.00 0.00 175.22 175.29 1hgg s ASP 175 N -3.11 6.76 -0.16 1.98 1.01 -1.26 -3.91 116.67 117.98 1hgg s ASP 175 Ca 0.30 2.00 0.01 0.00 0.71 0.00 0.00 52.55 55.57 1hgg s ASP 175 Cb 0.07 -2.58 0.01 0.00 1.01 0.00 0.00 42.92 41.43 1hgg s ASP 175 CO 0.06 -0.49 -0.19 -0.54 0.21 0.00 0.00 175.17 174.22 1hgg s LYS 176 N -2.57 3.08 -0.22 8.23 1.02 -0.29 -3.60 119.74 125.39 1hgg s LYS 176 Ca 0.58 -0.81 -0.16 0.00 0.02 0.00 0.00 55.97 55.60 1hgg s LYS 176 Cb -0.21 -2.54 -0.04 0.00 -0.52 0.00 0.00 37.83 34.52 1hgg s LYS 176 CO 0.26 -0.06 0.40 -1.17 -0.92 0.00 0.00 175.35 173.86 1hgg s LEU 177 N 0.96 4.12 -0.17 3.17 2.96 -0.58 -0.49 118.68 128.65 1hgg s LEU 177 Ca -0.03 0.46 -0.04 0.00 -0.22 0.00 0.00 54.13 54.30 1hgg s LEU 177 Cb -0.15 -2.50 -0.02 0.00 0.50 0.00 0.00 46.19 44.02 1hgg s LEU 177 CO -0.04 -0.12 -0.03 -0.31 -1.32 0.00 0.00 176.35 174.53 1hgg s TYR 178 N 1.55 3.01 -0.28 5.38 2.02 0.61 -1.26 117.35 128.38 1hgg s TYR 178 Ca 0.18 -0.41 -0.08 0.00 -0.37 0.00 0.00 57.07 56.39 1hgg s TYR 178 Cb -0.15 -1.99 -0.02 0.00 -0.40 0.00 0.00 41.96 39.40 1hgg s TYR 178 CO 0.08 -0.14 0.10 0.42 -1.57 0.00 0.00 175.55 174.45 1hgg s ILE 179 N 0.61 4.39 0.22 2.71 -1.09 -1.26 -1.02 121.20 125.75 1hgg s ILE 179 Ca -0.02 -0.33 0.02 0.00 -2.23 0.00 0.00 60.65 58.09 1hgg s ILE 179 Cb -0.14 -3.15 -0.01 0.00 -1.58 0.00 0.00 42.46 37.58 1hgg s ILE 179 CO 0.02 0.20 0.07 -2.67 -1.23 0.00 0.00 174.94 171.34 1hgg n TRP 180 N 4.94 0.09 -3.67 3.97 4.27 -0.82 -4.36 117.44 121.87 1hgg n TRP 180 Ca -0.15 -1.38 -0.02 0.00 -3.89 0.00 0.00 57.50 52.06 1hgg n TRP 180 Cb 0.50 -0.01 0.01 0.00 -1.36 0.00 0.00 31.31 30.46 1hgg n TRP 180 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1hgg n GLY 181 N 0.74 0.98 2.95 -1.67 0.00 -0.85 -0.94 105.19 106.39 1hgg n GLY 181 Ca -0.03 -1.08 -0.10 0.00 0.00 0.00 0.00 46.02 44.81 1hgg n GLY 181 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1hgg s ILE 182 N -2.30 0.08 -0.19 -0.61 2.07 -0.84 -1.51 121.20 117.89 1hgg s ILE 182 Ca 0.13 -0.66 -0.07 0.00 -1.41 0.00 0.00 60.65 58.64 1hgg s ILE 182 Cb -0.02 -0.20 -0.04 0.00 0.13 0.00 0.00 42.46 42.34 1hgg s ILE 182 CO 0.04 -0.36 0.05 -2.28 -1.91 0.00 0.00 174.94 170.48 1hgg s HIS 183 N -1.07 3.17 -0.39 3.50 5.65 0.54 -1.55 115.29 125.14 1hgg s HIS 183 Ca -0.12 -0.09 -0.14 0.00 0.25 0.00 0.00 55.06 54.96 1hgg s HIS 183 Cb -0.07 -2.10 0.01 0.00 -1.18 0.00 0.00 32.58 29.24 1hgg s HIS 183 CO -0.01 0.00 0.27 -1.01 -0.65 0.00 0.00 174.74 173.34 1hgg s HIS 184 N 0.67 3.24 0.68 3.88 0.09 0.12 -4.76 115.29 119.21 1hgg s HIS 184 Ca 0.03 -0.61 -0.13 0.00 -0.00 0.00 0.00 55.06 54.34 1hgg s HIS 184 Cb -0.13 -2.53 0.01 0.00 -0.00 0.00 0.00 32.58 29.92 1hgg s HIS 184 CO 0.02 -0.56 1.08 -2.14 -0.00 0.00 0.00 174.74 173.14 1hgg s PRO 185 N 1.66 2.81 0.09 8.40 0.02 -1.26 -2.67 135.00 144.04 1hgg s PRO 185 Ca 0.05 1.21 -0.02 0.00 0.02 0.00 0.00 61.00 62.26 1hgg s PRO 185 Cb -0.19 -1.96 -0.26 0.00 0.02 0.00 0.00 34.50 32.11 1hgg s PRO 185 CO 0.09 -1.22 1.17 0.77 -0.33 0.00 0.00 177.00 177.48 1hgg h SER 186 N -0.30 0.35 -4.24 2.53 0.02 -1.85 -2.50 113.55 107.56 1hgg h SER 186 Ca -0.45 -0.37 -0.33 0.00 -0.84 0.00 0.00 61.79 59.79 1hgg h SER 186 Cb 1.23 -0.11 -0.17 0.00 0.14 0.00 0.00 62.40 63.49 1hgg h SER 186 CO 0.55 1.28 -0.73 0.42 -1.14 0.00 0.00 176.83 177.21 1hgg s THR 187 N -2.69 1.05 0.34 -2.27 -4.23 -1.26 -2.37 115.64 104.21 1hgg s THR 187 Ca -0.03 -1.76 0.02 0.00 -1.18 0.00 0.00 61.69 58.74 1hgg s THR 187 Cb 0.08 -1.51 0.23 0.00 1.34 0.00 0.00 72.50 72.64 1hgg s THR 187 CO 0.87 -0.59 1.97 0.78 -0.54 0.00 0.00 174.62 177.11 1hgg h ASN 188 N 3.35 0.69 -0.21 3.99 2.35 -1.96 -1.17 115.58 122.62 1hgg h ASN 188 Ca -0.37 -0.05 0.04 0.00 -0.55 0.00 0.00 56.30 55.36 1hgg h ASN 188 Cb 1.19 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 39.35 1hgg h ASN 188 CO 0.55 0.56 -0.00 -0.61 -1.65 0.00 0.00 177.43 176.28 1hgg h GLN 189 N 0.79 0.06 -0.73 0.81 -0.00 -1.99 -1.44 115.11 112.61 1hgg h GLN 189 Ca 0.20 -0.00 0.05 0.00 -0.00 0.00 0.00 58.65 58.90 1hgg h GLN 189 Cb 0.02 -0.01 -0.05 0.00 0.00 0.00 0.00 27.48 27.43 1hgg h GLN 189 CO -0.03 0.04 0.43 1.49 0.00 0.00 0.00 178.83 180.76 1hgg h GLU 190 N 0.06 0.79 -0.50 1.69 4.81 -1.70 0.70 114.58 120.43 1hgg h GLU 190 Ca 0.10 -0.05 0.05 0.00 -0.13 0.00 0.00 59.36 59.34 1hgg h GLU 190 Cb 0.13 -0.18 -0.05 0.00 0.63 0.00 0.00 28.75 29.28 1hgg h GLU 190 CO -0.17 0.52 0.22 0.37 -0.73 0.00 0.00 179.01 179.22 1hgg h GLN 191 N 0.81 0.41 0.06 1.92 5.75 -0.65 -1.27 115.11 122.14 1hgg h GLN 191 Ca 0.31 -0.02 -0.25 0.00 -0.15 0.00 0.00 58.65 58.54 1hgg h GLN 191 Cb 0.13 -0.09 0.01 0.00 1.07 0.00 0.00 27.48 28.60 1hgg h GLN 191 CO -0.16 0.27 -1.09 1.79 -2.65 0.00 0.00 178.83 177.00 1hgg h THR 192 N 0.43 1.41 -0.87 2.39 1.35 -0.73 0.10 112.91 117.00 1hgg h THR 192 Ca 0.23 -2.65 0.07 0.00 -0.55 0.00 0.00 66.41 63.51 1hgg h THR 192 Cb 0.19 2.63 -0.07 0.00 -1.73 0.00 0.00 68.15 69.17 1hgg h THR 192 CO -0.19 0.79 0.53 0.28 -0.25 0.00 0.00 175.52 176.68 1hgg h SER 193 N 0.18 0.82 0.06 5.36 0.02 -0.43 -0.93 113.55 118.64 1hgg h SER 193 Ca -0.11 0.02 -0.32 0.00 -0.84 0.00 0.00 61.79 60.54 1hgg h SER 193 Cb 1.76 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 64.12 1hgg h SER 193 CO 0.19 0.51 -1.77 0.18 -1.14 0.00 0.00 176.83 174.80 1hgg n LEU 194 N -4.64 2.31 -0.31 5.07 4.77 -0.52 -4.65 117.00 119.03 1hgg n LEU 194 Ca 0.13 0.28 0.03 0.00 -0.03 0.00 0.00 56.01 56.43 1hgg n LEU 194 Cb 0.21 -1.03 0.05 0.00 -2.33 0.00 0.00 43.42 40.33 1hgg n LEU 194 CO 0.30 0.61 0.45 -1.22 -1.33 0.00 0.00 177.39 176.20 1hgg n TYR 195 N -3.90 0.12 0.00 -1.77 4.01 0.34 -1.36 117.16 114.60 1hgg n TYR 195 Ca -0.34 -0.22 0.00 0.00 -0.16 0.00 0.00 57.90 57.18 1hgg n TYR 195 Cb 0.89 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.90 1hgg n TYR 195 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1hgg n VAL 196 N 0.24 0.00 -1.65 -0.72 0.31 -0.35 -4.54 118.33 111.62 1hgg n VAL 196 Ca 0.05 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.95 1hgg n VAL 196 Cb 0.25 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 33.17 1hgg n VAL 196 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1hgg n GLN 197 N 0.00 1.77 -0.01 5.55 3.00 -1.26 -4.59 117.38 121.84 1hgg n GLN 197 Ca 0.00 0.62 0.09 0.00 -0.01 0.00 0.00 57.00 57.70 1hgg n GLN 197 Cb 0.00 -2.13 0.52 0.00 0.00 0.00 0.00 30.24 28.63 1hgg n GLN 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1hgg n ALA 198 N 0.20 2.60 -3.39 -1.58 0.00 -1.26 -4.52 120.51 112.56 1hgg n ALA 198 Ca 0.07 -0.14 -0.05 0.00 0.00 0.00 0.00 53.44 53.31 1hgg n ALA 198 Cb 0.35 -1.28 -0.06 0.00 0.00 0.00 0.00 19.45 18.46 1hgg n ALA 198 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1hgg s SER 199 N -1.56 -0.33 1.01 0.00 0.15 -1.26 -4.98 113.70 106.73 1hgg s SER 199 Ca 0.27 0.62 -0.10 0.00 0.70 0.00 0.00 55.95 57.44 1hgg s SER 199 Cb 0.13 1.49 0.14 0.00 -1.71 0.00 0.00 66.02 66.06 1hgg s SER 199 CO 0.21 -0.27 0.80 0.61 1.20 0.00 0.00 173.24 175.79 1hgg n GLY 200 N 5.39 -1.44 3.65 9.45 0.00 -1.26 -4.85 105.19 116.12 1hgg n GLY 200 Ca -0.05 -1.68 -0.01 0.00 0.00 0.00 0.00 46.02 44.28 1hgg n GLY 200 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1hgg s ARG 201 N -4.76 0.21 -0.10 1.61 3.52 -1.12 -4.42 118.95 113.89 1hgg s ARG 201 Ca 0.46 0.32 0.02 0.00 -0.13 0.00 0.00 55.73 56.39 1hgg s ARG 201 Cb -0.01 0.06 0.01 0.00 -1.56 0.00 0.00 34.95 33.45 1hgg s ARG 201 CO 0.32 -0.04 -0.14 0.08 -0.81 0.00 0.00 175.30 174.71 1hgg s VAL 202 N 0.85 1.39 -0.15 7.11 1.01 -0.20 -2.30 120.40 128.10 1hgg s VAL 202 Ca -0.04 -0.59 0.00 0.00 0.00 0.00 0.00 61.98 61.35 1hgg s VAL 202 Cb -0.03 -1.28 0.02 0.00 0.00 0.00 0.00 36.38 35.09 1hgg s VAL 202 CO -0.12 0.42 -0.13 -0.89 0.00 0.00 0.00 175.10 174.38 1hgg s THR 203 N 0.93 1.54 -0.07 3.92 2.01 0.29 -0.56 115.64 123.70 1hgg s THR 203 Ca -0.08 -0.64 0.05 0.00 0.31 0.00 0.00 61.69 61.32 1hgg s THR 203 Cb -0.15 -1.47 -0.01 0.00 0.01 0.00 0.00 72.50 70.88 1hgg s THR 203 CO -0.00 0.42 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.45 1hgg s VAL 204 N 1.50 2.40 0.18 3.82 1.01 -0.05 -0.93 120.40 128.33 1hgg s VAL 204 Ca 0.04 -0.94 -0.15 0.00 0.00 0.00 0.00 61.98 60.94 1hgg s VAL 204 Cb -0.13 -1.91 0.02 0.00 0.00 0.00 0.00 36.38 34.35 1hgg s VAL 204 CO -0.10 0.57 0.44 -0.94 0.00 0.00 0.00 175.10 175.06 1hgg s SER 205 N -0.16 -0.16 0.00 3.32 1.04 -0.80 -0.62 113.70 116.32 1hgg s SER 205 Ca -0.03 -0.59 0.00 0.00 0.48 0.00 0.00 55.95 55.81 1hgg s SER 205 Cb -0.14 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.51 1hgg s SER 205 CO 0.04 -0.99 0.00 0.35 0.98 0.00 0.00 173.24 173.62 1hgg n THR 206 N -0.29 0.00 0.13 2.02 -2.24 -0.45 -1.09 114.28 112.36 1hgg n THR 206 Ca -0.10 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.66 1hgg n THR 206 Cb 0.63 0.00 0.16 0.00 -2.10 0.00 0.00 70.33 69.01 1hgg n THR 206 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1hgg h ARG 207 N 0.00 0.03 0.00 -0.78 3.08 -1.97 -3.30 114.38 111.44 1hgg h ARG 207 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1hgg h ARG 207 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1hgg h ARG 207 CO 0.00 0.65 -0.61 0.00 -1.07 0.00 0.00 179.97 178.95 1hgg h ARG 208 N 0.02 0.00 -2.96 0.04 3.08 -1.96 -3.49 114.38 109.12 1hgg h ARG 208 Ca -0.01 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.05 1hgg h ARG 208 Cb 1.12 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.16 1hgg h ARG 208 CO 0.08 0.00 0.29 -1.54 -1.07 0.00 0.00 179.97 177.74 1hgg s SER 209 N -4.34 -0.04 -0.05 7.04 1.04 -1.24 -5.18 113.70 110.94 1hgg s SER 209 Ca 0.06 -1.02 -0.31 0.00 0.48 0.00 0.00 55.95 55.16 1hgg s SER 209 Cb 0.13 0.80 0.07 0.00 0.10 0.00 0.00 66.02 67.12 1hgg s SER 209 CO 0.72 -1.58 0.68 0.00 0.98 0.00 0.00 173.24 174.04 1hgg s GLN 210 N -2.56 1.06 -0.03 4.02 -2.07 -1.26 -1.34 119.66 117.47 1hgg s GLN 210 Ca 0.15 0.25 0.01 0.00 -1.82 0.00 0.00 55.36 53.95 1hgg s GLN 210 Cb -0.05 0.50 0.02 0.00 -1.09 0.00 0.00 33.01 32.39 1hgg s GLN 210 CO 0.10 -0.33 -0.04 -0.65 -1.32 0.00 0.00 175.29 173.05 1hgg s GLN 211 N -1.23 0.68 -0.12 9.60 -0.21 0.21 -4.98 119.66 123.60 1hgg s GLN 211 Ca -0.11 -0.11 0.02 0.00 0.02 0.00 0.00 55.36 55.18 1hgg s GLN 211 Cb -0.00 -0.70 0.01 0.00 1.00 0.00 0.00 33.01 33.33 1hgg s GLN 211 CO 0.10 -0.03 -0.17 0.99 -2.12 0.00 0.00 175.29 174.05 1hgg s THR 212 N 0.64 1.69 -0.02 -0.19 2.01 -1.26 -0.87 115.64 117.64 1hgg s THR 212 Ca -0.08 -0.75 0.07 0.00 0.31 0.00 0.00 61.69 61.23 1hgg s THR 212 Cb -0.11 -1.53 -0.02 0.00 0.01 0.00 0.00 72.50 70.85 1hgg s THR 212 CO -0.00 0.48 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.56 1hgg s ILE 213 N 0.96 2.40 -0.05 1.82 1.09 0.28 -4.97 121.20 122.73 1hgg s ILE 213 Ca -0.06 -1.01 0.04 0.00 -1.10 0.00 0.00 60.65 58.52 1hgg s ILE 213 Cb -0.15 -1.88 -0.02 0.00 -1.06 0.00 0.00 42.46 39.35 1hgg s ILE 213 CO -0.02 0.56 -0.17 0.27 -0.10 0.00 0.00 174.94 175.47 1hgg s ILE 214 N -0.67 2.77 1.29 2.92 -4.36 -1.26 -1.04 121.20 120.85 1hgg s ILE 214 Ca 0.11 -0.82 -0.18 0.00 -0.26 0.00 0.00 60.65 59.49 1hgg s ILE 214 Cb -0.10 -2.07 0.32 0.00 1.25 0.00 0.00 42.46 41.86 1hgg s ILE 214 CO -0.00 0.58 0.99 -2.16 0.24 0.00 0.00 174.94 174.59 1hgg s PRO 215 N -0.56 -1.87 -0.19 0.37 0.04 -1.26 -5.03 135.00 126.51 1hgg s PRO 215 Ca 0.08 0.41 -0.05 0.00 0.04 0.00 0.00 61.00 61.48 1hgg s PRO 215 Cb -0.11 -1.48 0.07 0.00 0.04 0.00 0.00 34.50 33.02 1hgg s PRO 215 CO 0.01 -4.24 0.14 -0.80 0.04 0.00 0.00 177.00 172.15 1hgg s ASN 216 N -2.96 2.01 0.16 6.66 0.02 -1.26 -4.98 114.94 114.59 1hgg s ASN 216 Ca 0.69 -0.49 -0.26 0.00 -1.02 0.00 0.00 52.86 51.78 1hgg s ASN 216 Cb -0.18 -0.01 -0.08 0.00 0.02 0.00 0.00 41.25 41.00 1hgg s ASN 216 CO 0.61 -0.34 0.80 -0.63 0.02 0.00 0.00 177.10 177.55 1hgg s ILE 217 N 2.21 4.37 0.00 0.60 1.01 -1.26 -4.36 121.20 123.77 1hgg s ILE 217 Ca 0.04 1.75 0.00 0.00 0.00 0.00 0.00 60.65 62.44 1hgg s ILE 217 Cb -0.16 -4.16 0.00 0.00 0.01 0.00 0.00 42.46 38.15 1hgg s ILE 217 CO -0.11 0.50 0.00 0.61 0.00 0.00 0.00 174.94 175.94 1hgg n GLY 218 N 1.68 3.39 3.76 6.18 0.00 -0.94 -4.98 105.19 114.29 1hgg n GLY 218 Ca -0.05 -1.01 -0.40 0.00 0.00 0.00 0.00 46.02 44.57 1hgg n GLY 218 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hgg s SER 219 N 0.00 7.19 0.54 1.61 0.01 -1.24 -4.34 113.70 117.47 1hgg s SER 219 Ca 0.00 1.42 0.04 0.00 1.31 0.00 0.00 55.95 58.72 1hgg s SER 219 Cb 0.00 -2.45 0.04 0.00 0.21 0.00 0.00 66.02 63.82 1hgg s SER 219 CO 0.00 0.08 0.33 0.54 0.41 0.00 0.00 173.24 174.60 1hgg n ARG 220 N 2.51 0.69 -2.09 12.44 3.00 -0.90 -5.08 116.66 127.24 1hgg n ARG 220 Ca -0.04 -3.50 -0.41 0.00 -0.01 0.00 0.00 57.85 53.89 1hgg n ARG 220 Cb 0.50 0.49 -0.02 0.00 0.00 0.00 0.00 32.46 33.43 1hgg n ARG 220 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.63 175.49 1hgg s PRO 221 N -4.18 4.33 -0.13 5.56 0.02 -1.26 -4.60 135.00 134.74 1hgg s PRO 221 Ca 0.25 2.25 -0.35 0.00 0.02 0.00 0.00 61.00 63.17 1hgg s PRO 221 Cb -0.02 -3.06 -0.12 0.00 0.02 0.00 0.00 34.50 31.32 1hgg s PRO 221 CO 0.16 -0.22 1.91 1.87 -0.33 0.00 0.00 177.00 180.38 1hgg n TRP 222 N 0.81 2.24 -3.78 6.54 -0.00 -1.25 -4.53 117.44 117.47 1hgg n TRP 222 Ca 0.00 0.06 -0.25 0.00 -0.00 0.00 0.00 57.50 57.31 1hgg n TRP 222 Cb 0.42 -2.64 -0.17 0.00 -0.00 0.00 0.00 31.31 28.91 1hgg n TRP 222 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 177.69 177.77 1hgg s VAL 223 N 4.46 0.51 -1.38 5.87 1.01 -0.15 -4.84 120.40 125.88 1hgg s VAL 223 Ca 0.95 -0.13 -0.04 0.00 0.00 0.00 0.00 61.98 62.76 1hgg s VAL 223 Cb -0.73 -0.75 0.00 0.00 0.00 0.00 0.00 36.38 34.90 1hgg s VAL 223 CO 0.52 0.14 0.42 0.54 0.00 0.00 0.00 175.10 176.72 1hgg n ARG 224 N 5.09 -2.59 -0.74 2.72 1.74 -1.26 -1.27 116.66 120.35 1hgg n ARG 224 Ca -0.08 0.35 0.00 0.00 -0.77 0.00 0.00 57.85 57.35 1hgg n ARG 224 Cb 0.49 -4.25 0.00 0.00 -1.02 0.00 0.00 32.46 27.68 1hgg n ARG 224 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hgg n GLY 225 N -2.04 1.51 3.34 -0.13 0.00 -1.26 -4.52 105.19 102.09 1hgg n GLY 225 Ca -0.28 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.45 1hgg n GLY 225 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hgg s LEU 226 N 0.00 2.20 0.00 0.99 1.43 -0.40 -4.98 118.68 117.92 1hgg s LEU 226 Ca 0.00 -0.62 0.19 0.00 -1.03 0.00 0.00 54.13 52.67 1hgg s LEU 226 Cb 0.00 -1.22 0.00 0.00 0.03 0.00 0.00 46.19 45.00 1hgg s LEU 226 CO 0.00 0.23 0.96 -1.20 0.23 0.00 0.00 176.35 176.57 1hgg n SER 227 N 1.59 1.85 -4.68 2.29 7.64 -1.26 -0.98 113.62 120.08 1hgg n SER 227 Ca -0.17 -1.43 -0.25 0.00 1.01 0.00 0.00 58.87 58.03 1hgg n SER 227 Cb 0.52 0.44 0.10 0.00 -1.01 0.00 0.00 64.21 64.27 1hgg n SER 227 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1hgg s SER 228 N -2.11 4.36 0.07 6.43 0.01 -1.26 -2.11 113.70 119.09 1hgg s SER 228 Ca 0.16 0.02 -0.12 0.00 1.31 0.00 0.00 55.95 57.33 1hgg s SER 228 Cb 0.15 -0.48 0.01 0.00 0.21 0.00 0.00 66.02 65.92 1hgg s SER 228 CO 0.46 -1.86 0.26 -0.13 0.41 0.00 0.00 173.24 172.38 1hgg s ARG 229 N -5.26 0.85 0.05 12.44 1.81 -1.09 -4.77 118.95 122.97 1hgg s ARG 229 Ca 0.65 -0.73 0.09 0.00 -1.72 0.00 0.00 55.73 54.01 1hgg s ARG 229 Cb -0.07 0.36 -0.03 0.00 -0.45 0.00 0.00 34.95 34.76 1hgg s ARG 229 CO 0.45 -0.28 -0.24 0.96 -0.68 0.00 0.00 175.30 175.51 1hgg s ILE 230 N -3.26 1.97 -0.07 1.52 -4.36 -0.67 -0.71 121.20 115.62 1hgg s ILE 230 Ca 0.00 -1.33 0.00 0.00 -0.26 0.00 0.00 60.65 59.07 1hgg s ILE 230 Cb 0.02 -1.69 -0.03 0.00 1.25 0.00 0.00 42.46 42.01 1hgg s ILE 230 CO -0.08 0.30 -0.06 -0.44 0.24 0.00 0.00 174.94 174.90 1hgg s SER 231 N -1.24 4.75 -0.04 4.36 0.01 -0.60 -1.43 113.70 119.52 1hgg s SER 231 Ca 0.10 0.01 -0.11 0.00 1.31 0.00 0.00 55.95 57.26 1hgg s SER 231 Cb -0.10 -1.22 -0.05 0.00 0.21 0.00 0.00 66.02 64.86 1hgg s SER 231 CO 0.02 0.37 0.30 -0.63 0.41 0.00 0.00 173.24 173.71 1hgg s ILE 232 N -0.82 5.23 0.25 1.44 -1.09 -0.27 -1.99 121.20 123.95 1hgg s ILE 232 Ca 0.13 0.53 0.01 0.00 -2.23 0.00 0.00 60.65 59.09 1hgg s ILE 232 Cb -0.11 -3.58 -0.05 0.00 -1.58 0.00 0.00 42.46 37.14 1hgg s ILE 232 CO 0.02 0.56 0.09 -0.31 -1.23 0.00 0.00 174.94 174.07 1hgg s TYR 233 N -1.10 1.51 0.03 3.97 2.02 -0.11 -4.10 117.35 119.57 1hgg s TYR 233 Ca 0.22 -1.18 -0.04 0.00 -0.37 0.00 0.00 57.07 55.70 1hgg s TYR 233 Cb -0.15 -0.88 -0.02 0.00 -0.40 0.00 0.00 41.96 40.52 1hgg s TYR 233 CO 0.11 -0.34 0.05 1.67 -1.57 0.00 0.00 175.55 175.47 1hgg s TRP 234 N -3.76 0.23 -0.03 2.71 1.48 -1.26 -1.95 118.94 116.36 1hgg s TRP 234 Ca 0.37 -0.52 -0.01 0.00 -1.06 0.00 0.00 56.10 54.89 1hgg s TRP 234 Cb 0.08 -0.17 0.03 0.00 -1.16 0.00 0.00 33.47 32.25 1hgg s TRP 234 CO 0.13 -0.30 0.05 0.99 -4.06 0.00 0.00 176.95 173.76 1hgg s THR 235 N -2.23 -0.05 -0.15 0.66 2.01 -0.18 -4.98 115.64 110.72 1hgg s THR 235 Ca -0.08 0.20 -0.08 0.00 0.31 0.00 0.00 61.69 62.04 1hgg s THR 235 Cb -0.04 -0.10 -0.04 0.00 0.01 0.00 0.00 72.50 72.33 1hgg s THR 235 CO -0.03 0.08 0.12 -0.63 -0.69 0.00 0.00 174.62 173.47 1hgg s ILE 236 N 1.01 5.31 -0.19 1.82 1.01 -1.26 -0.28 121.20 128.61 1hgg s ILE 236 Ca -0.08 0.14 -0.02 0.00 0.00 0.00 0.00 60.65 60.69 1hgg s ILE 236 Cb -0.12 -3.35 -0.00 0.00 0.01 0.00 0.00 42.46 39.00 1hgg s ILE 236 CO -0.03 0.55 -0.10 -0.69 0.00 0.00 0.00 174.94 174.67 1hgg s VAL 237 N -0.44 3.03 0.59 2.92 1.01 0.35 -4.95 120.40 122.91 1hgg s VAL 237 Ca 0.11 -0.63 -0.08 0.00 0.00 0.00 0.00 61.98 61.39 1hgg s VAL 237 Cb -0.12 -2.33 -0.02 0.00 0.00 0.00 0.00 36.38 33.91 1hgg s VAL 237 CO 0.02 0.47 0.94 -0.54 0.00 0.00 0.00 175.10 175.99 1hgg s LYS 238 N 1.13 3.30 0.31 2.72 1.02 -1.26 -1.13 119.74 125.83 1hgg s LYS 238 Ca 0.01 0.35 -0.29 0.00 0.02 0.00 0.00 55.97 56.06 1hgg s LYS 238 Cb -0.14 -2.21 -0.12 0.00 -0.52 0.00 0.00 37.83 34.84 1hgg s LYS 238 CO -0.03 -0.57 1.47 -2.30 -0.92 0.00 0.00 175.35 173.00 1hgg n PRO 239 N -2.60 2.44 -0.02 -1.68 -0.02 -1.25 -1.32 135.00 130.54 1hgg n PRO 239 Ca 0.04 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.38 1hgg n PRO 239 Cb 0.56 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 1hgg n PRO 239 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1hgg n GLY 240 N 1.48 2.31 0.21 -1.23 0.00 0.08 -5.02 105.19 103.03 1hgg n GLY 240 Ca 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.07 1hgg n GLY 240 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1hgg n ASP 241 N 0.00 0.07 -3.74 1.61 -0.08 -0.44 -4.84 116.55 109.14 1hgg n ASP 241 Ca 0.00 -1.06 -0.12 0.00 -1.51 0.00 0.00 54.79 52.10 1hgg n ASP 241 Cb 0.00 -0.04 -0.11 0.00 2.34 0.00 0.00 41.12 43.31 1hgg n ASP 241 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1hgg s VAL 242 N -0.04 -0.01 -0.05 5.18 0.11 -1.26 -1.04 120.40 123.29 1hgg s VAL 242 Ca 0.04 0.03 -0.16 0.00 -2.93 0.00 0.00 61.98 58.96 1hgg s VAL 242 Cb -0.00 -0.51 -0.05 0.00 -1.53 0.00 0.00 36.38 34.28 1hgg s VAL 242 CO 0.02 0.01 0.43 -0.22 -3.33 0.00 0.00 175.10 172.02 1hgg s LEU 243 N 0.55 4.40 -0.13 2.54 2.96 -0.04 -4.16 118.68 124.80 1hgg s LEU 243 Ca -0.03 0.90 -0.00 0.00 -0.22 0.00 0.00 54.13 54.78 1hgg s LEU 243 Cb -0.05 -2.62 0.02 0.00 0.50 0.00 0.00 46.19 44.05 1hgg s LEU 243 CO -0.03 0.20 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.40 1hgg s VAL 244 N -0.42 1.27 -0.20 1.68 1.01 -0.25 -0.94 120.40 122.55 1hgg s VAL 244 Ca 0.24 -0.45 -0.05 0.00 0.00 0.00 0.00 61.98 61.72 1hgg s VAL 244 Cb -0.16 -1.23 -0.03 0.00 0.00 0.00 0.00 36.38 34.96 1hgg s VAL 244 CO 0.12 0.41 0.01 -0.63 0.00 0.00 0.00 175.10 175.01 1hgg s ILE 245 N 1.58 4.05 -0.08 2.22 1.01 -0.31 -1.90 121.20 127.76 1hgg s ILE 245 Ca 0.04 -0.28 -0.00 0.00 0.00 0.00 0.00 60.65 60.41 1hgg s ILE 245 Cb -0.13 -2.83 0.02 0.00 0.01 0.00 0.00 42.46 39.54 1hgg s ILE 245 CO -0.09 0.43 -0.04 0.21 0.00 0.00 0.00 174.94 175.44 1hgg s ASN 246 N 0.96 1.63 0.11 3.58 3.84 -0.11 -0.84 114.94 124.11 1hgg s ASN 246 Ca 0.02 -0.18 -0.14 0.00 0.21 0.00 0.00 52.86 52.77 1hgg s ASN 246 Cb -0.14 -0.60 0.02 0.00 -0.55 0.00 0.00 41.25 39.98 1hgg s ASN 246 CO 0.02 -0.12 0.33 -0.55 -2.79 0.00 0.00 177.10 173.99 1hgg s SER 247 N 1.53 -0.12 -0.03 -4.21 0.15 -0.14 -0.55 113.70 110.32 1hgg s SER 247 Ca -0.01 -0.40 0.05 0.00 0.70 0.00 0.00 55.95 56.29 1hgg s SER 247 Cb -0.13 0.43 0.07 0.00 -1.71 0.00 0.00 66.02 64.67 1hgg s SER 247 CO -0.04 -0.80 0.91 -3.20 1.20 0.00 0.00 173.24 171.31 1hgg n ASN 248 N -0.11 1.03 0.00 5.45 5.15 -0.97 0.42 115.26 126.22 1hgg n ASN 248 Ca -0.16 -2.01 0.00 0.00 -0.60 0.00 0.00 54.58 51.81 1hgg n ASN 248 Cb 0.63 -0.16 0.00 0.00 -0.53 0.00 0.00 39.78 39.72 1hgg n ASN 248 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1hgg n GLY 249 N -0.46 4.23 2.63 8.20 0.00 -1.26 -4.67 105.19 113.86 1hgg n GLY 249 Ca 0.04 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.98 1hgg n GLY 249 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1hgg n ASN 250 N 0.00 -3.93 -4.73 1.61 4.13 -1.26 -2.80 115.26 108.27 1hgg n ASN 250 Ca 0.00 0.00 -0.41 0.00 1.68 0.00 0.00 54.58 55.85 1hgg n ASN 250 Cb 0.00 -1.91 -0.04 0.00 -1.54 0.00 0.00 39.78 36.29 1hgg n ASN 250 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1hgg s LEU 251 N 0.00 4.48 -0.43 3.41 2.96 -1.26 -0.34 118.68 127.50 1hgg s LEU 251 Ca 0.00 1.97 -0.12 0.00 -0.22 0.00 0.00 54.13 55.76 1hgg s LEU 251 Cb 0.00 -3.60 0.07 0.00 0.50 0.00 0.00 46.19 43.16 1hgg s LEU 251 CO 0.00 -0.19 0.31 -0.63 -1.32 0.00 0.00 176.35 174.52 1hgg s ILE 252 N -0.03 4.75 0.44 6.68 -1.09 -0.57 -3.35 121.20 128.03 1hgg s ILE 252 Ca 0.49 -1.14 -0.17 0.00 -2.23 0.00 0.00 60.65 57.60 1hgg s ILE 252 Cb -0.27 -3.83 -0.09 0.00 -1.58 0.00 0.00 42.46 36.69 1hgg s ILE 252 CO 0.33 -0.49 0.90 0.00 -1.23 0.00 0.00 174.94 174.45 1hgg s ALA 253 N 1.55 3.14 0.55 9.38 0.00 0.06 -2.01 121.76 134.43 1hgg s ALA 253 Ca 0.03 0.18 -0.16 0.00 0.00 0.00 0.00 51.96 52.01 1hgg s ALA 253 Cb -0.23 -3.02 -0.06 0.00 0.00 0.00 0.00 23.12 19.82 1hgg s ALA 253 CO 0.05 0.01 1.02 -1.25 0.00 0.00 0.00 175.76 175.59 1hgg s PRO 254 N -3.57 3.64 0.00 0.00 0.04 -1.26 0.09 135.00 133.94 1hgg s PRO 254 Ca 0.58 1.08 0.21 0.00 0.04 0.00 0.00 61.00 62.91 1hgg s PRO 254 Cb -0.10 -2.08 0.34 0.00 0.04 0.00 0.00 34.50 32.69 1hgg s PRO 254 CO 0.23 -0.54 1.30 0.54 0.04 0.00 0.00 177.00 178.58 1hgg n ARG 255 N -1.80 2.29 -0.59 4.56 1.74 -1.14 -4.71 116.66 117.02 1hgg n ARG 255 Ca 0.08 -2.09 0.00 0.00 -0.77 0.00 0.00 57.85 55.07 1hgg n ARG 255 Cb 0.53 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.52 1hgg n ARG 255 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hgg n GLY 256 N 1.31 -0.13 3.19 -0.13 0.00 -1.26 -1.19 105.19 106.98 1hgg n GLY 256 Ca 0.16 -1.08 -0.21 0.00 0.00 0.00 0.00 46.02 44.90 1hgg n GLY 256 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1hgg s TYR 257 N -3.80 1.38 0.13 1.61 -0.85 -0.42 -4.67 117.35 110.73 1hgg s TYR 257 Ca 0.00 -0.41 -0.21 0.00 -0.52 0.00 0.00 57.07 55.92 1hgg s TYR 257 Cb 0.00 -0.79 -0.07 0.00 0.38 0.00 0.00 41.96 41.48 1hgg s TYR 257 CO 0.00 0.08 0.66 -0.06 -1.52 0.00 0.00 175.55 174.71 1hgg s PHE 258 N -1.09 3.81 -0.05 -3.49 0.40 -0.39 -0.94 117.98 116.24 1hgg s PHE 258 Ca 0.01 1.40 -0.12 0.00 -0.60 0.00 0.00 56.93 57.63 1hgg s PHE 258 Cb -0.09 -2.60 -0.05 0.00 0.51 0.00 0.00 43.02 40.79 1hgg s PHE 258 CO 0.02 0.52 0.30 -1.59 0.70 0.00 0.00 175.22 175.18 1hgg s LYS 259 N -1.28 3.74 0.01 0.44 -2.85 -0.72 -1.53 119.74 117.57 1hgg s LYS 259 Ca 0.34 0.20 -0.11 0.00 -1.00 0.00 0.00 55.97 55.40 1hgg s LYS 259 Cb -0.20 -3.21 -0.05 0.00 -2.06 0.00 0.00 37.83 32.30 1hgg s LYS 259 CO 0.22 0.72 0.35 -1.64 0.10 0.00 0.00 175.35 175.09 1hgg s MET 260 N -1.03 3.75 0.31 1.78 -1.94 -1.24 -4.74 119.30 116.20 1hgg s MET 260 Ca 0.20 0.19 0.03 0.00 -1.71 0.00 0.00 55.69 54.40 1hgg s MET 260 Cb -0.15 -3.12 -0.01 0.00 2.01 0.00 0.00 34.83 33.56 1hgg s MET 260 CO 0.10 0.65 0.10 2.89 -0.01 0.00 0.00 175.02 178.75 1hgg n ARG 261 N 1.41 0.70 -3.95 2.03 1.85 -1.26 -4.77 116.66 112.67 1hgg n ARG 261 Ca -0.12 -2.59 -0.29 0.00 -1.00 0.00 0.00 57.85 53.85 1hgg n ARG 261 Cb 0.53 1.35 -0.17 0.00 -1.05 0.00 0.00 32.46 33.13 1hgg n ARG 261 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1hgg s THR 262 N -2.67 1.30 0.00 8.89 2.01 -1.26 -4.37 115.64 119.54 1hgg s THR 262 Ca 0.14 -0.57 0.00 0.00 0.31 0.00 0.00 61.69 61.57 1hgg s THR 262 Cb 0.01 -1.33 0.00 0.00 0.01 0.00 0.00 72.50 71.19 1hgg s THR 262 CO 0.10 0.31 0.00 0.61 -0.69 0.00 0.00 174.62 174.95 1hgg n GLY 263 N 4.84 3.00 1.28 4.40 0.00 -1.26 -5.03 105.19 112.42 1hgg n GLY 263 Ca -0.14 -0.54 0.08 0.00 0.00 0.00 0.00 46.02 45.42 1hgg n GLY 263 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1hgg n LYS 264 N 0.00 3.69 -2.96 1.61 2.85 -1.26 -4.99 118.16 117.10 1hgg n LYS 264 Ca 0.00 -2.94 -0.33 0.00 -1.05 0.00 0.00 58.31 53.99 1hgg n LYS 264 Cb 0.00 -1.99 -0.07 0.00 -0.65 0.00 0.00 35.03 32.33 1hgg n LYS 264 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 1hgg s SER 265 N -1.45 6.86 0.34 -5.58 0.01 -1.26 -4.88 113.70 107.75 1hgg s SER 265 Ca 0.47 1.50 -0.10 0.00 1.31 0.00 0.00 55.95 59.13 1hgg s SER 265 Cb 0.36 -2.46 0.04 0.00 0.21 0.00 0.00 66.02 64.17 1hgg s SER 265 CO 0.12 -0.29 0.63 -0.24 0.41 0.00 0.00 173.24 173.87 1hgg n SER 266 N -0.53 -1.83 -4.35 2.44 2.88 -0.76 -3.83 113.62 107.64 1hgg n SER 266 Ca 0.05 -2.51 -0.22 0.00 -1.33 0.00 0.00 58.87 54.86 1hgg n SER 266 Cb 0.54 3.11 -0.11 0.00 -0.75 0.00 0.00 64.21 67.00 1hgg n SER 266 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 1hgg s ILE 267 N -2.36 1.89 -0.12 2.46 2.07 -1.26 -1.38 121.20 122.50 1hgg s ILE 267 Ca 0.18 -1.99 -0.09 0.00 -1.41 0.00 0.00 60.65 57.34 1hgg s ILE 267 Cb -0.03 -1.92 0.04 0.00 0.13 0.00 0.00 42.46 40.68 1hgg s ILE 267 CO 0.13 -0.34 0.29 -0.32 -1.91 0.00 0.00 174.94 172.79 1hgg s MET 268 N -2.94 0.31 -0.24 3.50 -2.45 0.08 -4.86 119.30 112.70 1hgg s MET 268 Ca 0.18 0.49 -0.13 0.00 -1.25 0.00 0.00 55.69 54.97 1hgg s MET 268 Cb -0.05 0.06 -0.04 0.00 1.25 0.00 0.00 34.83 36.05 1hgg s MET 268 CO 0.07 -0.09 0.30 1.03 1.05 0.00 0.00 175.02 177.38 1hgg s ARG 269 N 0.62 4.08 -0.22 4.11 0.52 -1.26 -0.42 118.95 126.38 1hgg s ARG 269 Ca -0.04 -0.04 -0.26 0.00 -0.52 0.00 0.00 55.73 54.87 1hgg s ARG 269 Cb -0.05 -3.58 0.08 0.00 0.52 0.00 0.00 34.95 31.92 1hgg s ARG 269 CO -0.04 -0.08 0.79 0.45 0.02 0.00 0.00 175.30 176.44 1hgg s SER 270 N 1.27 -0.65 -0.08 0.23 0.15 -0.89 -4.80 113.70 108.93 1hgg s SER 270 Ca 0.13 1.13 0.16 0.00 0.70 0.00 0.00 55.95 58.07 1hgg s SER 270 Cb -0.15 1.10 0.55 0.00 -1.71 0.00 0.00 66.02 65.81 1hgg s SER 270 CO 0.08 -0.30 1.47 0.47 1.20 0.00 0.00 173.24 176.15 1hgg n ASP 271 N 2.13 3.97 -4.77 5.45 8.00 -1.26 -4.41 116.55 125.66 1hgg n ASP 271 Ca -0.14 -2.40 -0.37 0.00 0.71 0.00 0.00 54.79 52.58 1hgg n ASP 271 Cb 0.56 -0.46 -0.01 0.00 -0.02 0.00 0.00 41.12 41.18 1hgg n ASP 271 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1hgg s ALA 272 N -1.74 3.04 0.41 2.24 0.00 -1.26 -4.98 121.76 119.47 1hgg s ALA 272 Ca 0.41 0.95 -0.26 0.00 0.00 0.00 0.00 51.96 53.06 1hgg s ALA 272 Cb 0.26 -3.38 -0.09 0.00 0.00 0.00 0.00 23.12 19.91 1hgg s ALA 272 CO 0.19 -0.62 1.34 -2.14 0.00 0.00 0.00 175.76 174.53 1hgg s PRO 273 N -2.56 3.95 0.13 0.00 0.02 -1.26 -4.73 135.00 130.57 1hgg s PRO 273 Ca 0.61 2.23 -0.10 0.00 0.02 0.00 0.00 61.00 63.76 1hgg s PRO 273 Cb -0.29 -2.77 -0.06 0.00 0.02 0.00 0.00 34.50 31.39 1hgg s PRO 273 CO 0.36 -0.53 0.46 0.42 -0.33 0.00 0.00 177.00 177.38 1hgg s ILE 274 N -1.23 5.02 0.17 2.83 1.01 -1.26 -0.20 121.20 127.53 1hgg s ILE 274 Ca 0.57 0.47 -0.04 0.00 0.00 0.00 0.00 60.65 61.65 1hgg s ILE 274 Cb -0.40 -3.66 -0.03 0.00 0.01 0.00 0.00 42.46 38.39 1hgg s ILE 274 CO 0.51 0.17 0.17 -0.62 0.00 0.00 0.00 174.94 175.16 1hgg s ASP 275 N -1.98 0.17 -0.47 3.58 2.15 0.22 -4.85 116.67 115.49 1hgg s ASP 275 Ca 0.38 -1.17 -0.13 0.00 0.43 0.00 0.00 52.55 52.06 1hgg s ASP 275 Cb -0.13 0.38 0.09 0.00 -0.30 0.00 0.00 42.92 42.95 1hgg s ASP 275 CO 0.20 -0.84 0.37 -0.89 -0.17 0.00 0.00 175.17 173.85 1hgg s THR 276 N -4.06 4.88 0.07 1.71 2.01 -1.26 -0.28 115.64 118.71 1hgg s THR 276 Ca 0.27 -1.28 -0.26 0.00 0.31 0.00 0.00 61.69 60.72 1hgg s THR 276 Cb 0.06 -3.99 0.08 0.00 0.01 0.00 0.00 72.50 68.66 1hgg s THR 276 CO 0.05 -0.62 0.83 0.00 -0.69 0.00 0.00 174.62 174.19 1hgg s ILE 278 N -3.33 3.86 -0.29 0.00 1.10 -1.26 -3.01 121.20 118.29 1hgg s ILE 278 Ca 0.06 -0.39 -0.13 0.00 -0.51 0.00 0.00 60.65 59.68 1hgg s ILE 278 Cb -0.01 -2.65 0.10 0.00 0.15 0.00 0.00 42.46 40.05 1hgg s ILE 278 CO -0.07 0.53 0.66 -0.55 -2.11 0.00 0.00 174.94 173.40 1hgg s SER 279 N -0.07 -1.03 0.21 4.50 0.15 0.49 -4.92 113.70 113.03 1hgg s SER 279 Ca 0.02 1.53 0.06 0.00 0.70 0.00 0.00 55.95 58.25 1hgg s SER 279 Cb -0.13 1.83 0.14 0.00 -1.71 0.00 0.00 66.02 66.15 1hgg s SER 279 CO 0.03 -0.23 1.48 -0.33 1.20 0.00 0.00 173.24 175.39 1hgg h GLU 280 N 7.52 0.13 -5.19 5.44 3.07 -1.88 -3.35 114.58 120.32 1hgg h GLU 280 Ca -0.24 -0.12 -0.61 0.00 -0.50 0.00 0.00 59.36 57.89 1hgg h GLU 280 Cb 1.16 0.03 -0.13 0.00 -0.84 0.00 0.00 28.75 28.97 1hgg h GLU 280 CO 0.13 0.81 -0.48 0.00 -1.40 0.00 0.00 179.01 178.08 1hgg s ILE 282 N 0.78 1.99 0.07 0.00 1.01 -0.02 -2.83 121.20 122.19 1hgg s ILE 282 Ca 0.09 -1.05 0.06 0.00 0.00 0.00 0.00 60.65 59.74 1hgg s ILE 282 Cb -0.13 -1.66 -0.03 0.00 0.01 0.00 0.00 42.46 40.65 1hgg s ILE 282 CO 0.02 0.56 -0.16 -0.89 0.00 0.00 0.00 174.94 174.47 1hgg s THR 283 N -0.38 1.29 0.08 2.92 2.01 -1.07 -0.53 115.64 119.96 1hgg s THR 283 Ca 0.03 -1.26 0.30 0.00 0.31 0.00 0.00 61.69 61.07 1hgg s THR 283 Cb -0.12 -1.19 0.31 0.00 0.01 0.00 0.00 72.50 71.51 1hgg s THR 283 CO 0.01 -0.09 1.92 1.55 -0.69 0.00 0.00 174.62 177.32 1hgg h PRO 284 N 4.48 0.00 -0.01 4.92 0.13 -1.87 0.13 132.00 139.77 1hgg h PRO 284 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1hgg h PRO 284 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1hgg h PRO 284 CO 0.41 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.27 1hgg n ASN 285 N -2.57 0.34 0.00 1.44 4.13 -1.26 -4.29 115.26 113.05 1hgg n ASN 285 Ca -0.02 -1.23 0.00 0.00 1.68 0.00 0.00 54.58 55.01 1hgg n ASN 285 Cb 0.08 -0.01 0.00 0.00 -1.54 0.00 0.00 39.78 38.31 1hgg n ASN 285 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1hgg n GLY 286 N 0.98 2.43 3.79 7.41 0.00 0.44 -3.46 105.19 116.78 1hgg n GLY 286 Ca 0.20 -2.13 -0.34 0.00 0.00 0.00 0.00 46.02 43.75 1hgg n GLY 286 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hgg s SER 287 N 0.00 6.16 0.04 1.61 0.01 0.01 -2.58 113.70 118.94 1hgg s SER 287 Ca 0.00 1.95 0.03 0.00 1.31 0.00 0.00 55.95 59.24 1hgg s SER 287 Cb 0.00 -2.56 -0.02 0.00 0.21 0.00 0.00 66.02 63.65 1hgg s SER 287 CO 0.00 -0.91 -0.10 0.27 0.41 0.00 0.00 173.24 172.92 1hgg s ILE 288 N -2.02 0.72 0.07 1.44 -4.36 -1.13 -2.14 121.20 113.79 1hgg s ILE 288 Ca 0.68 -0.91 -0.30 0.00 -0.26 0.00 0.00 60.65 59.85 1hgg s ILE 288 Cb -0.17 -0.71 -0.05 0.00 1.25 0.00 0.00 42.46 42.77 1hgg s ILE 288 CO 0.23 -0.17 1.11 -2.16 0.24 0.00 0.00 174.94 174.20 1hgg s PRO 289 N -1.19 4.51 -0.36 0.37 0.04 -1.26 -4.29 135.00 132.82 1hgg s PRO 289 Ca -0.04 1.65 0.03 0.00 0.04 0.00 0.00 61.00 62.68 1hgg s PRO 289 Cb -0.08 -3.36 0.50 0.00 0.04 0.00 0.00 34.50 31.60 1hgg s PRO 289 CO 0.01 -0.10 1.73 0.27 0.04 0.00 0.00 177.00 178.94 1hgg n ASN 290 N 3.51 3.88 0.04 6.66 0.23 -1.26 -4.13 115.26 124.18 1hgg n ASN 290 Ca 0.06 -3.25 -0.14 0.00 -0.53 0.00 0.00 54.58 50.73 1hgg n ASN 290 Cb 0.48 -0.78 -0.03 0.00 -2.08 0.00 0.00 39.78 37.36 1hgg n ASN 290 CO 0.00 0.00 0.00 -2.24 -0.93 0.00 0.00 177.26 174.09 1hgg h ASP 291 N 0.85 0.63 -3.75 0.53 2.03 -1.95 -3.45 116.42 111.30 1hgg h ASP 291 Ca 0.49 -0.46 -0.50 0.00 -0.73 0.00 0.00 57.03 55.83 1hgg h ASP 291 Cb 2.30 -0.19 0.03 0.00 -0.83 0.00 0.00 39.33 40.65 1hgg h ASP 291 CO 0.88 1.24 0.17 -0.54 -1.03 0.00 0.00 179.24 179.97 1hgg s LYS 292 N -3.47 3.61 0.34 4.15 1.02 -1.26 -5.01 119.74 119.12 1hgg s LYS 292 Ca -0.07 0.37 0.18 0.00 0.02 0.00 0.00 55.97 56.47 1hgg s LYS 292 Cb 0.09 -2.32 0.28 0.00 -0.52 0.00 0.00 37.83 35.37 1hgg s LYS 292 CO 0.87 -0.24 1.55 -1.00 -0.92 0.00 0.00 175.35 175.61 1hgg h PRO 293 N 0.34 0.00 -5.24 -1.68 0.13 -1.87 -3.42 132.00 120.25 1hgg h PRO 293 Ca -0.46 0.00 -0.38 0.00 -0.87 0.00 0.00 66.00 64.29 1hgg h PRO 293 Cb 1.20 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.15 1hgg h PRO 293 CO 0.62 0.35 -0.75 -0.06 -0.23 0.00 0.00 178.00 177.93 1hgg s PHE 294 N -3.14 1.28 0.08 1.56 0.08 -0.81 -2.07 117.98 114.96 1hgg s PHE 294 Ca 0.04 -0.60 0.01 0.00 0.12 0.00 0.00 56.93 56.51 1hgg s PHE 294 Cb 0.08 -0.67 -0.04 0.00 -0.57 0.00 0.00 43.02 41.81 1hgg s PHE 294 CO 0.71 0.09 -0.06 1.14 -0.10 0.00 0.00 175.22 177.00 1hgg s GLN 295 N -2.75 0.76 -0.04 0.44 1.03 0.54 -0.52 119.66 119.12 1hgg s GLN 295 Ca 0.08 -1.26 0.06 0.00 0.04 0.00 0.00 55.36 54.28 1hgg s GLN 295 Cb -0.04 -0.13 0.08 0.00 0.03 0.00 0.00 33.01 32.95 1hgg s GLN 295 CO 0.02 -0.03 0.97 -1.71 -2.54 0.00 0.00 175.29 172.00 1hgg n ASN 296 N 0.13 1.61 0.01 12.60 4.05 -0.12 -1.06 115.26 132.49 1hgg n ASN 296 Ca -0.14 -2.17 -0.11 0.00 0.45 0.00 0.00 54.58 52.62 1hgg n ASN 296 Cb 0.60 -0.14 -0.08 0.00 1.23 0.00 0.00 39.78 41.38 1hgg n ASN 296 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 177.26 174.79 1hgg h VAL 297 N 1.11 1.06 -1.81 3.44 2.07 -1.86 -3.48 116.25 116.77 1hgg h VAL 297 Ca 0.00 -1.39 0.01 0.00 0.82 0.00 0.00 66.70 66.13 1hgg h VAL 297 Cb 0.81 1.84 -0.23 0.00 -1.52 0.00 0.00 31.29 32.19 1hgg h VAL 297 CO 0.00 0.30 0.30 0.21 0.02 0.00 0.00 177.57 178.40 1hgg s ASN 298 N -5.67 -0.59 0.22 0.57 3.84 -1.26 -5.00 114.94 107.04 1hgg s ASN 298 Ca -0.13 1.04 0.24 0.00 0.21 0.00 0.00 52.86 54.21 1hgg s ASN 298 Cb -0.00 1.01 0.92 0.00 -0.55 0.00 0.00 41.25 42.63 1hgg s ASN 298 CO 0.51 -0.27 1.72 2.29 -2.79 0.00 0.00 177.10 178.56 1hgg n LYS 299 N 2.08 0.19 -3.28 0.43 2.85 -1.26 -4.57 118.16 114.60 1hgg n LYS 299 Ca -0.14 0.34 -0.40 0.00 -1.05 0.00 0.00 58.31 57.06 1hgg n LYS 299 Cb 0.56 -1.81 -0.08 0.00 -0.65 0.00 0.00 35.03 33.05 1hgg n LYS 299 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1hgg s ILE 300 N -3.23 5.08 0.07 0.58 1.01 -1.26 -5.01 121.20 118.45 1hgg s ILE 300 Ca 0.06 0.64 -0.05 0.00 0.00 0.00 0.00 60.65 61.31 1hgg s ILE 300 Cb 0.10 -3.83 -0.02 0.00 0.01 0.00 0.00 42.46 38.72 1hgg s ILE 300 CO 0.44 0.02 0.08 0.42 0.00 0.00 0.00 174.94 175.90 1hgg s THR 301 N 2.27 0.18 -0.02 2.92 -4.23 -1.26 -4.16 115.64 111.33 1hgg s THR 301 Ca 0.19 -1.52 0.00 0.00 -1.18 0.00 0.00 61.69 59.18 1hgg s THR 301 Cb -0.16 -1.45 0.02 0.00 1.34 0.00 0.00 72.50 72.25 1hgg s THR 301 CO 0.11 -0.82 0.01 -0.47 -0.54 0.00 0.00 174.62 172.90 1hgg s TYR 302 N -3.90 0.19 0.00 3.99 6.14 0.31 -4.99 117.35 119.10 1hgg s TYR 302 Ca 0.07 0.04 0.00 0.00 0.64 0.00 0.00 57.07 57.81 1hgg s TYR 302 Cb 0.07 -0.30 0.00 0.00 0.42 0.00 0.00 41.96 42.15 1hgg s TYR 302 CO -0.10 -0.09 0.00 0.41 0.64 0.00 0.00 175.55 176.41 1hgg n GLY 303 N 3.95 -1.19 3.56 8.97 0.00 -1.26 -0.84 105.19 118.38 1hgg n GLY 303 Ca -0.25 -2.12 -0.36 0.00 0.00 0.00 0.00 46.02 43.29 1hgg n GLY 303 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hgg s ALA 304 N -2.00 2.32 0.23 4.61 0.00 -1.18 -4.87 121.76 120.86 1hgg s ALA 304 Ca 0.00 -1.93 0.11 0.00 0.00 0.00 0.00 51.96 50.14 1hgg s ALA 304 Cb 0.00 -4.53 -0.05 0.00 0.00 0.00 0.00 23.12 18.55 1hgg s ALA 304 CO 0.00 -4.05 -0.16 0.00 0.00 0.00 0.00 175.76 171.55 1hgg s PRO 306 N -3.12 2.17 0.01 0.00 0.02 -1.26 -4.95 135.00 127.86 1hgg s PRO 306 Ca 0.26 1.28 -0.30 0.00 0.02 0.00 0.00 61.00 62.26 1hgg s PRO 306 Cb -0.07 -1.88 -0.04 0.00 0.02 0.00 0.00 34.50 32.53 1hgg s PRO 306 CO 0.14 -1.73 1.14 0.15 -0.33 0.00 0.00 177.00 176.37 1hgg s LYS 307 N -4.70 4.44 0.34 5.54 1.02 -0.88 -4.46 119.74 121.04 1hgg s LYS 307 Ca 0.63 1.64 -0.28 0.00 0.02 0.00 0.00 55.97 57.98 1hgg s LYS 307 Cb -0.19 -3.44 -0.10 0.00 -0.52 0.00 0.00 37.83 33.58 1hgg s LYS 307 CO 0.53 -0.27 1.29 -0.47 -0.92 0.00 0.00 175.35 175.51 1hgg s TYR 308 N 1.42 3.05 0.04 3.18 5.04 -1.26 -0.34 117.35 128.49 1hgg s TYR 308 Ca 0.56 1.44 -0.00 0.00 -2.44 0.00 0.00 57.07 56.63 1hgg s TYR 308 Cb -0.26 -3.64 -0.03 0.00 0.35 0.00 0.00 41.96 38.39 1hgg s TYR 308 CO 0.26 -1.77 -0.03 0.54 -1.34 0.00 0.00 175.55 173.21 1hgg s VAL 309 N -1.17 0.22 0.14 3.14 0.11 -0.22 -4.85 120.40 117.77 1hgg s VAL 309 Ca 0.50 -1.39 -0.05 0.00 -2.93 0.00 0.00 61.98 58.11 1hgg s VAL 309 Cb -0.39 -0.94 -0.14 0.00 -1.53 0.00 0.00 36.38 33.39 1hgg s VAL 309 CO 0.51 -0.74 1.37 0.11 -3.33 0.00 0.00 175.10 173.01 1hgg h LYS 310 N 3.86 0.52 -6.93 1.54 1.57 -1.96 -3.41 116.57 111.76 1hgg h LYS 310 Ca -0.33 -0.45 -0.53 0.00 -1.87 0.00 0.00 60.65 57.46 1hgg h LYS 310 Cb 1.17 0.10 0.09 0.00 0.08 0.00 0.00 32.23 33.67 1hgg h LYS 310 CO 0.54 1.09 0.66 -0.65 -0.57 0.00 0.00 179.45 180.51 1hgg s GLN 311 N -3.58 4.08 0.08 3.15 1.11 -1.26 -4.96 119.66 118.28 1hgg s GLN 311 Ca -0.07 2.27 0.22 0.00 0.01 0.00 0.00 55.36 57.80 1hgg s GLN 311 Cb 0.10 -2.87 -0.11 0.00 -1.01 0.00 0.00 33.01 29.11 1hgg s GLN 311 CO 0.87 -0.44 0.84 0.27 0.01 0.00 0.00 175.29 176.83 1hgg n ASN 312 N 0.35 0.50 -3.84 5.90 0.23 -1.26 -4.67 115.26 112.46 1hgg n ASN 312 Ca 0.02 0.04 -0.15 0.00 -0.53 0.00 0.00 54.58 53.97 1hgg n ASN 312 Cb 0.42 1.09 -0.15 0.00 -2.08 0.00 0.00 39.78 39.06 1hgg n ASN 312 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1hgg s THR 313 N -3.37 0.09 -0.20 5.53 -1.32 -1.26 -4.80 115.64 110.31 1hgg s THR 313 Ca -0.02 0.05 -0.04 0.00 -1.21 0.00 0.00 61.69 60.47 1hgg s THR 313 Cb 0.13 -0.15 0.08 0.00 -1.51 0.00 0.00 72.50 71.04 1hgg s THR 313 CO 0.84 0.08 0.13 -0.76 -2.21 0.00 0.00 174.62 172.70 1hgg s LEU 314 N 0.57 0.28 -0.21 9.08 1.43 -1.26 -4.99 118.68 123.58 1hgg s LEU 314 Ca -0.05 -0.68 -0.14 0.00 -1.03 0.00 0.00 54.13 52.23 1hgg s LEU 314 Cb -0.08 -0.12 -0.04 0.00 0.03 0.00 0.00 46.19 45.98 1hgg s LEU 314 CO -0.01 -0.36 0.31 -0.54 0.23 0.00 0.00 176.35 175.97 1hgg s LYS 315 N 2.17 4.15 -0.33 1.70 1.02 -1.26 -0.81 119.74 126.39 1hgg s LYS 315 Ca 0.04 0.04 -0.16 0.00 0.02 0.00 0.00 55.97 55.91 1hgg s LYS 315 Cb -0.16 -3.52 -0.01 0.00 -0.52 0.00 0.00 37.83 33.61 1hgg s LYS 315 CO -0.16 0.03 0.43 -1.17 -0.92 0.00 0.00 175.35 173.56 1hgg s LEU 316 N 1.11 4.30 0.28 3.17 2.96 0.65 -4.65 118.68 126.50 1hgg s LEU 316 Ca 0.15 -0.00 -0.30 0.00 -0.22 0.00 0.00 54.13 53.76 1hgg s LEU 316 Cb -0.14 -2.47 -0.12 0.00 0.50 0.00 0.00 46.19 43.96 1hgg s LEU 316 CO 0.06 -0.36 1.58 0.00 -1.32 0.00 0.00 176.35 176.31 1hgg n ALA 317 N 5.52 2.38 -1.55 5.97 0.00 -1.26 -0.48 120.51 131.09 1hgg n ALA 317 Ca -0.07 0.38 0.07 0.00 0.00 0.00 0.00 53.44 53.81 1hgg n ALA 317 Cb 0.49 -2.44 0.16 0.00 0.00 0.00 0.00 19.45 17.67 1hgg n ALA 317 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1hgg n THR 318 N 2.16 1.81 -3.82 0.00 -2.24 -0.18 -4.85 114.28 107.15 1hgg n THR 318 Ca 0.09 -2.62 -0.06 0.00 -2.27 0.00 0.00 64.05 59.20 1hgg n THR 318 Cb 0.36 -0.09 -0.02 0.00 -2.10 0.00 0.00 70.33 68.48 1hgg n THR 318 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1hgg s GLY 319 N -2.92 -0.13 1.21 3.38 0.00 -1.17 -4.78 107.32 102.90 1hgg s GLY 319 Ca 0.34 -0.17 -0.20 0.00 0.00 0.00 0.00 44.72 44.70 1hgg s GLY 319 CO -0.05 -0.04 1.14 -3.16 0.00 0.00 0.00 173.10 170.98 1hgg s MET 320 N -3.65 -1.29 0.52 2.90 0.23 -1.26 -4.45 119.30 112.29 1hgg s MET 320 Ca 0.12 -0.20 -0.22 0.00 -1.03 0.00 0.00 55.69 54.36 1hgg s MET 320 Cb -0.04 -1.60 -0.06 0.00 -1.53 0.00 0.00 34.83 31.60 1hgg s MET 320 CO 0.05 -3.73 1.25 0.50 -2.03 0.00 0.00 175.02 171.06 1hgg s ARG 321 N -5.53 3.37 -0.45 3.16 3.52 -1.26 -0.97 118.95 120.78 1hgg s ARG 321 Ca 0.72 1.98 -0.17 0.00 -0.13 0.00 0.00 55.73 58.13 1hgg s ARG 321 Cb -0.08 -2.26 0.04 0.00 -1.56 0.00 0.00 34.95 31.09 1hgg s ARG 321 CO 0.55 -0.93 0.44 1.21 -0.81 0.00 0.00 175.30 175.77 1hgg s ASN 322 N -1.22 6.18 -0.77 -2.12 2.47 -0.70 -4.54 114.94 114.23 1hgg s ASN 322 Ca 0.69 -0.91 0.03 0.00 0.42 0.00 0.00 52.86 53.09 1hgg s ASN 322 Cb -0.34 -2.22 0.20 0.00 -1.45 0.00 0.00 41.25 37.44 1hgg s ASN 322 CO 0.40 -0.64 0.63 0.52 -3.72 0.00 0.00 177.10 174.30 1hgg n VAL 323 N 5.38 2.23 -1.54 -5.21 0.31 -1.26 -4.88 118.33 113.36 1hgg n VAL 323 Ca -0.09 -5.01 -0.35 0.00 -0.01 0.00 0.00 64.34 58.89 1hgg n VAL 323 Cb 0.46 -2.24 0.08 0.00 -0.91 0.00 0.00 33.84 31.23 1hgg n VAL 323 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1hgg s PRO 324 N -1.58 2.29 -0.17 5.55 0.04 -1.26 -4.89 135.00 134.99 1hgg s PRO 324 Ca 0.27 1.78 0.09 0.00 0.04 0.00 0.00 61.00 63.18 1hgg s PRO 324 Cb -0.03 -1.85 0.54 0.00 0.04 0.00 0.00 34.50 33.20 1hgg s PRO 324 CO -0.14 -1.72 1.35 -1.91 0.04 0.00 0.00 177.00 174.62 1hgg n GLU 325 N -2.51 3.45 0.00 4.56 2.13 -1.26 -4.86 120.64 122.15 1hgg n GLU 325 Ca 0.14 -2.08 0.00 0.00 0.66 0.00 0.00 57.16 55.88 1hgg n GLU 325 Cb 0.50 -1.99 0.00 0.00 0.27 0.00 0.00 31.44 30.22 1hgg n GLU 325 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 1hgg n LYS 326 N 0.33 0.00 0.00 5.31 2.85 -1.26 -5.00 118.16 120.40 1hgg n LYS 326 Ca 0.20 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.46 1hgg n LYS 326 Cb 0.91 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 35.29 1hgg n LYS 326 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 177.40 178.29 1hgg n GLN 327 N 0.00 0.00 0.00 -1.58 7.27 -1.26 -5.08 117.38 116.73 1hgg n GLN 327 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 1hgg n GLN 327 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 1hgg n GLN 327 CO 0.00 0.00 0.00 0.25 0.07 0.00 0.00 177.06 177.38