#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hgp s VAL 17 N 0.00 4.68 -0.74 2.52 1.01 -0.05 -3.93 120.40 123.88 3hgp s VAL 17 Ca 0.00 1.64 0.00 0.00 0.00 0.00 0.00 61.98 63.62 3hgp s VAL 17 Cb 0.00 -4.12 0.00 0.00 0.00 0.00 0.00 36.38 32.26 3hgp s VAL 17 CO 0.00 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.10 3hgp n GLY 18 N 2.27 0.04 3.93 4.51 0.00 -1.24 -2.25 105.19 112.45 3hgp n GLY 18 Ca -0.03 -0.53 -0.26 0.00 0.00 0.00 0.00 46.02 45.20 3hgp n GLY 18 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hgp s GLY 19 N -2.62 1.68 0.18 -0.02 0.00 -1.25 -4.82 107.32 100.47 3hgp s GLY 19 Ca 0.00 -0.90 0.07 0.00 0.00 0.00 0.00 44.72 43.89 3hgp s GLY 19 CO 0.00 -0.49 -0.14 -0.51 0.00 0.00 0.00 173.10 171.96 3hgp s THR 20 N -3.28 1.62 -0.01 0.90 -4.23 -0.11 -4.91 115.64 105.61 3hgp s THR 20 Ca 0.60 -2.10 -0.30 0.00 -1.18 0.00 0.00 61.69 58.71 3hgp s THR 20 Cb -0.11 -1.94 -0.05 0.00 1.34 0.00 0.00 72.50 71.75 3hgp s THR 20 CO 0.45 -0.57 1.32 -0.70 -0.54 0.00 0.00 174.62 174.58 3hgp s GLU 21 N -3.46 4.32 0.38 3.99 2.12 -1.26 -0.74 118.70 124.05 3hgp s GLU 21 Ca 0.19 1.85 -0.26 0.00 0.36 0.00 0.00 54.97 57.11 3hgp s GLU 21 Cb -0.01 -3.54 -0.09 0.00 0.26 0.00 0.00 34.13 30.75 3hgp s GLU 21 CO 0.05 -0.51 1.21 0.00 -0.54 0.00 0.00 175.26 175.48 3hgp s ALA 22 N 2.21 3.24 0.59 6.30 0.00 -0.14 -4.86 121.76 129.09 3hgp s ALA 22 Ca 0.61 1.05 -0.20 0.00 0.00 0.00 0.00 51.96 53.42 3hgp s ALA 22 Cb -0.29 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.39 3hgp s ALA 22 CO 0.25 -0.58 1.29 -0.65 0.00 0.00 0.00 175.76 176.07 3hgp s GLN 23 N -2.15 2.91 0.31 0.00 -0.21 -1.26 -4.85 119.66 114.40 3hgp s GLN 23 Ca 0.55 2.05 0.25 0.00 0.02 0.00 0.00 55.36 58.23 3hgp s GLN 23 Cb -0.33 -2.03 1.08 0.00 1.00 0.00 0.00 33.01 32.73 3hgp s GLN 23 CO 0.43 -1.31 1.75 0.07 -2.12 0.00 0.00 175.29 174.11 3hgp h ARG 24 N 1.01 0.00 -0.21 2.91 0.11 -1.98 -2.55 114.38 113.67 3hgp h ARG 24 Ca -0.51 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.57 3hgp h ARG 24 Cb 1.31 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.39 3hgp h ARG 24 CO 0.55 0.00 0.00 0.27 0.10 0.00 0.00 179.97 180.89 3hgp n ASN 25 N -2.36 2.78 -0.03 0.08 0.23 -1.26 -4.67 115.26 110.01 3hgp n ASN 25 Ca 0.01 -2.25 -0.15 0.00 -0.53 0.00 0.00 54.58 51.66 3hgp n ASN 25 Cb 0.21 -0.23 -0.04 0.00 -2.08 0.00 0.00 39.78 37.64 3hgp n ASN 25 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 3hgp h SER 26 N 1.27 0.90 -2.13 0.53 0.02 -1.77 -3.39 113.55 108.98 3hgp h SER 26 Ca 0.00 -0.54 -0.54 0.00 -0.84 0.00 0.00 61.79 59.86 3hgp h SER 26 Cb 0.80 -0.26 -0.41 0.00 0.14 0.00 0.00 62.40 62.67 3hgp h SER 26 CO 0.04 1.34 -0.91 0.79 -1.14 0.00 0.00 176.83 176.94 3hgp n TRP 27 N -3.95 1.96 0.52 3.45 7.02 -1.26 -4.95 117.44 120.23 3hgp n TRP 27 Ca -0.06 -3.90 0.06 0.00 -1.02 0.00 0.00 57.50 52.59 3hgp n TRP 27 Cb 0.69 -0.45 0.30 0.00 -2.42 0.00 0.00 31.31 29.43 3hgp n TRP 27 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 3hgp n PRO 28 N 0.25 0.09 0.02 -0.99 -0.04 -1.26 -1.78 135.00 131.29 3hgp n PRO 28 Ca 0.27 0.22 0.12 0.00 -0.04 0.00 0.00 63.50 64.08 3hgp n PRO 28 Cb 0.52 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.76 3hgp n PRO 28 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3hgp n SER 29 N -1.39 0.49 -4.74 3.54 3.41 -1.22 -1.94 113.62 111.76 3hgp n SER 29 Ca 0.05 -0.03 -0.41 0.00 -0.26 0.00 0.00 58.87 58.22 3hgp n SER 29 Cb 0.12 0.10 -0.02 0.00 -0.26 0.00 0.00 64.21 64.15 3hgp n SER 29 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 3hgp s GLN 30 N -3.05 4.27 0.29 4.33 2.00 -0.73 -0.70 119.66 126.08 3hgp s GLN 30 Ca 0.10 2.29 0.09 0.00 -2.00 0.00 0.00 55.36 55.84 3hgp s GLN 30 Cb 0.16 -3.12 -0.06 0.00 0.80 0.00 0.00 33.01 30.80 3hgp s GLN 30 CO 0.68 -0.42 -0.11 0.96 -0.50 0.00 0.00 175.29 175.90 3hgp s ILE 31 N 0.06 2.02 -0.23 -2.34 -5.25 -0.31 -4.57 121.20 110.58 3hgp s ILE 31 Ca 0.60 -2.22 -0.07 0.00 -0.99 0.00 0.00 60.65 57.98 3hgp s ILE 31 Cb -0.42 -2.45 -0.03 0.00 2.95 0.00 0.00 42.46 42.52 3hgp s ILE 31 CO 0.42 -0.32 0.05 -0.55 -1.79 0.00 0.00 174.94 172.75 3hgp s SER 32 N -3.50 5.07 -0.26 4.36 0.15 -0.48 -2.71 113.70 116.34 3hgp s SER 32 Ca 0.30 -0.18 -0.13 0.00 0.70 0.00 0.00 55.95 56.64 3hgp s SER 32 Cb 0.01 -1.89 -0.04 0.00 -1.71 0.00 0.00 66.02 62.39 3hgp s SER 32 CO 0.13 0.02 0.30 -0.22 1.20 0.00 0.00 173.24 174.67 3hgp s LEU 33 N 1.29 4.06 0.15 3.45 2.96 0.26 -0.79 118.68 130.05 3hgp s LEU 33 Ca 0.04 0.21 0.09 0.00 -0.22 0.00 0.00 54.13 54.26 3hgp s LEU 33 Cb -0.15 -2.31 -0.04 0.00 0.50 0.00 0.00 46.19 44.19 3hgp s LEU 33 CO 0.03 -0.10 -0.21 -1.10 -1.32 0.00 0.00 176.35 173.65 3hgp s GLN 34 N 1.75 1.29 0.19 1.98 -0.21 -0.15 -0.91 119.66 123.60 3hgp s GLN 34 Ca 0.12 -1.35 0.11 0.00 0.02 0.00 0.00 55.36 54.25 3hgp s GLN 34 Cb -0.15 -1.50 -0.04 0.00 1.00 0.00 0.00 33.01 32.31 3hgp s GLN 34 CO 0.09 0.33 -0.19 1.52 -2.12 0.00 0.00 175.29 174.92 3hgp s TYR 35 N -1.62 2.41 0.13 0.91 1.13 -0.03 -1.08 117.35 119.21 3hgp s TYR 35 Ca 0.14 -0.31 -0.30 0.00 -1.41 0.00 0.00 57.07 55.19 3hgp s TYR 35 Cb -0.08 -1.18 -0.06 0.00 -1.10 0.00 0.00 41.96 39.53 3hgp s TYR 35 CO 0.06 0.51 0.98 0.50 -2.51 0.00 0.00 175.55 175.10 3hgp s ARG 36 N -2.75 4.70 -0.34 -3.49 3.52 -0.39 -0.80 118.95 119.41 3hgp s ARG 36 Ca 0.22 1.50 -0.00 0.00 -0.13 0.00 0.00 55.73 57.32 3hgp s ARG 36 Cb -0.08 -3.35 0.11 0.00 -1.56 0.00 0.00 34.95 30.07 3hgp s ARG 36 CO 0.12 0.22 0.14 0.45 -0.81 0.00 0.00 175.30 175.42 3hgp s SER 36 N -0.14 3.79 1.80 -2.12 0.15 0.78 -4.80 113.70 113.16 3hgp s SER 36 Ca 0.47 -1.86 0.00 0.00 0.70 0.00 0.00 55.95 55.26 3hgp s SER 36 Cb -0.25 -0.80 0.00 0.00 -1.71 0.00 0.00 66.02 63.27 3hgp s SER 36 CO 0.31 -0.38 0.00 0.61 1.20 0.00 0.00 173.24 174.98 3hgp n GLY 36 N 4.54 3.34 0.35 9.45 0.00 -1.26 0.05 105.19 121.66 3hgp n GLY 36 Ca 0.01 0.25 0.14 0.00 0.00 0.00 0.00 46.02 46.42 3hgp n GLY 36 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hgp n SER 36 N 9.16 1.18 -3.52 1.61 3.41 -1.26 -4.96 113.62 119.24 3hgp n SER 36 Ca 0.00 -1.21 -0.22 0.00 -0.26 0.00 0.00 58.87 57.18 3hgp n SER 36 Cb 0.00 0.04 -0.07 0.00 -0.26 0.00 0.00 64.21 63.91 3hgp n SER 36 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3hgp n SER 37 N -0.24 0.46 -4.14 4.04 7.64 0.11 -5.16 113.62 116.34 3hgp n SER 37 Ca 0.17 -3.09 -0.22 0.00 1.01 0.00 0.00 58.87 56.74 3hgp n SER 37 Cb 0.33 1.24 -0.14 0.00 -1.01 0.00 0.00 64.21 64.63 3hgp n SER 37 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 3hgp s TRP 38 N -3.13 1.32 -0.06 1.43 0.52 -1.26 -0.15 118.94 117.60 3hgp s TRP 38 Ca 0.27 -0.30 0.04 0.00 0.02 0.00 0.00 56.10 56.13 3hgp s TRP 38 Cb 0.01 -0.82 0.00 0.00 -1.15 0.00 0.00 33.47 31.52 3hgp s TRP 38 CO 0.19 0.01 -0.16 0.00 0.02 0.00 0.00 176.95 177.01 3hgp s ALA 39 N -0.58 1.52 0.25 0.98 0.00 0.02 -4.91 121.76 119.04 3hgp s ALA 39 Ca 0.04 -0.63 -0.30 0.00 0.00 0.00 0.00 51.96 51.07 3hgp s ALA 39 Cb -0.07 -0.56 -0.11 0.00 0.00 0.00 0.00 23.12 22.38 3hgp s ALA 39 CO 0.00 0.22 1.53 -1.58 0.00 0.00 0.00 175.76 175.94 3hgp s HIS 40 N 0.28 2.92 0.00 0.00 2.46 -1.26 -0.85 115.29 118.84 3hgp s HIS 40 Ca -0.09 0.85 0.00 0.00 0.47 0.00 0.00 55.06 56.29 3hgp s HIS 40 Cb -0.14 -3.94 0.00 0.00 -0.13 0.00 0.00 32.58 28.37 3hgp s HIS 40 CO 0.04 -3.20 0.00 -2.37 -2.47 0.00 0.00 174.74 166.74 3hgp n THR 41 N 2.56 0.00 -3.78 0.89 5.66 -0.09 -4.90 114.28 114.61 3hgp n THR 41 Ca 0.09 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.99 3hgp n THR 41 Cb 0.39 -0.68 -0.05 0.00 -1.55 0.00 0.00 70.33 68.43 3hgp n THR 41 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3hgp n GLY 43 N -0.22 -0.27 3.80 0.00 0.00 0.44 -0.58 105.19 108.35 3hgp n GLY 43 Ca -0.12 -1.89 -0.03 0.00 0.00 0.00 0.00 46.02 43.98 3hgp n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hgp s GLY 44 N -5.40 -0.10 -0.12 -0.02 0.00 -1.10 -3.50 107.32 97.08 3hgp s GLY 44 Ca 0.69 -0.04 0.02 0.00 0.00 0.00 0.00 44.72 45.40 3hgp s GLY 44 CO 0.47 0.90 -0.19 -1.59 0.00 0.00 0.00 173.10 172.69 3hgp s THR 45 N -2.79 1.77 -0.10 0.90 2.01 0.10 -1.17 115.64 116.38 3hgp s THR 45 Ca 0.16 -0.81 -0.30 0.00 0.31 0.00 0.00 61.69 61.05 3hgp s THR 45 Cb -0.02 -1.58 -0.04 0.00 0.01 0.00 0.00 72.50 70.87 3hgp s THR 45 CO 0.03 0.49 1.47 -0.22 -0.69 0.00 0.00 174.62 175.71 3hgp s LEU 46 N 0.84 4.26 -0.01 4.42 2.96 0.12 -0.70 118.68 130.58 3hgp s LEU 46 Ca -0.08 2.00 0.05 0.00 -0.22 0.00 0.00 54.13 55.88 3hgp s LEU 46 Cb -0.15 -3.54 -0.07 0.00 0.50 0.00 0.00 46.19 42.93 3hgp s LEU 46 CO -0.01 -0.84 0.12 2.30 -1.32 0.00 0.00 176.35 176.60 3hgp n ILE 47 N 5.38 0.00 -4.22 6.68 -5.35 -0.03 -0.16 119.36 121.66 3hgp n ILE 47 Ca 0.16 -0.15 -0.13 0.00 -0.27 0.00 0.00 62.75 62.36 3hgp n ILE 47 Cb 0.44 0.48 -0.10 0.00 -1.74 0.00 0.00 39.64 38.72 3hgp n ILE 47 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 3hgp s ARG 48 N -2.20 1.21 0.63 6.28 1.81 -0.96 -4.75 118.95 120.97 3hgp s ARG 48 Ca -0.01 -1.63 0.40 0.00 -1.72 0.00 0.00 55.73 52.76 3hgp s ARG 48 Cb 0.03 0.15 2.08 0.00 -0.45 0.00 0.00 34.95 36.76 3hgp s ARG 48 CO 0.20 -0.35 2.25 1.96 -0.68 0.00 0.00 175.30 178.68 3hgp h GLN 49 N 2.60 0.00 0.00 3.54 4.20 -1.96 -2.41 115.11 121.08 3hgp h GLN 49 Ca -0.36 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.33 3hgp h GLN 49 Cb 1.24 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.00 3hgp h GLN 49 CO 0.55 0.01 -0.26 0.27 -0.67 0.00 0.00 178.83 178.73 3hgp n ASN 50 N -3.17 1.74 -3.85 1.46 6.94 -1.26 -1.19 115.26 115.94 3hgp n ASN 50 Ca -0.02 -3.04 -0.14 0.00 -0.02 0.00 0.00 54.58 51.37 3hgp n ASN 50 Cb 0.14 -0.41 -0.15 0.00 -2.36 0.00 0.00 39.78 37.00 3hgp n ASN 50 CO 0.00 0.00 0.00 0.26 -1.03 0.00 0.00 177.26 176.49 3hgp s TRP 51 N -2.32 0.10 -0.04 -2.53 0.52 -0.91 -0.59 118.94 113.17 3hgp s TRP 51 Ca 0.28 0.02 0.06 0.00 0.02 0.00 0.00 56.10 56.49 3hgp s TRP 51 Cb 0.26 -0.14 -0.02 0.00 -1.15 0.00 0.00 33.47 32.42 3hgp s TRP 51 CO -0.01 -0.04 -0.23 0.08 0.02 0.00 0.00 176.95 176.77 3hgp s VAL 52 N 0.37 2.28 -0.21 4.03 1.01 -0.08 -0.85 120.40 126.95 3hgp s VAL 52 Ca -0.03 -1.01 -0.11 0.00 0.00 0.00 0.00 61.98 60.83 3hgp s VAL 52 Cb -0.05 -1.83 -0.05 0.00 0.00 0.00 0.00 36.38 34.45 3hgp s VAL 52 CO -0.01 0.58 0.18 -0.32 0.00 0.00 0.00 175.10 175.53 3hgp s MET 53 N -0.42 4.17 0.11 2.72 1.75 0.12 -0.30 119.30 127.44 3hgp s MET 53 Ca 0.04 -0.16 0.02 0.00 -1.25 0.00 0.00 55.69 54.34 3hgp s MET 53 Cb -0.12 -3.46 -0.01 0.00 2.84 0.00 0.00 34.83 34.08 3hgp s MET 53 CO 0.01 0.20 0.12 -2.37 -0.65 0.00 0.00 175.02 172.33 3hgp n THR 54 N 3.80 0.00 -3.12 10.11 5.66 -0.25 -0.72 114.28 129.76 3hgp n THR 54 Ca -0.15 -0.74 -0.39 0.00 -3.05 0.00 0.00 64.05 59.72 3hgp n THR 54 Cb 0.52 0.39 -0.06 0.00 -1.55 0.00 0.00 70.33 69.63 3hgp n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3hgp s ALA 55 N -2.30 3.51 0.27 1.79 0.00 -1.26 -1.09 121.76 122.68 3hgp s ALA 55 Ca 0.12 0.21 -0.00 0.00 0.00 0.00 0.00 51.96 52.29 3hgp s ALA 55 Cb 0.00 -2.81 0.51 0.00 0.00 0.00 0.00 23.12 20.83 3hgp s ALA 55 CO 0.09 0.34 1.82 0.00 0.00 0.00 0.00 175.76 178.01 3hgp h ALA 56 N 4.44 1.41 0.00 0.00 0.00 -1.69 -1.93 119.26 121.49 3hgp h ALA 56 Ca -0.48 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3hgp h ALA 56 Cb 1.21 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.83 3hgp h ALA 56 CO 0.65 0.16 0.00 1.12 0.00 0.00 0.00 179.25 181.18 3hgp h HIS 57 N 0.91 0.00 -0.01 0.00 2.07 -1.92 -1.36 115.15 114.84 3hgp h HIS 57 Ca 0.47 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.88 3hgp h HIS 57 Cb 0.47 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.44 3hgp h HIS 57 CO -0.03 0.00 -0.51 0.00 -3.07 0.00 0.00 177.93 174.32 3hgp n VAL 59 N -3.93 0.00 -1.64 0.00 0.24 -0.60 -4.71 118.33 107.68 3hgp n VAL 59 Ca -0.02 -0.49 -0.31 0.00 -2.04 0.00 0.00 64.34 61.48 3hgp n VAL 59 Cb 0.53 1.03 -0.04 0.00 -1.47 0.00 0.00 33.84 33.89 3hgp n VAL 59 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 3hgp n ASP 60 N -0.15 7.01 -3.86 -1.34 5.75 -0.67 -4.85 116.55 118.43 3hgp n ASP 60 Ca 0.01 -3.14 -0.11 0.00 -0.01 0.00 0.00 54.79 51.54 3hgp n ASP 60 Cb 0.04 -1.29 -0.09 0.00 -1.03 0.00 0.00 41.12 38.75 3hgp n ASP 60 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3hgp s ARG 61 N -1.35 0.60 -1.24 0.11 0.52 -1.26 -4.98 118.95 111.35 3hgp s ARG 61 Ca 0.58 -0.54 -0.17 0.00 -0.52 0.00 0.00 55.73 55.09 3hgp s ARG 61 Cb 0.31 0.25 0.11 0.00 0.52 0.00 0.00 34.95 36.14 3hgp s ARG 61 CO -0.17 -0.16 1.59 -1.21 0.02 0.00 0.00 175.30 175.37 3hgp s GLU 62 N -2.05 4.00 0.07 3.54 0.41 -1.26 -4.88 118.70 118.52 3hgp s GLU 62 Ca -0.09 -2.17 -0.06 0.00 -0.41 0.00 0.00 54.97 52.24 3hgp s GLU 62 Cb -0.04 -5.32 -0.02 0.00 -1.78 0.00 0.00 34.13 26.97 3hgp s GLU 62 CO -0.01 -2.05 0.10 -0.51 -0.49 0.00 0.00 175.26 172.30 3hgp s LEU 63 N 3.18 1.85 -0.17 1.80 1.43 -1.26 -5.15 118.68 120.37 3hgp s LEU 63 Ca 0.48 -0.76 -0.04 0.00 -1.03 0.00 0.00 54.13 52.78 3hgp s LEU 63 Cb 0.01 0.69 -0.03 0.00 0.03 0.00 0.00 46.19 46.89 3hgp s LEU 63 CO 0.03 -0.66 -0.03 -0.89 0.23 0.00 0.00 176.35 175.04 3hgp s THR 64 N -3.74 3.93 0.16 5.49 2.01 -1.26 -5.04 115.64 117.19 3hgp s THR 64 Ca 0.05 -0.34 0.08 0.00 0.31 0.00 0.00 61.69 61.79 3hgp s THR 64 Cb 0.05 -2.74 -0.04 0.00 0.01 0.00 0.00 72.50 69.79 3hgp s THR 64 CO -0.10 0.48 -0.07 -0.36 -0.69 0.00 0.00 174.62 173.87 3hgp s PHE 65 N 0.52 2.71 0.13 4.92 0.08 -1.26 -1.26 117.98 123.82 3hgp s PHE 65 Ca -0.02 -0.19 0.01 0.00 0.12 0.00 0.00 56.93 56.85 3hgp s PHE 65 Cb -0.14 -1.34 -0.04 0.00 -0.57 0.00 0.00 43.02 40.93 3hgp s PHE 65 CO 0.03 0.50 -0.03 -0.98 -0.10 0.00 0.00 175.22 174.64 3hgp s ARG 65 N -2.73 0.93 -0.05 0.44 1.70 -0.24 -3.65 118.95 115.36 3hgp s ARG 65 Ca 0.25 -1.41 0.04 0.00 -0.47 0.00 0.00 55.73 54.14 3hgp s ARG 65 Cb -0.09 -0.16 -0.02 0.00 -0.57 0.00 0.00 34.95 34.11 3hgp s ARG 65 CO 0.16 -0.09 -0.16 0.08 -1.08 0.00 0.00 175.30 174.21 3hgp s VAL 66 N -3.70 2.92 -0.20 4.99 1.01 0.16 -0.98 120.40 124.60 3hgp s VAL 66 Ca 0.17 -0.78 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 3hgp s VAL 66 Cb 0.06 -2.13 0.01 0.00 0.00 0.00 0.00 36.38 34.32 3hgp s VAL 66 CO -0.01 0.59 -0.13 -0.69 0.00 0.00 0.00 175.10 174.86 3hgp s VAL 67 N -0.68 2.62 0.24 2.92 1.01 0.03 -0.99 120.40 125.54 3hgp s VAL 67 Ca 0.11 -0.76 0.06 0.00 0.00 0.00 0.00 61.98 61.38 3hgp s VAL 67 Cb -0.11 -2.15 -0.03 0.00 0.00 0.00 0.00 36.38 34.09 3hgp s VAL 67 CO 0.00 0.48 0.30 0.68 0.00 0.00 0.00 175.10 176.57 3hgp s VAL 68 N 1.37 4.97 -1.51 2.92 -7.23 -0.58 -1.38 120.40 118.96 3hgp s VAL 68 Ca 0.05 -1.13 0.00 0.00 -1.81 0.00 0.00 61.98 59.09 3hgp s VAL 68 Cb -0.14 -3.69 0.00 0.00 0.56 0.00 0.00 36.38 33.11 3hgp s VAL 68 CO -0.09 -0.33 0.00 0.61 -0.31 0.00 0.00 175.10 174.98 3hgp n GLY 69 N -1.31 0.71 3.73 2.32 0.00 -1.25 -1.16 105.19 108.24 3hgp n GLY 69 Ca -0.09 -0.26 -0.38 0.00 0.00 0.00 0.00 46.02 45.30 3hgp n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3hgp s GLU 70 N -4.01 4.32 -0.02 1.61 2.56 -1.26 -3.07 118.70 118.84 3hgp s GLU 70 Ca 0.00 0.47 -0.01 0.00 0.00 0.00 0.00 54.97 55.43 3hgp s GLU 70 Cb 0.00 -3.42 -0.01 0.00 2.00 0.00 0.00 34.13 32.70 3hgp s GLU 70 CO 0.00 0.19 -0.02 1.58 -0.56 0.00 0.00 175.26 176.45 3hgp n HIS 71 N 3.54 0.00 -4.04 5.30 -0.00 -1.26 -4.93 115.22 113.83 3hgp n HIS 71 Ca -0.07 0.00 -0.34 0.00 -0.00 0.00 0.00 57.72 57.31 3hgp n HIS 71 Cb 0.52 -0.07 -0.15 0.00 -0.00 0.00 0.00 29.99 30.29 3hgp n HIS 71 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 3hgp s ASN 72 N -5.05 3.85 0.58 0.26 3.84 -1.26 -1.27 114.94 115.89 3hgp s ASN 72 Ca -0.03 -0.82 0.35 0.00 0.21 0.00 0.00 52.86 52.57 3hgp s ASN 72 Cb 0.01 -1.58 1.77 0.00 -0.55 0.00 0.00 41.25 40.90 3hgp s ASN 72 CO 0.03 -0.07 2.16 -0.07 -2.79 0.00 0.00 177.10 176.36 3hgp h LEU 73 N 7.95 0.00 -2.35 3.21 3.38 -1.28 -3.09 115.31 123.13 3hgp h LEU 73 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.60 3hgp h LEU 73 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 3hgp h LEU 73 CO 0.59 0.05 0.00 0.59 0.09 0.00 0.00 178.44 179.75 3hgp n ASN 74 N -3.34 2.70 -3.89 -0.43 3.02 -1.26 -4.99 115.26 107.06 3hgp n ASN 74 Ca -0.02 -1.83 -0.11 0.00 -0.03 0.00 0.00 54.58 52.60 3hgp n ASN 74 Cb 0.19 -0.17 -0.10 0.00 -0.61 0.00 0.00 39.78 39.10 3hgp n ASN 74 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3hgp s GLN 75 N -1.03 0.50 -0.25 3.52 -0.21 -1.17 -5.11 119.66 115.90 3hgp s GLN 75 Ca 0.23 -0.50 -0.29 0.00 0.02 0.00 0.00 55.36 54.82 3hgp s GLN 75 Cb 0.13 0.20 -0.02 0.00 1.00 0.00 0.00 33.01 34.32 3hgp s GLN 75 CO 0.18 -0.12 1.60 1.21 -2.12 0.00 0.00 175.29 176.04 3hgp s ASN 76 N -1.56 6.34 0.18 5.90 2.47 -1.26 -4.62 114.94 122.39 3hgp s ASN 76 Ca -0.13 1.50 0.10 0.00 0.42 0.00 0.00 52.86 54.75 3hgp s ASN 76 Cb -0.06 -2.53 -0.06 0.00 -1.45 0.00 0.00 41.25 37.14 3hgp s ASN 76 CO 0.00 -1.31 1.37 0.44 -3.72 0.00 0.00 177.10 173.88 3hgp h ASP 77 N 10.87 0.00 0.00 -4.21 5.19 -1.92 -3.48 116.42 122.87 3hgp h ASP 77 Ca -0.33 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.08 3hgp h ASP 77 Cb 1.15 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.66 3hgp h ASP 77 CO 1.01 0.82 0.00 0.61 -3.12 0.00 0.00 179.24 178.57 3hgp n GLY 78 N 1.18 0.48 0.00 2.75 0.00 -1.26 -4.90 105.19 103.44 3hgp n GLY 78 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.50 3hgp n GLY 78 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hgp n THR 79 N -2.93 0.00 -2.54 2.61 -2.24 -1.26 -5.11 114.28 102.81 3hgp n THR 79 Ca 0.00 -0.24 -0.34 0.00 -2.27 0.00 0.00 64.05 61.21 3hgp n THR 79 Cb 0.00 1.34 -0.04 0.00 -2.10 0.00 0.00 70.33 69.53 3hgp n THR 79 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3hgp s GLU 80 N -0.17 3.84 -0.08 -0.78 8.01 -1.17 -4.39 118.70 123.95 3hgp s GLU 80 Ca 0.00 1.28 0.03 0.00 0.01 0.00 0.00 54.97 56.28 3hgp s GLU 80 Cb 0.00 -2.11 0.01 0.00 -4.31 0.00 0.00 34.13 27.72 3hgp s GLU 80 CO 0.00 -0.39 -0.16 -0.65 0.01 0.00 0.00 175.26 174.08 3hgp s GLN 81 N -3.35 2.13 -0.22 1.61 -0.21 -0.31 -4.98 119.66 114.33 3hgp s GLN 81 Ca 0.65 -0.56 -0.08 0.00 0.02 0.00 0.00 55.36 55.40 3hgp s GLN 81 Cb -0.15 -1.72 -0.04 0.00 1.00 0.00 0.00 33.01 32.11 3hgp s GLN 81 CO 0.21 0.05 0.08 0.71 -2.12 0.00 0.00 175.29 174.22 3hgp s TYR 82 N 0.65 3.18 -0.02 0.91 1.51 -1.26 -1.52 117.35 120.80 3hgp s TYR 82 Ca -0.14 -0.10 -0.03 0.00 -1.01 0.00 0.00 57.07 55.79 3hgp s TYR 82 Cb -0.16 -2.18 0.00 0.00 -0.11 0.00 0.00 41.96 39.51 3hgp s TYR 82 CO 0.04 -0.08 0.06 0.54 -1.11 0.00 0.00 175.55 175.01 3hgp s VAL 83 N 1.03 0.03 0.72 0.71 0.11 -0.17 -5.01 120.40 117.82 3hgp s VAL 83 Ca 0.05 -0.25 -0.12 0.00 -2.93 0.00 0.00 61.98 58.72 3hgp s VAL 83 Cb -0.14 -0.18 0.03 0.00 -1.53 0.00 0.00 36.38 34.56 3hgp s VAL 83 CO 0.03 -0.14 1.09 -0.83 -3.33 0.00 0.00 175.10 171.93 3hgp s GLY 84 N -0.41 1.88 -0.36 6.54 0.00 -1.26 -0.66 107.32 113.04 3hgp s GLY 84 Ca -0.05 0.37 -0.16 0.00 0.00 0.00 0.00 44.72 44.88 3hgp s GLY 84 CO 0.00 0.71 0.39 0.14 0.00 0.00 0.00 173.10 174.34 3hgp s VAL 85 N -2.68 5.14 -0.12 1.40 1.01 -1.24 -0.76 120.40 123.15 3hgp s VAL 85 Ca 0.63 -0.04 -0.01 0.00 0.00 0.00 0.00 61.98 62.56 3hgp s VAL 85 Cb -0.18 -3.89 -0.25 0.00 0.00 0.00 0.00 36.38 32.06 3hgp s VAL 85 CO 0.50 -0.19 0.37 1.67 0.00 0.00 0.00 175.10 177.45 3hgp n GLN 86 N 5.46 0.72 -3.82 2.72 7.27 0.40 -4.85 117.38 125.27 3hgp n GLN 86 Ca -0.08 0.25 -0.12 0.00 0.07 0.00 0.00 57.00 57.11 3hgp n GLN 86 Cb 0.49 -1.70 -0.12 0.00 2.41 0.00 0.00 30.24 31.32 3hgp n GLN 86 CO 0.00 0.00 0.00 0.21 0.07 0.00 0.00 177.06 177.34 3hgp s LYS 87 N -2.56 0.27 -0.14 3.69 2.20 -1.01 -4.98 119.74 117.20 3hgp s LYS 87 Ca -0.19 0.10 0.02 0.00 -0.36 0.00 0.00 55.97 55.54 3hgp s LYS 87 Cb 0.07 0.12 0.01 0.00 -1.51 0.00 0.00 37.83 36.52 3hgp s LYS 87 CO 0.77 -0.04 -0.21 0.42 -0.36 0.00 0.00 175.35 175.92 3hgp s ILE 88 N -0.24 2.02 -0.32 5.43 1.01 -1.26 -0.69 121.20 127.15 3hgp s ILE 88 Ca -0.03 -0.95 0.04 0.00 0.00 0.00 0.00 60.65 59.70 3hgp s ILE 88 Cb -0.03 -1.79 0.09 0.00 0.01 0.00 0.00 42.46 40.74 3hgp s ILE 88 CO 0.01 0.54 0.03 -0.69 0.00 0.00 0.00 174.94 174.82 3hgp s VAL 89 N 0.87 2.17 0.31 2.92 1.01 0.25 -5.00 120.40 122.94 3hgp s VAL 89 Ca -0.06 -2.17 -0.23 0.00 0.00 0.00 0.00 61.98 59.53 3hgp s VAL 89 Cb -0.15 -2.55 -0.10 0.00 0.00 0.00 0.00 36.38 33.58 3hgp s VAL 89 CO -0.03 -0.51 0.88 -0.69 0.00 0.00 0.00 175.10 174.75 3hgp s VAL 90 N 0.98 4.35 0.21 2.92 1.01 -1.26 -0.87 120.40 127.74 3hgp s VAL 90 Ca 0.08 1.59 -0.32 0.00 0.00 0.00 0.00 61.98 63.33 3hgp s VAL 90 Cb -0.19 -3.89 -0.13 0.00 0.00 0.00 0.00 36.38 32.17 3hgp s VAL 90 CO -0.08 0.07 1.55 1.57 0.00 0.00 0.00 175.10 178.20 3hgp n HIS 91 N 0.37 2.40 0.33 5.22 -0.00 -0.67 -4.85 115.22 118.02 3hgp n HIS 91 Ca 0.02 0.29 0.22 0.00 0.46 0.00 0.00 57.72 58.71 3hgp n HIS 91 Cb 0.51 -2.54 1.17 0.00 -0.12 0.00 0.00 29.99 29.01 3hgp n HIS 91 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 3hgp h PRO 92 N 5.31 0.00 -0.01 1.57 0.11 -1.93 -1.66 132.00 135.39 3hgp h PRO 92 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3hgp h PRO 92 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3hgp h PRO 92 CO 0.84 0.00 -0.24 0.66 -0.21 0.00 0.00 178.00 179.05 3hgp n TYR 93 N -3.05 0.00 -1.86 0.65 0.53 -1.26 -4.92 117.16 107.24 3hgp n TYR 93 Ca -0.03 0.00 -0.41 0.00 -1.02 0.00 0.00 57.90 56.44 3hgp n TYR 93 Cb 0.08 -0.06 -0.02 0.00 -1.03 0.00 0.00 39.34 38.31 3hgp n TYR 93 CO 0.00 0.00 0.00 -0.46 -1.02 0.00 0.00 176.86 175.38 3hgp s TRP 94 N -2.37 2.82 -0.18 -0.72 -0.11 -0.63 -4.84 118.94 112.91 3hgp s TRP 94 Ca 0.26 0.93 -0.02 0.00 1.22 0.00 0.00 56.10 58.48 3hgp s TRP 94 Cb 0.19 -3.97 -0.01 0.00 -1.50 0.00 0.00 33.47 28.18 3hgp s TRP 94 CO 0.48 -3.17 -0.08 -0.80 -4.62 0.00 0.00 176.95 168.77 3hgp s ASN 95 N 0.33 4.22 0.15 5.86 0.01 -1.26 -5.02 114.94 119.23 3hgp s ASN 95 Ca 0.60 -0.35 -0.34 0.00 -0.71 0.00 0.00 52.86 52.07 3hgp s ASN 95 Cb -0.46 -1.69 -0.16 0.00 0.41 0.00 0.00 41.25 39.35 3hgp s ASN 95 CO 0.49 0.07 1.23 0.41 -1.51 0.00 0.00 177.10 177.78 3hgp n THR 96 N 4.21 0.64 -2.32 1.60 -1.04 -1.26 -1.74 114.28 114.37 3hgp n THR 96 Ca -0.18 -0.16 -0.20 0.00 -2.04 0.00 0.00 64.05 61.47 3hgp n THR 96 Cb 0.52 -0.88 -0.01 0.00 -1.82 0.00 0.00 70.33 68.13 3hgp n THR 96 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3hgp n ASP 97 N 2.19 -5.59 -3.34 8.00 10.43 -1.26 -4.92 116.55 122.05 3hgp n ASP 97 Ca 0.16 0.01 -0.26 0.00 2.57 0.00 0.00 54.79 57.28 3hgp n ASP 97 Cb 0.24 -4.64 -0.08 0.00 1.84 0.00 0.00 41.12 38.47 3hgp n ASP 97 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 3hgp n ASP 98 N -1.70 1.12 -1.76 -2.24 -0.08 -0.71 -5.10 116.55 106.08 3hgp n ASP 98 Ca -0.23 -2.85 0.00 0.00 -1.51 0.00 0.00 54.79 50.20 3hgp n ASP 98 Cb 0.67 -0.64 0.00 0.00 2.34 0.00 0.00 41.12 43.49 3hgp n ASP 98 CO 0.00 0.00 0.00 1.33 0.12 0.00 0.00 177.20 178.65 3hgp n VAL 99 N 1.59 0.47 0.00 5.18 0.24 -1.26 -4.05 118.33 120.51 3hgp n VAL 99 Ca 0.25 -0.11 0.00 0.00 -2.04 0.00 0.00 64.34 62.44 3hgp n VAL 99 Cb 0.48 -1.06 0.00 0.00 -1.47 0.00 0.00 33.84 31.78 3hgp n VAL 99 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3hgp n ALA 99 N 1.75 0.00 0.00 2.33 0.00 -1.26 -4.83 120.51 118.50 3hgp n ALA 99 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3hgp n ALA 99 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.58 3hgp n ALA 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hgp n GLY 100 N 0.00 -1.82 2.38 0.00 0.00 -1.26 -4.96 105.19 99.53 3hgp n GLY 100 Ca 0.00 -1.51 -0.19 0.00 0.00 0.00 0.00 46.02 44.32 3hgp n GLY 100 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3hgp n TYR 101 N 0.00 -0.81 -2.67 1.61 4.01 -1.26 -4.60 117.16 113.45 3hgp n TYR 101 Ca 0.00 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.31 3hgp n TYR 101 Cb 0.00 -3.64 0.00 0.00 -0.31 0.00 0.00 39.34 35.39 3hgp n TYR 101 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 3hgp n ASP 102 N -1.55 5.04 -3.66 7.72 2.03 -1.26 -4.26 116.55 120.60 3hgp n ASP 102 Ca -0.22 -2.98 -0.15 0.00 0.52 0.00 0.00 54.79 51.97 3hgp n ASP 102 Cb 0.67 -1.60 -0.08 0.00 -0.72 0.00 0.00 41.12 39.38 3hgp n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 3hgp s ILE 103 N 2.11 0.01 -0.00 5.18 2.07 -1.26 -3.96 121.20 125.35 3hgp s ILE 103 Ca 0.45 -0.12 -0.16 0.00 -1.41 0.00 0.00 60.65 59.41 3hgp s ILE 103 Cb 0.02 -0.78 0.03 0.00 0.13 0.00 0.00 42.46 41.86 3hgp s ILE 103 CO 0.01 -0.06 0.35 0.00 -1.91 0.00 0.00 174.94 173.33 3hgp s ALA 104 N -0.50 -0.86 -0.02 1.50 0.00 -0.25 -1.66 121.76 119.96 3hgp s ALA 104 Ca -0.06 0.35 0.05 0.00 0.00 0.00 0.00 51.96 52.30 3hgp s ALA 104 Cb -0.03 0.13 -0.03 0.00 0.00 0.00 0.00 23.12 23.19 3hgp s ALA 104 CO 0.04 -0.31 -0.15 -0.51 0.00 0.00 0.00 175.76 174.83 3hgp s LEU 105 N -1.48 2.72 -0.18 0.00 1.43 -0.05 -1.09 118.68 120.02 3hgp s LEU 105 Ca -0.11 -0.26 0.00 0.00 -1.03 0.00 0.00 54.13 52.72 3hgp s LEU 105 Cb -0.04 -1.57 0.01 0.00 0.03 0.00 0.00 46.19 44.63 3hgp s LEU 105 CO 0.03 0.31 -0.17 -0.76 0.23 0.00 0.00 176.35 175.99 3hgp s LEU 106 N -0.99 2.30 -0.17 1.79 1.43 0.58 -0.58 118.68 123.04 3hgp s LEU 106 Ca 0.13 -0.58 -0.22 0.00 -1.03 0.00 0.00 54.13 52.43 3hgp s LEU 106 Cb -0.11 -1.53 -0.02 0.00 0.03 0.00 0.00 46.19 44.56 3hgp s LEU 106 CO 0.02 0.02 0.69 -0.60 0.23 0.00 0.00 176.35 176.71 3hgp s ARG 107 N 1.21 4.27 0.47 1.70 3.52 0.14 -0.90 118.95 129.37 3hgp s ARG 107 Ca 0.03 0.75 -0.17 0.00 -0.13 0.00 0.00 55.73 56.21 3hgp s ARG 107 Cb -0.14 -3.55 -0.09 0.00 -1.56 0.00 0.00 34.95 29.61 3hgp s ARG 107 CO -0.09 -0.21 0.95 -0.51 -0.81 0.00 0.00 175.30 174.63 3hgp s LEU 108 N 1.78 3.74 0.52 -0.88 1.43 0.25 -0.45 118.68 125.06 3hgp s LEU 108 Ca 0.32 1.55 0.31 0.00 -1.03 0.00 0.00 54.13 55.28 3hgp s LEU 108 Cb -0.16 -4.45 1.13 0.00 0.03 0.00 0.00 46.19 42.74 3hgp s LEU 108 CO 0.12 -0.50 1.90 0.00 0.23 0.00 0.00 176.35 178.10 3hgp h ALA 109 N 1.26 1.00 -2.29 4.21 0.00 -1.27 -3.43 119.26 118.73 3hgp h ALA 109 Ca -0.47 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.23 3hgp h ALA 109 Cb 1.18 -0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.82 3hgp h ALA 109 CO 0.62 0.02 -0.67 -0.65 0.00 0.00 0.00 179.25 178.57 3hgp s GLN 110 N -3.58 0.81 -0.18 0.00 -1.52 -1.26 -5.00 119.66 108.93 3hgp s GLN 110 Ca 0.02 -1.35 -0.22 0.00 -1.95 0.00 0.00 55.36 51.87 3hgp s GLN 110 Cb 0.08 0.05 -0.02 0.00 -0.22 0.00 0.00 33.01 32.90 3hgp s GLN 110 CO 0.58 -0.13 0.67 -1.12 -0.25 0.00 0.00 175.29 175.04 3hgp s SER 111 N -3.02 6.76 0.52 5.90 0.01 -1.26 -4.56 113.70 118.05 3hgp s SER 111 Ca 0.15 0.93 -0.19 0.00 1.31 0.00 0.00 55.95 58.15 3hgp s SER 111 Cb 0.07 -2.37 -0.07 0.00 0.21 0.00 0.00 66.02 63.86 3hgp s SER 111 CO -0.04 -0.28 1.04 0.68 0.41 0.00 0.00 173.24 175.05 3hgp s VAL 112 N 1.85 3.89 0.27 3.43 -7.23 -0.33 -4.97 120.40 117.31 3hgp s VAL 112 Ca 0.31 1.06 -0.23 0.00 -1.81 0.00 0.00 61.98 61.31 3hgp s VAL 112 Cb -0.16 -3.46 -0.09 0.00 0.56 0.00 0.00 36.38 33.23 3hgp s VAL 112 CO 0.11 -0.37 0.84 0.42 -0.31 0.00 0.00 175.10 175.79 3hgp s THR 113 N -2.19 4.39 0.14 5.32 -4.23 -1.26 -4.83 115.64 112.97 3hgp s THR 113 Ca 0.65 1.56 -0.04 0.00 -1.18 0.00 0.00 61.69 62.68 3hgp s THR 113 Cb -0.15 -3.93 -0.05 0.00 1.34 0.00 0.00 72.50 69.70 3hgp s THR 113 CO 0.26 0.17 0.36 -0.76 -0.54 0.00 0.00 174.62 174.10 3hgp s LEU 114 N -2.03 4.27 0.00 4.79 1.43 -1.26 -4.84 118.68 121.05 3hgp s LEU 114 Ca 0.47 0.53 -0.03 0.00 -1.03 0.00 0.00 54.13 54.07 3hgp s LEU 114 Cb -0.17 -3.25 0.01 0.00 0.03 0.00 0.00 46.19 42.80 3hgp s LEU 114 CO 0.22 0.06 0.12 -0.46 0.23 0.00 0.00 176.35 176.52 3hgp n ASN 115 N 0.04 -0.19 0.05 2.29 0.23 -0.24 -4.95 115.26 112.49 3hgp n ASN 115 Ca -0.03 -1.10 0.08 0.00 -0.53 0.00 0.00 54.58 53.01 3hgp n ASN 115 Cb 0.52 0.31 0.36 0.00 -2.08 0.00 0.00 39.78 38.88 3hgp n ASN 115 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 3hgp n SER 116 N -0.62 0.25 -0.14 0.53 3.41 -1.26 -1.78 113.62 114.01 3hgp n SER 116 Ca -0.00 0.57 0.09 0.00 -0.26 0.00 0.00 58.87 59.27 3hgp n SER 116 Cb 0.07 -0.62 -0.08 0.00 -0.26 0.00 0.00 64.21 63.32 3hgp n SER 116 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3hgp n TYR 117 N -1.78 0.00 -3.56 7.33 4.01 -1.26 -4.60 117.16 117.31 3hgp n TYR 117 Ca 0.03 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.50 3hgp n TYR 117 Cb 0.17 0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.05 3hgp n TYR 117 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3hgp s VAL 118 N -2.63 -0.11 0.04 -0.72 1.01 -0.73 -3.74 120.40 113.51 3hgp s VAL 118 Ca 0.10 -0.48 -0.01 0.00 0.00 0.00 0.00 61.98 61.58 3hgp s VAL 118 Cb 0.15 -0.81 -0.03 0.00 0.00 0.00 0.00 36.38 35.69 3hgp s VAL 118 CO 0.70 -0.52 -0.01 -1.10 0.00 0.00 0.00 175.10 174.17 3hgp s GLN 119 N 2.14 0.54 0.31 2.72 -1.52 -0.82 -1.08 119.66 121.96 3hgp s GLN 119 Ca 0.06 -1.02 -0.29 0.00 -1.95 0.00 0.00 55.36 52.16 3hgp s GLN 119 Cb -0.16 0.19 -0.10 0.00 -0.22 0.00 0.00 33.01 32.72 3hgp s GLN 119 CO -0.25 -0.10 1.22 -0.51 -0.25 0.00 0.00 175.29 175.39 3hgp s LEU 120 N -2.50 4.48 0.21 2.90 1.43 -1.26 -3.39 118.68 120.56 3hgp s LEU 120 Ca 0.00 2.50 -0.30 0.00 -1.03 0.00 0.00 54.13 55.31 3hgp s LEU 120 Cb 0.03 -3.64 -0.09 0.00 0.03 0.00 0.00 46.19 42.52 3hgp s LEU 120 CO -0.07 -0.36 1.25 -0.83 0.23 0.00 0.00 176.35 176.57 3hgp s GLY 121 N -0.64 2.61 -0.06 -3.19 0.00 0.78 -4.81 107.32 102.00 3hgp s GLY 121 Ca 0.47 1.04 -0.30 0.00 0.00 0.00 0.00 44.72 45.94 3hgp s GLY 121 CO 0.47 1.94 1.11 0.14 0.00 0.00 0.00 173.10 176.77 3hgp s VAL 122 N -0.10 4.49 0.09 1.40 1.01 -1.26 -4.84 120.40 121.19 3hgp s VAL 122 Ca 0.54 1.79 0.02 0.00 0.00 0.00 0.00 61.98 64.33 3hgp s VAL 122 Cb -0.35 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 31.84 3hgp s VAL 122 CO 0.39 0.02 0.15 -0.76 0.00 0.00 0.00 175.10 174.90 3hgp s LEU 123 N 1.96 4.07 0.68 3.92 1.43 -1.26 -0.21 118.68 129.27 3hgp s LEU 123 Ca 0.53 0.10 -0.13 0.00 -1.03 0.00 0.00 54.13 53.60 3hgp s LEU 123 Cb -0.22 -2.70 0.01 0.00 0.03 0.00 0.00 46.19 43.30 3hgp s LEU 123 CO 0.21 0.15 1.07 -2.16 0.23 0.00 0.00 176.35 175.86 3hgp s PRO 124 N -2.58 2.87 0.55 1.29 0.04 -1.26 -4.90 135.00 131.01 3hgp s PRO 124 Ca 0.32 1.13 -0.21 0.00 0.04 0.00 0.00 61.00 62.28 3hgp s PRO 124 Cb -0.12 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.40 3hgp s PRO 124 CO 0.25 -1.16 1.30 1.03 0.04 0.00 0.00 177.00 178.46 3hgp s ARG 125 N -4.61 3.13 0.17 4.56 0.52 -1.26 -4.79 118.95 116.67 3hgp s ARG 125 Ca 0.61 2.09 -0.33 0.00 -0.52 0.00 0.00 55.73 57.59 3hgp s ARG 125 Cb -0.16 -2.18 -0.15 0.00 0.52 0.00 0.00 34.95 32.97 3hgp s ARG 125 CO 0.48 -1.16 1.21 0.00 0.02 0.00 0.00 175.30 175.85 3hgp n ALA 126 N -1.14 -0.57 -0.21 2.13 0.00 -1.26 -1.96 120.51 117.49 3hgp n ALA 126 Ca 0.11 0.46 0.00 0.00 0.00 0.00 0.00 53.44 54.01 3hgp n ALA 126 Cb 0.46 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.85 3hgp n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hgp n GLY 127 N 2.08 1.67 3.72 0.00 0.00 -0.68 -5.01 105.19 106.97 3hgp n GLY 127 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 3hgp n GLY 127 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hgp s THR 128 N -2.90 2.89 -0.06 2.61 2.01 -0.83 -5.00 115.64 114.37 3hgp s THR 128 Ca 0.00 0.66 0.05 0.00 0.31 0.00 0.00 61.69 62.71 3hgp s THR 128 Cb 0.00 -3.42 -0.01 0.00 0.01 0.00 0.00 72.50 69.08 3hgp s THR 128 CO 0.00 0.06 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.14 3hgp s ILE 129 N 0.91 1.83 0.22 1.82 -1.09 -1.26 -4.76 121.20 118.87 3hgp s ILE 129 Ca 0.66 -0.93 -0.30 0.00 -2.23 0.00 0.00 60.65 57.84 3hgp s ILE 129 Cb -0.41 -1.56 -0.09 0.00 -1.58 0.00 0.00 42.46 38.83 3hgp s ILE 129 CO 0.33 0.51 0.96 -0.76 -1.23 0.00 0.00 174.94 174.75 3hgp s LEU 130 N -0.02 4.62 0.68 2.97 1.43 -1.26 -5.05 118.68 122.05 3hgp s LEU 130 Ca -0.06 1.95 -0.17 0.00 -1.03 0.00 0.00 54.13 54.82 3hgp s LEU 130 Cb -0.14 -3.61 0.01 0.00 0.03 0.00 0.00 46.19 42.48 3hgp s LEU 130 CO 0.04 0.10 1.27 0.00 0.23 0.00 0.00 176.35 177.99 3hgp n ALA 131 N 1.69 0.92 -1.61 4.21 0.00 -1.26 -4.88 120.51 119.57 3hgp n ALA 131 Ca -0.01 -0.06 -0.41 0.00 0.00 0.00 0.00 53.44 52.96 3hgp n ALA 131 Cb 0.47 -2.31 0.02 0.00 0.00 0.00 0.00 19.45 17.63 3hgp n ALA 131 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3hgp n ASN 132 N -2.16 1.22 -1.37 0.00 5.15 -1.26 -2.45 115.26 114.40 3hgp n ASN 132 Ca 0.15 1.00 -0.13 0.00 -0.60 0.00 0.00 54.58 55.00 3hgp n ASN 132 Cb 0.48 -1.36 -0.02 0.00 -0.53 0.00 0.00 39.78 38.35 3hgp n ASN 132 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 3hgp n ASN 133 N 0.31 -4.15 -4.79 1.20 5.15 0.24 -4.93 115.26 108.30 3hgp n ASN 133 Ca 0.10 0.06 -0.35 0.00 -0.60 0.00 0.00 54.58 53.78 3hgp n ASN 133 Cb 0.41 -3.22 -0.03 0.00 -0.53 0.00 0.00 39.78 36.40 3hgp n ASN 133 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 3hgp s SER 134 N -2.51 6.39 -0.14 1.20 0.01 -1.03 -4.56 113.70 113.06 3hgp s SER 134 Ca 0.00 2.05 -0.29 0.00 1.31 0.00 0.00 55.95 59.01 3hgp s SER 134 Cb 0.00 -2.58 -0.01 0.00 0.21 0.00 0.00 66.02 63.64 3hgp s SER 134 CO 0.00 -0.75 1.16 -2.16 0.41 0.00 0.00 173.24 171.90 3hgp s PRO 135 N -2.92 4.30 0.03 12.44 0.04 -1.26 -1.43 135.00 146.21 3hgp s PRO 135 Ca 0.64 1.56 -0.03 0.00 0.04 0.00 0.00 61.00 63.21 3hgp s PRO 135 Cb -0.21 -3.65 -0.02 0.00 0.04 0.00 0.00 34.50 30.67 3hgp s PRO 135 CO 0.25 -0.56 0.03 0.00 0.04 0.00 0.00 177.00 176.76 3hgp s TYR 137 N -2.57 2.46 0.22 0.00 2.02 0.49 -0.74 117.35 119.23 3hgp s TYR 137 Ca -0.05 -0.87 -0.22 0.00 -0.37 0.00 0.00 57.07 55.55 3hgp s TYR 137 Cb -0.02 -1.63 -0.08 0.00 -0.40 0.00 0.00 41.96 39.83 3hgp s TYR 137 CO -0.05 -0.32 0.78 -1.50 -1.57 0.00 0.00 175.55 172.89 3hgp s ILE 138 N 0.10 4.45 0.10 2.71 2.07 -0.24 -0.86 121.20 129.53 3hgp s ILE 138 Ca -0.11 1.50 0.06 0.00 -1.41 0.00 0.00 60.65 60.69 3hgp s ILE 138 Cb -0.16 -3.97 -0.03 0.00 0.13 0.00 0.00 42.46 38.43 3hgp s ILE 138 CO 0.06 0.29 -0.16 0.42 -1.91 0.00 0.00 174.94 173.65 3hgp s THR 139 N -1.43 1.38 0.00 4.00 -4.23 -1.21 -1.33 115.64 112.83 3hgp s THR 139 Ca 0.42 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 59.37 3hgp s THR 139 Cb -0.19 -1.41 0.00 0.00 1.34 0.00 0.00 72.50 72.24 3hgp s THR 139 CO 0.23 -0.27 0.00 0.61 -0.54 0.00 0.00 174.62 174.65 3hgp n GLY 140 N 0.88 0.11 1.15 3.99 0.00 -0.43 -4.54 105.19 106.34 3hgp n GLY 140 Ca -0.18 -1.19 0.10 0.00 0.00 0.00 0.00 46.02 44.74 3hgp n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3hgp n TRP 141 N -0.84 0.86 -0.52 1.61 8.01 -1.26 -1.57 117.44 123.74 3hgp n TRP 141 Ca 0.00 -0.52 -0.29 0.00 -1.31 0.00 0.00 57.50 55.38 3hgp n TRP 141 Cb 0.00 -0.04 0.27 0.00 -2.01 0.00 0.00 31.31 29.53 3hgp n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 3hgp s GLY 142 N -1.01 1.48 0.30 6.99 0.00 -1.25 -1.29 107.32 112.54 3hgp s GLY 142 Ca 0.41 -0.54 -0.27 0.00 0.00 0.00 0.00 44.72 44.32 3hgp s GLY 142 CO 0.27 0.34 0.98 1.04 0.00 0.00 0.00 173.10 175.72 3hgp n LEU 143 N -5.25 1.72 -0.24 0.66 4.77 0.32 -1.96 117.00 117.02 3hgp n LEU 143 Ca 0.08 1.16 0.13 0.00 -0.03 0.00 0.00 56.01 57.34 3hgp n LEU 143 Cb 0.58 -1.28 0.30 0.00 -2.33 0.00 0.00 43.42 40.69 3hgp n LEU 143 CO 0.50 -1.51 0.57 0.35 -1.33 0.00 0.00 177.39 175.97 3hgp n THR 144 N 0.11 0.00 -3.81 -5.08 -2.24 -0.69 -1.18 114.28 101.38 3hgp n THR 144 Ca 0.10 -0.12 -0.11 0.00 -2.27 0.00 0.00 64.05 61.64 3hgp n THR 144 Cb 0.33 0.49 -0.08 0.00 -2.10 0.00 0.00 70.33 68.97 3hgp n THR 144 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3hgp s ARG 145 N -2.57 0.72 0.22 -0.78 0.52 -1.26 -4.06 118.95 111.72 3hgp s ARG 145 Ca 0.22 -0.56 -0.32 0.00 -0.52 0.00 0.00 55.73 54.55 3hgp s ARG 145 Cb 0.19 0.30 -0.14 0.00 0.52 0.00 0.00 34.95 35.83 3hgp s ARG 145 CO 0.56 -0.21 1.45 2.41 0.02 0.00 0.00 175.30 179.52 3hgp n THR 147 N 0.72 0.69 -2.16 0.02 -1.04 -1.26 -0.77 114.28 110.48 3hgp n THR 147 Ca -0.19 -0.17 -0.21 0.00 -2.04 0.00 0.00 64.05 61.44 3hgp n THR 147 Cb 0.59 -1.48 -0.03 0.00 -1.82 0.00 0.00 70.33 67.59 3hgp n THR 147 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3hgp n ASN 148 N 2.48 -5.73 0.00 8.00 3.02 -1.26 -4.97 115.26 116.81 3hgp n ASN 148 Ca 0.13 0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.83 3hgp n ASN 148 Cb 0.30 -4.86 0.00 0.00 -0.61 0.00 0.00 39.78 34.62 3hgp n ASN 148 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hgp n GLY 149 N -0.82 2.07 3.30 7.41 0.00 0.05 -5.13 105.19 112.07 3hgp n GLY 149 Ca -0.23 -1.83 -0.17 0.00 0.00 0.00 0.00 46.02 43.79 3hgp n GLY 149 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3hgp s GLN 150 N 4.38 1.21 0.64 1.61 -2.07 -1.26 -4.92 119.66 119.26 3hgp s GLN 150 Ca 0.00 -1.52 -0.18 0.00 -1.82 0.00 0.00 55.36 51.85 3hgp s GLN 150 Cb 0.00 -0.93 -0.02 0.00 -1.09 0.00 0.00 33.01 30.97 3hgp s GLN 150 CO 0.00 0.14 1.10 1.28 -1.32 0.00 0.00 175.29 176.50 3hgp n LEU 151 N -0.25 4.70 -4.78 2.60 4.77 -1.26 -1.70 117.00 121.08 3hgp n LEU 151 Ca -0.09 0.79 -0.34 0.00 -0.03 0.00 0.00 56.01 56.33 3hgp n LEU 151 Cb 0.60 -1.46 0.01 0.00 -2.33 0.00 0.00 43.42 40.24 3hgp n LEU 151 CO 0.33 -1.53 0.76 0.00 -1.33 0.00 0.00 177.39 175.63 3hgp s ALA 152 N -1.51 2.65 -0.14 -1.18 0.00 -0.41 -4.81 121.76 116.35 3hgp s ALA 152 Ca 0.79 0.71 -0.25 0.00 0.00 0.00 0.00 51.96 53.20 3hgp s ALA 152 Cb -0.39 -3.33 -0.23 0.00 0.00 0.00 0.00 23.12 19.17 3hgp s ALA 152 CO 0.44 -0.89 0.65 1.96 0.00 0.00 0.00 175.76 177.92 3hgp h GLN 153 N 0.85 0.00 -6.00 0.00 4.20 -1.94 -3.45 115.11 108.78 3hgp h GLN 153 Ca -0.49 0.00 -0.61 0.00 0.06 0.00 0.00 58.65 57.61 3hgp h GLN 153 Cb 1.25 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.99 3hgp h GLN 153 CO 0.56 0.89 -0.38 0.95 -0.67 0.00 0.00 178.83 180.19 3hgp s THR 154 N -2.17 5.27 0.18 -0.54 -4.23 -1.26 -0.82 115.64 112.07 3hgp s THR 154 Ca -0.18 0.01 -0.33 0.00 -1.18 0.00 0.00 61.69 60.01 3hgp s THR 154 Cb -0.02 -3.60 -0.13 0.00 1.34 0.00 0.00 72.50 70.09 3hgp s THR 154 CO 0.61 0.21 1.63 -0.11 -0.54 0.00 0.00 174.62 176.42 3hgp n LEU 155 N 0.59 3.44 -4.78 4.79 7.94 -0.40 -4.84 117.00 123.74 3hgp n LEU 155 Ca -0.07 1.08 -0.26 0.00 -1.11 0.00 0.00 56.01 55.65 3hgp n LEU 155 Cb 0.52 -1.48 -0.06 0.00 0.53 0.00 0.00 43.42 42.93 3hgp n LEU 155 CO 0.46 -0.11 -0.23 -1.10 -1.11 0.00 0.00 177.39 175.29 3hgp s GLN 156 N 0.96 2.83 0.06 1.96 -1.52 -0.61 -0.97 119.66 122.37 3hgp s GLN 156 Ca 0.77 -0.91 0.05 0.00 -1.95 0.00 0.00 55.36 53.31 3hgp s GLN 156 Cb -0.61 -2.60 -0.03 0.00 -0.22 0.00 0.00 33.01 29.55 3hgp s GLN 156 CO 0.36 0.48 -0.13 1.14 -0.25 0.00 0.00 175.29 176.89 3hgp s GLN 157 N -3.11 0.78 -0.06 2.91 -2.07 0.08 -1.31 119.66 116.87 3hgp s GLN 157 Ca 0.30 -0.91 -0.05 0.00 -1.82 0.00 0.00 55.36 52.88 3hgp s GLN 157 Cb -0.10 -0.75 0.02 0.00 -1.09 0.00 0.00 33.01 31.10 3hgp s GLN 157 CO 0.23 0.16 0.17 0.00 -1.32 0.00 0.00 175.29 174.53 3hgp s ALA 158 N -1.26 -0.40 -0.30 2.60 0.00 -0.44 -0.94 121.76 121.03 3hgp s ALA 158 Ca -0.03 0.50 -0.29 0.00 0.00 0.00 0.00 51.96 52.14 3hgp s ALA 158 Cb -0.10 -0.30 0.01 0.00 0.00 0.00 0.00 23.12 22.73 3hgp s ALA 158 CO 0.02 -0.09 1.17 -0.47 0.00 0.00 0.00 175.76 176.39 3hgp s TYR 159 N 0.22 2.97 -0.36 0.00 5.04 -1.26 -1.08 117.35 122.87 3hgp s TYR 159 Ca -0.01 1.07 0.02 0.00 -2.44 0.00 0.00 57.07 55.71 3hgp s TYR 159 Cb -0.02 -3.75 0.11 0.00 0.35 0.00 0.00 41.96 38.65 3hgp s TYR 159 CO -0.01 -1.16 0.12 -0.51 -1.34 0.00 0.00 175.55 172.65 3hgp s LEU 160 N 3.88 3.53 0.51 6.97 1.43 0.08 -4.94 118.68 130.14 3hgp s LEU 160 Ca 0.50 -2.15 -0.21 0.00 -1.03 0.00 0.00 54.13 51.24 3hgp s LEU 160 Cb -0.14 -1.28 -0.06 0.00 0.03 0.00 0.00 46.19 44.74 3hgp s LEU 160 CO 0.18 -0.36 1.20 -2.16 0.23 0.00 0.00 176.35 175.44 3hgp s PRO 161 N 0.93 3.44 0.66 1.29 0.04 -1.26 -3.79 135.00 136.31 3hgp s PRO 161 Ca 0.12 1.84 -0.16 0.00 0.04 0.00 0.00 61.00 62.85 3hgp s PRO 161 Cb -0.20 -2.23 -0.00 0.00 0.04 0.00 0.00 34.50 32.11 3hgp s PRO 161 CO -0.12 -0.84 1.13 0.95 0.04 0.00 0.00 177.00 178.17 3hgp s THR 162 N -1.55 3.04 -0.23 1.26 -4.23 -0.51 -0.69 115.64 112.72 3hgp s THR 162 Ca 0.69 0.51 0.02 0.00 -1.18 0.00 0.00 61.69 61.73 3hgp s THR 162 Cb -0.30 -3.05 0.04 0.00 1.34 0.00 0.00 72.50 70.53 3hgp s THR 162 CO 0.35 -0.27 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.34 3hgp s VAL 163 N -2.18 2.19 1.05 2.29 1.01 -0.26 -0.59 120.40 123.91 3hgp s VAL 163 Ca 0.69 -1.36 -0.12 0.00 0.00 0.00 0.00 61.98 61.19 3hgp s VAL 163 Cb -0.23 -2.16 0.22 0.00 0.00 0.00 0.00 36.38 34.21 3hgp s VAL 163 CO 0.40 0.17 1.07 1.51 0.00 0.00 0.00 175.10 178.25 3hgp s ASP 164 N 1.18 2.08 0.20 3.32 1.47 -1.26 -4.02 116.67 119.64 3hgp s ASP 164 Ca -0.04 1.42 -0.10 0.00 1.18 0.00 0.00 52.55 55.01 3hgp s ASP 164 Cb -0.17 -2.12 0.15 0.00 -0.34 0.00 0.00 42.92 40.43 3hgp s ASP 164 CO -0.08 -3.50 1.86 0.22 0.68 0.00 0.00 175.17 174.35 3hgp h TYR 165 N -2.15 0.96 -0.62 2.11 3.20 -1.93 0.31 116.97 118.85 3hgp h TYR 165 Ca -0.56 0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.38 3hgp h TYR 165 Cb 1.32 -0.32 -0.06 0.00 1.54 0.00 0.00 36.73 39.22 3hgp h TYR 165 CO 0.31 0.63 0.33 0.00 -1.64 0.00 0.00 178.16 177.79 3hgp h ALA 166 N 1.25 0.83 -0.02 1.82 0.00 -1.97 0.64 119.26 121.80 3hgp h ALA 166 Ca 0.27 0.03 -0.18 0.00 0.00 0.00 0.00 54.91 55.02 3hgp h ALA 166 Cb -0.06 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.66 3hgp h ALA 166 CO -0.05 -0.02 -0.71 0.82 0.00 0.00 0.00 179.25 179.29 3hgp h ILE 167 N 0.60 1.38 -0.32 0.00 2.04 -1.81 -3.33 117.51 116.08 3hgp h ILE 167 Ca 0.28 -2.09 -0.06 0.00 1.00 0.00 0.00 64.86 63.99 3hgp h ILE 167 Cb 0.21 2.48 -0.02 0.00 -0.74 0.00 0.00 36.82 38.76 3hgp h ILE 167 CO -0.20 0.62 -0.06 0.00 0.00 0.00 0.00 178.15 178.52 3hgp n SER 169 N -4.25 8.07 0.00 0.00 3.41 0.19 -0.42 113.62 120.63 3hgp n SER 169 Ca 0.01 -3.06 0.00 0.00 -0.26 0.00 0.00 58.87 55.56 3hgp n SER 169 Cb 0.28 -1.39 0.00 0.00 -0.26 0.00 0.00 64.21 62.83 3hgp n SER 169 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3hgp n SER 170 N 2.06 0.00 0.00 4.04 7.64 -1.26 -3.55 113.62 122.55 3hgp n SER 170 Ca 0.64 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.52 3hgp n SER 170 Cb 0.25 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 3hgp n SER 170 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 3hgp n TYR 171 N 0.00 0.00 1.10 1.43 4.02 -1.26 -4.87 117.16 117.58 3hgp n TYR 171 Ca 0.00 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 58.01 3hgp n TYR 171 Cb 0.00 0.00 0.14 0.00 -0.02 0.00 0.00 39.34 39.46 3hgp n TYR 171 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76 3hgp n TRP 172 N 0.00 0.00 -3.93 -0.72 7.02 0.44 -4.88 117.44 115.37 3hgp n TRP 172 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 3hgp n TRP 172 Cb 0.00 -0.03 0.00 0.00 -2.42 0.00 0.00 31.31 28.86 3hgp n TRP 172 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3hgp n GLY 173 N 1.38 2.01 0.00 6.99 0.00 -1.20 -2.22 105.19 112.14 3hgp n GLY 173 Ca 0.11 -0.44 0.10 0.00 0.00 0.00 0.00 46.02 45.79 3hgp n GLY 173 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hgp n SER 174 N -1.01 0.00 -0.28 1.61 3.41 -1.26 -3.07 113.62 113.01 3hgp n SER 174 Ca 0.00 -0.13 -0.01 0.00 -0.26 0.00 0.00 58.87 58.47 3hgp n SER 174 Cb 0.00 -0.24 0.19 0.00 -0.26 0.00 0.00 64.21 63.90 3hgp n SER 174 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3hgp h THR 175 N 0.00 1.22 -3.35 6.66 2.02 -1.82 -3.42 112.91 114.22 3hgp h THR 175 Ca 0.00 -0.42 -0.56 0.00 0.77 0.00 0.00 66.41 66.20 3hgp h THR 175 Cb 0.16 -0.02 -0.04 0.00 -1.74 0.00 0.00 68.15 66.51 3hgp h THR 175 CO 0.00 0.22 0.05 -0.69 0.37 0.00 0.00 175.52 175.47 3hgp s VAL 176 N -5.93 4.77 0.30 3.16 1.01 -1.18 -4.83 120.40 117.70 3hgp s VAL 176 Ca -0.12 1.40 0.08 0.00 0.00 0.00 0.00 61.98 63.35 3hgp s VAL 176 Cb 0.18 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 3hgp s VAL 176 CO 0.80 0.43 0.13 -0.54 0.00 0.00 0.00 175.10 175.93 3hgp s LYS 177 N -0.39 2.50 0.06 2.72 1.02 -1.26 -4.86 119.74 119.53 3hgp s LYS 177 Ca 0.33 -1.39 0.17 0.00 0.02 0.00 0.00 55.97 55.11 3hgp s LYS 177 Cb -0.20 -2.29 0.73 0.00 -0.52 0.00 0.00 37.83 35.55 3hgp s LYS 177 CO 0.20 0.23 1.54 -1.71 -0.92 0.00 0.00 175.35 174.69 3hgp n ASN 178 N -1.12 0.17 -0.35 2.83 5.15 -1.26 -1.48 115.26 119.20 3hgp n ASN 178 Ca -0.05 0.54 0.03 0.00 -0.60 0.00 0.00 54.58 54.51 3hgp n ASN 178 Cb 0.60 -0.58 0.10 0.00 -0.53 0.00 0.00 39.78 39.37 3hgp n ASN 178 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 3hgp n SER 179 N -1.69 1.02 -4.49 1.20 3.41 -1.26 -4.85 113.62 106.97 3hgp n SER 179 Ca 0.03 -1.98 -0.25 0.00 -0.26 0.00 0.00 58.87 56.41 3hgp n SER 179 Cb 0.19 -0.12 -0.10 0.00 -0.26 0.00 0.00 64.21 63.91 3hgp n SER 179 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 3hgp s MET 180 N -1.75 1.75 -0.09 4.33 -1.94 -0.55 -0.75 119.30 120.30 3hgp s MET 180 Ca 0.14 -1.56 0.02 0.00 -1.71 0.00 0.00 55.69 52.57 3hgp s MET 180 Cb 0.07 -1.90 -0.02 0.00 2.01 0.00 0.00 34.83 34.99 3hgp s MET 180 CO 0.10 0.38 -0.14 0.08 -0.01 0.00 0.00 175.02 175.43 3hgp s VAL 181 N -2.06 3.07 -0.12 -6.03 1.01 0.37 -4.68 120.40 111.95 3hgp s VAL 181 Ca 0.26 -0.69 -0.06 0.00 0.00 0.00 0.00 61.98 61.49 3hgp s VAL 181 Cb -0.07 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 3hgp s VAL 181 CO 0.14 0.56 0.11 0.00 0.00 0.00 0.00 175.10 175.91 3hgp s ALA 183 N -0.91 -0.74 0.00 0.00 0.00 -0.51 -1.11 121.76 118.49 3hgp s ALA 183 Ca 0.14 0.86 0.00 0.00 0.00 0.00 0.00 51.96 52.96 3hgp s ALA 183 Cb -0.12 -0.50 0.00 0.00 0.00 0.00 0.00 23.12 22.50 3hgp s ALA 183 CO 0.03 -0.14 0.00 0.41 0.00 0.00 0.00 175.76 176.06 3hgp n GLY 184 N 2.97 0.90 2.03 0.00 0.00 0.13 -1.29 105.19 109.94 3hgp n GLY 184 Ca -0.13 -1.31 -0.01 0.00 0.00 0.00 0.00 46.02 44.57 3hgp n GLY 184 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hgp n GLY 185 N 0.00 0.45 0.00 -0.02 0.00 -1.26 -4.58 105.19 99.78 3hgp n GLY 185 Ca 0.00 -1.04 0.15 0.00 0.00 0.00 0.00 46.02 45.13 3hgp n GLY 185 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hgp n ASP 186 N 1.83 0.00 0.00 1.61 5.75 -1.26 -1.01 116.55 123.47 3hgp n ASP 186 Ca -0.01 -0.17 0.00 0.00 -0.01 0.00 0.00 54.79 54.60 3hgp n ASP 186 Cb 0.06 -0.27 0.00 0.00 -1.03 0.00 0.00 41.12 39.87 3hgp n ASP 186 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hgp n GLY 187 N 1.21 1.61 0.45 6.12 0.00 -1.26 -4.75 105.19 108.58 3hgp n GLY 187 Ca 0.14 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.12 3hgp n GLY 187 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3hgp n VAL 188 N -2.00 0.26 -5.04 1.61 0.31 -1.26 -4.53 118.33 107.68 3hgp n VAL 188 Ca 0.00 -0.08 -0.32 0.00 -0.01 0.00 0.00 64.34 63.93 3hgp n VAL 188 Cb 0.00 -1.13 -0.14 0.00 -0.91 0.00 0.00 33.84 31.65 3hgp n VAL 188 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3hgp s ARG 188 N -2.09 2.43 0.04 5.55 0.52 -1.26 -3.65 118.95 120.49 3hgp s ARG 188 Ca -0.07 -0.78 -0.28 0.00 -0.52 0.00 0.00 55.73 54.08 3hgp s ARG 188 Cb 0.02 -2.27 0.10 0.00 0.52 0.00 0.00 34.95 33.31 3hgp s ARG 188 CO 0.10 0.57 1.10 -1.54 0.02 0.00 0.00 175.30 175.54 3hgp s SER 189 N -0.61 -0.15 0.88 0.23 1.04 -0.95 -4.35 113.70 109.78 3hgp s SER 189 Ca 0.09 -0.22 -0.12 0.00 0.48 0.00 0.00 55.95 56.18 3hgp s SER 189 Cb -0.11 0.32 0.12 0.00 0.10 0.00 0.00 66.02 66.45 3hgp s SER 189 CO 0.00 -0.58 1.09 -0.83 0.98 0.00 0.00 173.24 173.91 3hgp s GLY 190 N -2.84 1.62 0.31 7.32 0.00 -1.26 -0.88 107.32 111.59 3hgp s GLY 190 Ca 0.12 -0.10 -0.20 0.00 0.00 0.00 0.00 44.72 44.55 3hgp s GLY 190 CO -0.02 0.38 0.74 0.00 0.00 0.00 0.00 173.10 174.20 3hgp n GLN 192 N -0.48 2.44 0.00 0.00 3.00 -1.26 -1.09 117.38 119.99 3hgp n GLN 192 Ca -0.05 0.88 0.00 0.00 -0.01 0.00 0.00 57.00 57.82 3hgp n GLN 192 Cb 0.59 -2.70 0.00 0.00 0.00 0.00 0.00 30.24 28.14 3hgp n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3hgp n GLY 193 N 3.77 1.49 0.13 1.08 0.00 -1.26 -0.52 105.19 109.89 3hgp n GLY 193 Ca 0.17 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.22 3hgp n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3hgp h ASP 194 N 0.00 0.00 -0.95 1.61 3.45 -1.38 -3.19 116.42 115.96 3hgp h ASP 194 Ca 0.00 0.00 -0.68 0.00 0.43 0.00 0.00 57.03 56.78 3hgp h ASP 194 Cb 0.00 0.00 0.08 0.00 -0.56 0.00 0.00 39.33 38.85 3hgp h ASP 194 CO 0.00 0.46 -0.27 -1.20 -1.57 0.00 0.00 179.24 176.66 3hgp n SER 195 N -3.10 -0.70 0.00 6.45 7.64 -1.26 -1.47 113.62 121.18 3hgp n SER 195 Ca -0.01 1.08 0.00 0.00 1.01 0.00 0.00 58.87 60.95 3hgp n SER 195 Cb 0.74 -0.89 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 3hgp n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hgp n GLY 196 N 1.70 2.99 3.93 0.23 0.00 0.45 -0.42 105.19 114.08 3hgp n GLY 196 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 3hgp n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hgp s GLY 197 N -1.77 1.81 0.41 -0.02 0.00 -0.54 -3.29 107.32 103.92 3hgp s GLY 197 Ca 0.00 -1.29 -0.16 0.00 0.00 0.00 0.00 44.72 43.26 3hgp s GLY 197 CO 0.00 -0.47 0.86 2.56 0.00 0.00 0.00 173.10 176.05 3hgp s PRO 198 N -5.94 4.01 -0.29 2.90 0.04 -1.26 -0.98 135.00 133.49 3hgp s PRO 198 Ca 0.76 0.83 -0.05 0.00 0.04 0.00 0.00 61.00 62.58 3hgp s PRO 198 Cb -0.03 -2.28 0.02 0.00 0.04 0.00 0.00 34.50 32.25 3hgp s PRO 198 CO 0.54 -0.03 0.04 -1.17 0.04 0.00 0.00 177.00 176.41 3hgp s LEU 199 N -3.45 3.73 -0.25 -3.56 2.96 -0.42 -3.30 118.68 114.40 3hgp s LEU 199 Ca 0.57 -0.87 -0.11 0.00 -0.22 0.00 0.00 54.13 53.50 3hgp s LEU 199 Cb -0.10 -1.80 -0.05 0.00 0.50 0.00 0.00 46.19 44.74 3hgp s LEU 199 CO 0.22 -0.20 0.17 -1.00 -1.32 0.00 0.00 176.35 174.22 3hgp s HIS 200 N 1.41 3.29 -0.03 5.38 3.76 -0.04 -1.01 115.29 128.05 3hgp s HIS 200 Ca 0.00 0.19 0.06 0.00 -0.15 0.00 0.00 55.06 55.16 3hgp s HIS 200 Cb -0.18 -2.30 -0.01 0.00 1.11 0.00 0.00 32.58 31.20 3hgp s HIS 200 CO 0.00 0.00 -0.21 0.00 -0.85 0.00 0.00 174.74 173.69 3hgp s LEU 202 N -0.28 4.24 -0.05 0.00 2.96 -0.53 -1.44 118.68 123.58 3hgp s LEU 202 Ca 0.03 0.20 -0.00 0.00 -0.22 0.00 0.00 54.13 54.13 3hgp s LEU 202 Cb -0.10 -2.77 0.03 0.00 0.50 0.00 0.00 46.19 43.84 3hgp s LEU 202 CO 0.01 -0.56 -0.01 -0.69 -1.32 0.00 0.00 176.35 173.78 3hgp s VAL 203 N 2.66 0.35 -1.51 1.68 1.01 -0.53 -4.63 120.40 119.43 3hgp s VAL 203 Ca 0.24 0.04 -0.11 0.00 0.00 0.00 0.00 61.98 62.15 3hgp s VAL 203 Cb -0.15 -0.45 0.07 0.00 0.00 0.00 0.00 36.38 35.86 3hgp s VAL 203 CO 0.14 0.21 0.88 0.59 0.00 0.00 0.00 175.10 176.91 3hgp n ASN 204 N 4.48 -3.71 0.00 3.32 3.02 -1.26 -1.92 115.26 119.20 3hgp n ASN 204 Ca -0.19 -0.83 0.00 0.00 -0.03 0.00 0.00 54.58 53.53 3hgp n ASN 204 Cb 0.50 -3.72 0.00 0.00 -0.61 0.00 0.00 39.78 35.95 3hgp n ASN 204 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hgp n GLY 205 N -1.66 1.62 3.22 7.41 0.00 -1.26 -5.02 105.19 109.51 3hgp n GLY 205 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 3hgp n GLY 205 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3hgp s GLN 206 N -0.08 2.29 0.15 1.61 0.74 -0.81 -5.10 119.66 118.45 3hgp s GLN 206 Ca 0.00 -0.80 -0.30 0.00 0.05 0.00 0.00 55.36 54.31 3hgp s GLN 206 Cb 0.00 -1.95 -0.07 0.00 1.10 0.00 0.00 33.01 32.09 3hgp s GLN 206 CO 0.00 0.33 0.99 0.71 -0.55 0.00 0.00 175.29 176.77 3hgp s TYR 207 N -0.09 3.79 0.09 1.67 2.02 -1.26 -1.45 117.35 122.12 3hgp s TYR 207 Ca -0.04 1.77 0.03 0.00 -0.37 0.00 0.00 57.07 58.46 3hgp s TYR 207 Cb -0.13 -3.10 -0.04 0.00 -0.40 0.00 0.00 41.96 38.30 3hgp s TYR 207 CO 0.03 0.05 -0.09 0.00 -1.57 0.00 0.00 175.55 173.98 3hgp s ALA 208 N -0.26 1.02 -0.72 3.71 0.00 -0.52 -4.68 121.76 120.31 3hgp s ALA 208 Ca 0.46 -1.19 -0.21 0.00 0.00 0.00 0.00 51.96 51.02 3hgp s ALA 208 Cb -0.25 0.07 0.09 0.00 0.00 0.00 0.00 23.12 23.03 3hgp s ALA 208 CO 0.31 -0.10 0.98 0.08 0.00 0.00 0.00 175.76 177.04 3hgp s VAL 209 N -2.68 4.47 -0.30 0.00 1.01 0.70 -0.51 120.40 123.08 3hgp s VAL 209 Ca 0.06 -0.72 0.23 0.00 0.00 0.00 0.00 61.98 61.54 3hgp s VAL 209 Cb -0.01 -4.69 0.07 0.00 0.00 0.00 0.00 36.38 31.75 3hgp s VAL 209 CO -0.01 -1.44 1.18 0.45 0.00 0.00 0.00 175.10 175.27 3hgp h HIS 210 N 9.36 0.00 -3.84 5.22 3.86 -1.38 -3.38 115.15 124.98 3hgp h HIS 210 Ca -0.18 0.00 -0.29 0.00 -1.16 0.00 0.00 60.37 58.74 3hgp h HIS 210 Cb 1.06 0.00 -0.18 0.00 1.06 0.00 0.00 27.41 29.35 3hgp h HIS 210 CO 1.00 0.00 -0.73 0.20 0.86 0.00 0.00 177.93 179.27 3hgp s GLY 211 N -4.28 0.71 -0.25 2.45 0.00 -1.15 -1.44 107.32 103.37 3hgp s GLY 211 Ca 0.01 -1.07 -0.03 0.00 0.00 0.00 0.00 44.72 43.63 3hgp s GLY 211 CO 0.76 -1.14 -0.04 0.14 0.00 0.00 0.00 173.10 172.82 3hgp s VAL 212 N -2.29 3.15 0.22 1.40 1.01 -0.52 -1.30 120.40 122.07 3hgp s VAL 212 Ca 0.01 -0.83 -0.32 0.00 0.00 0.00 0.00 61.98 60.84 3hgp s VAL 212 Cb -0.04 -2.55 -0.12 0.00 0.00 0.00 0.00 36.38 33.67 3hgp s VAL 212 CO -0.01 0.25 1.72 0.41 0.00 0.00 0.00 175.10 177.47 3hgp n THR 213 N 4.73 0.08 0.03 3.92 -1.04 -0.15 -0.48 114.28 121.36 3hgp n THR 213 Ca -0.17 -0.02 -0.00 0.00 -2.04 0.00 0.00 64.05 61.82 3hgp n THR 213 Cb 0.48 -1.99 -0.00 0.00 -1.82 0.00 0.00 70.33 67.00 3hgp n THR 213 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 3hgp n SER 214 N 3.85 0.71 -3.90 8.00 2.88 0.11 -0.41 113.62 124.85 3hgp n SER 214 Ca 0.15 0.09 -0.09 0.00 -1.33 0.00 0.00 58.87 57.69 3hgp n SER 214 Cb 0.35 -0.22 -0.04 0.00 -0.75 0.00 0.00 64.21 63.55 3hgp n SER 214 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 3hgp s PHE 215 N -1.63 0.13 0.35 0.66 -0.71 -0.68 -4.90 117.98 111.20 3hgp s PHE 215 Ca -0.00 -0.51 0.04 0.00 -1.04 0.00 0.00 56.93 55.42 3hgp s PHE 215 Cb 0.00 0.32 -0.03 0.00 -1.21 0.00 0.00 43.02 42.10 3hgp s PHE 215 CO 0.00 -1.00 0.14 0.14 -1.34 0.00 0.00 175.22 173.17 3hgp s VAL 216 N -3.96 0.51 0.66 -2.49 -7.23 -1.26 -1.24 120.40 105.39 3hgp s VAL 216 Ca 0.16 -2.00 -0.17 0.00 -1.81 0.00 0.00 61.98 58.16 3hgp s VAL 216 Cb -0.01 -2.47 -0.00 0.00 0.56 0.00 0.00 36.38 34.45 3hgp s VAL 216 CO 0.05 0.00 1.24 -0.55 -0.31 0.00 0.00 175.10 175.53 3hgp s SER 217 N -3.48 4.66 0.14 4.85 0.15 -1.23 -4.92 113.70 113.88 3hgp s SER 217 Ca 0.31 2.46 0.17 0.00 0.70 0.00 0.00 55.95 59.59 3hgp s SER 217 Cb 0.04 -2.60 0.74 0.00 -1.71 0.00 0.00 66.02 62.49 3hgp s SER 217 CO 0.17 -1.95 1.51 0.54 1.20 0.00 0.00 173.24 174.71 3hgp n ARG 217 N -2.07 0.09 0.01 5.44 1.74 -1.26 -2.72 116.66 117.90 3hgp n ARG 217 Ca 0.14 0.41 0.11 0.00 -0.77 0.00 0.00 57.85 57.75 3hgp n ARG 217 Cb 0.49 -1.71 0.12 0.00 -1.02 0.00 0.00 32.46 30.34 3hgp n ARG 217 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3hgp n LEU 218 N -1.89 0.63 0.00 0.55 4.77 -1.26 -5.05 117.00 114.75 3hgp n LEU 218 Ca 0.02 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 3hgp n LEU 218 Cb 0.14 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 3hgp n LEU 218 CO 0.13 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 3hgp n GLY 219 N 1.44 1.27 0.23 -0.72 0.00 -1.10 -5.01 105.19 101.31 3hgp n GLY 219 Ca 0.04 -1.48 -0.09 0.00 0.00 0.00 0.00 46.02 44.49 3hgp n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hgp s ASN 221 N -5.00 6.19 -0.05 0.00 4.22 -1.26 -4.69 114.94 114.34 3hgp s ASN 221 Ca -0.09 -1.46 0.00 0.00 -2.14 0.00 0.00 52.86 49.17 3hgp s ASN 221 Cb 0.01 -2.28 0.02 0.00 1.28 0.00 0.00 41.25 40.29 3hgp s ASN 221 CO 0.28 -1.02 -0.02 -0.69 -2.04 0.00 0.00 177.10 173.60 3hgp s VAL 221 N 2.40 0.45 0.27 3.54 1.01 -1.26 -4.73 120.40 122.08 3hgp s VAL 221 Ca 0.10 -0.02 -0.30 0.00 0.00 0.00 0.00 61.98 61.76 3hgp s VAL 221 Cb -0.25 -0.52 -0.11 0.00 0.00 0.00 0.00 36.38 35.50 3hgp s VAL 221 CO 0.06 0.23 1.55 -0.89 0.00 0.00 0.00 175.10 176.05 3hgp s THR 222 N 1.28 2.26 -1.79 3.92 2.01 -1.26 -1.53 115.64 120.54 3hgp s THR 222 Ca -0.05 0.22 0.00 0.00 0.31 0.00 0.00 61.69 62.16 3hgp s THR 222 Cb -0.14 -3.14 0.00 0.00 0.01 0.00 0.00 72.50 69.24 3hgp s THR 222 CO -0.02 0.03 0.00 0.54 -0.69 0.00 0.00 174.62 174.48 3hgp n ARG 223 N 2.36 -1.18 -3.49 4.92 1.74 -0.18 -4.91 116.66 115.92 3hgp n ARG 223 Ca 0.08 1.09 -0.27 0.00 -0.77 0.00 0.00 57.85 57.99 3hgp n ARG 223 Cb 0.38 -5.31 -0.09 0.00 -1.02 0.00 0.00 32.46 26.42 3hgp n ARG 223 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3hgp n LYS 224 N -2.49 1.60 -1.35 5.56 4.76 -0.58 -4.31 118.16 121.34 3hgp n LYS 224 Ca -0.17 -4.08 -0.36 0.00 -2.87 0.00 0.00 58.31 50.83 3hgp n LYS 224 Cb 0.55 -1.94 0.08 0.00 -1.84 0.00 0.00 35.03 31.88 3hgp n LYS 224 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 3hgp n PRO 225 N 1.55 0.49 -1.80 1.97 -0.04 -1.26 -4.45 135.00 131.46 3hgp n PRO 225 Ca 0.25 0.22 -0.40 0.00 -0.04 0.00 0.00 63.50 63.53 3hgp n PRO 225 Cb 0.43 -2.15 0.02 0.00 -0.04 0.00 0.00 33.50 31.76 3hgp n PRO 225 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 3hgp s THR 226 N -1.82 2.08 -0.06 0.52 2.01 -0.41 -4.75 115.64 113.21 3hgp s THR 226 Ca 0.72 0.07 0.03 0.00 0.31 0.00 0.00 61.69 62.82 3hgp s THR 226 Cb -0.35 -3.04 -0.02 0.00 0.01 0.00 0.00 72.50 69.10 3hgp s THR 226 CO 0.51 0.01 -0.15 0.54 -0.69 0.00 0.00 174.62 174.84 3hgp s VAL 227 N -1.20 2.96 0.07 3.82 0.11 -0.38 -1.43 120.40 124.36 3hgp s VAL 227 Ca 0.60 -0.75 0.06 0.00 -2.93 0.00 0.00 61.98 58.97 3hgp s VAL 227 Cb -0.44 -2.16 -0.03 0.00 -1.53 0.00 0.00 36.38 32.22 3hgp s VAL 227 CO 0.57 0.58 -0.17 -0.36 -3.33 0.00 0.00 175.10 172.38 3hgp s PHE 228 N -0.52 1.48 0.19 1.54 0.08 0.15 -0.71 117.98 120.18 3hgp s PHE 228 Ca 0.07 -0.42 -0.30 0.00 0.12 0.00 0.00 56.93 56.40 3hgp s PHE 228 Cb -0.12 -0.83 -0.09 0.00 -0.57 0.00 0.00 43.02 41.41 3hgp s PHE 228 CO 0.01 0.11 1.33 0.99 -0.10 0.00 0.00 175.22 177.56 3hgp s THR 229 N -1.10 3.18 -0.56 0.64 2.01 0.36 -0.48 115.64 119.69 3hgp s THR 229 Ca 0.03 0.95 -0.28 0.00 0.31 0.00 0.00 61.69 62.70 3hgp s THR 229 Cb -0.09 -3.61 0.03 0.00 0.01 0.00 0.00 72.50 68.84 3hgp s THR 229 CO 0.03 0.13 1.19 -0.60 -0.69 0.00 0.00 174.62 174.68 3hgp s ARG 230 N 0.05 3.55 0.26 4.92 3.52 0.07 -1.43 118.95 129.88 3hgp s ARG 230 Ca 0.58 0.31 -0.02 0.00 -0.13 0.00 0.00 55.73 56.47 3hgp s ARG 230 Cb -0.37 -4.00 0.46 0.00 -1.56 0.00 0.00 34.95 29.48 3hgp s ARG 230 CO 0.37 -1.64 1.81 0.28 -0.81 0.00 0.00 175.30 175.31 3hgp h VAL 231 N 6.18 0.87 0.00 7.11 2.07 -1.54 -1.66 116.25 129.29 3hgp h VAL 231 Ca -0.25 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.00 3hgp h VAL 231 Cb 1.06 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 3hgp h VAL 231 CO 1.18 0.15 0.00 -1.54 0.02 0.00 0.00 177.57 177.37 3hgp n SER 232 N -4.74 0.20 0.03 0.57 3.41 -1.26 -0.91 113.62 110.91 3hgp n SER 232 Ca 0.15 0.56 0.13 0.00 -0.26 0.00 0.00 58.87 59.46 3hgp n SER 232 Cb 0.33 -0.60 0.49 0.00 -0.26 0.00 0.00 64.21 64.17 3hgp n SER 232 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hgp n ALA 233 N -1.59 2.49 -0.47 7.33 0.00 -0.62 -1.69 120.51 125.97 3hgp n ALA 233 Ca 0.02 -0.12 0.04 0.00 0.00 0.00 0.00 53.44 53.38 3hgp n ALA 233 Cb 0.12 -1.41 0.05 0.00 0.00 0.00 0.00 19.45 18.21 3hgp n ALA 233 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3hgp n TYR 234 N -1.74 0.00 -0.13 0.00 4.02 -0.09 -4.80 117.16 114.42 3hgp n TYR 234 Ca 0.06 -0.64 -0.07 0.00 -0.01 0.00 0.00 57.90 57.24 3hgp n TYR 234 Cb 0.37 -0.08 0.01 0.00 -0.02 0.00 0.00 39.34 39.62 3hgp n TYR 234 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 3hgp h ILE 235 N 0.30 1.05 -0.69 -0.72 1.08 -1.72 -0.02 117.51 116.80 3hgp h ILE 235 Ca 0.00 -0.17 -0.03 0.00 -0.39 0.00 0.00 64.86 64.26 3hgp h ILE 235 Cb 0.72 0.50 -0.03 0.00 -3.07 0.00 0.00 36.82 34.94 3hgp h ILE 235 CO 0.00 0.09 0.30 0.28 -0.69 0.00 0.00 178.15 178.13 3hgp h SER 236 N 0.51 0.92 -0.04 1.72 0.02 -1.92 -0.91 113.55 113.86 3hgp h SER 236 Ca 0.16 -0.15 0.02 0.00 -0.84 0.00 0.00 61.79 60.97 3hgp h SER 236 Cb -0.00 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.28 3hgp h SER 236 CO -0.07 0.82 -0.06 -0.25 -1.14 0.00 0.00 176.83 176.14 3hgp h TRP 237 N 0.96 -0.14 -0.10 3.45 7.01 -1.79 0.14 115.95 125.49 3hgp h TRP 237 Ca 0.23 0.01 0.04 0.00 2.11 0.00 0.00 58.89 61.27 3hgp h TRP 237 Cb 0.17 0.07 -0.04 0.00 -2.10 0.00 0.00 29.16 27.26 3hgp h TRP 237 CO 0.01 -0.09 -0.13 0.82 -2.79 0.00 0.00 178.44 176.26 3hgp h ILE 238 N -0.08 0.65 -0.84 2.65 2.04 -0.79 -0.39 117.51 120.74 3hgp h ILE 238 Ca 0.04 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.88 3hgp h ILE 238 Cb 0.13 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 36.82 3hgp h ILE 238 CO -0.09 0.00 0.44 0.78 0.00 0.00 0.00 178.15 179.29 3hgp h ASN 239 N -0.17 1.06 -0.61 1.72 2.35 -0.96 -1.51 115.58 117.46 3hgp h ASN 239 Ca 0.08 -0.10 -0.09 0.00 -0.55 0.00 0.00 56.30 55.64 3hgp h ASN 239 Cb 0.28 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 3hgp h ASN 239 CO -0.20 0.86 0.03 0.78 -1.65 0.00 0.00 177.43 177.25 3hgp h ASN 240 N 1.18 1.02 -0.27 5.81 2.35 -0.54 -1.12 115.58 124.02 3hgp h ASN 240 Ca 0.29 -0.29 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 3hgp h ASN 240 Cb 0.05 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.14 3hgp h ASN 240 CO -0.04 1.06 0.13 0.58 -1.65 0.00 0.00 177.43 177.51 3hgp h VAL 241 N 0.95 1.14 -0.53 2.81 2.07 -0.71 -1.79 116.25 120.20 3hgp h VAL 241 Ca 0.18 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 3hgp h VAL 241 Cb 0.52 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 3hgp h VAL 241 CO 0.03 0.15 0.28 0.40 0.02 0.00 0.00 177.57 178.44 3hgp h ILE 242 N 0.30 1.19 0.00 4.57 2.04 -1.16 -2.40 117.51 122.04 3hgp h ILE 242 Ca 0.09 -0.49 -0.05 0.00 1.00 0.00 0.00 64.86 65.41 3hgp h ILE 242 Cb 0.11 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 3hgp h ILE 242 CO -0.01 0.20 -0.26 0.00 0.00 0.00 0.00 178.15 178.08 3hgp h ALA 243 N 1.11 1.26 -0.01 1.87 0.00 -1.07 -2.69 119.26 119.73 3hgp h ALA 243 Ca 0.18 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3hgp h ALA 243 Cb 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3hgp h ALA 243 CO -0.03 0.32 -0.20 -1.13 0.00 0.00 0.00 179.25 178.21 3hgp n SER 244 N -3.77 1.48 0.00 0.00 3.41 -0.69 -5.09 113.62 108.96 3hgp n SER 244 Ca -0.01 -1.25 0.00 0.00 -0.26 0.00 0.00 58.87 57.35 3hgp n SER 244 Cb 0.36 0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 3hgp n SER 244 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47