#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g51 s LYS 48 N 0.00 3.46 -0.32 0.38 2.47 0.21 -4.87 119.74 121.06 3g51 s LYS 48 Ca 0.00 -0.20 -0.21 0.00 -1.56 0.00 0.00 55.97 54.00 3g51 s LYS 48 Cb 0.00 -3.89 -0.00 0.00 -1.46 0.00 0.00 37.83 32.48 3g51 s LYS 48 CO 0.00 -0.88 0.68 -1.21 0.16 0.00 0.00 175.35 174.10 3g51 s GLU 49 N 2.75 3.86 -0.42 4.03 2.02 -1.26 -0.48 118.70 129.20 3g51 s GLU 49 Ca 0.23 0.31 -0.14 0.00 0.02 0.00 0.00 54.97 55.38 3g51 s GLU 49 Cb -0.14 -3.75 0.03 0.00 0.10 0.00 0.00 34.13 30.37 3g51 s GLU 49 CO 0.17 -0.65 0.30 0.42 0.02 0.00 0.00 175.26 175.52 3g51 s ILE 50 N 2.74 5.15 0.22 -1.63 1.01 0.62 -4.91 121.20 124.41 3g51 s ILE 50 Ca 0.27 -0.77 -0.31 0.00 0.00 0.00 0.00 60.65 59.85 3g51 s ILE 50 Cb -0.14 -3.91 -0.10 0.00 0.01 0.00 0.00 42.46 38.31 3g51 s ILE 50 CO 0.13 -0.35 1.52 0.00 0.00 0.00 0.00 174.94 176.24 3g51 s ALA 51 N 1.65 3.71 -0.38 9.38 0.00 -1.26 -0.62 121.76 134.24 3g51 s ALA 51 Ca 0.04 1.39 -0.14 0.00 0.00 0.00 0.00 51.96 53.25 3g51 s ALA 51 Cb -0.20 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.32 3g51 s ALA 51 CO 0.09 -0.80 0.29 0.42 0.00 0.00 0.00 175.76 175.76 3g51 s ILE 52 N 0.45 5.26 0.00 0.00 -1.09 -0.64 -4.86 121.20 120.31 3g51 s ILE 52 Ca 0.64 -0.41 0.00 0.00 -2.23 0.00 0.00 60.65 58.65 3g51 s ILE 52 Cb -0.44 -3.84 0.00 0.00 -1.58 0.00 0.00 42.46 36.61 3g51 s ILE 52 CO 0.39 -0.17 0.00 0.35 -1.23 0.00 0.00 174.94 174.28 3g51 n THR 53 N 5.16 0.00 -3.67 2.92 -2.24 -1.26 -4.54 114.28 110.65 3g51 n THR 53 Ca -0.11 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.53 3g51 n THR 53 Cb 0.48 -0.45 -0.08 0.00 -2.10 0.00 0.00 70.33 68.19 3g51 n THR 53 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 3g51 s HIS 54 N -1.49 -0.62 -0.20 4.78 -3.43 -1.26 -3.67 115.29 109.39 3g51 s HIS 54 Ca 0.00 1.48 -0.19 0.00 -0.80 0.00 0.00 55.06 55.55 3g51 s HIS 54 Cb 0.00 0.23 0.05 0.00 -1.43 0.00 0.00 32.58 31.43 3g51 s HIS 54 CO 0.00 -0.34 0.55 -1.58 -2.00 0.00 0.00 174.74 171.37 3g51 s HIS 55 N 0.12 -0.60 -0.12 0.38 5.04 -0.47 -4.84 115.29 114.81 3g51 s HIS 55 Ca -0.01 1.46 -0.02 0.00 -1.54 0.00 0.00 55.06 54.95 3g51 s HIS 55 Cb -0.04 0.20 0.04 0.00 0.04 0.00 0.00 32.58 32.83 3g51 s HIS 55 CO 0.02 -0.29 0.01 0.08 -2.34 0.00 0.00 174.74 172.22 3g51 s VAL 56 N 0.29 0.45 0.58 0.89 1.01 -1.26 -1.59 120.40 120.77 3g51 s VAL 56 Ca -0.00 -0.13 -0.20 0.00 0.00 0.00 0.00 61.98 61.64 3g51 s VAL 56 Cb -0.04 -0.73 -0.04 0.00 0.00 0.00 0.00 36.38 35.58 3g51 s VAL 56 CO 0.01 0.10 1.34 -0.75 0.00 0.00 0.00 175.10 175.80 3g51 s LYS 57 N 1.92 2.93 0.23 2.72 2.36 -0.41 -4.88 119.74 124.61 3g51 s LYS 57 Ca 0.03 2.20 -0.31 0.00 -2.55 0.00 0.00 55.97 55.33 3g51 s LYS 57 Cb -0.14 -2.12 -0.11 0.00 -1.05 0.00 0.00 37.83 34.41 3g51 s LYS 57 CO -0.06 -1.34 1.65 -1.21 1.55 0.00 0.00 175.35 175.93 3g51 s GLU 58 N -3.07 4.14 0.00 4.03 0.41 -1.26 -1.73 118.70 121.22 3g51 s GLU 58 Ca 0.75 2.56 0.00 0.00 -0.41 0.00 0.00 54.97 57.87 3g51 s GLU 58 Cb -0.40 -3.07 0.00 0.00 -1.78 0.00 0.00 34.13 28.88 3g51 s GLU 58 CO 0.46 -0.68 0.00 0.41 -0.49 0.00 0.00 175.26 174.95 3g51 n GLY 59 N 3.30 3.09 3.63 -1.39 0.00 -1.26 -5.06 105.19 107.50 3g51 n GLY 59 Ca 0.13 -0.86 -0.29 0.00 0.00 0.00 0.00 46.02 45.00 3g51 n GLY 59 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3g51 s HIS 60 N -0.13 1.90 0.12 1.61 3.76 -0.71 -4.99 115.29 116.85 3g51 s HIS 60 Ca 0.00 1.10 0.07 0.00 -0.15 0.00 0.00 55.06 56.08 3g51 s HIS 60 Cb 0.00 -3.20 -0.04 0.00 1.11 0.00 0.00 32.58 30.44 3g51 s HIS 60 CO 0.00 -3.11 -0.08 -1.21 -0.85 0.00 0.00 174.74 169.49 3g51 s GLU 61 N -4.81 2.18 0.16 1.40 8.01 -1.26 -4.86 118.70 119.51 3g51 s GLU 61 Ca 0.66 -1.04 -0.34 0.00 0.01 0.00 0.00 54.97 54.26 3g51 s GLU 61 Cb -0.20 -2.31 -0.16 0.00 -4.31 0.00 0.00 34.13 27.15 3g51 s GLU 61 CO 0.59 0.50 1.22 1.17 0.01 0.00 0.00 175.26 178.75 3g51 n LYS 62 N 0.54 1.20 -3.95 1.61 4.81 -1.26 -4.97 118.16 116.14 3g51 n LYS 62 Ca -0.13 0.43 -0.23 0.00 -0.87 0.00 0.00 58.31 57.52 3g51 n LYS 62 Cb 0.53 -1.97 -0.05 0.00 0.02 0.00 0.00 35.03 33.56 3g51 n LYS 62 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3g51 s ALA 63 N -0.03 3.68 0.27 3.14 0.00 -1.26 -5.14 121.76 122.42 3g51 s ALA 63 Ca 0.75 -1.85 -0.12 0.00 0.00 0.00 0.00 51.96 50.75 3g51 s ALA 63 Cb -0.86 -0.81 0.00 0.00 0.00 0.00 0.00 23.12 21.44 3g51 s ALA 63 CO 0.51 -0.05 0.51 0.16 0.00 0.00 0.00 175.76 176.89 3g51 s ASP 64 N -3.93 0.07 0.56 0.00 -4.77 -1.26 -4.87 116.67 102.46 3g51 s ASP 64 Ca 0.41 -1.02 0.23 0.00 -3.30 0.00 0.00 52.55 48.87 3g51 s ASP 64 Cb -0.02 0.62 1.55 0.00 -1.09 0.00 0.00 42.92 43.98 3g51 s ASP 64 CO 0.24 -1.21 2.19 -0.65 0.70 0.00 0.00 175.17 176.44 3g51 h PRO 65 N 2.21 0.00 0.00 2.11 0.11 -1.98 -1.79 132.00 132.66 3g51 h PRO 65 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3g51 h PRO 65 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3g51 h PRO 65 CO 0.36 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.02 3g51 n SER 66 N -4.17 0.19 -0.59 -2.05 3.41 -1.26 -2.77 113.62 106.37 3g51 n SER 66 Ca -0.02 0.53 0.11 0.00 -0.26 0.00 0.00 58.87 59.23 3g51 n SER 66 Cb 0.12 -0.58 0.38 0.00 -0.26 0.00 0.00 64.21 63.87 3g51 n SER 66 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g51 n GLN 67 N -1.69 1.78 -4.32 4.33 6.02 -0.67 -4.90 117.38 117.92 3g51 n GLN 67 Ca 0.05 -1.16 -0.21 0.00 -0.01 0.00 0.00 57.00 55.67 3g51 n GLN 67 Cb 0.26 -1.42 -0.11 0.00 1.02 0.00 0.00 30.24 30.00 3g51 n GLN 67 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3g51 s PHE 68 N -1.81 1.74 -0.00 1.08 0.08 -1.12 -0.63 117.98 117.32 3g51 s PHE 68 Ca 0.34 -0.50 0.04 0.00 0.12 0.00 0.00 56.93 56.92 3g51 s PHE 68 Cb 0.18 -0.86 -0.01 0.00 -0.57 0.00 0.00 43.02 41.76 3g51 s PHE 68 CO 0.28 0.31 -0.12 -1.83 -0.10 0.00 0.00 175.22 173.76 3g51 s GLU 69 N -2.97 0.96 0.24 0.44 -1.05 -0.43 -4.91 118.70 110.98 3g51 s GLU 69 Ca 0.16 -0.48 -0.30 0.00 -0.15 0.00 0.00 54.97 54.21 3g51 s GLU 69 Cb -0.05 -0.93 -0.09 0.00 -0.44 0.00 0.00 34.13 32.63 3g51 s GLU 69 CO 0.06 0.25 1.11 -0.51 0.95 0.00 0.00 175.26 177.12 3g51 s LEU 70 N -0.42 4.52 -0.12 1.83 1.43 -1.26 -1.12 118.68 123.54 3g51 s LEU 70 Ca 0.04 2.21 -0.04 0.00 -1.03 0.00 0.00 54.13 55.31 3g51 s LEU 70 Cb -0.05 -3.62 -0.06 0.00 0.03 0.00 0.00 46.19 42.49 3g51 s LEU 70 CO -0.00 -0.19 -0.14 0.18 0.23 0.00 0.00 176.35 176.43 3g51 n LEU 71 N 1.72 1.67 -3.92 1.79 4.77 0.38 -4.92 117.00 118.50 3g51 n LEU 71 Ca 0.01 0.07 -0.00 0.00 -0.03 0.00 0.00 56.01 56.05 3g51 n LEU 71 Cb 0.45 -0.38 0.01 0.00 -2.33 0.00 0.00 43.42 41.17 3g51 n LEU 71 CO 0.54 0.42 0.94 -1.59 -1.33 0.00 0.00 177.39 176.38 3g51 s LYS 72 N -2.23 0.88 -0.17 3.23 -2.85 -1.19 -5.00 119.74 112.41 3g51 s LYS 72 Ca -0.17 -0.57 -0.14 0.00 -1.00 0.00 0.00 55.97 54.10 3g51 s LYS 72 Cb 0.06 0.25 -0.05 0.00 -2.06 0.00 0.00 37.83 36.03 3g51 s LYS 72 CO 0.24 -0.41 0.30 0.08 0.10 0.00 0.00 175.35 175.65 3g51 s VAL 73 N -2.12 5.29 -0.03 1.79 1.01 -1.26 -0.23 120.40 124.86 3g51 s VAL 73 Ca 0.25 0.54 0.11 0.00 0.00 0.00 0.00 61.98 62.88 3g51 s VAL 73 Cb -0.01 -3.64 -0.23 0.00 0.00 0.00 0.00 36.38 32.50 3g51 s VAL 73 CO 0.02 0.36 0.73 -0.07 0.00 0.00 0.00 175.10 176.15 3g51 h LEU 74 N 6.91 0.02 0.00 3.92 3.38 -0.71 -3.46 115.31 125.38 3g51 h LEU 74 Ca -0.40 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.53 3g51 h LEU 74 Cb 1.16 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.91 3g51 h LEU 74 CO 0.74 1.03 0.00 0.61 0.09 0.00 0.00 178.44 180.92 3g51 n GLY 75 N 1.55 -1.32 2.84 0.83 0.00 -1.10 -4.99 105.19 103.01 3g51 n GLY 75 Ca -0.15 -1.03 -0.20 0.00 0.00 0.00 0.00 46.02 44.64 3g51 n GLY 75 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3g51 s GLN 76 N -1.79 0.62 0.27 1.61 2.00 -1.26 -0.26 119.66 120.85 3g51 s GLN 76 Ca 0.00 -0.00 0.01 0.00 -2.00 0.00 0.00 55.36 53.37 3g51 s GLN 76 Cb 0.00 -0.77 0.01 0.00 0.80 0.00 0.00 33.01 33.06 3g51 s GLN 76 CO 0.00 -0.15 0.12 0.41 -0.50 0.00 0.00 175.29 175.17 3g51 n GLY 77 N 4.34 3.31 0.28 2.59 0.00 0.81 -4.97 105.19 111.55 3g51 n GLY 77 Ca -0.21 -2.26 0.03 0.00 0.00 0.00 0.00 46.02 43.58 3g51 n GLY 77 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3g51 h SER 78 N 0.46 0.41 -0.55 1.61 0.02 -2.01 -2.77 113.55 110.72 3g51 h SER 78 Ca -0.19 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 3g51 h SER 78 Cb 0.65 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.09 3g51 h SER 78 CO 0.31 0.40 0.00 0.49 -1.14 0.00 0.00 176.83 176.90 3g51 n PHE 79 N -4.38 1.88 0.00 3.45 3.72 -1.26 -4.96 117.46 115.91 3g51 n PHE 79 Ca 0.02 -0.73 0.00 0.00 -0.05 0.00 0.00 57.45 56.69 3g51 n PHE 79 Cb 0.16 -0.45 0.00 0.00 -0.94 0.00 0.00 39.48 38.24 3g51 n PHE 79 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3g51 n GLY 80 N 0.57 0.73 3.81 1.37 0.00 -1.04 -4.63 105.19 106.00 3g51 n GLY 80 Ca 0.27 -2.26 -0.33 0.00 0.00 0.00 0.00 46.02 43.71 3g51 n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g51 s LYS 81 N -0.80 3.36 -0.16 1.61 1.02 -1.26 -0.14 119.74 123.38 3g51 s LYS 81 Ca 0.00 1.16 -0.01 0.00 0.02 0.00 0.00 55.97 57.15 3g51 s LYS 81 Cb 0.00 -2.04 -0.01 0.00 -0.52 0.00 0.00 37.83 35.26 3g51 s LYS 81 CO 0.00 -0.77 -0.13 0.08 -0.92 0.00 0.00 175.35 173.61 3g51 s VAL 82 N -2.51 2.92 0.07 3.17 1.01 0.64 -4.51 120.40 121.18 3g51 s VAL 82 Ca 0.63 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.95 3g51 s VAL 82 Cb -0.15 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 3g51 s VAL 82 CO 0.37 0.51 0.08 -0.36 0.00 0.00 0.00 175.10 175.70 3g51 s PHE 83 N 0.74 3.20 -0.12 5.22 0.08 -0.06 0.03 117.98 127.07 3g51 s PHE 83 Ca -0.06 0.10 -0.21 0.00 0.12 0.00 0.00 56.93 56.88 3g51 s PHE 83 Cb -0.15 -1.64 -0.04 0.00 -0.57 0.00 0.00 43.02 40.62 3g51 s PHE 83 CO 0.01 0.52 0.59 -1.17 -0.10 0.00 0.00 175.22 175.08 3g51 s LEU 84 N -2.30 4.26 0.13 -0.37 2.96 0.68 -0.16 118.68 123.89 3g51 s LEU 84 Ca 0.28 0.95 0.05 0.00 -0.22 0.00 0.00 54.13 55.20 3g51 s LEU 84 Cb -0.12 -2.87 -0.04 0.00 0.50 0.00 0.00 46.19 43.65 3g51 s LEU 84 CO 0.21 -0.10 -0.13 0.68 -1.32 0.00 0.00 176.35 175.70 3g51 s VAL 85 N 0.95 1.29 -0.11 1.68 -7.23 -0.49 -0.47 120.40 116.02 3g51 s VAL 85 Ca 0.31 -1.84 0.01 0.00 -1.81 0.00 0.00 61.98 58.65 3g51 s VAL 85 Cb -0.16 -1.64 -0.02 0.00 0.56 0.00 0.00 36.38 35.12 3g51 s VAL 85 CO 0.13 -0.53 -0.15 -0.75 -0.31 0.00 0.00 175.10 173.50 3g51 s LYS 86 N -3.04 3.16 -0.09 4.82 2.20 -0.27 -1.55 119.74 124.96 3g51 s LYS 86 Ca 0.12 -0.71 -0.30 0.00 -0.36 0.00 0.00 55.97 54.72 3g51 s LYS 86 Cb -0.02 -2.54 -0.02 0.00 -1.51 0.00 0.00 37.83 33.73 3g51 s LYS 86 CO 0.02 0.30 1.16 0.21 -0.36 0.00 0.00 175.35 176.69 3g51 s LYS 87 N 0.12 4.34 0.02 4.03 2.47 -0.46 -1.31 119.74 128.95 3g51 s LYS 87 Ca -0.07 1.60 0.22 0.00 -1.56 0.00 0.00 55.97 56.16 3g51 s LYS 87 Cb -0.15 -3.59 -0.09 0.00 -1.46 0.00 0.00 37.83 32.54 3g51 s LYS 87 CO 0.05 -0.48 0.90 0.44 0.16 0.00 0.00 175.35 176.42 3g51 n ILE 88 N 4.77 0.10 -3.81 5.43 -5.35 0.20 0.10 119.36 120.79 3g51 n ILE 88 Ca 0.11 -0.23 -0.09 0.00 -0.27 0.00 0.00 62.75 62.26 3g51 n ILE 88 Cb 0.46 0.35 -0.06 0.00 -1.74 0.00 0.00 39.64 38.65 3g51 n ILE 88 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3g51 s SER 89 N -3.82 0.01 0.00 7.28 1.04 -1.26 -4.71 113.70 112.25 3g51 s SER 89 Ca 0.03 -0.59 0.00 0.00 0.48 0.00 0.00 55.95 55.86 3g51 s SER 89 Cb 0.15 0.39 0.00 0.00 0.10 0.00 0.00 66.02 66.66 3g51 s SER 89 CO 0.84 -0.79 0.00 0.61 0.98 0.00 0.00 173.24 174.87 3g51 n GLY 90 N -0.13 0.63 0.38 7.32 0.00 -1.26 -4.12 105.19 108.01 3g51 n GLY 90 Ca -0.14 -2.14 0.18 0.00 0.00 0.00 0.00 46.02 43.93 3g51 n GLY 90 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3g51 h SER 91 N 0.00 0.17 -0.61 1.61 0.87 -1.98 0.31 113.55 113.91 3g51 h SER 91 Ca 0.00 0.01 -0.26 0.00 -1.23 0.00 0.00 61.79 60.30 3g51 h SER 91 Cb 0.00 -0.02 -0.16 0.00 -0.44 0.00 0.00 62.40 61.78 3g51 h SER 91 CO 0.00 0.09 0.22 -0.90 -0.53 0.00 0.00 176.83 175.71 3g51 n ASP 92 N -4.42 3.52 -4.65 6.23 5.75 -1.26 -5.02 116.55 116.70 3g51 n ASP 92 Ca 0.12 -3.52 -0.43 0.00 -0.01 0.00 0.00 54.79 50.95 3g51 n ASP 92 Cb 0.59 -0.71 -0.00 0.00 -1.03 0.00 0.00 41.12 39.97 3g51 n ASP 92 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3g51 n ALA 93 N -0.85 0.70 0.00 2.12 0.00 0.09 -1.97 120.51 120.61 3g51 n ALA 93 Ca 0.41 0.34 0.00 0.00 0.00 0.00 0.00 53.44 54.19 3g51 n ALA 93 Cb 1.28 -2.16 0.00 0.00 0.00 0.00 0.00 19.45 18.57 3g51 n ALA 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3g51 n ARG 94 N 0.49 0.00 -2.23 0.00 1.74 0.29 -4.97 116.66 111.98 3g51 n ARG 94 Ca 0.07 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.77 3g51 n ARG 94 Cb 0.36 -1.08 -0.01 0.00 -1.02 0.00 0.00 32.46 30.71 3g51 n ARG 94 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 3g51 s GLN 95 N -0.26 3.92 -0.06 5.56 2.00 -0.83 -4.76 119.66 125.23 3g51 s GLN 95 Ca 0.00 1.88 -0.05 0.00 -2.00 0.00 0.00 55.36 55.20 3g51 s GLN 95 Cb 0.00 -2.60 -0.04 0.00 0.80 0.00 0.00 33.01 31.17 3g51 s GLN 95 CO 0.00 -0.44 0.16 -0.51 -0.50 0.00 0.00 175.29 174.00 3g51 s LEU 96 N -2.67 4.38 0.12 3.68 1.43 -1.26 -1.35 118.68 123.00 3g51 s LEU 96 Ca 0.59 0.40 -0.02 0.00 -1.03 0.00 0.00 54.13 54.07 3g51 s LEU 96 Cb -0.32 -2.36 -0.03 0.00 0.03 0.00 0.00 46.19 43.51 3g51 s LEU 96 CO 0.39 0.33 0.08 -0.31 0.23 0.00 0.00 176.35 177.07 3g51 s TYR 97 N -1.19 0.72 0.18 0.29 2.02 -0.60 -4.34 117.35 114.44 3g51 s TYR 97 Ca 0.21 -1.13 -0.09 0.00 -0.37 0.00 0.00 57.07 55.70 3g51 s TYR 97 Cb -0.12 -0.40 -0.07 0.00 -0.40 0.00 0.00 41.96 40.97 3g51 s TYR 97 CO 0.12 -0.52 0.48 0.00 -1.57 0.00 0.00 175.55 174.06 3g51 s ALA 98 N -4.01 3.65 -0.04 3.71 0.00 0.34 -1.39 121.76 124.01 3g51 s ALA 98 Ca 0.20 -0.35 0.03 0.00 0.00 0.00 0.00 51.96 51.83 3g51 s ALA 98 Cb 0.07 -2.34 0.01 0.00 0.00 0.00 0.00 23.12 20.86 3g51 s ALA 98 CO -0.01 0.55 -0.11 1.41 0.00 0.00 0.00 175.76 177.61 3g51 s MET 99 N -2.59 1.33 -0.05 0.00 1.75 0.77 -0.46 119.30 120.06 3g51 s MET 99 Ca 0.43 -0.37 0.03 0.00 -1.25 0.00 0.00 55.69 54.53 3g51 s MET 99 Cb -0.12 -1.17 -0.03 0.00 2.84 0.00 0.00 34.83 36.35 3g51 s MET 99 CO 0.22 0.08 -0.12 0.15 -0.65 0.00 0.00 175.02 174.70 3g51 s LYS 100 N 0.42 2.57 -0.23 4.11 1.02 -0.40 -0.88 119.74 126.35 3g51 s LYS 100 Ca -0.08 -0.65 0.02 0.00 0.02 0.00 0.00 55.97 55.27 3g51 s LYS 100 Cb -0.12 -2.44 0.05 0.00 -0.52 0.00 0.00 37.83 34.79 3g51 s LYS 100 CO 0.02 0.64 -0.12 0.08 -0.92 0.00 0.00 175.35 175.05 3g51 s VAL 101 N -0.76 1.96 0.46 3.17 1.01 -1.26 -0.82 120.40 124.16 3g51 s VAL 101 Ca 0.12 -1.34 0.04 0.00 0.00 0.00 0.00 61.98 60.80 3g51 s VAL 101 Cb -0.11 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 3g51 s VAL 101 CO 0.01 0.10 0.05 -0.76 0.00 0.00 0.00 175.10 174.50 3g51 s LEU 102 N 1.23 2.64 -0.07 3.92 1.43 0.14 -4.58 118.68 123.39 3g51 s LEU 102 Ca -0.05 -1.45 -0.22 0.00 -1.03 0.00 0.00 54.13 51.38 3g51 s LEU 102 Cb -0.18 -0.91 -0.30 0.00 0.03 0.00 0.00 46.19 44.83 3g51 s LEU 102 CO -0.07 -0.67 0.83 0.50 0.23 0.00 0.00 176.35 177.17 3g51 h LYS 103 N 1.49 0.25 -2.80 1.70 3.64 -0.85 0.16 116.57 120.16 3g51 h LYS 103 Ca -0.43 -0.44 0.10 0.00 -1.27 0.00 0.00 60.65 58.61 3g51 h LYS 103 Cb 1.28 0.16 -0.06 0.00 -0.41 0.00 0.00 32.23 33.20 3g51 h LYS 103 CO 0.75 1.21 0.31 -1.59 -2.27 0.00 0.00 179.45 177.86 3g51 s LYS 104 N -2.41 1.63 -0.18 1.90 -2.85 -1.11 -3.89 119.74 112.83 3g51 s LYS 104 Ca -0.15 -0.92 -0.22 0.00 -1.00 0.00 0.00 55.97 53.69 3g51 s LYS 104 Cb 0.01 0.55 0.06 0.00 -2.06 0.00 0.00 37.83 36.38 3g51 s LYS 104 CO 0.80 -0.75 0.58 0.00 0.10 0.00 0.00 175.35 176.08 3g51 s ALA 105 N -3.62 -1.45 0.06 0.59 0.00 -1.26 -0.71 121.76 115.37 3g51 s ALA 105 Ca 0.12 1.50 0.02 0.00 0.00 0.00 0.00 51.96 53.60 3g51 s ALA 105 Cb -0.05 -0.74 -0.03 0.00 0.00 0.00 0.00 23.12 22.31 3g51 s ALA 105 CO 0.06 -0.29 -0.07 0.95 0.00 0.00 0.00 175.76 176.41 3g51 s THR 106 N -0.05 0.55 -0.30 0.00 -4.23 0.09 -1.62 115.64 110.08 3g51 s THR 106 Ca -0.03 -1.39 -0.04 0.00 -1.18 0.00 0.00 61.69 59.05 3g51 s THR 106 Cb -0.04 -0.99 0.03 0.00 1.34 0.00 0.00 72.50 72.85 3g51 s THR 106 CO 0.02 -0.58 0.04 -0.22 -0.54 0.00 0.00 174.62 173.34 3g51 s LEU 107 N -2.13 3.90 -0.25 4.79 2.96 0.20 0.03 118.68 128.19 3g51 s LEU 107 Ca -0.02 -1.05 -0.25 0.00 -0.22 0.00 0.00 54.13 52.59 3g51 s LEU 107 Cb -0.04 -1.79 -0.00 0.00 0.50 0.00 0.00 46.19 44.86 3g51 s LEU 107 CO -0.02 -0.25 0.87 -0.54 -1.32 0.00 0.00 176.35 175.09 3g51 s LYS 108 N 1.36 4.17 -0.19 1.98 1.02 -1.26 -0.27 119.74 126.55 3g51 s LYS 108 Ca -0.02 0.98 0.01 0.00 0.02 0.00 0.00 55.97 56.97 3g51 s LYS 108 Cb -0.19 -3.65 0.03 0.00 -0.52 0.00 0.00 37.83 33.50 3g51 s LYS 108 CO 0.00 -0.56 -0.18 0.08 -0.92 0.00 0.00 175.35 173.77 3g51 s VAL 109 N 2.93 2.02 -1.30 3.17 1.01 0.36 -4.64 120.40 123.96 3g51 s VAL 109 Ca 0.36 -1.02 0.01 0.00 0.00 0.00 0.00 61.98 61.33 3g51 s VAL 109 Cb -0.15 -1.88 0.05 0.00 0.00 0.00 0.00 36.38 34.40 3g51 s VAL 109 CO 0.08 0.43 0.74 -2.11 0.00 0.00 0.00 175.10 174.24 3g51 n ARG 110 N 4.61 1.22 0.00 2.72 1.85 -0.56 -0.62 116.66 125.87 3g51 n ARG 110 Ca -0.19 -0.21 0.00 0.00 -1.00 0.00 0.00 57.85 56.45 3g51 n ARG 110 Cb 0.49 -1.38 0.00 0.00 -1.05 0.00 0.00 32.46 30.51 3g51 n ARG 110 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 3g51 n ASP 120 N -0.09 0.00 -0.15 2.89 2.03 -1.26 -4.50 116.55 115.47 3g51 n ASP 120 Ca 0.02 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.33 3g51 n ASP 120 Cb 0.23 0.00 0.25 0.00 -0.72 0.00 0.00 41.12 40.88 3g51 n ASP 120 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 3g51 h ILE 121 N 0.00 1.19 0.00 5.18 6.09 -2.04 0.12 117.51 128.06 3g51 h ILE 121 Ca 0.00 -0.52 0.00 0.00 -1.37 0.00 0.00 64.86 62.97 3g51 h ILE 121 Cb 0.00 0.38 0.00 0.00 0.47 0.00 0.00 36.82 37.67 3g51 h ILE 121 CO 0.00 0.22 0.00 0.18 -3.07 0.00 0.00 178.15 175.48 3g51 n LEU 122 N -4.37 0.08 -0.10 2.19 4.77 -1.26 -1.85 117.00 116.47 3g51 n LEU 122 Ca 0.06 0.52 -0.16 0.00 -0.03 0.00 0.00 56.01 56.40 3g51 n LEU 122 Cb 0.11 -0.51 -0.13 0.00 -2.33 0.00 0.00 43.42 40.56 3g51 n LEU 122 CO 0.38 -0.26 -1.20 0.52 -1.33 0.00 0.00 177.39 175.50 3g51 n VAL 123 N -1.59 1.50 0.14 4.08 0.31 -0.38 -4.44 118.33 117.96 3g51 n VAL 123 Ca 0.04 -0.67 0.03 0.00 -0.01 0.00 0.00 64.34 63.73 3g51 n VAL 123 Cb 0.20 -1.19 0.41 0.00 -0.91 0.00 0.00 33.84 32.35 3g51 n VAL 123 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3g51 h GLU 124 N 0.01 0.18 0.00 5.55 4.39 -0.19 -2.32 114.58 122.20 3g51 h GLU 124 Ca -0.54 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.12 3g51 h GLU 124 Cb 2.01 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 30.63 3g51 h GLU 124 CO -0.03 0.33 0.00 1.33 -1.16 0.00 0.00 179.01 179.48 3g51 n VAL 125 N -4.28 0.56 -1.78 3.13 0.24 -0.77 -4.79 118.33 110.63 3g51 n VAL 125 Ca -0.01 0.14 -0.41 0.00 -2.04 0.00 0.00 64.34 62.02 3g51 n VAL 125 Cb 0.26 -0.84 -0.01 0.00 -1.47 0.00 0.00 33.84 31.78 3g51 n VAL 125 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 3g51 s ASN 126 N -2.68 6.35 -0.02 -1.34 0.01 -0.88 -4.92 114.94 111.47 3g51 s ASN 126 Ca 0.15 3.00 -0.29 0.00 -0.71 0.00 0.00 52.86 55.00 3g51 s ASN 126 Cb 0.12 -2.65 0.08 0.00 0.41 0.00 0.00 41.25 39.21 3g51 s ASN 126 CO 0.28 -0.91 0.73 -2.28 -1.51 0.00 0.00 177.10 173.42 3g51 s HIS 127 N -0.41 -0.56 0.50 2.20 2.46 -1.26 -5.04 115.29 113.18 3g51 s HIS 127 Ca 0.59 0.79 0.21 0.00 0.47 0.00 0.00 55.06 57.13 3g51 s HIS 127 Cb -0.47 0.46 1.27 0.00 -0.13 0.00 0.00 32.58 33.71 3g51 s HIS 127 CO 0.54 -0.61 2.00 -1.35 -2.47 0.00 0.00 174.74 172.84 3g51 h PRO 128 N 2.62 0.13 -0.21 2.88 0.11 -1.94 -2.72 132.00 132.87 3g51 h PRO 128 Ca -0.27 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.78 3g51 h PRO 128 Cb 1.19 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.24 3g51 h PRO 128 CO 0.37 0.08 -0.07 1.19 -0.21 0.00 0.00 178.00 179.37 3g51 n PHE 129 N -4.42 0.69 -4.59 0.65 3.72 -1.26 -4.89 117.46 107.35 3g51 n PHE 129 Ca 0.09 -1.18 -0.23 0.00 -0.05 0.00 0.00 57.45 56.09 3g51 n PHE 129 Cb 0.50 -0.32 -0.16 0.00 -0.94 0.00 0.00 39.48 38.56 3g51 n PHE 129 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3g51 s ILE 130 N -3.00 1.06 0.44 4.37 1.01 -1.03 -1.38 121.20 122.68 3g51 s ILE 130 Ca 0.40 -0.53 -0.24 0.00 0.00 0.00 0.00 60.65 60.28 3g51 s ILE 130 Cb 0.35 -0.92 -0.09 0.00 0.01 0.00 0.00 42.46 41.81 3g51 s ILE 130 CO 0.03 0.31 1.18 0.55 0.00 0.00 0.00 174.94 177.02 3g51 n VAL 131 N 3.11 2.70 -3.59 2.92 3.14 -0.37 -4.43 118.33 121.81 3g51 n VAL 131 Ca -0.17 -0.50 -0.37 0.00 -2.96 0.00 0.00 64.34 60.34 3g51 n VAL 131 Cb 0.54 -1.43 -0.06 0.00 -1.06 0.00 0.00 33.84 31.83 3g51 n VAL 131 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 3g51 s LYS 132 N -2.24 3.94 -0.22 1.45 2.20 -1.26 -4.90 119.74 118.70 3g51 s LYS 132 Ca 0.63 0.19 -0.19 0.00 -0.36 0.00 0.00 55.97 56.25 3g51 s LYS 132 Cb -0.51 -3.29 -0.03 0.00 -1.51 0.00 0.00 37.83 32.50 3g51 s LYS 132 CO 0.56 0.54 0.56 -1.17 -0.36 0.00 0.00 175.35 175.48 3g51 s LEU 133 N -0.50 4.11 -0.17 5.43 2.96 -1.26 -1.59 118.68 127.65 3g51 s LEU 133 Ca 0.20 0.68 0.00 0.00 -0.22 0.00 0.00 54.13 54.78 3g51 s LEU 133 Cb -0.14 -2.76 -0.22 0.00 0.50 0.00 0.00 46.19 43.57 3g51 s LEU 133 CO 0.08 -0.25 0.15 1.41 -1.32 0.00 0.00 176.35 176.42 3g51 n HIS 134 N 5.15 0.67 -3.82 5.38 8.25 0.60 -4.74 115.22 126.72 3g51 n HIS 134 Ca -0.03 0.16 -0.12 0.00 -0.26 0.00 0.00 57.72 57.47 3g51 n HIS 134 Cb 0.50 -1.09 -0.09 0.00 1.12 0.00 0.00 29.99 30.43 3g51 n HIS 134 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3g51 s TYR 135 N -2.54 -0.03 -0.01 4.41 2.02 -1.08 -1.29 117.35 118.82 3g51 s TYR 135 Ca -0.25 -0.04 0.00 0.00 -0.37 0.00 0.00 57.07 56.42 3g51 s TYR 135 Cb 0.08 0.01 0.01 0.00 -0.40 0.00 0.00 41.96 41.65 3g51 s TYR 135 CO 0.72 -0.37 0.00 0.00 -1.57 0.00 0.00 175.55 174.33 3g51 s ALA 136 N -1.72 0.10 0.05 3.71 0.00 -0.62 -1.19 121.76 122.09 3g51 s ALA 136 Ca -0.12 0.06 -0.17 0.00 0.00 0.00 0.00 51.96 51.73 3g51 s ALA 136 Cb -0.05 -0.10 0.03 0.00 0.00 0.00 0.00 23.12 23.01 3g51 s ALA 136 CO 0.01 -0.02 0.39 -0.59 0.00 0.00 0.00 175.76 175.55 3g51 s PHE 137 N 0.31 -0.23 -0.07 0.00 -0.71 -0.84 -1.37 117.98 115.08 3g51 s PHE 137 Ca -0.03 0.13 0.04 0.00 -1.04 0.00 0.00 56.93 56.04 3g51 s PHE 137 Cb -0.04 0.20 -0.01 0.00 -1.21 0.00 0.00 43.02 41.95 3g51 s PHE 137 CO -0.01 -0.57 -0.20 -0.65 -1.34 0.00 0.00 175.22 172.44 3g51 s GLN 138 N -2.66 2.74 -0.15 1.99 -0.21 -1.24 -0.37 119.66 119.76 3g51 s GLN 138 Ca -0.04 -0.82 -0.06 0.00 0.02 0.00 0.00 55.36 54.46 3g51 s GLN 138 Cb -0.00 -2.31 0.07 0.00 1.00 0.00 0.00 33.01 31.76 3g51 s GLN 138 CO -0.04 0.39 0.32 0.99 -2.12 0.00 0.00 175.29 174.83 3g51 s THR 139 N -0.15 -0.35 -1.01 -0.19 2.01 -0.60 -4.95 115.64 110.40 3g51 s THR 139 Ca -0.03 0.20 -0.04 0.00 0.31 0.00 0.00 61.69 62.13 3g51 s THR 139 Cb -0.14 -0.52 0.00 0.00 0.01 0.00 0.00 72.50 71.86 3g51 s THR 139 CO 0.04 0.08 0.87 -1.84 -0.69 0.00 0.00 174.62 173.08 3g51 n GLU 140 N 5.01 -5.80 -2.12 4.92 0.28 -1.26 -2.74 120.64 118.93 3g51 n GLU 140 Ca -0.13 0.65 -0.15 0.00 -0.16 0.00 0.00 57.16 57.38 3g51 n GLU 140 Cb 0.51 -5.13 -0.02 0.00 1.43 0.00 0.00 31.44 28.23 3g51 n GLU 140 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3g51 n GLY 141 N -1.45 0.08 3.16 -1.84 0.00 -1.26 -5.01 105.19 98.87 3g51 n GLY 141 Ca -0.09 -0.28 -0.20 0.00 0.00 0.00 0.00 46.02 45.45 3g51 n GLY 141 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g51 s LYS 142 N -4.46 0.95 -0.18 1.61 1.02 -1.11 -4.72 119.74 112.85 3g51 s LYS 142 Ca 0.00 -0.81 -0.04 0.00 0.02 0.00 0.00 55.97 55.15 3g51 s LYS 142 Cb 0.00 -0.97 -0.02 0.00 -0.52 0.00 0.00 37.83 36.32 3g51 s LYS 142 CO 0.00 0.24 -0.04 -1.17 -0.92 0.00 0.00 175.35 173.46 3g51 s LEU 143 N -1.25 3.11 -0.18 3.17 2.96 0.55 -1.56 118.68 125.49 3g51 s LEU 143 Ca 0.01 -0.23 -0.06 0.00 -0.22 0.00 0.00 54.13 53.63 3g51 s LEU 143 Cb -0.08 -1.77 -0.03 0.00 0.50 0.00 0.00 46.19 44.81 3g51 s LEU 143 CO 0.01 0.09 0.03 -0.31 -1.32 0.00 0.00 176.35 174.86 3g51 s TYR 144 N 0.82 3.15 -0.16 5.38 2.02 0.50 -0.69 117.35 128.36 3g51 s TYR 144 Ca -0.01 -0.12 -0.01 0.00 -0.37 0.00 0.00 57.07 56.57 3g51 s TYR 144 Cb -0.15 -2.06 -0.01 0.00 -0.40 0.00 0.00 41.96 39.35 3g51 s TYR 144 CO 0.02 0.02 -0.12 -0.51 -1.57 0.00 0.00 175.55 173.39 3g51 s LEU 145 N 0.53 2.62 -0.25 -1.29 1.43 -0.00 -1.98 118.68 119.72 3g51 s LEU 145 Ca 0.01 -0.42 -0.06 0.00 -1.03 0.00 0.00 54.13 52.63 3g51 s LEU 145 Cb -0.13 -1.61 -0.01 0.00 0.03 0.00 0.00 46.19 44.47 3g51 s LEU 145 CO 0.02 0.08 0.03 -0.63 0.23 0.00 0.00 176.35 176.08 3g51 s ILE 146 N 0.87 3.85 0.27 -0.59 -1.09 -0.33 -1.27 121.20 122.91 3g51 s ILE 146 Ca -0.03 -0.47 0.07 0.00 -2.23 0.00 0.00 60.65 57.98 3g51 s ILE 146 Cb -0.15 -2.85 -0.06 0.00 -1.58 0.00 0.00 42.46 37.82 3g51 s ILE 146 CO -0.00 0.28 -0.08 -0.76 -1.23 0.00 0.00 174.94 173.15 3g51 s LEU 147 N 1.52 2.49 0.23 2.97 1.43 0.39 -0.29 118.68 127.43 3g51 s LEU 147 Ca 0.05 -1.16 -0.29 0.00 -1.03 0.00 0.00 54.13 51.70 3g51 s LEU 147 Cb -0.16 -0.66 -0.16 0.00 0.03 0.00 0.00 46.19 45.25 3g51 s LEU 147 CO 0.01 -0.30 0.77 0.47 0.23 0.00 0.00 176.35 177.52 3g51 n ASP 148 N -0.55 -0.06 -4.57 2.29 8.00 -0.62 -0.50 116.55 120.54 3g51 n ASP 148 Ca -0.06 1.15 -0.43 0.00 0.71 0.00 0.00 54.79 56.17 3g51 n ASP 148 Cb 0.63 -1.10 -0.03 0.00 -0.02 0.00 0.00 41.12 40.60 3g51 n ASP 148 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3g51 s PHE 149 N -0.93 2.79 -0.27 1.24 5.36 -1.26 -3.82 117.98 121.08 3g51 s PHE 149 Ca 0.63 0.40 -0.24 0.00 -0.96 0.00 0.00 56.93 56.76 3g51 s PHE 149 Cb -0.85 -4.25 -0.00 0.00 -0.34 0.00 0.00 43.02 37.58 3g51 s PHE 149 CO 0.57 -1.32 0.83 -0.51 -1.46 0.00 0.00 175.22 173.34 3g51 s LEU 150 N 4.28 4.07 0.00 6.12 1.43 -1.26 -4.95 118.68 128.38 3g51 s LEU 150 Ca 0.40 0.89 0.23 0.00 -1.03 0.00 0.00 54.13 54.62 3g51 s LEU 150 Cb -0.09 -3.17 0.08 0.00 0.03 0.00 0.00 46.19 43.04 3g51 s LEU 150 CO 0.26 -0.59 1.13 0.54 0.23 0.00 0.00 176.35 177.93 3g51 n ARG 151 N 6.16 0.77 0.00 1.70 1.74 -1.24 -4.40 116.66 121.39 3g51 n ARG 151 Ca 0.05 -0.60 0.13 0.00 -0.77 0.00 0.00 57.85 56.66 3g51 n ARG 151 Cb 0.48 -1.49 0.33 0.00 -1.02 0.00 0.00 32.46 30.76 3g51 n ARG 151 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3g51 n GLY 152 N 1.43 0.06 0.23 -0.13 0.00 0.44 -4.80 105.19 102.42 3g51 n GLY 152 Ca 0.08 -0.51 0.03 0.00 0.00 0.00 0.00 46.02 45.62 3g51 n GLY 152 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g51 n GLY 153 N 1.29 -1.41 3.86 -0.02 0.00 -1.24 -4.60 105.19 103.06 3g51 n GLY 153 Ca 0.15 -1.48 -0.31 0.00 0.00 0.00 0.00 46.02 44.38 3g51 n GLY 153 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3g51 s ASP 154 N -2.97 6.59 0.14 1.61 -4.77 -1.26 -0.97 116.67 115.03 3g51 s ASP 154 Ca 0.00 1.38 -0.16 0.00 -3.30 0.00 0.00 52.55 50.47 3g51 s ASP 154 Cb 0.00 -2.43 0.00 0.00 -1.09 0.00 0.00 42.92 39.41 3g51 s ASP 154 CO 0.00 -0.49 1.69 0.25 0.70 0.00 0.00 175.17 177.32 3g51 h LEU 155 N 1.12 0.57 -1.33 2.11 5.85 -1.54 -2.66 115.31 119.43 3g51 h LEU 155 Ca -0.47 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.07 3g51 h LEU 155 Cb 1.19 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.04 3g51 h LEU 155 CO 0.63 0.57 0.26 -0.26 -0.34 0.00 0.00 178.44 179.30 3g51 h PHE 156 N 0.53 0.70 -0.48 1.25 0.05 -1.87 -1.03 116.94 116.09 3g51 h PHE 156 Ca 0.14 -0.01 -0.13 0.00 3.82 0.00 0.00 57.97 61.78 3g51 h PHE 156 Cb 0.18 -0.23 -0.01 0.00 2.00 0.00 0.00 35.95 37.89 3g51 h PHE 156 CO -0.00 0.51 -0.22 1.15 -0.18 0.00 0.00 178.31 179.57 3g51 h THR 157 N 0.72 1.27 -0.67 -1.55 2.02 -1.90 -1.49 112.91 111.32 3g51 h THR 157 Ca 0.18 -1.39 -0.05 0.00 0.77 0.00 0.00 66.41 65.93 3g51 h THR 157 Cb 0.06 1.13 -0.03 0.00 -1.74 0.00 0.00 68.15 67.57 3g51 h THR 157 CO -0.03 0.48 0.24 -0.09 0.37 0.00 0.00 175.52 176.49 3g51 h ARG 158 N 0.86 1.01 -0.34 6.66 9.65 -1.04 -2.65 114.38 128.53 3g51 h ARG 158 Ca 0.11 -0.20 -0.09 0.00 -1.10 0.00 0.00 59.98 58.70 3g51 h ARG 158 Cb 0.80 -0.16 -0.02 0.00 -1.39 0.00 0.00 29.97 29.21 3g51 h ARG 158 CO 0.07 0.86 -0.16 -0.07 2.80 0.00 0.00 179.97 183.47 3g51 h LEU 159 N 0.95 0.60 -1.90 3.80 3.38 -1.07 -2.80 115.31 118.27 3g51 h LEU 159 Ca 0.22 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3g51 h LEU 159 Cb 0.25 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3g51 h LEU 159 CO -0.01 0.78 0.00 0.77 0.09 0.00 0.00 178.44 180.06 3g51 h SER 160 N 0.55 0.00 0.05 -0.43 4.64 -0.92 -1.66 113.55 115.78 3g51 h SER 160 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 3g51 h SER 160 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 3g51 h SER 160 CO 0.04 0.00 -0.02 0.29 -0.87 0.00 0.00 176.83 176.27 3g51 n LYS 161 N -2.94 1.20 -4.05 4.77 5.02 -1.05 -4.74 118.16 116.37 3g51 n LYS 161 Ca -0.01 -0.39 -0.34 0.00 -2.02 0.00 0.00 58.31 55.55 3g51 n LYS 161 Cb 0.20 -1.49 -0.15 0.00 -0.02 0.00 0.00 35.03 33.56 3g51 n LYS 161 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3g51 s GLU 162 N -2.07 3.13 0.15 1.97 0.41 -0.63 -5.01 118.70 116.65 3g51 s GLU 162 Ca 0.41 -0.75 -0.09 0.00 -0.41 0.00 0.00 54.97 54.13 3g51 s GLU 162 Cb 0.21 -2.73 -0.02 0.00 -1.78 0.00 0.00 34.13 29.81 3g51 s GLU 162 CO 0.37 -0.20 1.46 0.28 -0.49 0.00 0.00 175.26 176.68 3g51 h VAL 163 N 5.85 1.28 -0.49 2.63 2.07 -1.85 -3.38 116.25 122.37 3g51 h VAL 163 Ca -0.44 -1.67 -0.10 0.00 0.82 0.00 0.00 66.70 65.30 3g51 h VAL 163 Cb 1.15 1.56 -0.06 0.00 -1.52 0.00 0.00 31.29 32.42 3g51 h VAL 163 CO 0.63 0.55 0.09 0.23 0.02 0.00 0.00 177.57 179.08 3g51 n MET 164 N -4.02 3.33 -1.85 1.57 2.81 -1.26 -5.05 117.12 112.65 3g51 n MET 164 Ca -0.03 -3.03 -0.35 0.00 -1.81 0.00 0.00 57.70 52.48 3g51 n MET 164 Cb 0.59 -2.03 0.05 0.00 -0.71 0.00 0.00 33.22 31.12 3g51 n MET 164 CO 0.00 0.00 0.00 -0.59 1.51 0.00 0.00 175.97 176.89 3g51 s PHE 165 N -2.94 2.37 0.43 2.03 -0.71 -1.26 -5.02 117.98 112.88 3g51 s PHE 165 Ca 0.49 1.54 0.07 0.00 -1.04 0.00 0.00 56.93 58.00 3g51 s PHE 165 Cb 0.40 -3.41 -0.03 0.00 -1.21 0.00 0.00 43.02 38.77 3g51 s PHE 165 CO 0.10 -2.16 0.27 0.95 -1.34 0.00 0.00 175.22 173.04 3g51 s THR 166 N -1.84 2.35 0.25 -4.49 -4.23 -1.26 -5.01 115.64 101.41 3g51 s THR 166 Ca 0.74 -1.56 -0.04 0.00 -1.18 0.00 0.00 61.69 59.66 3g51 s THR 166 Cb -0.28 -2.91 0.24 0.00 1.34 0.00 0.00 72.50 70.90 3g51 s THR 166 CO 0.37 0.00 1.85 -0.08 -0.54 0.00 0.00 174.62 176.22 3g51 h GLU 167 N 1.22 0.99 -0.23 3.99 4.81 -1.98 -2.29 114.58 121.09 3g51 h GLU 167 Ca -0.42 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 58.66 3g51 h GLU 167 Cb 1.26 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 30.41 3g51 h GLU 167 CO 0.65 0.65 -0.24 1.49 -0.73 0.00 0.00 179.01 180.83 3g51 h GLU 168 N 1.02 0.43 0.07 1.92 4.57 -1.99 0.09 114.58 120.69 3g51 h GLU 168 Ca 0.41 -0.15 -0.00 0.00 -1.18 0.00 0.00 59.36 58.43 3g51 h GLU 168 Cb 0.23 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.79 3g51 h GLU 168 CO -0.19 0.64 -0.04 -0.44 -1.18 0.00 0.00 179.01 177.80 3g51 h ASP 169 N 0.38 -0.08 -0.75 1.04 3.32 -1.83 -2.85 116.42 115.66 3g51 h ASP 169 Ca 0.06 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 3g51 h ASP 169 Cb 0.63 0.02 -0.04 0.00 0.22 0.00 0.00 39.33 40.16 3g51 h ASP 169 CO 0.04 0.04 0.44 0.58 -1.72 0.00 0.00 179.24 178.63 3g51 h VAL 170 N -0.20 1.21 -0.82 -1.35 2.07 -1.13 -2.48 116.25 113.57 3g51 h VAL 170 Ca -0.01 -0.49 0.09 0.00 0.82 0.00 0.00 66.70 67.11 3g51 h VAL 170 Cb 0.17 0.16 -0.06 0.00 -1.52 0.00 0.00 31.29 30.05 3g51 h VAL 170 CO 0.02 0.23 0.53 0.50 0.02 0.00 0.00 177.57 178.87 3g51 h LYS 171 N 1.05 0.78 -0.21 1.57 3.64 -0.83 -1.24 116.57 121.33 3g51 h LYS 171 Ca 0.27 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 3g51 h LYS 171 Cb -0.02 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 3g51 h LYS 171 CO -0.05 0.52 0.13 0.35 -2.27 0.00 0.00 179.45 178.13 3g51 h PHE 172 N 0.80 0.26 -0.35 1.91 3.57 -1.21 -0.49 116.94 121.44 3g51 h PHE 172 Ca 0.37 0.00 -0.16 0.00 3.53 0.00 0.00 57.97 61.72 3g51 h PHE 172 Cb 0.38 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 3g51 h PHE 172 CO -0.00 0.18 -0.40 1.88 -2.23 0.00 0.00 178.31 177.73 3g51 h TYR 173 N 0.27 1.04 -0.88 0.41 0.05 -1.44 -2.50 116.97 113.92 3g51 h TYR 173 Ca 0.08 -0.32 -0.02 0.00 0.05 0.00 0.00 58.73 58.52 3g51 h TYR 173 Cb -0.01 -0.22 -0.04 0.00 1.01 0.00 0.00 36.73 37.47 3g51 h TYR 173 CO -0.06 1.12 0.48 -0.07 -1.05 0.00 0.00 178.16 178.58 3g51 h LEU 174 N 0.70 1.11 -0.44 3.88 3.38 -1.14 -1.39 115.31 121.41 3g51 h LEU 174 Ca 0.05 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 3g51 h LEU 174 Cb 0.99 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 3g51 h LEU 174 CO 0.10 0.90 0.18 0.00 0.09 0.00 0.00 178.44 179.70 3g51 h ALA 175 N 1.26 0.57 -0.65 1.53 0.00 -0.87 0.50 119.26 121.60 3g51 h ALA 175 Ca 0.31 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 3g51 h ALA 175 Cb 0.04 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3g51 h ALA 175 CO -0.05 0.17 0.28 0.93 0.00 0.00 0.00 179.25 180.59 3g51 h GLU 176 N 0.57 0.96 -0.91 0.00 5.08 -1.30 -2.33 114.58 116.64 3g51 h GLU 176 Ca 0.15 -0.16 0.03 0.00 -1.00 0.00 0.00 59.36 58.38 3g51 h GLU 176 Cb 0.19 -0.16 -0.05 0.00 0.50 0.00 0.00 28.75 29.22 3g51 h GLU 176 CO -0.01 0.79 0.59 1.25 -1.00 0.00 0.00 179.01 180.62 3g51 h LEU 177 N 0.91 0.99 -0.85 1.33 5.85 -0.97 -2.17 115.31 120.40 3g51 h LEU 177 Ca 0.22 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 3g51 h LEU 177 Cb 0.17 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.93 3g51 h LEU 177 CO -0.02 0.68 0.41 0.00 -0.34 0.00 0.00 178.44 179.17 3g51 h ALA 178 N 1.37 1.09 -0.49 1.25 0.00 -0.50 -0.63 119.26 121.36 3g51 h ALA 178 Ca 0.36 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 3g51 h ALA 178 Cb -0.01 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 3g51 h ALA 178 CO -0.11 0.65 0.19 -0.07 0.00 0.00 0.00 179.25 179.91 3g51 h LEU 179 N 1.21 0.68 -0.35 0.00 3.38 -0.99 -1.67 115.31 117.57 3g51 h LEU 179 Ca 0.29 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 58.09 3g51 h LEU 179 Cb 0.11 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3g51 h LEU 179 CO -0.04 0.68 0.22 0.00 0.09 0.00 0.00 178.44 179.39 3g51 h ALA 180 N 1.04 0.44 -0.18 1.53 0.00 -1.00 -1.11 119.26 119.97 3g51 h ALA 180 Ca 0.16 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3g51 h ALA 180 Cb 0.21 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3g51 h ALA 180 CO -0.01 -0.12 0.07 -0.07 0.00 0.00 0.00 179.25 179.11 3g51 h LEU 181 N 0.44 0.26 -1.31 0.00 3.38 -0.95 -2.48 115.31 114.65 3g51 h LEU 181 Ca 0.14 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 3g51 h LEU 181 Cb -0.02 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 3g51 h LEU 181 CO -0.05 0.36 0.07 -0.78 0.09 0.00 0.00 178.44 178.14 3g51 h ASP 182 N 0.14 0.50 -0.19 -0.43 3.58 -1.23 -0.48 116.42 118.29 3g51 h ASP 182 Ca 0.06 -0.07 0.03 0.00 0.42 0.00 0.00 57.03 57.47 3g51 h ASP 182 Cb 0.19 -0.13 -0.03 0.00 1.72 0.00 0.00 39.33 41.08 3g51 h ASP 182 CO -0.00 0.52 0.02 -0.74 -2.88 0.00 0.00 179.24 176.15 3g51 h HIS 183 N 0.53 0.03 -0.47 0.28 2.76 -0.80 0.31 115.15 117.78 3g51 h HIS 183 Ca 0.12 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.30 3g51 h HIS 183 Cb 0.23 0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.19 3g51 h HIS 183 CO 0.01 -0.00 0.25 -0.07 -1.30 0.00 0.00 177.93 176.82 3g51 h LEU 184 N 0.09 0.59 -1.33 0.26 3.38 -0.96 -2.43 115.31 114.90 3g51 h LEU 184 Ca 0.09 -0.09 0.06 0.00 0.09 0.00 0.00 57.88 58.03 3g51 h LEU 184 Cb 0.10 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.65 3g51 h LEU 184 CO -0.13 0.51 0.49 0.45 0.09 0.00 0.00 178.44 179.85 3g51 h HIS 185 N 0.62 0.82 0.00 1.13 3.86 -0.66 -0.25 115.15 120.66 3g51 h HIS 185 Ca 0.16 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.39 3g51 h HIS 185 Cb 0.06 -0.27 -0.00 0.00 1.06 0.00 0.00 27.41 28.26 3g51 h HIS 185 CO -0.02 0.44 -0.00 0.66 0.86 0.00 0.00 177.93 179.87 3g51 h SER 186 N 0.81 0.00 -0.46 2.45 4.64 -0.43 -0.39 113.55 120.17 3g51 h SER 186 Ca 0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 3g51 h SER 186 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 3g51 h SER 186 CO -0.11 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.04 3g51 n LEU 187 N -3.10 3.57 0.00 5.97 4.77 -0.22 -4.93 117.00 123.05 3g51 n LEU 187 Ca -0.02 -1.61 0.00 0.00 -0.03 0.00 0.00 56.01 54.36 3g51 n LEU 187 Cb 0.15 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 3g51 n LEU 187 CO 0.23 0.80 0.00 0.61 -1.33 0.00 0.00 177.39 177.69 3g51 n GLY 188 N 1.53 0.42 3.75 -0.72 0.00 -0.16 -4.75 105.19 105.26 3g51 n GLY 188 Ca 0.20 -0.89 -0.35 0.00 0.00 0.00 0.00 46.02 44.98 3g51 n GLY 188 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3g51 s ILE 189 N -2.00 4.69 -0.11 -0.61 1.01 -0.50 -1.50 121.20 122.18 3g51 s ILE 189 Ca 0.00 -0.14 0.01 0.00 0.00 0.00 0.00 60.65 60.52 3g51 s ILE 189 Cb 0.00 -3.01 -0.02 0.00 0.01 0.00 0.00 42.46 39.44 3g51 s ILE 189 CO 0.00 0.58 -0.13 -0.63 0.00 0.00 0.00 174.94 174.76 3g51 s ILE 190 N -0.96 3.08 0.13 2.92 1.01 -1.26 -2.90 121.20 123.22 3g51 s ILE 190 Ca 0.15 -0.67 -0.14 0.00 0.00 0.00 0.00 60.65 59.98 3g51 s ILE 190 Cb -0.12 -2.27 -0.00 0.00 0.01 0.00 0.00 42.46 40.08 3g51 s ILE 190 CO 0.04 0.54 1.61 0.22 0.00 0.00 0.00 174.94 177.35 3g51 h TYR 191 N 6.32 0.77 0.00 3.97 3.20 -1.93 -3.43 116.97 125.87 3g51 h TYR 191 Ca -0.32 -0.11 0.00 0.00 3.14 0.00 0.00 58.73 61.44 3g51 h TYR 191 Cb 1.20 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 39.26 3g51 h TYR 191 CO 0.50 0.74 0.00 0.54 -1.64 0.00 0.00 178.16 178.31 3g51 n ARG 192 N -4.47 0.00 -1.89 1.82 1.74 -1.26 -4.56 116.66 108.03 3g51 n ARG 192 Ca -0.00 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 56.83 3g51 n ARG 192 Cb 0.25 0.00 0.03 0.00 -1.02 0.00 0.00 32.46 31.72 3g51 n ARG 192 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3g51 n ASP 193 N 3.61 5.23 -4.69 0.55 2.03 -1.26 -4.96 116.55 117.07 3g51 n ASP 193 Ca 0.00 -3.76 -0.42 0.00 0.52 0.00 0.00 54.79 51.13 3g51 n ASP 193 Cb 0.00 -0.43 -0.03 0.00 -0.72 0.00 0.00 41.12 39.94 3g51 n ASP 193 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 3g51 s LEU 194 N -3.62 4.38 0.16 -2.67 2.96 -1.26 -4.98 118.68 113.65 3g51 s LEU 194 Ca 0.53 2.57 -0.14 0.00 -0.22 0.00 0.00 54.13 56.87 3g51 s LEU 194 Cb 0.42 -3.56 0.02 0.00 0.50 0.00 0.00 46.19 43.57 3g51 s LEU 194 CO 0.03 -0.92 0.41 -1.59 -1.32 0.00 0.00 176.35 172.95 3g51 s LYS 195 N 2.67 1.21 0.33 1.98 -2.85 -1.26 -4.82 119.74 116.99 3g51 s LYS 195 Ca 0.76 -0.91 0.07 0.00 -1.00 0.00 0.00 55.97 54.89 3g51 s LYS 195 Cb -0.42 0.46 0.74 0.00 -2.06 0.00 0.00 37.83 36.55 3g51 s LYS 195 CO 0.34 -0.48 1.85 -1.35 0.10 0.00 0.00 175.35 175.80 3g51 h PRO 196 N 2.37 0.76 0.00 1.78 0.11 -1.95 -1.29 132.00 133.78 3g51 h PRO 196 Ca -0.31 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.75 3g51 h PRO 196 Cb 1.25 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3g51 h PRO 196 CO 0.44 0.50 0.00 0.93 -0.21 0.00 0.00 178.00 179.66 3g51 h GLU 197 N 0.78 0.00 -0.02 1.05 3.07 -1.98 -0.58 114.58 116.91 3g51 h GLU 197 Ca 0.48 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.34 3g51 h GLU 197 Cb 0.69 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.60 3g51 h GLU 197 CO -0.25 0.00 -0.09 0.09 -1.40 0.00 0.00 179.01 177.36 3g51 n ASN 198 N -2.61 1.86 -4.15 1.42 4.13 -0.49 -4.77 115.26 110.66 3g51 n ASN 198 Ca -0.01 -1.52 -0.38 0.00 1.68 0.00 0.00 54.58 54.35 3g51 n ASN 198 Cb 0.12 0.07 -0.10 0.00 -1.54 0.00 0.00 39.78 38.32 3g51 n ASN 198 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3g51 s ILE 199 N -2.14 3.61 0.52 2.41 1.01 -0.23 -0.87 121.20 125.52 3g51 s ILE 199 Ca 0.31 -2.07 0.06 0.00 0.00 0.00 0.00 60.65 58.95 3g51 s ILE 199 Cb 0.20 -3.43 0.06 0.00 0.01 0.00 0.00 42.46 39.30 3g51 s ILE 199 CO 0.38 -0.74 0.49 0.18 0.00 0.00 0.00 174.94 175.25 3g51 n LEU 200 N 4.57 0.00 -4.18 2.97 4.32 -0.53 -1.50 117.00 122.66 3g51 n LEU 200 Ca -0.03 -2.60 -0.22 0.00 -0.02 0.00 0.00 56.01 53.15 3g51 n LEU 200 Cb 0.41 -0.14 -0.14 0.00 -1.62 0.00 0.00 43.42 41.93 3g51 n LEU 200 CO 0.36 -0.60 -0.48 -0.76 -1.22 0.00 0.00 177.39 174.68 3g51 s LEU 201 N 0.00 2.16 0.00 2.23 1.43 -0.14 -0.80 118.68 123.55 3g51 s LEU 201 Ca 0.37 -0.47 -0.06 0.00 -1.03 0.00 0.00 54.13 52.95 3g51 s LEU 201 Cb -0.03 -0.74 0.11 0.00 0.03 0.00 0.00 46.19 45.56 3g51 s LEU 201 CO 0.23 0.09 0.68 -0.90 0.23 0.00 0.00 176.35 176.68 3g51 n ASP 202 N 1.93 0.36 0.27 2.29 5.68 -0.52 -0.42 116.55 126.13 3g51 n ASP 202 Ca -0.17 -1.43 0.18 0.00 -0.50 0.00 0.00 54.79 52.86 3g51 n ASP 202 Cb 0.54 -0.49 0.80 0.00 -1.14 0.00 0.00 41.12 40.84 3g51 n ASP 202 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3g51 h GLU 203 N 0.00 0.00 -0.01 0.11 9.09 -1.91 -1.58 114.58 120.28 3g51 h GLU 203 Ca -0.22 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.19 3g51 h GLU 203 Cb 0.68 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.78 3g51 h GLU 203 CO 0.18 0.00 -0.37 0.39 0.05 0.00 0.00 179.01 179.26 3g51 n GLU 204 N -2.91 1.08 -0.38 1.06 1.02 -1.26 -4.57 120.64 114.69 3g51 n GLU 204 Ca -0.00 -0.80 0.00 0.00 -0.02 0.00 0.00 57.16 56.33 3g51 n GLU 204 Cb 0.21 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.15 3g51 n GLU 204 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3g51 n GLY 205 N 1.38 0.80 3.87 0.62 0.00 -0.60 -4.72 105.19 106.54 3g51 n GLY 205 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 3g51 n GLY 205 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3g51 s HIS 206 N -2.08 3.47 0.35 1.61 3.76 -1.26 -4.78 115.29 116.36 3g51 s HIS 206 Ca 0.00 1.14 -0.28 0.00 -0.15 0.00 0.00 55.06 55.76 3g51 s HIS 206 Cb 0.00 -2.52 -0.11 0.00 1.11 0.00 0.00 32.58 31.06 3g51 s HIS 206 CO 0.00 -0.18 1.46 0.42 -0.85 0.00 0.00 174.74 175.59 3g51 s ILE 207 N -2.45 2.22 -0.13 0.60 -1.09 -1.26 -1.44 121.20 117.65 3g51 s ILE 207 Ca 0.53 0.21 -0.04 0.00 -2.23 0.00 0.00 60.65 59.12 3g51 s ILE 207 Cb -0.10 -3.14 0.06 0.00 -1.58 0.00 0.00 42.46 37.70 3g51 s ILE 207 CO 0.32 0.05 0.12 -0.54 -1.23 0.00 0.00 174.94 173.65 3g51 s LYS 208 N -1.83 0.05 0.38 2.79 -0.14 0.02 -4.35 119.74 116.65 3g51 s LYS 208 Ca 0.53 0.17 -0.26 0.00 -1.36 0.00 0.00 55.97 55.05 3g51 s LYS 208 Cb -0.45 -1.19 -0.09 0.00 -1.68 0.00 0.00 37.83 34.42 3g51 s LYS 208 CO 0.59 -0.54 1.17 -0.51 -0.76 0.00 0.00 175.35 175.30 3g51 s LEU 209 N 2.20 4.26 0.00 3.17 1.43 -0.48 -1.45 118.68 127.82 3g51 s LEU 209 Ca 0.04 2.36 0.28 0.00 -1.03 0.00 0.00 54.13 55.78 3g51 s LEU 209 Cb -0.14 -3.94 1.15 0.00 0.03 0.00 0.00 46.19 43.29 3g51 s LEU 209 CO -0.08 -0.58 1.81 0.35 0.23 0.00 0.00 176.35 178.08 3g51 n THR 210 N 0.29 0.00 -4.09 5.49 -2.24 -0.05 -1.24 114.28 112.45 3g51 n THR 210 Ca 0.03 -0.08 -0.15 0.00 -2.27 0.00 0.00 64.05 61.58 3g51 n THR 210 Cb 0.46 0.03 -0.04 0.00 -2.10 0.00 0.00 70.33 68.68 3g51 n THR 210 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3g51 s ASP 211 N -2.43 1.01 -0.10 3.42 -1.08 -1.26 -4.89 116.67 111.33 3g51 s ASP 211 Ca 0.29 -1.53 0.24 0.00 -0.52 0.00 0.00 52.55 51.04 3g51 s ASP 211 Cb 0.20 0.68 0.45 0.00 -1.46 0.00 0.00 42.92 42.79 3g51 s ASP 211 CO 0.47 -1.34 1.15 2.22 0.52 0.00 0.00 175.17 178.19 3g51 n PHE 212 N -0.59 0.43 -0.06 -5.34 -1.74 -1.26 -4.71 117.46 104.20 3g51 n PHE 212 Ca 0.01 -1.11 0.00 0.00 -0.56 0.00 0.00 57.45 55.79 3g51 n PHE 212 Cb 0.61 -0.14 0.00 0.00 1.52 0.00 0.00 39.48 41.47 3g51 n PHE 212 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 3g51 n GLY 213 N 0.06 0.97 3.76 4.97 0.00 -1.26 -4.95 105.19 108.74 3g51 n GLY 213 Ca 0.05 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 3g51 n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g51 s LEU 214 N 0.00 4.40 -0.46 0.99 1.43 -1.26 -4.57 118.68 119.21 3g51 s LEU 214 Ca 0.00 2.68 -0.21 0.00 -1.03 0.00 0.00 54.13 55.57 3g51 s LEU 214 Cb 0.00 -3.64 0.03 0.00 0.03 0.00 0.00 46.19 42.61 3g51 s LEU 214 CO 0.00 -0.64 0.69 -0.44 0.23 0.00 0.00 176.35 176.19 3g51 s SER 215 N -0.01 6.33 0.22 2.29 0.01 0.10 -4.93 113.70 117.71 3g51 s SER 215 Ca 0.55 -0.38 0.06 0.00 1.31 0.00 0.00 55.95 57.49 3g51 s SER 215 Cb -0.41 -2.34 -0.04 0.00 0.21 0.00 0.00 66.02 63.45 3g51 s SER 215 CO 0.48 -0.85 0.17 -0.54 0.41 0.00 0.00 173.24 172.91 3g51 s LYS 216 N 2.97 2.92 -0.13 12.44 1.02 -1.26 -0.73 119.74 136.96 3g51 s LYS 216 Ca 0.23 -0.98 -0.00 0.00 0.02 0.00 0.00 55.97 55.24 3g51 s LYS 216 Cb -0.14 -2.60 0.03 0.00 -0.52 0.00 0.00 37.83 34.60 3g51 s LYS 216 CO 0.19 0.43 -0.09 -1.21 -0.92 0.00 0.00 175.35 173.75 3g51 s GLU 217 N -3.55 1.70 0.86 1.68 2.02 0.12 -4.96 118.70 116.57 3g51 s GLU 217 Ca 0.32 -0.35 -0.11 0.00 0.02 0.00 0.00 54.97 54.85 3g51 s GLU 217 Cb -0.09 -1.76 0.11 0.00 0.10 0.00 0.00 34.13 32.50 3g51 s GLU 217 CO 0.24 -0.28 1.11 -1.54 0.02 0.00 0.00 175.26 174.81 3g51 s SER 218 N 1.65 3.62 0.00 -0.19 1.04 -1.26 -0.37 113.70 118.19 3g51 s SER 218 Ca 0.05 1.89 0.14 0.00 0.48 0.00 0.00 55.95 58.50 3g51 s SER 218 Cb -0.13 -2.48 0.82 0.00 0.10 0.00 0.00 66.02 64.33 3g51 s SER 218 CO -0.09 -2.61 1.24 2.30 0.98 0.00 0.00 173.24 175.06 3g51 n ILE 219 N -3.90 0.00 0.00 -1.02 -5.35 -1.26 -4.08 119.36 103.76 3g51 n ILE 219 Ca 0.09 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.57 3g51 n ILE 219 Cb 0.53 -0.72 0.00 0.00 -1.74 0.00 0.00 39.64 37.71 3g51 n ILE 219 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 3g51 n THR 231 N -0.96 0.00 0.46 7.28 -1.04 -1.26 -4.95 114.28 113.82 3g51 n THR 231 Ca 0.10 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 62.24 3g51 n THR 231 Cb 0.05 0.00 0.30 0.00 -1.82 0.00 0.00 70.33 68.86 3g51 n THR 231 CO 0.00 0.00 0.00 -0.37 -0.64 0.00 0.00 175.07 174.06 3g51 h VAL 232 N 0.00 0.00 -0.09 12.58 -1.51 -1.98 -3.35 116.25 121.90 3g51 h VAL 232 Ca 0.00 -0.69 0.03 0.00 -1.23 0.00 0.00 66.70 64.81 3g51 h VAL 232 Cb 0.00 1.66 -0.00 0.00 -2.13 0.00 0.00 31.29 30.82 3g51 h VAL 232 CO 0.00 0.00 0.12 -0.33 -1.23 0.00 0.00 177.57 176.13 3g51 h GLU 233 N 0.00 0.00 -0.02 5.19 3.07 -1.96 -1.07 114.58 119.79 3g51 h GLU 233 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3g51 h GLU 233 Cb 0.84 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.75 3g51 h GLU 233 CO 0.00 0.00 -0.17 0.66 -1.40 0.00 0.00 179.01 178.10 3g51 n TYR 234 N -3.67 0.00 -2.78 4.33 4.01 -1.26 -4.83 117.16 112.96 3g51 n TYR 234 Ca -0.01 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.33 3g51 n TYR 234 Cb 0.22 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.19 3g51 n TYR 234 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 3g51 s MET 235 N -1.86 4.80 0.57 -0.72 -1.94 -0.41 -3.89 119.30 115.85 3g51 s MET 235 Ca 0.20 1.44 -0.18 0.00 -1.71 0.00 0.00 55.69 55.44 3g51 s MET 235 Cb 0.16 -3.29 -0.05 0.00 2.01 0.00 0.00 34.83 33.66 3g51 s MET 235 CO 0.35 0.48 1.11 0.00 -0.01 0.00 0.00 175.02 176.94 3g51 s ALA 236 N -0.99 2.66 0.24 3.03 0.00 -1.26 -4.79 121.76 120.65 3g51 s ALA 236 Ca 0.41 0.69 -0.04 0.00 0.00 0.00 0.00 51.96 53.02 3g51 s ALA 236 Cb -0.25 -3.33 0.42 0.00 0.00 0.00 0.00 23.12 19.96 3g51 s ALA 236 CO 0.31 -0.84 1.77 -1.35 0.00 0.00 0.00 175.76 175.64 3g51 h PRO 237 N 0.88 0.57 0.00 0.00 0.11 -1.88 0.13 132.00 131.82 3g51 h PRO 237 Ca -0.49 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.57 3g51 h PRO 237 Cb 1.25 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3g51 h PRO 237 CO 0.56 0.38 -0.09 1.05 -0.21 0.00 0.00 178.00 179.69 3g51 h GLU 238 N 0.59 0.00 0.12 1.05 9.09 -1.90 -2.17 114.58 121.36 3g51 h GLU 238 Ca 0.40 0.00 -0.15 0.00 0.05 0.00 0.00 59.36 59.66 3g51 h GLU 238 Cb 0.50 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.62 3g51 h GLU 238 CO -0.32 0.09 -0.67 0.28 0.05 0.00 0.00 179.01 178.45 3g51 h VAL 239 N 0.00 1.57 -0.58 -1.06 2.07 -1.01 -2.61 116.25 114.63 3g51 h VAL 239 Ca -0.00 -2.51 0.09 0.00 0.82 0.00 0.00 66.70 65.10 3g51 h VAL 239 Cb 0.35 3.24 -0.07 0.00 -1.52 0.00 0.00 31.29 33.30 3g51 h VAL 239 CO 0.01 0.70 0.21 0.58 0.02 0.00 0.00 177.57 179.09 3g51 h VAL 240 N -0.48 0.78 -0.44 2.57 2.07 -0.61 -1.99 116.25 118.15 3g51 h VAL 240 Ca -0.12 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.27 3g51 h VAL 240 Cb 1.53 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 3g51 h VAL 240 CO 0.13 0.07 0.00 -0.46 0.02 0.00 0.00 177.57 177.33 3g51 n ASN 241 N -5.01 2.58 -1.58 0.57 0.23 -0.85 -4.92 115.26 106.29 3g51 n ASN 241 Ca 0.08 -2.07 -0.19 0.00 -0.53 0.00 0.00 54.58 51.87 3g51 n ASN 241 Cb 0.26 -0.34 -0.08 0.00 -2.08 0.00 0.00 39.78 37.54 3g51 n ASN 241 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3g51 n ARG 242 N 0.76 -1.43 0.09 -3.83 1.74 -0.75 -4.84 116.66 108.41 3g51 n ARG 242 Ca 0.15 1.11 -0.05 0.00 -0.77 0.00 0.00 57.85 58.29 3g51 n ARG 242 Cb 0.43 -5.47 0.01 0.00 -1.02 0.00 0.00 32.46 26.41 3g51 n ARG 242 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3g51 h ARG 243 N 0.00 0.05 0.00 5.56 3.08 -1.74 -3.49 114.38 117.84 3g51 h ARG 243 Ca -0.39 -0.05 0.05 0.00 0.07 0.00 0.00 59.98 59.66 3g51 h ARG 243 Cb 1.24 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.29 3g51 h ARG 243 CO 0.57 0.86 0.13 0.41 -1.07 0.00 0.00 179.97 180.87 3g51 n GLY 244 N 0.86 0.66 3.28 0.04 0.00 -1.17 -5.10 105.19 103.76 3g51 n GLY 244 Ca -0.01 -0.88 0.03 0.00 0.00 0.00 0.00 46.02 45.16 3g51 n GLY 244 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3g51 s HIS 245 N -3.28 -0.47 0.25 1.61 2.46 -1.26 -4.17 115.29 110.43 3g51 s HIS 245 Ca 0.04 0.73 0.05 0.00 0.47 0.00 0.00 55.06 56.36 3g51 s HIS 245 Cb -0.00 0.25 -0.02 0.00 -0.13 0.00 0.00 32.58 32.68 3g51 s HIS 245 CO 0.00 -0.24 0.19 0.25 -2.47 0.00 0.00 174.74 172.47 3g51 n THR 246 N 4.98 0.00 0.27 0.89 -2.24 -1.26 -5.01 114.28 111.91 3g51 n THR 246 Ca -0.08 -1.79 0.14 0.00 -2.27 0.00 0.00 64.05 60.05 3g51 n THR 246 Cb 0.54 0.86 0.66 0.00 -2.10 0.00 0.00 70.33 70.29 3g51 n THR 246 CO 0.00 0.00 0.00 0.06 -0.57 0.00 0.00 175.07 174.56 3g51 h GLN 247 N 0.00 0.00 -0.05 -0.78 3.07 -2.00 -2.28 115.11 113.07 3g51 h GLN 247 Ca -0.18 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.54 3g51 h GLN 247 Cb 0.88 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.44 3g51 h GLN 247 CO 0.27 0.00 -0.05 1.03 0.09 0.00 0.00 178.83 180.17 3g51 h SER 248 N 0.00 0.06 -0.00 0.06 0.87 -1.93 -1.52 113.55 111.08 3g51 h SER 248 Ca 0.00 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.54 3g51 h SER 248 Cb 0.17 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.11 3g51 h SER 248 CO 0.00 0.13 -0.02 0.00 -0.53 0.00 0.00 176.83 176.40 3g51 h ALA 249 N 1.88 1.84 -0.12 6.23 0.00 -1.79 -2.28 119.26 125.02 3g51 h ALA 249 Ca 0.02 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 3g51 h ALA 249 Cb 0.13 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3g51 h ALA 249 CO 0.01 0.13 -0.37 -0.44 0.00 0.00 0.00 179.25 178.57 3g51 h ASP 250 N 0.09 0.26 1.01 0.00 3.32 -1.46 -2.54 116.42 117.10 3g51 h ASP 250 Ca 0.02 -0.10 -0.09 0.00 0.02 0.00 0.00 57.03 56.88 3g51 h ASP 250 Cb 0.11 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 3g51 h ASP 250 CO 0.00 0.62 -0.43 -0.50 -1.72 0.00 0.00 179.24 177.21 3g51 h TRP 251 N 0.22 0.00 -0.06 4.55 -0.00 -1.47 -0.62 115.95 118.57 3g51 h TRP 251 Ca 0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 58.90 3g51 h TRP 251 Cb 0.76 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 29.92 3g51 h TRP 251 CO 0.01 0.43 0.00 2.35 -0.00 0.00 0.00 178.44 181.23 3g51 h TRP 252 N 0.00 0.12 -0.93 0.49 2.91 -1.34 -1.56 115.95 115.64 3g51 h TRP 252 Ca -0.00 -0.02 0.07 0.00 1.13 0.00 0.00 58.89 60.06 3g51 h TRP 252 Cb 1.05 -0.03 -0.06 0.00 -0.51 0.00 0.00 29.16 29.60 3g51 h TRP 252 CO 0.00 0.37 0.59 0.77 -1.03 0.00 0.00 178.44 179.14 3g51 h SER 253 N -0.18 0.93 -0.35 2.65 0.02 -1.20 -0.72 113.55 114.70 3g51 h SER 253 Ca 0.02 0.01 0.06 0.00 -0.84 0.00 0.00 61.79 61.04 3g51 h SER 253 Cb 0.33 -0.18 -0.05 0.00 0.14 0.00 0.00 62.40 62.63 3g51 h SER 253 CO 0.00 0.59 0.03 0.15 -1.14 0.00 0.00 176.83 176.46 3g51 h PHE 254 N 1.07 0.03 -0.99 3.45 3.57 -1.03 -0.31 116.94 122.73 3g51 h PHE 254 Ca 0.40 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.96 3g51 h PHE 254 Cb 0.18 0.04 -0.05 0.00 2.79 0.00 0.00 35.95 38.90 3g51 h PHE 254 CO -0.02 -0.03 0.65 0.78 -2.23 0.00 0.00 178.31 177.46 3g51 h GLY 255 N 0.13 1.43 0.96 2.40 0.00 -0.17 -0.65 103.07 107.17 3g51 h GLY 255 Ca 0.17 -0.50 -0.02 0.00 0.00 0.00 0.00 47.33 46.97 3g51 h GLY 255 CO -0.26 0.45 0.18 -2.08 0.00 0.00 0.00 176.54 174.83 3g51 h VAL 256 N 1.29 1.20 -0.56 4.60 2.07 -0.35 0.74 116.25 125.24 3g51 h VAL 256 Ca 0.38 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 3g51 h VAL 256 Cb -0.06 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 3g51 h VAL 256 CO -0.11 0.23 0.31 -0.07 0.02 0.00 0.00 177.57 177.96 3g51 h LEU 257 N 0.57 0.69 -0.16 2.57 3.38 -0.72 -0.45 115.31 121.19 3g51 h LEU 257 Ca 0.15 -0.08 0.03 0.00 0.09 0.00 0.00 57.88 58.07 3g51 h LEU 257 Cb 0.19 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 3g51 h LEU 257 CO -0.01 0.57 -0.03 -0.03 0.09 0.00 0.00 178.44 179.03 3g51 h MET 258 N 0.75 0.02 -0.54 1.13 4.05 -0.82 0.01 114.93 119.52 3g51 h MET 258 Ca 0.20 -0.00 0.07 0.00 -0.28 0.00 0.00 59.70 59.69 3g51 h MET 258 Cb 0.03 -0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 30.76 3g51 h MET 258 CO -0.03 0.01 0.21 0.35 0.23 0.00 0.00 176.91 177.67 3g51 h PHE 259 N 0.02 0.37 -0.44 1.39 3.57 -0.58 -0.97 116.94 120.29 3g51 h PHE 259 Ca 0.08 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.46 3g51 h PHE 259 Cb 0.11 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.75 3g51 h PHE 259 CO -0.18 0.12 -0.27 1.49 -2.23 0.00 0.00 178.31 177.25 3g51 h GLU 260 N 0.40 0.94 -0.14 1.11 4.81 -0.65 -1.24 114.58 119.81 3g51 h GLU 260 Ca 0.26 -0.42 -0.13 0.00 -0.13 0.00 0.00 59.36 58.94 3g51 h GLU 260 Cb 0.28 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 3g51 h GLU 260 CO -0.25 1.08 -0.48 0.52 -0.73 0.00 0.00 179.01 179.16 3g51 h MET 261 N 0.80 0.34 0.00 1.92 2.86 -0.73 0.39 114.93 120.50 3g51 h MET 261 Ca 0.09 -0.19 -0.03 0.00 -2.06 0.00 0.00 59.70 57.51 3g51 h MET 261 Cb 0.84 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.50 3g51 h MET 261 CO 0.07 0.75 -0.54 -0.07 1.06 0.00 0.00 176.91 178.18 3g51 h LEU 262 N 0.28 0.00 0.00 1.22 3.38 -1.03 -3.38 115.31 115.78 3g51 h LEU 262 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3g51 h LEU 262 Cb 0.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.70 3g51 h LEU 262 CO 0.08 0.12 -0.82 0.35 0.09 0.00 0.00 178.44 178.26 3g51 n THR 263 N -2.95 0.00 -0.99 0.22 -2.24 -0.48 -5.01 114.28 102.82 3g51 n THR 263 Ca 0.01 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 3g51 n THR 263 Cb 0.59 0.58 0.00 0.00 -2.10 0.00 0.00 70.33 69.41 3g51 n THR 263 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3g51 n GLY 264 N 2.23 0.60 3.10 3.38 0.00 0.12 -5.02 105.19 109.60 3g51 n GLY 264 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 3g51 n GLY 264 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3g51 s THR 265 N -2.37 0.58 0.34 2.61 -4.23 -1.25 -5.04 115.64 106.29 3g51 s THR 265 Ca 0.00 -1.45 -0.24 0.00 -1.18 0.00 0.00 61.69 58.82 3g51 s THR 265 Cb 0.00 -1.07 -0.10 0.00 1.34 0.00 0.00 72.50 72.67 3g51 s THR 265 CO 0.00 -0.61 0.93 -0.76 -0.54 0.00 0.00 174.62 173.64 3g51 s LEU 266 N -2.22 4.25 0.21 4.79 1.43 -1.26 -3.76 118.68 122.11 3g51 s LEU 266 Ca -0.01 1.77 0.00 0.00 -1.03 0.00 0.00 54.13 54.87 3g51 s LEU 266 Cb -0.03 -4.11 0.18 0.00 0.03 0.00 0.00 46.19 42.26 3g51 s LEU 266 CO -0.02 -0.13 1.53 1.55 0.23 0.00 0.00 176.35 179.51 3g51 h PRO 267 N 2.89 0.42 -3.83 1.29 0.13 -1.92 -3.42 132.00 127.55 3g51 h PRO 267 Ca -0.47 -0.27 -0.51 0.00 -0.87 0.00 0.00 66.00 63.87 3g51 h PRO 267 Cb 1.19 0.03 -0.39 0.00 0.13 0.00 0.00 31.00 31.97 3g51 h PRO 267 CO 0.64 0.87 -0.78 -0.06 -0.23 0.00 0.00 178.00 178.45 3g51 s PHE 268 N -3.91 1.21 -0.28 1.56 0.08 -1.26 -4.98 117.98 110.39 3g51 s PHE 268 Ca -0.06 -0.78 -0.09 0.00 0.12 0.00 0.00 56.93 56.12 3g51 s PHE 268 Cb 0.12 -1.09 0.12 0.00 -0.57 0.00 0.00 43.02 41.60 3g51 s PHE 268 CO 0.82 -0.54 0.60 -1.14 -0.10 0.00 0.00 175.22 174.86 3g51 s GLN 269 N 1.80 0.53 0.00 0.44 0.74 -1.26 -4.83 119.66 117.07 3g51 s GLN 269 Ca 0.01 1.37 0.00 0.00 0.05 0.00 0.00 55.36 56.79 3g51 s GLN 269 Cb -0.15 0.77 0.00 0.00 1.10 0.00 0.00 33.01 34.72 3g51 s GLN 269 CO -0.07 -0.22 0.00 0.41 -0.55 0.00 0.00 175.29 174.86 3g51 n GLY 270 N 5.44 2.20 0.18 2.59 0.00 -1.26 -4.94 105.19 109.40 3g51 n GLY 270 Ca -0.11 -2.08 0.13 0.00 0.00 0.00 0.00 46.02 43.95 3g51 n GLY 270 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3g51 h LYS 271 N 0.00 0.00 -3.67 1.61 2.10 -2.01 -3.45 116.57 111.15 3g51 h LYS 271 Ca 0.00 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.53 3g51 h LYS 271 Cb 0.00 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 31.26 3g51 h LYS 271 CO 0.00 0.00 -0.06 0.16 -2.00 0.00 0.00 179.45 177.55 3g51 s ASP 272 N -5.61 0.24 0.24 7.07 -4.77 -1.26 -5.05 116.67 107.53 3g51 s ASP 272 Ca 0.08 -1.13 -0.07 0.00 -3.30 0.00 0.00 52.55 48.13 3g51 s ASP 272 Cb 0.08 0.66 0.25 0.00 -1.09 0.00 0.00 42.92 42.81 3g51 s ASP 272 CO 0.63 -1.29 1.90 0.08 0.70 0.00 0.00 175.17 177.19 3g51 h ARG 273 N 2.16 1.14 -0.52 2.11 0.11 -1.99 -1.04 114.38 116.35 3g51 h ARG 273 Ca -0.27 -0.07 0.08 0.00 0.10 0.00 0.00 59.98 59.81 3g51 h ARG 273 Cb 1.25 -0.26 -0.06 0.00 1.11 0.00 0.00 29.97 32.01 3g51 h ARG 273 CO 0.37 0.75 0.17 -0.22 0.10 0.00 0.00 179.97 181.15 3g51 h LYS 274 N 1.18 0.34 -0.08 0.08 3.64 -1.99 -1.05 116.57 118.67 3g51 h LYS 274 Ca 0.34 -0.02 -0.22 0.00 -1.27 0.00 0.00 60.65 59.48 3g51 h LYS 274 Cb -0.07 -0.08 0.01 0.00 -0.41 0.00 0.00 32.23 31.68 3g51 h LYS 274 CO -0.09 0.22 -0.84 1.49 -2.27 0.00 0.00 179.45 177.95 3g51 h GLU 275 N 0.35 0.63 -0.72 1.90 4.81 -1.86 -2.84 114.58 116.84 3g51 h GLU 275 Ca 0.26 -0.56 0.04 0.00 -0.13 0.00 0.00 59.36 58.97 3g51 h GLU 275 Cb 0.29 0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.76 3g51 h GLU 275 CO -0.27 1.18 0.44 1.15 -0.73 0.00 0.00 179.01 180.77 3g51 h THR 276 N 0.40 1.05 -0.47 0.32 2.02 -0.86 -0.50 112.91 114.87 3g51 h THR 276 Ca -0.07 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 66.82 3g51 h THR 276 Cb 1.47 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 3g51 h THR 276 CO 0.16 0.15 0.27 0.24 0.37 0.00 0.00 175.52 176.71 3g51 h MET 277 N 0.83 0.64 -0.86 6.66 2.86 -1.16 -0.33 114.93 123.57 3g51 h MET 277 Ca 0.30 -0.07 -0.03 0.00 -2.06 0.00 0.00 59.70 57.85 3g51 h MET 277 Cb 0.09 -0.13 -0.04 0.00 0.06 0.00 0.00 31.60 31.58 3g51 h MET 277 CO -0.14 0.49 0.44 1.15 1.06 0.00 0.00 176.91 179.90 3g51 h THR 278 N 0.62 1.26 -0.38 2.22 2.02 -1.19 -2.28 112.91 115.18 3g51 h THR 278 Ca 0.17 -0.70 -0.01 0.00 0.77 0.00 0.00 66.41 66.64 3g51 h THR 278 Cb 0.02 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.54 3g51 h THR 278 CO -0.03 0.31 0.20 0.24 0.37 0.00 0.00 175.52 176.60 3g51 h MET 279 N 1.22 0.54 -0.87 6.66 2.86 -0.55 -1.02 114.93 123.77 3g51 h MET 279 Ca 0.30 -0.07 0.11 0.00 -2.06 0.00 0.00 59.70 57.97 3g51 h MET 279 Cb 0.09 -0.10 -0.06 0.00 0.06 0.00 0.00 31.60 31.58 3g51 h MET 279 CO -0.04 0.46 0.56 0.82 1.06 0.00 0.00 176.91 179.77 3g51 h ILE 280 N 0.48 0.94 0.09 -1.22 2.04 -0.74 0.11 117.51 119.20 3g51 h ILE 280 Ca 0.13 -0.28 -0.27 0.00 1.00 0.00 0.00 64.86 65.45 3g51 h ILE 280 Cb 0.09 0.05 0.01 0.00 -0.74 0.00 0.00 36.82 36.23 3g51 h ILE 280 CO -0.02 0.15 -1.15 -0.07 0.00 0.00 0.00 178.15 177.06 3g51 h LEU 281 N 0.81 0.60 0.00 1.44 3.38 -0.85 -3.43 115.31 117.27 3g51 h LEU 281 Ca 0.41 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.82 3g51 h LEU 281 Cb 0.47 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3g51 h LEU 281 CO -0.17 1.39 -0.10 0.29 0.09 0.00 0.00 178.44 179.94 3g51 n LYS 282 N -3.69 2.85 -2.10 1.13 5.02 -0.44 -5.10 118.16 115.83 3g51 n LYS 282 Ca -0.10 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.85 3g51 n LYS 282 Cb 0.95 -0.33 0.01 0.00 -0.02 0.00 0.00 35.03 35.65 3g51 n LYS 282 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3g51 s ALA 283 N -0.35 2.64 0.75 7.82 0.00 0.00 -5.03 121.76 127.59 3g51 s ALA 283 Ca 0.00 0.68 -0.11 0.00 0.00 0.00 0.00 51.96 52.53 3g51 s ALA 283 Cb 0.00 -3.33 0.04 0.00 0.00 0.00 0.00 23.12 19.83 3g51 s ALA 283 CO 0.00 -0.90 1.08 0.15 0.00 0.00 0.00 175.76 176.09 3g51 s LYS 284 N -3.62 2.51 -0.10 0.00 -0.14 -1.26 -4.97 119.74 112.17 3g51 s LYS 284 Ca 0.70 0.85 -0.04 0.00 -1.36 0.00 0.00 55.97 56.12 3g51 s LYS 284 Cb -0.21 -1.95 0.05 0.00 -1.68 0.00 0.00 37.83 34.04 3g51 s LYS 284 CO 0.32 -1.38 0.17 -1.17 -0.76 0.00 0.00 175.35 172.53 3g51 s LEU 285 N -5.69 -0.08 0.29 3.17 2.96 -1.26 -5.06 118.68 113.02 3g51 s LEU 285 Ca 0.59 0.27 -0.29 0.00 -0.22 0.00 0.00 54.13 54.48 3g51 s LEU 285 Cb -0.15 0.28 -0.10 0.00 0.50 0.00 0.00 46.19 46.73 3g51 s LEU 285 CO 0.55 -0.25 1.22 -0.83 -1.32 0.00 0.00 176.35 175.72 3g51 s GLY 286 N 2.30 2.96 -0.11 7.98 0.00 -1.26 -5.00 107.32 114.18 3g51 s GLY 286 Ca 0.03 1.09 -0.29 0.00 0.00 0.00 0.00 44.72 45.55 3g51 s GLY 286 CO -0.06 1.77 1.00 -0.29 0.00 0.00 0.00 173.10 175.51 3g51 s MET 287 N -1.42 4.41 0.06 2.90 1.75 -1.26 -4.99 119.30 120.76 3g51 s MET 287 Ca 0.48 1.37 -0.33 0.00 -1.25 0.00 0.00 55.69 55.96 3g51 s MET 287 Cb -0.36 -3.55 -0.12 0.00 2.84 0.00 0.00 34.83 33.64 3g51 s MET 287 CO 0.46 -0.33 1.80 -2.30 -0.65 0.00 0.00 175.02 174.00 3g51 n PRO 288 N 5.07 2.45 0.01 4.11 -0.02 -1.26 -4.89 135.00 140.47 3g51 n PRO 288 Ca 0.09 0.89 0.13 0.00 -2.02 0.00 0.00 63.50 62.59 3g51 n PRO 288 Cb 0.49 -2.75 0.38 0.00 -0.02 0.00 0.00 33.50 31.60 3g51 n PRO 288 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3g51 n GLN 289 N 5.56 0.04 -0.45 -0.52 1.13 -1.26 -3.76 117.38 118.12 3g51 n GLN 289 Ca 0.19 0.02 0.08 0.00 -1.94 0.00 0.00 57.00 55.35 3g51 n GLN 289 Cb 0.33 -1.53 0.27 0.00 0.11 0.00 0.00 30.24 29.42 3g51 n GLN 289 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 3g51 n PHE 290 N -1.59 1.04 -3.36 1.08 3.72 -1.26 -4.94 117.46 112.16 3g51 n PHE 290 Ca 0.06 -0.68 -0.26 0.00 -0.05 0.00 0.00 57.45 56.52 3g51 n PHE 290 Cb 0.35 -0.22 -0.02 0.00 -0.94 0.00 0.00 39.48 38.65 3g51 n PHE 290 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3g51 s LEU 291 N -2.00 4.03 0.74 4.37 1.43 -1.25 -5.08 118.68 120.93 3g51 s LEU 291 Ca 0.40 0.55 -0.14 0.00 -1.03 0.00 0.00 54.13 53.92 3g51 s LEU 291 Cb 0.28 -3.40 0.04 0.00 0.03 0.00 0.00 46.19 43.15 3g51 s LEU 291 CO 0.16 -0.25 1.17 -0.94 0.23 0.00 0.00 176.35 176.72 3g51 s SER 292 N -3.67 4.26 0.30 2.29 1.04 -1.26 -4.78 113.70 111.88 3g51 s SER 292 Ca 0.41 2.22 0.03 0.00 0.48 0.00 0.00 55.95 59.10 3g51 s SER 292 Cb -0.10 -2.57 0.63 0.00 0.10 0.00 0.00 66.02 64.08 3g51 s SER 292 CO 0.34 -2.21 1.83 -0.65 0.98 0.00 0.00 173.24 173.53 3g51 h PRO 293 N -0.48 0.88 -0.54 4.02 0.11 -1.98 -0.90 132.00 133.12 3g51 h PRO 293 Ca -0.47 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 3g51 h PRO 293 Cb 1.28 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 3g51 h PRO 293 CO 0.50 0.58 0.19 0.93 -0.21 0.00 0.00 178.00 179.99 3g51 h GLU 294 N 0.91 0.82 -0.47 1.05 3.07 -1.94 -0.72 114.58 117.29 3g51 h GLU 294 Ca 0.50 -0.16 -0.04 0.00 -0.50 0.00 0.00 59.36 59.16 3g51 h GLU 294 Cb 0.59 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 28.35 3g51 h GLU 294 CO -0.27 0.73 0.13 0.00 -1.40 0.00 0.00 179.01 178.20 3g51 h ALA 295 N 1.05 0.62 -0.74 3.43 0.00 -1.76 -1.85 119.26 120.00 3g51 h ALA 295 Ca 0.18 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.92 3g51 h ALA 295 Cb 0.24 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 3g51 h ALA 295 CO -0.01 0.29 0.48 1.96 0.00 0.00 0.00 179.25 181.97 3g51 h GLN 296 N 0.63 0.91 -0.35 0.00 4.20 -0.96 -1.46 115.11 118.08 3g51 h GLN 296 Ca 0.15 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 3g51 h GLN 296 Cb 0.30 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 3g51 h GLN 296 CO -0.00 0.60 0.18 1.03 -0.67 0.00 0.00 178.83 179.97 3g51 h SER 297 N 0.94 0.46 -0.49 1.46 0.87 -0.89 -1.00 113.55 114.89 3g51 h SER 297 Ca 0.29 -0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 3g51 h SER 297 Cb -0.02 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 61.80 3g51 h SER 297 CO -0.10 0.44 0.32 0.25 -0.53 0.00 0.00 176.83 177.21 3g51 h LEU 298 N 0.44 0.57 -0.39 2.23 5.85 -0.99 -1.30 115.31 121.72 3g51 h LEU 298 Ca 0.12 -0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.86 3g51 h LEU 298 Cb 0.09 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 40.93 3g51 h LEU 298 CO -0.02 0.43 0.12 -0.07 -0.34 0.00 0.00 178.44 178.57 3g51 h LEU 299 N 0.66 0.12 -1.09 2.25 3.38 -1.04 -0.79 115.31 118.79 3g51 h LEU 299 Ca 0.18 0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.24 3g51 h LEU 299 Cb -0.05 0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 3g51 h LEU 299 CO -0.04 0.10 0.61 -0.09 0.09 0.00 0.00 178.44 179.12 3g51 h ARG 300 N 0.28 1.13 0.00 1.13 2.43 -0.72 -0.81 114.38 117.82 3g51 h ARG 300 Ca 0.18 -0.07 -0.10 0.00 -0.81 0.00 0.00 59.98 59.19 3g51 h ARG 300 Cb 0.18 -0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 3g51 h ARG 300 CO -0.20 0.75 -0.46 0.52 -1.51 0.00 0.00 179.97 179.07 3g51 h MET 301 N 1.17 0.00 0.05 0.20 2.86 -0.54 -3.22 114.93 115.44 3g51 h MET 301 Ca 0.38 0.00 -0.27 0.00 -2.06 0.00 0.00 59.70 57.75 3g51 h MET 301 Cb 0.03 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.66 3g51 h MET 301 CO -0.12 0.46 -1.40 -0.07 1.06 0.00 0.00 176.91 176.84 3g51 h LEU 302 N 0.00 0.15 -4.14 1.22 3.38 -0.85 -1.57 115.31 113.50 3g51 h LEU 302 Ca -0.00 -0.22 -0.39 0.00 0.09 0.00 0.00 57.88 57.36 3g51 h LEU 302 Cb 1.23 -0.05 -0.14 0.00 0.09 0.00 0.00 40.66 41.78 3g51 h LEU 302 CO 0.06 1.18 0.26 0.49 0.09 0.00 0.00 178.44 180.52 3g51 n PHE 303 N -3.31 1.27 -3.39 1.13 3.72 -0.34 -4.56 117.46 111.99 3g51 n PHE 303 Ca -0.11 -1.84 -0.38 0.00 -0.05 0.00 0.00 57.45 55.07 3g51 n PHE 303 Cb 1.01 -1.28 -0.07 0.00 -0.94 0.00 0.00 39.48 38.20 3g51 n PHE 303 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3g51 s LYS 304 N -1.25 4.26 0.39 -1.08 -0.14 -1.26 -4.97 119.74 115.69 3g51 s LYS 304 Ca 0.52 0.28 0.21 0.00 -1.36 0.00 0.00 55.97 55.62 3g51 s LYS 304 Cb 0.33 -3.47 0.60 0.00 -1.68 0.00 0.00 37.83 33.60 3g51 s LYS 304 CO -0.13 0.10 1.69 0.00 -0.76 0.00 0.00 175.35 176.25 3g51 h ARG 305 N 6.94 0.00 -6.18 1.68 3.08 -1.97 -3.40 114.38 114.54 3g51 h ARG 305 Ca -0.39 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.06 3g51 h ARG 305 Cb 1.17 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 31.12 3g51 h ARG 305 CO 0.74 0.28 0.62 1.21 -1.07 0.00 0.00 179.97 181.75 3g51 s ASN 306 N -6.27 6.56 0.48 7.04 3.84 -1.26 -4.66 114.94 120.67 3g51 s ASN 306 Ca 0.02 0.29 0.13 0.00 0.21 0.00 0.00 52.86 53.51 3g51 s ASN 306 Cb 0.09 -2.46 1.11 0.00 -0.55 0.00 0.00 41.25 39.43 3g51 s ASN 306 CO 0.67 -1.01 2.11 -0.65 -2.79 0.00 0.00 177.10 175.43 3g51 h PRO 307 N 8.91 0.22 0.00 0.43 0.11 -1.98 -0.86 132.00 138.84 3g51 h PRO 307 Ca -0.24 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.85 3g51 h PRO 307 Cb 1.08 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 3g51 h PRO 307 CO 1.02 0.15 -0.07 0.00 -0.21 0.00 0.00 178.00 178.89 3g51 h ALA 308 N 1.89 1.04 -0.33 -0.75 0.00 -1.94 -2.77 119.26 116.39 3g51 h ALA 308 Ca 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3g51 h ALA 308 Cb 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3g51 h ALA 308 CO -0.01 0.09 0.00 -1.71 0.00 0.00 0.00 179.25 177.61 3g51 n ASN 309 N -3.23 3.24 -4.81 0.00 5.15 -0.34 -4.65 115.26 110.62 3g51 n ASN 309 Ca -0.00 -1.94 -0.36 0.00 -0.60 0.00 0.00 54.58 51.68 3g51 n ASN 309 Cb 0.31 -0.21 -0.06 0.00 -0.53 0.00 0.00 39.78 39.28 3g51 n ASN 309 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 3g51 s ARG 310 N -1.38 4.31 0.26 1.20 3.52 -1.05 -4.91 118.95 120.90 3g51 s ARG 310 Ca 0.34 0.95 -0.31 0.00 -0.13 0.00 0.00 55.73 56.58 3g51 s ARG 310 Cb 0.20 -2.89 -0.13 0.00 -1.56 0.00 0.00 34.95 30.57 3g51 s ARG 310 CO 0.28 0.39 1.49 -0.11 -0.81 0.00 0.00 175.30 176.54 3g51 n LEU 311 N 0.76 3.56 0.00 -0.88 7.94 -0.59 -1.48 117.00 126.32 3g51 n LEU 311 Ca -0.02 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.02 3g51 n LEU 311 Cb 0.51 -1.49 0.00 0.00 0.53 0.00 0.00 43.42 42.97 3g51 n LEU 311 CO 0.43 -0.25 0.00 0.61 -1.11 0.00 0.00 177.39 177.08 3g51 n GLY 312 N 2.24 1.74 0.77 -3.96 0.00 -1.26 -4.91 105.19 99.82 3g51 n GLY 312 Ca 0.11 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.25 3g51 n GLY 312 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g51 n ALA 313 N -1.94 2.84 -1.34 4.61 0.00 -0.55 -4.21 120.51 119.93 3g51 n ALA 313 Ca 0.00 -0.66 -0.08 0.00 0.00 0.00 0.00 53.44 52.70 3g51 n ALA 313 Cb 0.00 -0.83 0.08 0.00 0.00 0.00 0.00 19.45 18.70 3g51 n ALA 313 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g51 n GLY 314 N 1.37 -1.28 0.31 0.00 0.00 -1.26 -4.88 105.19 99.44 3g51 n GLY 314 Ca 0.13 -1.68 0.03 0.00 0.00 0.00 0.00 46.02 44.49 3g51 n GLY 314 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3g51 h PRO 315 N 0.00 0.79 -0.05 1.61 0.11 -1.98 -1.92 132.00 130.55 3g51 h PRO 315 Ca -0.16 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.90 3g51 h PRO 315 Cb 0.44 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.37 3g51 h PRO 315 CO 0.11 0.52 0.00 -0.25 -0.21 0.00 0.00 178.00 178.17 3g51 n ASP 316 N -4.73 0.75 0.00 -2.05 9.92 -1.26 -4.98 116.55 114.20 3g51 n ASP 316 Ca 0.14 -1.44 0.00 0.00 -0.53 0.00 0.00 54.79 52.95 3g51 n ASP 316 Cb 0.27 -0.03 0.00 0.00 -0.64 0.00 0.00 41.12 40.72 3g51 n ASP 316 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3g51 n GLY 317 N 0.99 3.12 0.32 0.44 0.00 -0.72 -1.38 105.19 107.95 3g51 n GLY 317 Ca 0.17 -0.05 0.19 0.00 0.00 0.00 0.00 46.02 46.33 3g51 n GLY 317 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3g51 h VAL 318 N 0.00 0.27 0.00 1.61 3.04 -1.91 -0.71 116.25 118.55 3g51 h VAL 318 Ca 0.00 -0.03 -0.01 0.00 -1.01 0.00 0.00 66.70 65.65 3g51 h VAL 318 Cb 0.00 1.02 -0.00 0.00 -2.01 0.00 0.00 31.29 30.30 3g51 h VAL 318 CO 0.00 0.00 -0.07 -0.33 -1.01 0.00 0.00 177.57 176.17 3g51 h GLU 319 N 0.00 0.00 -0.65 4.17 4.39 -1.61 0.09 114.58 120.97 3g51 h GLU 319 Ca -0.00 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 3g51 h GLU 319 Cb 0.02 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.64 3g51 h GLU 319 CO 0.00 0.07 0.38 0.93 -1.16 0.00 0.00 179.01 179.23 3g51 h GLU 320 N 0.00 0.88 0.10 2.33 5.08 -1.24 -1.29 114.58 120.44 3g51 h GLU 320 Ca -0.00 -0.08 -0.13 0.00 -1.00 0.00 0.00 59.36 58.15 3g51 h GLU 320 Cb 0.19 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 29.27 3g51 h GLU 320 CO 0.01 0.62 -0.59 0.82 -1.00 0.00 0.00 179.01 178.87 3g51 h ILE 321 N 0.89 1.59 -0.19 3.13 2.04 -1.19 -3.23 117.51 120.54 3g51 h ILE 321 Ca 0.23 -2.48 -0.02 0.00 1.00 0.00 0.00 64.86 63.59 3g51 h ILE 321 Cb -0.03 3.25 -0.01 0.00 -0.74 0.00 0.00 36.82 39.29 3g51 h ILE 321 CO -0.04 0.68 0.01 0.11 0.00 0.00 0.00 178.15 178.91 3g51 h LYS 322 N -0.56 0.28 -0.01 2.37 1.57 -1.05 -2.14 116.57 117.02 3g51 h LYS 322 Ca -0.10 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 3g51 h LYS 322 Cb 1.45 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.71 3g51 h LYS 322 CO 0.10 0.29 -0.10 0.54 -0.57 0.00 0.00 179.45 179.71 3g51 n ARG 323 N -4.39 1.22 -2.04 3.15 1.74 -0.50 -4.75 116.66 111.10 3g51 n ARG 323 Ca -0.00 -0.66 -0.38 0.00 -0.77 0.00 0.00 57.85 56.03 3g51 n ARG 323 Cb 0.17 -1.49 0.01 0.00 -1.02 0.00 0.00 32.46 30.13 3g51 n ARG 323 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 3g51 s HIS 324 N -2.23 2.65 0.52 -1.55 2.46 -0.81 -4.89 115.29 111.45 3g51 s HIS 324 Ca 0.33 1.45 0.23 0.00 0.47 0.00 0.00 55.06 57.53 3g51 s HIS 324 Cb 0.20 -3.60 1.36 0.00 -0.13 0.00 0.00 32.58 30.41 3g51 s HIS 324 CO 0.42 -2.14 2.03 0.66 -2.47 0.00 0.00 174.74 173.24 3g51 h SER 325 N 1.98 0.01 -0.62 9.88 4.64 -1.91 0.24 113.55 127.78 3g51 h SER 325 Ca -0.50 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 60.88 3g51 h SER 325 Cb 1.27 -0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.32 3g51 h SER 325 CO 0.60 0.01 0.41 0.15 -0.87 0.00 0.00 176.83 177.12 3g51 h PHE 326 N 0.01 0.62 -0.66 4.77 3.57 -1.90 -2.33 116.94 121.02 3g51 h PHE 326 Ca 0.20 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.71 3g51 h PHE 326 Cb 0.77 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 39.31 3g51 h PHE 326 CO -0.00 0.33 0.00 1.19 -2.23 0.00 0.00 178.31 177.60 3g51 n PHE 327 N -4.47 1.53 0.29 0.41 3.72 0.07 -4.53 117.46 114.47 3g51 n PHE 327 Ca 0.09 -0.61 0.16 0.00 -0.05 0.00 0.00 57.45 57.03 3g51 n PHE 327 Cb 0.23 -0.25 0.92 0.00 -0.94 0.00 0.00 39.48 39.44 3g51 n PHE 327 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3g51 h SER 328 N 4.17 0.00 0.93 4.37 4.64 -1.38 -1.14 113.55 125.14 3g51 h SER 328 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3g51 h SER 328 Cb 1.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.57 3g51 h SER 328 CO 0.24 0.00 -0.02 0.35 -0.87 0.00 0.00 176.83 176.53 3g51 n THR 329 N -3.81 0.00 -3.46 2.95 -2.24 -1.26 -4.84 114.28 101.61 3g51 n THR 329 Ca -0.03 -0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.38 3g51 n THR 329 Cb 0.10 -0.46 -0.07 0.00 -2.10 0.00 0.00 70.33 67.79 3g51 n THR 329 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3g51 s ILE 330 N -2.96 5.25 -0.54 2.28 -1.09 -0.43 -5.04 121.20 118.68 3g51 s ILE 330 Ca 0.15 0.62 -0.20 0.00 -2.23 0.00 0.00 60.65 58.99 3g51 s ILE 330 Cb 0.19 -3.68 0.06 0.00 -1.58 0.00 0.00 42.46 37.45 3g51 s ILE 330 CO 0.53 0.32 0.72 -0.62 -1.23 0.00 0.00 174.94 174.66 3g51 s ASP 331 N 0.80 6.24 0.37 3.58 -1.08 -1.26 -4.94 116.67 120.38 3g51 s ASP 331 Ca 0.18 -0.87 0.06 0.00 -0.52 0.00 0.00 52.55 51.40 3g51 s ASP 331 Cb -0.14 -2.33 0.74 0.00 -1.46 0.00 0.00 42.92 39.73 3g51 s ASP 331 CO 0.06 -1.03 1.95 -0.50 0.52 0.00 0.00 175.17 176.17 3g51 h TRP 332 N 9.13 0.46 -0.15 -5.34 4.06 -1.96 -0.26 115.95 121.89 3g51 h TRP 332 Ca -0.28 -0.03 -0.07 0.00 2.06 0.00 0.00 58.89 60.58 3g51 h TRP 332 Cb 1.09 -0.14 -0.00 0.00 -1.00 0.00 0.00 29.16 29.10 3g51 h TRP 332 CO 0.81 0.42 -0.18 -0.91 -3.56 0.00 0.00 178.44 175.02 3g51 h ASN 333 N 0.45 0.43 -0.82 -3.49 2.35 -2.00 -0.97 115.58 111.53 3g51 h ASN 333 Ca 0.11 -0.50 -0.03 0.00 -0.55 0.00 0.00 56.30 55.33 3g51 h ASN 333 Cb 0.21 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 38.42 3g51 h ASN 333 CO -0.00 0.84 0.39 0.11 -1.65 0.00 0.00 177.43 177.12 3g51 h LYS 334 N 0.03 1.18 -0.25 0.81 1.57 -1.92 -2.38 116.57 115.61 3g51 h LYS 334 Ca 0.02 -0.17 0.03 0.00 -1.87 0.00 0.00 60.65 58.65 3g51 h LYS 334 Cb 0.73 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.80 3g51 h LYS 334 CO 0.04 0.91 0.08 1.25 -0.57 0.00 0.00 179.45 181.16 3g51 h LEU 335 N 1.16 0.08 -0.91 2.94 5.85 -0.92 -1.20 115.31 122.31 3g51 h LEU 335 Ca 0.28 0.03 0.07 0.00 0.84 0.00 0.00 57.88 59.10 3g51 h LEU 335 Cb 0.12 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.10 3g51 h LEU 335 CO -0.04 0.08 0.57 0.22 -0.34 0.00 0.00 178.44 178.94 3g51 h TYR 336 N 0.19 1.06 -0.03 1.25 3.20 -0.90 -1.34 116.97 120.40 3g51 h TYR 336 Ca 0.11 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.01 3g51 h TYR 336 Cb 0.08 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 38.01 3g51 h TYR 336 CO -0.13 0.53 0.00 0.54 -1.64 0.00 0.00 178.16 177.46 3g51 n ARG 337 N -4.58 1.13 -2.88 1.82 1.74 -0.92 -4.88 116.66 108.08 3g51 n ARG 337 Ca 0.14 -0.19 -0.22 0.00 -0.77 0.00 0.00 57.85 56.80 3g51 n ARG 337 Cb 0.19 -1.26 0.02 0.00 -1.02 0.00 0.00 32.46 30.40 3g51 n ARG 337 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3g51 n ARG 338 N -0.54 -4.13 0.18 5.56 1.74 -0.51 -4.89 116.66 114.08 3g51 n ARG 338 Ca 0.12 0.93 0.08 0.00 -0.77 0.00 0.00 57.85 58.21 3g51 n ARG 338 Cb 0.10 -5.75 0.11 0.00 -1.02 0.00 0.00 32.46 25.90 3g51 n ARG 338 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 3g51 h GLU 339 N -1.06 0.00 -5.55 5.56 5.08 -1.45 -3.45 114.58 113.71 3g51 h GLU 339 Ca -0.52 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.24 3g51 h GLU 339 Cb 1.37 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.51 3g51 h GLU 339 CO 0.57 0.20 -0.03 0.42 -1.00 0.00 0.00 179.01 179.17 3g51 s ILE 340 N -3.11 5.10 0.19 3.13 1.01 -1.26 -5.03 121.20 121.23 3g51 s ILE 340 Ca 0.06 0.97 -0.30 0.00 0.00 0.00 0.00 60.65 61.38 3g51 s ILE 340 Cb 0.06 -3.85 -0.09 0.00 0.01 0.00 0.00 42.46 38.59 3g51 s ILE 340 CO 0.70 0.17 1.34 -1.00 0.00 0.00 0.00 174.94 176.16 3g51 s HIS 341 N 1.64 3.22 0.64 3.97 3.76 -1.26 -4.99 115.29 122.27 3g51 s HIS 341 Ca 0.24 1.14 -0.18 0.00 -0.15 0.00 0.00 55.06 56.12 3g51 s HIS 341 Cb -0.15 -3.65 -0.01 0.00 1.11 0.00 0.00 32.58 29.88 3g51 s HIS 341 CO 0.10 -2.09 1.23 -2.14 -0.85 0.00 0.00 174.74 170.99 3g51 s PRO 342 N 0.06 2.65 0.43 8.40 0.02 -1.26 -4.91 135.00 140.38 3g51 s PRO 342 Ca 0.58 1.86 0.11 0.00 0.02 0.00 0.00 61.00 63.58 3g51 s PRO 342 Cb -0.37 -1.88 0.97 0.00 0.02 0.00 0.00 34.50 33.23 3g51 s PRO 342 CO 0.38 -1.47 2.02 -1.35 -0.33 0.00 0.00 177.00 176.25 3g51 h PRO 343 N 0.48 0.44 -5.13 5.54 0.11 -1.91 -3.43 132.00 128.10 3g51 h PRO 343 Ca -0.50 -0.03 -0.39 0.00 0.11 0.00 0.00 66.00 65.20 3g51 h PRO 343 Cb 1.31 -0.10 -0.23 0.00 0.11 0.00 0.00 31.00 32.09 3g51 h PRO 343 CO 0.53 0.29 -0.77 -0.06 -0.21 0.00 0.00 178.00 177.78 3g51 s PHE 344 N -5.42 1.07 -0.04 0.65 0.08 -1.26 -5.15 117.98 107.91 3g51 s PHE 344 Ca -0.08 -0.43 -0.00 0.00 0.12 0.00 0.00 56.93 56.54 3g51 s PHE 344 Cb 0.19 -0.62 -0.04 0.00 -0.57 0.00 0.00 43.02 41.98 3g51 s PHE 344 CO 0.74 0.02 0.02 -1.59 -0.10 0.00 0.00 175.22 174.31 3g51 s LYS 345 N -1.49 2.94 0.00 0.44 -2.85 -1.26 -4.72 119.74 112.80 3g51 s LYS 345 Ca -0.03 -0.49 0.00 0.00 -1.00 0.00 0.00 55.97 54.45 3g51 s LYS 345 Cb -0.09 -2.77 0.00 0.00 -2.06 0.00 0.00 37.83 32.91 3g51 s LYS 345 CO 0.02 0.66 0.22 -2.30 0.10 0.00 0.00 175.35 174.05