#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c7u n GLY 2 N 0.00 2.19 3.90 0.00 0.00 -1.26 -5.05 105.19 104.97 3c7u n GLY 2 Ca 0.00 -1.64 -0.29 0.00 0.00 0.00 0.00 46.02 44.08 3c7u n GLY 2 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3c7u s VAL 3 N -1.43 1.99 0.36 1.61 -7.23 -1.26 -4.90 120.40 109.54 3c7u s VAL 3 Ca 0.00 0.00 -0.28 0.00 -1.81 0.00 0.00 61.98 59.89 3c7u s VAL 3 Cb 0.00 -2.97 -0.10 0.00 0.56 0.00 0.00 36.38 33.87 3c7u s VAL 3 CO 0.00 0.00 1.38 -0.32 -0.31 0.00 0.00 175.10 175.85 3c7u s MET 4 N -5.70 4.18 0.23 4.82 0.00 -0.66 -4.94 119.30 117.24 3c7u s MET 4 Ca 0.68 2.35 0.00 0.00 0.00 0.00 0.00 55.69 58.72 3c7u s MET 4 Cb -0.08 -2.97 -0.05 0.00 0.00 0.00 0.00 34.83 31.74 3c7u s MET 4 CO 0.51 -0.38 0.12 0.95 0.00 0.00 0.00 175.02 176.22 3c7u s THR 5 N -1.15 0.28 0.24 10.11 -4.23 -1.26 -4.16 115.64 115.47 3c7u s THR 5 Ca 0.52 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.96 3c7u s THR 5 Cb -0.42 -2.57 0.24 0.00 1.34 0.00 0.00 72.50 71.10 3c7u s THR 5 CO 0.56 0.00 1.92 1.23 -0.54 0.00 0.00 174.62 177.79 3c7u h GLY 6 N 2.48 1.37 0.92 3.99 0.00 -1.93 -1.70 103.07 108.21 3c7u h GLY 6 Ca -0.37 -0.52 0.00 0.00 0.00 0.00 0.00 47.33 46.45 3c7u h GLY 6 CO 0.56 0.51 -0.04 0.00 0.00 0.00 0.00 176.54 177.57 3c7u h ALA 7 N 1.35 -0.05 -0.87 3.60 0.00 -1.97 -1.52 119.26 119.81 3c7u h ALA 7 Ca 0.36 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 3c7u h ALA 7 Cb -0.14 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 3c7u h ALA 7 CO -0.08 -0.54 0.46 0.87 0.00 0.00 0.00 179.25 179.97 3c7u h LYS 8 N -0.08 1.21 -0.32 0.00 1.57 -1.87 -2.06 116.57 115.03 3c7u h LYS 8 Ca 0.01 -0.15 0.06 0.00 -1.87 0.00 0.00 60.65 58.70 3c7u h LYS 8 Cb 0.09 -0.23 -0.05 0.00 0.08 0.00 0.00 32.23 32.11 3c7u h LYS 8 CO -0.03 0.90 -0.01 0.35 -0.57 0.00 0.00 179.45 180.09 3c7u h PHE 9 N 1.22 -0.03 -0.80 -1.35 3.57 -1.12 -1.83 116.94 116.60 3c7u h PHE 9 Ca 0.30 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.89 3c7u h PHE 9 Cb 0.05 0.06 -0.06 0.00 2.79 0.00 0.00 35.95 38.79 3c7u h PHE 9 CO 0.01 -0.06 0.48 1.15 -2.23 0.00 0.00 178.31 177.66 3c7u h THR 10 N 0.08 1.01 -0.35 4.41 2.02 -0.94 -3.17 112.91 115.97 3c7u h THR 10 Ca 0.16 -0.30 -0.14 0.00 0.77 0.00 0.00 66.41 66.89 3c7u h THR 10 Cb 0.21 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.68 3c7u h THR 10 CO -0.27 0.16 -0.35 1.56 0.37 0.00 0.00 175.52 176.99 3c7u h GLN 11 N 0.88 0.82 -6.73 6.66 4.20 -1.13 -3.43 115.11 116.37 3c7u h GLN 11 Ca 0.35 -0.40 -0.53 0.00 0.06 0.00 0.00 58.65 58.13 3c7u h GLN 11 Cb 0.18 0.00 0.07 0.00 0.30 0.00 0.00 27.48 28.03 3c7u h GLN 11 CO -0.18 1.04 0.88 0.42 -0.67 0.00 0.00 178.83 180.32 3c7u s ILE 12 N -4.41 2.29 0.11 2.54 1.01 -0.71 -5.02 121.20 117.02 3c7u s ILE 12 Ca -0.10 0.23 0.07 0.00 0.00 0.00 0.00 60.65 60.85 3c7u s ILE 12 Cb 0.12 -3.15 -0.04 0.00 0.01 0.00 0.00 42.46 39.41 3c7u s ILE 12 CO 0.86 0.03 -0.17 -1.10 0.00 0.00 0.00 174.94 174.55 3c7u s GLN 13 N 0.13 1.06 0.46 2.79 -0.21 -1.26 -4.96 119.66 117.68 3c7u s GLN 13 Ca 0.66 -1.18 -0.24 0.00 0.02 0.00 0.00 55.36 54.62 3c7u s GLN 13 Cb -0.46 -1.14 -0.09 0.00 1.00 0.00 0.00 33.01 32.33 3c7u s GLN 13 CO 0.41 0.25 1.23 1.19 -2.12 0.00 0.00 175.29 176.24 3c7u n PHE 14 N 0.85 1.92 0.00 0.91 3.01 -1.26 -2.30 117.46 120.59 3c7u n PHE 14 Ca -0.18 0.49 0.00 0.00 1.01 0.00 0.00 57.45 58.77 3c7u n PHE 14 Cb 0.55 -2.33 0.00 0.00 -0.01 0.00 0.00 39.48 37.69 3c7u n PHE 14 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3c7u n GLY 15 N 0.89 3.28 3.78 1.37 0.00 -0.14 -4.91 105.19 109.46 3c7u n GLY 15 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 3c7u n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3c7u s MET 16 N -0.87 2.79 0.70 1.61 -1.94 -0.97 -4.48 119.30 116.14 3c7u s MET 16 Ca 0.00 1.32 -0.04 0.00 -1.71 0.00 0.00 55.69 55.26 3c7u s MET 16 Cb 0.00 -1.95 0.09 0.00 2.01 0.00 0.00 34.83 34.98 3c7u s MET 16 CO 0.00 -1.25 0.99 0.95 -0.01 0.00 0.00 175.02 175.70 3c7u s THR 17 N -2.45 2.29 0.19 2.05 -4.23 -1.26 -0.63 115.64 111.59 3c7u s THR 17 Ca 0.65 -0.42 -0.09 0.00 -1.18 0.00 0.00 61.69 60.66 3c7u s THR 17 Cb -0.19 -2.87 0.09 0.00 1.34 0.00 0.00 72.50 70.87 3c7u s THR 17 CO 0.43 0.00 1.68 0.03 -0.54 0.00 0.00 174.62 176.23 3c7u h ARG 18 N -0.55 1.10 -0.39 3.99 3.08 -1.83 -2.49 114.38 117.28 3c7u h ARG 18 Ca -0.42 -0.30 -0.11 0.00 0.07 0.00 0.00 59.98 59.23 3c7u h ARG 18 Cb 1.29 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 31.20 3c7u h ARG 18 CO 0.50 1.01 -0.19 0.37 -1.07 0.00 0.00 179.97 180.59 3c7u h GLN 19 N 1.02 0.76 -0.41 0.04 5.75 -1.94 -2.22 115.11 118.09 3c7u h GLN 19 Ca 0.20 -0.29 -0.01 0.00 -0.15 0.00 0.00 58.65 58.40 3c7u h GLN 19 Cb 0.45 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.93 3c7u h GLN 19 CO 0.01 0.89 0.22 1.96 -2.65 0.00 0.00 178.83 179.26 3c7u h GLN 20 N 0.67 0.58 -0.35 1.69 4.20 -1.90 -1.00 115.11 119.01 3c7u h GLN 20 Ca 0.10 -0.07 0.04 0.00 0.06 0.00 0.00 58.65 58.78 3c7u h GLN 20 Cb 0.68 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.31 3c7u h GLN 20 CO 0.05 0.48 0.10 0.28 -0.67 0.00 0.00 178.83 179.07 3c7u h VAL 21 N 0.53 0.87 -0.50 -0.54 2.07 -1.33 -1.72 116.25 115.64 3c7u h VAL 21 Ca 0.14 -0.08 -0.08 0.00 0.82 0.00 0.00 66.70 67.51 3c7u h VAL 21 Cb 0.07 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 3c7u h VAL 21 CO -0.02 0.04 0.00 -0.07 0.02 0.00 0.00 177.57 177.54 3c7u h LEU 22 N 0.23 0.80 -0.27 2.57 3.38 -1.23 0.60 115.31 121.39 3c7u h LEU 22 Ca 0.16 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 3c7u h LEU 22 Cb 0.16 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3c7u h LEU 22 CO -0.19 0.86 0.01 0.44 0.09 0.00 0.00 178.44 179.66 3c7u h ASP 23 N 0.78 0.45 -0.13 -0.43 3.32 -0.74 0.18 116.42 119.85 3c7u h ASP 23 Ca 0.15 -0.30 -0.07 0.00 0.02 0.00 0.00 57.03 56.83 3c7u h ASP 23 Cb 0.46 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.89 3c7u h ASP 23 CO 0.02 0.64 -0.21 0.40 -1.72 0.00 0.00 179.24 178.36 3c7u h ILE 24 N 0.25 1.37 -0.12 0.35 2.04 -1.25 -3.34 117.51 116.82 3c7u h ILE 24 Ca 0.08 -1.46 -0.17 0.00 1.00 0.00 0.00 64.86 64.31 3c7u h ILE 24 Cb 0.40 2.02 -0.01 0.00 -0.74 0.00 0.00 36.82 38.49 3c7u h ILE 24 CO 0.01 0.43 -0.64 0.00 0.00 0.00 0.00 178.15 177.95 3c7u h ALA 25 N 0.55 0.68 0.00 1.87 0.00 -0.84 -3.48 119.26 118.03 3c7u h ALA 25 Ca 0.01 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.36 3c7u h ALA 25 Cb 0.79 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3c7u h ALA 25 CO 0.05 0.73 0.00 0.41 0.00 0.00 0.00 179.25 180.43 3c7u n GLY 26 N 0.39 0.35 0.51 0.00 0.00 0.61 -4.52 105.19 102.53 3c7u n GLY 26 Ca -0.04 -0.82 0.35 0.00 0.00 0.00 0.00 46.02 45.52 3c7u n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c7u h ALA 27 N 0.00 2.88 0.00 4.61 0.00 -1.82 0.15 119.26 125.09 3c7u h ALA 27 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3c7u h ALA 27 Cb 0.00 0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3c7u h ALA 27 CO 0.00 -1.35 0.00 0.93 0.00 0.00 0.00 179.25 178.83 3c7u h GLU 28 N 0.13 0.00 0.00 0.00 3.07 -1.91 -1.68 114.58 114.19 3c7u h GLU 28 Ca 0.69 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.55 3c7u h GLU 28 Cb 2.35 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 30.26 3c7u h GLU 28 CO -0.20 0.00 -0.48 0.09 -1.40 0.00 0.00 179.01 177.03 3c7u n ASN 29 N -2.92 0.48 -4.62 1.42 3.02 0.52 -4.98 115.26 108.18 3c7u n ASN 29 Ca -0.01 -0.14 -0.25 0.00 -0.03 0.00 0.00 54.58 54.14 3c7u n ASN 29 Cb 0.18 0.18 -0.08 0.00 -0.61 0.00 0.00 39.78 39.45 3c7u n ASN 29 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3c7u s GLU 31 N -3.14 1.01 0.18 0.00 -1.05 -0.12 -4.97 118.70 110.59 3c7u s GLU 31 Ca 0.28 -1.13 -0.07 0.00 -0.15 0.00 0.00 54.97 53.90 3c7u s GLU 31 Cb -0.08 0.35 -0.02 0.00 -0.44 0.00 0.00 34.13 33.94 3c7u s GLU 31 CO 0.18 -0.34 0.26 -0.08 0.95 0.00 0.00 175.26 176.22 3c7u s THR 32 N -3.94 0.05 0.00 1.83 -1.32 -1.26 -1.26 115.64 109.75 3c7u s THR 32 Ca 0.13 -1.56 0.00 0.00 -1.21 0.00 0.00 61.69 59.05 3c7u s THR 32 Cb 0.04 -2.02 0.00 0.00 -1.51 0.00 0.00 72.50 69.01 3c7u s THR 32 CO -0.04 -0.24 0.00 0.61 -2.21 0.00 0.00 174.62 172.74 3c7u n GLY 33 N -0.23 -1.14 7.00 6.08 0.00 0.16 -4.93 105.19 112.14 3c7u n GLY 33 Ca -0.05 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.76 3c7u n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3c7u n GLY 34 N 0.00 3.63 0.21 -0.02 0.00 -1.26 -1.49 105.19 106.26 3c7u n GLY 34 Ca 0.00 -0.02 0.15 0.00 0.00 0.00 0.00 46.02 46.15 3c7u n GLY 34 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3c7u h SER 35 N 0.00 0.00 -0.02 1.61 0.02 -2.02 -3.10 113.55 110.04 3c7u h SER 35 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3c7u h SER 35 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 3c7u h SER 35 CO 0.00 0.00 -0.15 0.49 -1.14 0.00 0.00 176.83 176.03 3c7u n PHE 36 N -2.57 0.00 -0.11 3.45 3.01 -0.55 -5.06 117.46 115.63 3c7u n PHE 36 Ca -0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 3c7u n PHE 36 Cb 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.64 3c7u n PHE 36 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3c7u n GLY 37 N 1.22 3.52 0.92 1.37 0.00 -1.18 -1.62 105.19 109.42 3c7u n GLY 37 Ca 0.11 -0.10 0.10 0.00 0.00 0.00 0.00 46.02 46.13 3c7u n GLY 37 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3c7u n ASP 38 N 4.57 2.72 -4.84 1.61 5.75 -1.26 0.40 116.55 125.50 3c7u n ASP 38 Ca 0.00 -1.92 -0.30 0.00 -0.01 0.00 0.00 54.79 52.55 3c7u n ASP 38 Cb 0.00 -0.26 0.05 0.00 -1.03 0.00 0.00 41.12 39.89 3c7u n ASP 38 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 3c7u s SER 39 N -1.30 5.27 -0.19 -1.12 0.01 -0.64 -4.75 113.70 110.99 3c7u s SER 39 Ca 0.36 1.38 -0.02 0.00 1.31 0.00 0.00 55.95 58.97 3c7u s SER 39 Cb 0.19 -2.23 -0.01 0.00 0.21 0.00 0.00 66.02 64.19 3c7u s SER 39 CO 0.27 -1.48 -0.09 -0.63 0.41 0.00 0.00 173.24 171.72 3c7u s ILE 40 N -3.17 3.12 -0.17 1.44 -1.09 -0.47 -4.11 121.20 116.75 3c7u s ILE 40 Ca 0.58 -0.60 0.00 0.00 -2.23 0.00 0.00 60.65 58.41 3c7u s ILE 40 Cb -0.13 -2.38 0.01 0.00 -1.58 0.00 0.00 42.46 38.38 3c7u s ILE 40 CO 0.54 0.47 -0.16 -2.28 -1.23 0.00 0.00 174.94 172.28 3c7u s HIS 41 N 1.09 2.79 -0.10 3.97 5.65 -0.39 -0.52 115.29 127.79 3c7u s HIS 41 Ca 0.01 -1.24 0.04 0.00 0.25 0.00 0.00 55.06 54.11 3c7u s HIS 41 Cb -0.15 -1.92 0.00 0.00 -1.18 0.00 0.00 32.58 29.34 3c7u s HIS 41 CO -0.02 -0.60 -0.22 0.00 -0.65 0.00 0.00 174.74 173.25 3c7u s ARG 43 N 0.41 4.25 0.00 0.00 0.52 0.52 -1.55 118.95 123.10 3c7u s ARG 43 Ca -0.18 0.61 0.00 0.00 -0.52 0.00 0.00 55.73 55.64 3c7u s ARG 43 Cb -0.18 -3.34 0.00 0.00 0.52 0.00 0.00 34.95 31.95 3c7u s ARG 43 CO 0.08 0.38 0.00 0.41 0.02 0.00 0.00 175.30 176.19 3c7u n GLY 44 N 2.52 1.22 3.77 -3.53 0.00 0.13 -1.66 105.19 107.63 3c7u n GLY 44 Ca -0.08 -1.79 -0.33 0.00 0.00 0.00 0.00 46.02 43.81 3c7u n GLY 44 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3c7u s HIS 45 N 1.53 2.58 0.29 1.61 -3.43 -1.26 -4.60 115.29 112.01 3c7u s HIS 45 Ca 0.00 1.55 -0.30 0.00 -0.80 0.00 0.00 55.06 55.52 3c7u s HIS 45 Cb 0.00 -3.18 -0.13 0.00 -1.43 0.00 0.00 32.58 27.84 3c7u s HIS 45 CO 0.00 -1.75 1.40 0.00 -2.00 0.00 0.00 174.74 172.39 3c7u n ALA 46 N -2.47 1.48 -3.67 -1.38 0.00 -1.26 -1.13 120.51 112.07 3c7u n ALA 46 Ca 0.10 0.38 -0.09 0.00 0.00 0.00 0.00 53.44 53.84 3c7u n ALA 46 Cb 0.52 -2.30 -0.09 0.00 0.00 0.00 0.00 19.45 17.57 3c7u n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3c7u s ALA 47 N -0.50 -1.29 0.00 0.00 0.00 -0.91 -4.74 121.76 114.32 3c7u s ALA 47 Ca 0.62 1.75 0.00 0.00 0.00 0.00 0.00 51.96 54.32 3c7u s ALA 47 Cb -0.59 -1.17 0.00 0.00 0.00 0.00 0.00 23.12 21.37 3c7u s ALA 47 CO 0.55 -0.44 0.00 0.41 0.00 0.00 0.00 175.76 176.28 3c7u n GLY 48 N 4.60 2.06 0.24 0.00 0.00 -0.57 -0.19 105.19 111.34 3c7u n GLY 48 Ca -0.19 0.44 0.12 0.00 0.00 0.00 0.00 46.02 46.39 3c7u n GLY 48 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3c7u h ASP 49 N 0.00 0.00 0.00 1.61 3.45 -1.92 -3.47 116.42 116.09 3c7u h ASP 49 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3c7u h ASP 49 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 3c7u h ASP 49 CO 0.00 0.17 0.00 0.00 -1.57 0.00 0.00 179.24 177.84 3c7u n TYR 50 N -3.47 0.00 -3.55 4.55 9.36 0.74 -5.18 117.16 119.60 3c7u n TYR 50 Ca -0.01 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 61.07 3c7u n TYR 50 Cb 0.34 0.00 -0.05 0.00 -0.63 0.00 0.00 39.34 39.00 3c7u n TYR 50 CO 0.00 0.00 0.00 0.71 0.22 0.00 0.00 176.86 177.79 3c7u s TYR 51 N 2.14 -0.45 0.53 2.98 1.51 -1.19 -2.14 117.35 120.73 3c7u s TYR 51 Ca 0.00 0.50 -0.22 0.00 -1.01 0.00 0.00 57.07 56.34 3c7u s TYR 51 Cb 0.00 0.37 -0.05 0.00 -0.11 0.00 0.00 41.96 42.17 3c7u s TYR 51 CO 0.00 -0.67 1.32 0.00 -1.11 0.00 0.00 175.55 175.09 3c7u s ALA 52 N -2.54 2.83 0.20 3.71 0.00 -0.29 -4.74 121.76 120.94 3c7u s ALA 52 Ca -0.05 1.25 -0.22 0.00 0.00 0.00 0.00 51.96 52.95 3c7u s ALA 52 Cb -0.01 -3.53 0.05 0.00 0.00 0.00 0.00 23.12 19.63 3c7u s ALA 52 CO -0.02 -1.25 0.63 1.52 0.00 0.00 0.00 175.76 176.63 3c7u s TYR 53 N -1.35 -0.39 0.16 0.00 -0.85 -0.71 0.18 117.35 114.39 3c7u s TYR 53 Ca 0.70 0.08 0.07 0.00 -0.52 0.00 0.00 57.07 57.41 3c7u s TYR 53 Cb -0.38 0.58 -0.04 0.00 0.38 0.00 0.00 41.96 42.50 3c7u s TYR 53 CO 0.45 -0.97 -0.14 0.00 -1.52 0.00 0.00 175.55 173.36 3c7u s ALA 54 N -3.82 1.75 -0.05 9.51 0.00 -0.60 -1.76 121.76 126.79 3c7u s ALA 54 Ca 0.05 -1.48 -0.02 0.00 0.00 0.00 0.00 51.96 50.51 3c7u s ALA 54 Cb -0.02 -0.08 0.04 0.00 0.00 0.00 0.00 23.12 23.05 3c7u s ALA 54 CO -0.06 0.08 0.10 0.99 0.00 0.00 0.00 175.76 176.87 3c7u s THR 55 N -2.59 -0.11 -0.21 0.00 2.01 0.42 -1.17 115.64 113.99 3c7u s THR 55 Ca 0.16 0.27 -0.02 0.00 0.31 0.00 0.00 61.69 62.41 3c7u s THR 55 Cb -0.02 -0.19 0.00 0.00 0.01 0.00 0.00 72.50 72.30 3c7u s THR 55 CO 0.04 0.11 -0.09 -0.36 -0.69 0.00 0.00 174.62 173.63 3c7u s PHE 56 N 1.55 2.91 0.16 4.92 0.08 0.32 -1.39 117.98 126.53 3c7u s PHE 56 Ca -0.04 -1.19 -0.02 0.00 0.12 0.00 0.00 56.93 55.80 3c7u s PHE 56 Cb -0.12 -2.05 -0.05 0.00 -0.57 0.00 0.00 43.02 40.24 3c7u s PHE 56 CO -0.05 -0.64 0.36 0.20 -0.10 0.00 0.00 175.22 175.00 3c7u s GLY 57 N 1.41 2.04 0.21 4.36 0.00 -0.46 -1.37 107.32 113.51 3c7u s GLY 57 Ca 0.05 -0.71 0.10 0.00 0.00 0.00 0.00 44.72 44.17 3c7u s GLY 57 CO -0.06 -0.66 -0.21 -1.36 0.00 0.00 0.00 173.10 170.82 3c7u s PHE 58 N -1.73 2.11 0.59 1.90 0.40 -1.26 -1.35 117.98 118.63 3c7u s PHE 58 Ca 0.39 -0.40 0.30 0.00 -0.60 0.00 0.00 56.93 56.62 3c7u s PHE 58 Cb -0.12 -1.00 1.73 0.00 0.51 0.00 0.00 43.02 44.14 3c7u s PHE 58 CO 0.27 0.50 2.15 1.79 0.70 0.00 0.00 175.22 180.63 3c7u h THR 59 N 2.92 0.46 -2.49 0.64 1.35 -1.32 -3.45 112.91 111.02 3c7u h THR 59 Ca -0.43 0.00 0.15 0.00 -0.55 0.00 0.00 66.41 65.59 3c7u h THR 59 Cb 1.22 0.88 -0.05 0.00 -1.73 0.00 0.00 68.15 68.48 3c7u h THR 59 CO 0.53 0.00 0.51 -0.94 -0.25 0.00 0.00 175.52 175.37 3c7u s SER 60 N -5.83 -0.08 0.00 5.36 1.04 -1.26 -5.00 113.70 107.94 3c7u s SER 60 Ca -0.05 -0.60 0.27 0.00 0.48 0.00 0.00 55.95 56.05 3c7u s SER 60 Cb 0.15 0.53 1.49 0.00 0.10 0.00 0.00 66.02 68.29 3c7u s SER 60 CO 0.53 -1.02 1.94 0.00 0.98 0.00 0.00 173.24 175.68 3c7u n ALA 61 N -0.58 2.43 -1.75 5.32 0.00 -1.26 -4.66 120.51 120.00 3c7u n ALA 61 Ca -0.05 -0.15 -0.40 0.00 0.00 0.00 0.00 53.44 52.84 3c7u n ALA 61 Cb 0.60 -1.44 0.01 0.00 0.00 0.00 0.00 19.45 18.63 3c7u n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3c7u n ALA 62 N -1.13 2.00 0.24 0.00 0.00 -1.26 -4.88 120.51 115.49 3c7u n ALA 62 Ca 0.17 0.28 0.18 0.00 0.00 0.00 0.00 53.44 54.06 3c7u n ALA 62 Cb 0.14 -2.38 0.84 0.00 0.00 0.00 0.00 19.45 18.06 3c7u n ALA 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3c7u h ALA 63 N 2.44 1.61 -0.46 0.00 0.00 -2.03 -0.92 119.26 119.89 3c7u h ALA 63 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3c7u h ALA 63 Cb 1.27 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3c7u h ALA 63 CO 0.62 -0.38 0.00 -0.40 0.00 0.00 0.00 179.25 179.09 3c7u n ASP 64 N -3.31 3.89 -4.67 0.00 5.75 -1.26 -4.67 116.55 112.28 3c7u n ASP 64 Ca 0.01 -2.41 -0.31 0.00 -0.01 0.00 0.00 54.79 52.07 3c7u n ASP 64 Cb 0.40 -0.45 0.16 0.00 -1.03 0.00 0.00 41.12 40.21 3c7u n ASP 64 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3c7u s ALA 65 N -1.75 1.38 0.13 2.12 0.00 -0.35 -5.00 121.76 118.29 3c7u s ALA 65 Ca 0.39 0.39 0.08 0.00 0.00 0.00 0.00 51.96 52.83 3c7u s ALA 65 Cb 0.26 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.97 3c7u s ALA 65 CO 0.18 -2.68 -0.13 0.15 0.00 0.00 0.00 175.76 173.28 3c7u s LYS 66 N -4.70 1.95 -0.11 0.00 -0.14 -1.26 -4.19 119.74 111.29 3c7u s LYS 66 Ca 0.66 -1.17 -0.29 0.00 -1.36 0.00 0.00 55.97 53.81 3c7u s LYS 66 Cb -0.22 -2.18 -0.07 0.00 -1.68 0.00 0.00 37.83 33.69 3c7u s LYS 66 CO 0.58 0.47 2.08 0.08 -0.76 0.00 0.00 175.35 177.81 3c7u s VAL 67 N -1.33 3.05 -0.40 3.17 1.01 0.20 -0.83 120.40 125.27 3c7u s VAL 67 Ca 0.21 0.05 0.04 0.00 0.00 0.00 0.00 61.98 62.28 3c7u s VAL 67 Cb -0.10 -3.05 0.08 0.00 0.00 0.00 0.00 36.38 33.30 3c7u s VAL 67 CO 0.13 -0.02 0.89 -0.90 0.00 0.00 0.00 175.10 175.19 3c7u n ASP 68 N 9.79 1.90 -3.69 3.32 5.68 -0.46 -0.96 116.55 132.13 3c7u n ASP 68 Ca 0.25 -1.64 -0.10 0.00 -0.50 0.00 0.00 54.79 52.80 3c7u n ASP 68 Cb 0.43 -0.05 -0.10 0.00 -1.14 0.00 0.00 41.12 40.26 3c7u n ASP 68 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 3c7u s SER 69 N -0.71 -0.47 -0.08 -1.12 0.15 -1.15 -1.09 113.70 109.22 3c7u s SER 69 Ca 0.07 0.93 0.01 0.00 0.70 0.00 0.00 55.95 57.66 3c7u s SER 69 Cb 0.04 0.91 0.02 0.00 -1.71 0.00 0.00 66.02 65.27 3c7u s SER 69 CO 0.05 -0.20 -0.11 -0.54 1.20 0.00 0.00 173.24 173.64 3c7u s LYS 70 N 1.66 1.67 0.02 5.44 1.02 -0.19 -1.35 119.74 128.02 3c7u s LYS 70 Ca -0.08 -0.37 0.01 0.00 0.02 0.00 0.00 55.97 55.55 3c7u s LYS 70 Cb -0.09 -1.50 -0.02 0.00 -0.52 0.00 0.00 37.83 35.71 3c7u s LYS 70 CO -0.13 -0.08 -0.05 -1.12 -0.92 0.00 0.00 175.35 173.05 3c7u s SER 71 N 1.04 0.50 0.04 2.83 0.01 -0.49 -1.73 113.70 115.90 3c7u s SER 71 Ca -0.07 -0.38 -0.27 0.00 1.31 0.00 0.00 55.95 56.54 3c7u s SER 71 Cb -0.15 0.03 0.07 0.00 0.21 0.00 0.00 66.02 66.18 3c7u s SER 71 CO -0.01 -0.16 0.63 0.00 0.41 0.00 0.00 173.24 174.11 3c7u s GLN 72 N -1.07 1.13 -0.05 12.44 1.03 -0.38 -0.44 119.66 132.33 3c7u s GLN 72 Ca -0.08 -0.07 0.02 0.00 0.04 0.00 0.00 55.36 55.27 3c7u s GLN 72 Cb -0.07 0.53 0.01 0.00 0.03 0.00 0.00 33.01 33.51 3c7u s GLN 72 CO -0.00 -0.42 -0.10 -1.21 -2.54 0.00 0.00 175.29 171.02 3c7u s GLU 73 N -2.27 1.34 -0.77 9.60 2.02 -0.73 -4.56 118.70 123.33 3c7u s GLU 73 Ca -0.06 -0.34 0.00 0.00 0.02 0.00 0.00 54.97 54.59 3c7u s GLU 73 Cb -0.00 -1.17 0.00 0.00 0.10 0.00 0.00 34.13 33.06 3c7u s GLU 73 CO 0.00 0.05 0.00 1.63 0.02 0.00 0.00 175.26 176.96 3c7u n LYS 74 N 3.67 -0.80 -0.06 1.61 5.02 -1.26 -1.73 118.16 124.60 3c7u n LYS 74 Ca -0.22 0.68 -0.22 0.00 -2.02 0.00 0.00 58.31 56.54 3c7u n LYS 74 Cb 0.52 -4.56 -0.13 0.00 -0.02 0.00 0.00 35.03 30.85 3c7u n LYS 74 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3c7u n LEU 75 N -0.83 2.52 -4.80 -0.35 4.77 -1.26 -4.79 117.00 112.27 3c7u n LEU 75 Ca -0.07 0.17 -0.37 0.00 -0.03 0.00 0.00 56.01 55.71 3c7u n LEU 75 Cb 0.31 -1.01 -0.07 0.00 -2.33 0.00 0.00 43.42 40.32 3c7u n LEU 75 CO 0.11 0.75 -0.06 -0.76 -1.33 0.00 0.00 177.39 176.10 3c7u s LEU 76 N -7.11 4.33 -0.09 2.23 1.43 -1.26 -3.60 118.68 114.61 3c7u s LEU 76 Ca -0.28 0.56 -0.02 0.00 -1.03 0.00 0.00 54.13 53.36 3c7u s LEU 76 Cb 0.08 -2.29 -0.03 0.00 0.03 0.00 0.00 46.19 43.97 3c7u s LEU 76 CO 0.67 0.25 0.01 0.00 0.23 0.00 0.00 176.35 177.51 3c7u s ALA 77 N -0.32 3.30 0.34 4.21 0.00 -1.26 -5.00 121.76 123.03 3c7u s ALA 77 Ca 0.17 -0.80 -0.29 0.00 0.00 0.00 0.00 51.96 51.04 3c7u s ALA 77 Cb -0.13 -1.50 -0.10 0.00 0.00 0.00 0.00 23.12 21.38 3c7u s ALA 77 CO 0.05 0.58 1.37 -1.25 0.00 0.00 0.00 175.76 176.51 3c7u s PRO 78 N -0.86 4.28 0.38 0.00 0.04 -1.26 -4.94 135.00 132.64 3c7u s PRO 78 Ca 0.13 2.33 0.21 0.00 0.04 0.00 0.00 61.00 63.71 3c7u s PRO 78 Cb -0.11 -3.04 0.47 0.00 0.04 0.00 0.00 34.50 31.85 3c7u s PRO 78 CO 0.02 -0.31 1.63 0.66 0.04 0.00 0.00 177.00 179.05 3c7u h SER 79 N 3.34 0.00 -0.79 6.66 4.64 -1.81 -3.41 113.55 122.19 3c7u h SER 79 Ca -0.49 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.71 3c7u h SER 79 Cb 1.23 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.16 3c7u h SER 79 CO 0.66 0.27 -0.41 0.00 -0.87 0.00 0.00 176.83 176.47 3c7u n ALA 80 N -2.19 -2.28 -2.18 5.18 0.00 -0.17 -5.04 120.51 113.84 3c7u n ALA 80 Ca 0.02 -0.81 -0.43 0.00 0.00 0.00 0.00 53.44 52.22 3c7u n ALA 80 Cb 0.57 -1.87 -0.02 0.00 0.00 0.00 0.00 19.45 18.12 3c7u n ALA 80 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3c7u s PRO 81 N 0.88 4.13 -0.01 0.00 0.04 -1.19 -3.46 135.00 135.39 3c7u s PRO 81 Ca 0.29 1.90 0.02 0.00 0.04 0.00 0.00 61.00 63.24 3c7u s PRO 81 Cb 0.04 -3.91 0.03 0.00 0.04 0.00 0.00 34.50 30.70 3c7u s PRO 81 CO -0.07 -0.87 0.81 0.25 0.04 0.00 0.00 177.00 177.16 3c7u n THR 82 N 5.60 0.57 -2.15 1.26 -2.24 -1.25 -3.56 114.28 112.51 3c7u n THR 82 Ca 0.16 -0.61 -0.36 0.00 -2.27 0.00 0.00 64.05 60.97 3c7u n THR 82 Cb 0.44 0.62 0.01 0.00 -2.10 0.00 0.00 70.33 69.30 3c7u n THR 82 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3c7u s LEU 83 N -0.68 3.83 0.17 3.22 2.96 -1.18 -4.87 118.68 122.13 3c7u s LEU 83 Ca 0.04 2.34 -0.03 0.00 -0.22 0.00 0.00 54.13 56.25 3c7u s LEU 83 Cb 0.03 -4.44 -0.03 0.00 0.50 0.00 0.00 46.19 42.25 3c7u s LEU 83 CO 0.00 -1.24 0.16 0.42 -1.32 0.00 0.00 176.35 174.36 3c7u s THR 84 N -1.60 0.05 0.36 3.68 -4.23 -1.26 -4.13 115.64 108.51 3c7u s THR 84 Ca 0.71 -1.81 0.03 0.00 -1.18 0.00 0.00 61.69 59.44 3c7u s THR 84 Cb -0.29 -2.18 0.26 0.00 1.34 0.00 0.00 72.50 71.64 3c7u s THR 84 CO 0.33 -0.24 2.02 0.25 -0.54 0.00 0.00 174.62 176.44 3c7u h LEU 85 N 2.67 0.69 -0.29 4.79 5.85 -1.62 -1.56 115.31 125.85 3c7u h LEU 85 Ca -0.34 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 3c7u h LEU 85 Cb 1.23 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.07 3c7u h LEU 85 CO 0.53 0.50 0.13 0.00 -0.34 0.00 0.00 178.44 179.26 3c7u h ALA 86 N 1.62 0.38 -0.73 1.25 0.00 -1.96 0.11 119.26 119.93 3c7u h ALA 86 Ca 0.22 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 3c7u h ALA 86 Cb -0.09 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 3c7u h ALA 86 CO -0.05 -0.04 0.21 0.87 0.00 0.00 0.00 179.25 180.24 3c7u h LYS 87 N 0.33 1.13 -0.88 0.00 1.57 -1.83 -2.44 116.57 114.45 3c7u h LYS 87 Ca 0.10 -0.25 0.03 0.00 -1.87 0.00 0.00 60.65 58.66 3c7u h LYS 87 Cb 0.15 -0.16 -0.05 0.00 0.08 0.00 0.00 32.23 32.25 3c7u h LYS 87 CO -0.01 0.97 0.57 0.35 -0.57 0.00 0.00 179.45 180.76 3c7u h PHE 88 N 1.09 1.06 -0.37 -1.35 3.57 -0.67 -2.13 116.94 118.15 3c7u h PHE 88 Ca 0.23 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.76 3c7u h PHE 88 Cb 0.32 -0.35 -0.02 0.00 2.79 0.00 0.00 35.95 38.69 3c7u h PHE 88 CO 0.03 0.61 0.24 -0.91 -2.23 0.00 0.00 178.31 176.05 3c7u h ASN 89 N 1.10 0.42 1.16 0.41 -0.26 -0.52 -2.57 115.58 115.32 3c7u h ASN 89 Ca 0.35 -0.01 -0.04 0.00 -0.56 0.00 0.00 56.30 56.04 3c7u h ASN 89 Cb 0.01 -0.10 -0.01 0.00 -1.06 0.00 0.00 38.32 37.16 3c7u h ASN 89 CO -0.12 0.30 -0.18 1.56 -1.06 0.00 0.00 177.43 177.94 3c7u h GLN 90 N 0.50 0.00 -6.55 0.81 4.20 -1.09 -3.44 115.11 109.53 3c7u h GLN 90 Ca 0.13 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.32 3c7u h GLN 90 Cb -0.06 0.00 0.03 0.00 0.30 0.00 0.00 27.48 27.76 3c7u h GLN 90 CO -0.03 0.18 0.93 0.08 -0.67 0.00 0.00 178.83 179.32 3c7u s VAL 91 N -3.51 2.77 -0.02 -0.54 1.01 -0.97 -5.01 120.40 114.13 3c7u s VAL 91 Ca 0.02 0.45 0.04 0.00 0.00 0.00 0.00 61.98 62.49 3c7u s VAL 91 Cb 0.09 -3.29 -0.01 0.00 0.00 0.00 0.00 36.38 33.17 3c7u s VAL 91 CO 0.63 0.02 -0.15 0.42 0.00 0.00 0.00 175.10 176.03 3c7u s THR 92 N 1.73 1.17 -0.04 3.92 -4.23 -1.26 -5.05 115.64 111.88 3c7u s THR 92 Ca 0.72 -0.62 -0.39 0.00 -1.18 0.00 0.00 61.69 60.22 3c7u s THR 92 Cb -0.42 -0.98 -0.17 0.00 1.34 0.00 0.00 72.50 72.26 3c7u s THR 92 CO 0.32 0.33 1.42 0.52 -0.54 0.00 0.00 174.62 176.67 3c7u n VAL 93 N 2.82 0.07 0.00 2.29 0.31 -1.26 -1.92 118.33 120.65 3c7u n VAL 93 Ca -0.15 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 3c7u n VAL 93 Cb 0.55 -0.79 0.00 0.00 -0.91 0.00 0.00 33.84 32.68 3c7u n VAL 93 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3c7u n GLY 94 N 2.86 1.78 3.75 2.92 0.00 -0.46 -5.01 105.19 111.03 3c7u n GLY 94 Ca 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.89 3c7u n GLY 94 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3c7u s MET 95 N -0.70 2.72 0.56 1.61 1.00 -0.81 -4.66 119.30 119.03 3c7u s MET 95 Ca 0.00 1.68 -0.08 0.00 0.00 0.00 0.00 55.69 57.29 3c7u s MET 95 Cb 0.00 -1.91 -0.03 0.00 0.00 0.00 0.00 34.83 32.89 3c7u s MET 95 CO 0.00 -1.37 0.91 0.95 0.00 0.00 0.00 175.02 175.51 3c7u s THR 96 N -1.91 4.56 0.27 2.05 -4.23 -1.26 -0.09 115.64 115.02 3c7u s THR 96 Ca 0.73 0.43 -0.01 0.00 -1.18 0.00 0.00 61.69 61.67 3c7u s THR 96 Cb -0.27 -3.78 0.25 0.00 1.34 0.00 0.00 72.50 70.04 3c7u s THR 96 CO 0.38 -0.88 1.74 -0.09 -0.54 0.00 0.00 174.62 175.22 3c7u h ARG 97 N -0.09 0.50 -0.63 3.99 2.43 -1.74 0.20 114.38 119.04 3c7u h ARG 97 Ca -0.46 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 58.70 3c7u h ARG 97 Cb 1.21 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 30.61 3c7u h ARG 97 CO 0.62 0.33 0.40 0.00 -1.51 0.00 0.00 179.97 179.81 3c7u h ALA 98 N 1.60 0.81 -0.20 2.80 0.00 -1.94 -1.22 119.26 121.11 3c7u h ALA 98 Ca 0.48 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 55.16 3c7u h ALA 98 Cb 0.76 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3c7u h ALA 98 CO -0.42 0.18 -0.65 1.96 0.00 0.00 0.00 179.25 180.32 3c7u h GLN 99 N 0.80 0.73 0.47 0.00 4.20 -1.68 -2.79 115.11 116.84 3c7u h GLN 99 Ca 0.24 -0.52 -0.02 0.00 0.06 0.00 0.00 58.65 58.41 3c7u h GLN 99 Cb -0.03 0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.83 3c7u h GLN 99 CO -0.08 1.14 -0.22 0.28 -0.67 0.00 0.00 178.83 179.28 3c7u h VAL 100 N 0.53 0.54 -0.74 -0.54 2.07 -0.83 -2.68 116.25 114.61 3c7u h VAL 100 Ca -0.01 -0.02 0.11 0.00 0.82 0.00 0.00 66.70 67.60 3c7u h VAL 100 Cb 1.24 0.55 -0.05 0.00 -1.52 0.00 0.00 31.29 31.52 3c7u h VAL 100 CO 0.13 0.00 0.49 -0.07 0.02 0.00 0.00 177.57 178.14 3c7u h LEU 101 N -0.64 0.52 -1.14 2.57 3.38 -1.28 -0.52 115.31 118.20 3c7u h LEU 101 Ca -0.06 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 3c7u h LEU 101 Cb 0.49 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 3c7u h LEU 101 CO 0.11 0.30 -0.20 0.00 0.09 0.00 0.00 178.44 178.74 3c7u h ALA 102 N 1.64 1.28 0.06 1.53 0.00 -1.41 -0.69 119.26 121.67 3c7u h ALA 102 Ca 0.35 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 3c7u h ALA 102 Cb 0.58 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.27 3c7u h ALA 102 CO -0.12 0.48 -0.51 1.15 0.00 0.00 0.00 179.25 180.25 3c7u h THR 103 N 0.33 1.56 0.00 0.00 2.02 -0.83 -3.38 112.91 112.60 3c7u h THR 103 Ca 0.06 -2.29 0.00 0.00 0.77 0.00 0.00 66.41 64.95 3c7u h THR 103 Cb 0.54 3.03 0.00 0.00 -1.74 0.00 0.00 68.15 69.98 3c7u h THR 103 CO 0.04 0.64 -0.68 1.33 0.37 0.00 0.00 175.52 177.21 3c7u n VAL 104 N -4.31 0.03 0.00 3.16 0.24 -0.34 -4.86 118.33 112.25 3c7u n VAL 104 Ca -0.12 -0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 3c7u n VAL 104 Cb 0.66 0.40 0.00 0.00 -1.47 0.00 0.00 33.84 33.44 3c7u n VAL 104 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3c7u n GLY 105 N 1.48 2.69 0.32 7.63 0.00 -0.29 -3.51 105.19 113.51 3c7u n GLY 105 Ca 0.05 -1.33 0.21 0.00 0.00 0.00 0.00 46.02 44.94 3c7u n GLY 105 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3c7u h GLN 106 N 0.00 0.00 -0.08 1.61 7.50 -1.83 -2.76 115.11 119.56 3c7u h GLN 106 Ca 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 59.13 3c7u h GLN 106 Cb 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.52 3c7u h GLN 106 CO 0.00 0.01 -0.13 0.41 -1.50 0.00 0.00 178.83 177.62 3c7u n GLY 107 N -0.84 4.82 0.07 3.46 0.00 -1.26 -4.71 105.19 106.74 3c7u n GLY 107 Ca -0.02 -1.18 0.12 0.00 0.00 0.00 0.00 46.02 44.94 3c7u n GLY 107 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3c7u h SER 108 N 0.62 0.00 -3.36 1.61 0.02 -1.51 -0.37 113.55 110.55 3c7u h SER 108 Ca 0.02 -0.20 -0.65 0.00 -0.84 0.00 0.00 61.79 60.12 3c7u h SER 108 Cb 1.14 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 63.51 3c7u h SER 108 CO 0.07 0.10 -0.77 0.00 -1.14 0.00 0.00 176.83 175.10 3c7u s THR 110 N -1.43 1.64 -0.40 0.00 -4.23 0.37 -4.74 115.64 106.85 3c7u s THR 110 Ca 0.21 -2.17 -0.25 0.00 -1.18 0.00 0.00 61.69 58.31 3c7u s THR 110 Cb -0.10 -2.16 0.02 0.00 1.34 0.00 0.00 72.50 71.60 3c7u s THR 110 CO 0.12 -0.51 0.87 -0.89 -0.54 0.00 0.00 174.62 173.68 3c7u s THR 111 N -3.03 4.60 -0.14 3.99 2.01 -1.26 -1.05 115.64 120.76 3c7u s THR 111 Ca 0.24 0.93 -0.25 0.00 0.31 0.00 0.00 61.69 62.92 3c7u s THR 111 Cb 0.01 -4.32 -0.23 0.00 0.01 0.00 0.00 72.50 67.97 3c7u s THR 111 CO 0.08 -0.60 0.67 -0.25 -0.69 0.00 0.00 174.62 173.83 3c7u h TRP 112 N 8.67 0.00 -3.49 4.92 2.91 -1.24 -3.40 115.95 124.32 3c7u h TRP 112 Ca -0.24 0.00 -0.20 0.00 1.13 0.00 0.00 58.89 59.58 3c7u h TRP 112 Cb 1.08 0.00 -0.27 0.00 -0.51 0.00 0.00 29.16 29.47 3c7u h TRP 112 CO 0.83 0.89 -0.60 0.45 -1.03 0.00 0.00 178.44 178.99 3c7u s SER 113 N -6.16 -0.10 -0.12 2.65 0.15 -0.43 -1.25 113.70 108.45 3c7u s SER 113 Ca -0.17 0.19 -0.05 0.00 0.70 0.00 0.00 55.95 56.62 3c7u s SER 113 Cb -0.02 0.21 0.06 0.00 -1.71 0.00 0.00 66.02 64.56 3c7u s SER 113 CO 0.61 -0.05 0.25 -0.70 1.20 0.00 0.00 173.24 174.55 3c7u s GLU 114 N -0.01 0.14 -0.03 5.44 2.12 -0.71 0.01 118.70 125.67 3c7u s GLU 114 Ca -0.01 0.72 0.01 0.00 0.36 0.00 0.00 54.97 56.05 3c7u s GLU 114 Cb -0.01 -0.06 0.02 0.00 0.26 0.00 0.00 34.13 34.34 3c7u s GLU 114 CO 0.00 -0.28 -0.04 -0.47 -0.54 0.00 0.00 175.26 173.93 3c7u s TYR 115 N 2.33 0.62 -0.55 5.30 6.04 -0.31 -1.02 117.35 129.76 3c7u s TYR 115 Ca 0.01 -0.14 -0.06 0.00 0.04 0.00 0.00 57.07 56.91 3c7u s TYR 115 Cb -0.12 -0.56 0.14 0.00 -1.04 0.00 0.00 41.96 40.38 3c7u s TYR 115 CO -0.08 -0.15 0.39 0.71 -1.54 0.00 0.00 175.55 174.88 3c7u s TYR 116 N 0.77 3.49 0.44 4.97 1.51 -0.25 -1.66 117.35 126.62 3c7u s TYR 116 Ca -0.10 -2.30 0.35 0.00 -1.01 0.00 0.00 57.07 54.02 3c7u s TYR 116 Cb -0.13 -3.37 1.81 0.00 -0.11 0.00 0.00 41.96 40.16 3c7u s TYR 116 CO -0.00 -0.94 2.17 -1.00 -1.11 0.00 0.00 175.55 174.67 3c7u h PRO 117 N 7.80 0.00 -0.25 -1.71 0.13 -1.82 -2.43 132.00 133.72 3c7u h PRO 117 Ca -0.09 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.96 3c7u h PRO 117 Cb 1.02 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.10 3c7u h PRO 117 CO 0.76 0.04 -0.06 0.00 -0.23 0.00 0.00 178.00 178.51 3c7u n ALA 118 N -2.16 3.53 -1.50 -0.56 0.00 -1.26 -5.06 120.51 113.50 3c7u n ALA 118 Ca -0.02 -2.79 -0.51 0.00 0.00 0.00 0.00 53.44 50.13 3c7u n ALA 118 Cb 0.18 -0.66 -0.04 0.00 0.00 0.00 0.00 19.45 18.93 3c7u n ALA 118 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 3c7u n TYR 119 N -0.95 0.51 1.98 0.00 4.19 -0.92 -0.72 117.16 121.24 3c7u n TYR 119 Ca 0.26 0.87 0.12 0.00 3.31 0.00 0.00 57.90 62.46 3c7u n TYR 119 Cb 0.91 -2.12 0.68 0.00 0.49 0.00 0.00 39.34 39.30 3c7u n TYR 119 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 3c7u n PRO 120 N 1.33 1.02 -1.53 2.98 -0.04 -1.26 -5.10 135.00 132.41 3c7u n PRO 120 Ca 0.17 -0.04 -0.32 0.00 -0.04 0.00 0.00 63.50 63.27 3c7u n PRO 120 Cb 0.22 -1.36 0.07 0.00 -0.04 0.00 0.00 33.50 32.38 3c7u n PRO 120 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3c7u s SER 121 N -1.72 4.82 0.00 3.54 0.15 0.10 -4.94 113.70 115.65 3c7u s SER 121 Ca 0.35 1.92 0.25 0.00 0.70 0.00 0.00 55.95 59.18 3c7u s SER 121 Cb 0.16 -2.54 0.52 0.00 -1.71 0.00 0.00 66.02 62.45 3c7u s SER 121 CO 0.27 -1.83 1.44 0.35 1.20 0.00 0.00 173.24 174.67 3c7u n THR 122 N -2.92 0.00 -1.64 6.45 -2.24 -1.26 -4.45 114.28 108.22 3c7u n THR 122 Ca 0.10 -0.37 -0.48 0.00 -2.27 0.00 0.00 64.05 61.02 3c7u n THR 122 Cb 0.52 1.06 -0.05 0.00 -2.10 0.00 0.00 70.33 69.76 3c7u n THR 122 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3c7u n ALA 123 N 0.70 0.39 -1.14 6.98 0.00 -1.26 -1.24 120.51 124.95 3c7u n ALA 123 Ca 0.15 0.48 -0.05 0.00 0.00 0.00 0.00 53.44 54.02 3c7u n ALA 123 Cb 0.49 -2.24 -0.02 0.00 0.00 0.00 0.00 19.45 17.68 3c7u n ALA 123 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3c7u n GLY 124 N 3.03 0.62 3.64 0.00 0.00 -1.26 -4.20 105.19 107.01 3c7u n GLY 124 Ca 0.17 -0.15 -0.51 0.00 0.00 0.00 0.00 46.02 45.54 3c7u n GLY 124 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3c7u n VAL 125 N -2.46 0.09 -4.37 1.61 3.14 -0.37 -4.62 118.33 111.35 3c7u n VAL 125 Ca -0.05 -0.02 -0.34 0.00 -2.96 0.00 0.00 64.34 60.98 3c7u n VAL 125 Cb 0.36 -1.19 -0.12 0.00 -1.06 0.00 0.00 33.84 31.83 3c7u n VAL 125 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 3c7u s THR 126 N 1.35 3.99 -0.11 1.55 -4.23 -0.66 -0.58 115.64 116.95 3c7u s THR 126 Ca 0.85 -0.32 0.01 0.00 -1.18 0.00 0.00 61.69 61.05 3c7u s THR 126 Cb -0.86 -2.75 0.02 0.00 1.34 0.00 0.00 72.50 70.25 3c7u s THR 126 CO 0.47 0.50 -0.14 -0.22 -0.54 0.00 0.00 174.62 174.69 3c7u s LEU 127 N 0.30 1.65 -0.11 4.79 2.96 -0.79 -1.17 118.68 126.31 3c7u s LEU 127 Ca -0.03 -0.40 0.03 0.00 -0.22 0.00 0.00 54.13 53.51 3c7u s LEU 127 Cb -0.14 -1.04 -0.00 0.00 0.50 0.00 0.00 46.19 45.51 3c7u s LEU 127 CO 0.03 -0.00 -0.21 -0.55 -1.32 0.00 0.00 176.35 174.30 3c7u s SER 128 N 1.06 3.36 0.07 3.68 0.15 0.10 0.25 113.70 122.38 3c7u s SER 128 Ca -0.05 -0.49 0.08 0.00 0.70 0.00 0.00 55.95 56.19 3c7u s SER 128 Cb -0.15 -1.47 -0.03 0.00 -1.71 0.00 0.00 66.02 62.66 3c7u s SER 128 CO -0.02 0.16 -0.21 -0.76 1.20 0.00 0.00 173.24 173.61 3c7u s LEU 129 N 0.37 2.51 -0.17 3.45 1.43 0.39 -0.86 118.68 125.81 3c7u s LEU 129 Ca -0.16 -0.53 -0.03 0.00 -1.03 0.00 0.00 54.13 52.38 3c7u s LEU 129 Cb -0.17 -1.45 -0.02 0.00 0.03 0.00 0.00 46.19 44.58 3c7u s LEU 129 CO 0.08 0.23 -0.05 -0.44 0.23 0.00 0.00 176.35 176.40 3c7u s SER 130 N -1.64 4.59 0.08 2.29 0.01 -0.21 -1.58 113.70 117.23 3c7u s SER 130 Ca 0.15 -0.21 0.09 0.00 1.31 0.00 0.00 55.95 57.28 3c7u s SER 130 Cb -0.10 -1.75 -0.03 0.00 0.21 0.00 0.00 66.02 64.34 3c7u s SER 130 CO 0.06 0.13 -0.23 0.00 0.41 0.00 0.00 173.24 173.60 3c7u s PHE 132 N -0.95 0.91 0.70 0.00 0.40 -0.10 -1.31 117.98 117.63 3c7u s PHE 132 Ca 0.10 -0.57 -0.05 0.00 -0.60 0.00 0.00 56.93 55.81 3c7u s PHE 132 Cb -0.10 -0.52 0.08 0.00 0.51 0.00 0.00 43.02 42.99 3c7u s PHE 132 CO 0.03 -0.04 0.99 0.16 0.70 0.00 0.00 175.22 177.06 3c7u s ASP 133 N -1.99 4.69 0.01 1.36 1.47 -1.20 -3.13 116.67 117.88 3c7u s ASP 133 Ca -0.02 0.20 -0.02 0.00 1.18 0.00 0.00 52.55 53.89 3c7u s ASP 133 Cb -0.07 -0.80 -0.00 0.00 -0.34 0.00 0.00 42.92 41.71 3c7u s ASP 133 CO 0.00 -1.64 0.18 0.55 0.68 0.00 0.00 175.17 174.94 3c7u n VAL 134 N -2.85 -0.04 -1.42 2.11 3.14 -1.23 -1.00 118.33 117.04 3c7u n VAL 134 Ca 0.10 0.27 0.03 0.00 -2.96 0.00 0.00 64.34 61.78 3c7u n VAL 134 Cb 0.60 -0.35 0.20 0.00 -1.06 0.00 0.00 33.84 33.23 3c7u n VAL 134 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 3c7u n ASP 135 N -2.98 2.26 -0.01 6.55 8.00 -1.26 -4.76 116.55 124.35 3c7u n ASP 135 Ca 0.00 -3.68 -0.15 0.00 0.71 0.00 0.00 54.79 51.67 3c7u n ASP 135 Cb 0.02 -0.56 -0.04 0.00 -0.02 0.00 0.00 41.12 40.51 3c7u n ASP 135 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 3c7u h GLY 136 N 0.93 0.80 -3.49 0.44 0.00 -1.24 -3.41 103.07 97.10 3c7u h GLY 136 Ca 0.08 -1.10 -0.52 0.00 0.00 0.00 0.00 47.33 45.79 3c7u h GLY 136 CO 0.17 0.98 0.59 -0.47 0.00 0.00 0.00 176.54 177.81 3c7u s TYR 137 N -3.77 2.97 -0.12 5.60 5.04 -1.26 -0.31 117.35 125.50 3c7u s TYR 137 Ca -0.09 1.46 -0.05 0.00 -2.44 0.00 0.00 57.07 55.95 3c7u s TYR 137 Cb 0.09 -3.59 0.06 0.00 0.35 0.00 0.00 41.96 38.87 3c7u s TYR 137 CO 0.89 -1.79 0.26 0.45 -1.34 0.00 0.00 175.55 174.02 3c7u s SER 138 N -0.77 0.22 0.08 4.32 0.15 -1.26 -4.86 113.70 111.58 3c7u s SER 138 Ca 0.54 0.57 0.25 0.00 0.70 0.00 0.00 55.95 58.01 3c7u s SER 138 Cb -0.37 0.62 0.51 0.00 -1.71 0.00 0.00 66.02 65.08 3c7u s SER 138 CO 0.47 -0.22 1.44 -0.24 1.20 0.00 0.00 173.24 175.89 3c7u n SER 139 N 5.09 0.59 0.00 5.45 2.88 -1.26 -4.29 113.62 122.08 3c7u n SER 139 Ca -0.11 0.09 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 3c7u n SER 139 Cb 0.50 0.05 0.00 0.00 -0.75 0.00 0.00 64.21 64.01 3c7u n SER 139 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3c7u n THR 140 N -1.89 0.00 0.00 2.46 -2.24 -1.26 -4.68 114.28 106.66 3c7u n THR 140 Ca 0.04 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 3c7u n THR 140 Cb 0.40 1.19 0.00 0.00 -2.10 0.00 0.00 70.33 69.82 3c7u n THR 140 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3c7u n GLY 141 N 0.19 5.51 3.41 3.38 0.00 -1.26 -1.51 105.19 114.92 3c7u n GLY 141 Ca 0.00 -0.87 -0.33 0.00 0.00 0.00 0.00 46.02 44.82 3c7u n GLY 141 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3c7u s PHE 142 N 2.51 2.71 0.67 1.61 0.40 -1.26 -4.38 117.98 120.24 3c7u s PHE 142 Ca 0.00 -0.41 -0.17 0.00 -0.60 0.00 0.00 56.93 55.75 3c7u s PHE 142 Cb 0.00 -1.71 -0.02 0.00 0.51 0.00 0.00 43.02 41.80 3c7u s PHE 142 CO 0.00 -0.01 0.99 0.66 0.70 0.00 0.00 175.22 177.56 3c7u n TYR 143 N 2.85 0.83 -2.55 0.36 4.01 -1.26 -4.73 117.16 116.67 3c7u n TYR 143 Ca -0.18 0.41 -0.18 0.00 -0.16 0.00 0.00 57.90 57.79 3c7u n TYR 143 Cb 0.52 -2.12 0.01 0.00 -0.31 0.00 0.00 39.34 37.45 3c7u n TYR 143 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3c7u n ARG 144 N -1.51 2.43 0.00 -0.72 1.74 0.58 -4.96 116.66 114.22 3c7u n ARG 144 Ca 0.14 -3.94 0.00 0.00 -0.77 0.00 0.00 57.85 53.28 3c7u n ARG 144 Cb 0.49 -1.81 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 3c7u n ARG 144 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3c7u n GLY 145 N -0.32 2.27 3.45 -0.13 0.00 -1.24 -4.22 105.19 105.00 3c7u n GLY 145 Ca 0.26 -0.30 -0.10 0.00 0.00 0.00 0.00 46.02 45.88 3c7u n GLY 145 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3c7u s SER 146 N 0.00 -0.15 0.05 1.61 1.04 -0.63 -3.23 113.70 112.38 3c7u s SER 146 Ca 0.00 -0.61 -0.07 0.00 0.48 0.00 0.00 55.95 55.76 3c7u s SER 146 Cb 0.00 0.53 -0.01 0.00 0.10 0.00 0.00 66.02 66.64 3c7u s SER 146 CO 0.00 -0.99 0.12 0.00 0.98 0.00 0.00 173.24 173.35 3c7u s ALA 147 N -3.90 -0.12 -0.21 5.32 0.00 -0.43 -0.76 121.76 121.66 3c7u s ALA 147 Ca 0.11 -0.53 -0.01 0.00 0.00 0.00 0.00 51.96 51.53 3c7u s ALA 147 Cb 0.01 0.29 0.02 0.00 0.00 0.00 0.00 23.12 23.43 3c7u s ALA 147 CO -0.02 -0.36 -0.12 -1.58 0.00 0.00 0.00 175.76 173.68 3c7u s HIS 148 N -2.83 2.92 -0.21 0.00 2.46 0.14 -1.43 115.29 116.34 3c7u s HIS 148 Ca -0.03 -1.48 -0.02 0.00 0.47 0.00 0.00 55.06 53.99 3c7u s HIS 148 Cb 0.00 -2.00 0.00 0.00 -0.13 0.00 0.00 32.58 30.45 3c7u s HIS 148 CO -0.06 -0.73 -0.09 -0.51 -2.47 0.00 0.00 174.74 170.89 3c7u s LEU 149 N 1.34 2.70 -0.13 8.88 1.02 -0.62 -1.20 118.68 130.66 3c7u s LEU 149 Ca 0.03 -0.52 -0.01 0.00 0.02 0.00 0.00 54.13 53.66 3c7u s LEU 149 Cb -0.15 -1.66 -0.02 0.00 0.02 0.00 0.00 46.19 44.39 3c7u s LEU 149 CO -0.08 -0.03 -0.11 0.00 0.02 0.00 0.00 176.35 176.15 3c7u s ALA 150 N 1.41 2.70 0.20 4.21 0.00 -0.42 -0.46 121.76 129.39 3c7u s ALA 150 Ca 0.05 -0.88 0.10 0.00 0.00 0.00 0.00 51.96 51.23 3c7u s ALA 150 Cb -0.14 -1.26 -0.04 0.00 0.00 0.00 0.00 23.12 21.67 3c7u s ALA 150 CO -0.06 0.27 -0.21 -0.06 0.00 0.00 0.00 175.76 175.70 3c7u s PHE 151 N 0.27 2.11 -0.03 0.00 0.40 0.14 -0.79 117.98 120.07 3c7u s PHE 151 Ca -0.08 -0.40 -0.01 0.00 -0.60 0.00 0.00 56.93 55.84 3c7u s PHE 151 Cb -0.15 -1.02 0.03 0.00 0.51 0.00 0.00 43.02 42.39 3c7u s PHE 151 CO 0.05 0.47 0.04 0.99 0.70 0.00 0.00 175.22 177.47 3c7u s THR 152 N -1.99 -0.06 -1.39 0.64 2.01 -0.80 -1.89 115.64 112.16 3c7u s THR 152 Ca 0.21 0.31 -0.07 0.00 0.31 0.00 0.00 61.69 62.44 3c7u s THR 152 Cb -0.06 -0.14 0.04 0.00 0.01 0.00 0.00 72.50 72.35 3c7u s THR 152 CO 0.09 0.14 0.54 0.47 -0.69 0.00 0.00 174.62 175.17 3c7u n ASP 153 N 4.72 -4.72 -0.04 3.53 8.00 0.25 -2.34 116.55 125.96 3c7u n ASP 153 Ca -0.16 -0.34 -0.01 0.00 0.71 0.00 0.00 54.79 55.00 3c7u n ASP 153 Cb 0.50 -3.85 -0.00 0.00 -0.02 0.00 0.00 41.12 37.74 3c7u n ASP 153 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3c7u n GLY 154 N -1.32 0.47 3.28 0.44 0.00 -1.26 -5.01 105.19 101.79 3c7u n GLY 154 Ca -0.06 -0.19 -0.32 0.00 0.00 0.00 0.00 46.02 45.45 3c7u n GLY 154 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3c7u s VAL 155 N -1.92 2.49 0.10 1.61 1.01 -0.99 -1.81 120.40 120.90 3c7u s VAL 155 Ca 0.00 -0.86 -0.31 0.00 0.00 0.00 0.00 61.98 60.81 3c7u s VAL 155 Cb 0.00 -2.00 -0.09 0.00 0.00 0.00 0.00 36.38 34.29 3c7u s VAL 155 CO 0.00 0.54 1.76 -0.22 0.00 0.00 0.00 175.10 177.19 3c7u s LEU 156 N 0.36 4.39 -0.04 3.92 2.96 0.87 -1.90 118.68 129.24 3c7u s LEU 156 Ca -0.15 2.64 0.10 0.00 -0.22 0.00 0.00 54.13 56.50 3c7u s LEU 156 Cb -0.17 -3.56 -0.15 0.00 0.50 0.00 0.00 46.19 42.81 3c7u s LEU 156 CO 0.07 -0.96 0.17 0.00 -1.32 0.00 0.00 176.35 174.31 3c7u n GLN 157 N 5.74 1.00 -3.52 1.98 1.13 0.03 -1.36 117.38 122.37 3c7u n GLN 157 Ca 0.17 -0.07 -0.10 0.00 -1.94 0.00 0.00 57.00 55.06 3c7u n GLN 157 Cb 0.39 -1.25 -0.03 0.00 0.11 0.00 0.00 30.24 29.46 3c7u n GLN 157 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 3c7u s GLY 158 N -3.55 -0.42 -0.01 1.08 0.00 -1.12 -4.96 107.32 98.35 3c7u s GLY 158 Ca -0.04 1.34 -0.10 0.00 0.00 0.00 0.00 44.72 45.91 3c7u s GLY 158 CO 0.43 0.60 0.21 -1.59 0.00 0.00 0.00 173.10 172.75 3c7u s LYS 159 N -2.35 0.54 -0.09 2.90 -2.85 -1.26 -1.31 119.74 115.33 3c7u s LYS 159 Ca 0.01 -0.28 -0.25 0.00 -1.00 0.00 0.00 55.97 54.45 3c7u s LYS 159 Cb -0.01 0.23 0.06 0.00 -2.06 0.00 0.00 37.83 36.05 3c7u s LYS 159 CO -0.04 -0.14 0.59 0.50 0.10 0.00 0.00 175.35 176.36 3c7u s ARG 160 N -1.28 0.89 0.05 1.78 3.52 -0.34 -4.98 118.95 118.58 3c7u s ARG 160 Ca -0.13 0.32 0.00 0.00 -0.13 0.00 0.00 55.73 55.79 3c7u s ARG 160 Cb -0.06 0.42 -0.03 0.00 -1.56 0.00 0.00 34.95 33.71 3c7u s ARG 160 CO 0.03 -0.23 -0.04 1.14 -0.81 0.00 0.00 175.30 175.38 3c7u s GLN 161 N -0.81 0.55 -0.06 5.12 1.03 -1.26 0.25 119.66 124.47 3c7u s GLN 161 Ca -0.09 -0.98 0.00 0.00 0.04 0.00 0.00 55.36 54.34 3c7u s GLN 161 Cb -0.02 0.02 0.02 0.00 0.03 0.00 0.00 33.01 33.06 3c7u s GLN 161 CO 0.06 -0.05 -0.03 -1.58 -2.54 0.00 0.00 175.29 171.16 3c7u s TRP 162 N -2.69 0.74 -1.08 9.60 0.51 0.06 -4.89 118.94 121.21 3c7u s TRP 162 Ca -0.02 -0.22 0.00 0.00 -2.12 0.00 0.00 56.10 53.74 3c7u s TRP 162 Cb -0.01 -0.74 0.00 0.00 -0.81 0.00 0.00 33.47 31.91 3c7u s TRP 162 CO -0.05 -0.26 0.00 -3.47 -0.51 0.00 0.00 176.95 172.66 3c7u n ASP 163 N 4.53 -4.91 -4.77 2.95 4.64 -1.26 -1.60 116.55 116.13 3c7u n ASP 163 Ca -0.17 0.25 -0.38 0.00 -1.38 0.00 0.00 54.79 53.11 3c7u n ASP 163 Cb 0.50 -3.30 -0.02 0.00 -1.04 0.00 0.00 41.12 37.26 3c7u n ASP 163 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 3c7u s LEU 164 N -2.30 4.21 0.00 -2.67 1.43 -1.26 -4.13 118.68 113.96 3c7u s LEU 164 Ca 0.00 2.32 0.01 0.00 -1.03 0.00 0.00 54.13 55.44 3c7u s LEU 164 Cb 0.00 -4.01 0.01 0.00 0.03 0.00 0.00 46.19 42.22 3c7u s LEU 164 CO 0.00 -0.63 0.55 1.33 0.23 0.00 0.00 176.35 177.82