#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gdj s PHE 64 N 0.00 3.60 -0.17 1.61 0.40 -1.26 -5.09 117.98 117.07 2gdj s PHE 64 Ca 0.00 0.53 -0.07 0.00 -0.60 0.00 0.00 56.93 56.79 2gdj s PHE 64 Cb 0.00 -1.94 -0.04 0.00 0.51 0.00 0.00 43.02 41.55 2gdj s PHE 64 CO 0.00 0.73 0.06 0.15 0.70 0.00 0.00 175.22 176.86 2gdj s LYS 65 N -1.07 3.91 0.27 0.44 1.02 -1.26 -5.10 119.74 117.95 2gdj s LYS 65 Ca 0.16 -0.35 0.02 0.00 0.02 0.00 0.00 55.97 55.82 2gdj s LYS 65 Cb -0.12 -3.18 -0.05 0.00 -0.52 0.00 0.00 37.83 33.96 2gdj s LYS 65 CO 0.05 0.30 0.07 -1.54 -0.92 0.00 0.00 175.35 173.31 2gdj s SER 66 N 0.28 1.58 0.78 2.83 1.04 -1.26 -4.72 113.70 114.22 2gdj s SER 66 Ca 0.03 -1.35 0.00 0.00 0.48 0.00 0.00 55.95 55.11 2gdj s SER 66 Cb -0.12 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.07 2gdj s SER 66 CO 0.00 -0.67 0.00 0.61 0.98 0.00 0.00 173.24 174.17 2gdj n GLY 67 N -0.51 2.98 0.41 7.32 0.00 -1.26 -1.84 105.19 112.29 2gdj n GLY 67 Ca -0.01 0.06 0.23 0.00 0.00 0.00 0.00 46.02 46.30 2gdj n GLY 67 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2gdj h ILE 68 N 0.00 0.64 -0.71 -0.61 -0.00 -2.01 -1.72 117.51 113.11 2gdj h ILE 68 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 64.86 64.80 2gdj h ILE 68 Cb 0.00 0.66 -0.03 0.00 -0.00 0.00 0.00 36.82 37.45 2gdj h ILE 68 CO 0.00 0.00 0.20 0.44 -0.00 0.00 0.00 178.15 178.79 2gdj h ASP 69 N 0.00 1.05 0.09 2.19 5.19 -1.75 -1.11 116.42 122.08 2gdj h ASP 69 Ca 0.31 -0.21 0.01 0.00 -0.62 0.00 0.00 57.03 56.52 2gdj h ASP 69 Cb 1.27 -0.28 -0.02 0.00 0.18 0.00 0.00 39.33 40.49 2gdj h ASP 69 CO -0.00 0.99 -0.13 -0.07 -3.12 0.00 0.00 179.24 176.91 2gdj h LEU 70 N 1.07 -0.36 -0.84 1.55 3.38 -1.42 0.11 115.31 118.80 2gdj h LEU 70 Ca 0.23 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.28 2gdj h LEU 70 Cb 0.33 0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.16 2gdj h LEU 70 CO -0.00 -0.20 0.53 -0.07 0.09 0.00 0.00 178.44 178.79 2gdj h LEU 71 N -0.27 0.86 -1.29 1.67 3.38 -1.56 -0.79 115.31 117.31 2gdj h LEU 71 Ca 0.02 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 2gdj h LEU 71 Cb 0.28 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2gdj h LEU 71 CO -0.06 0.58 -0.35 0.11 0.09 0.00 0.00 178.44 178.80 2gdj h LYS 72 N 1.01 0.00 -0.05 1.13 1.57 -0.73 -1.54 116.57 117.95 2gdj h LYS 72 Ca 0.35 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.93 2gdj h LYS 72 Cb 0.07 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.38 2gdj h LYS 72 CO -0.14 0.35 -0.81 0.37 -0.57 0.00 0.00 179.45 178.65 2gdj h GLN 73 N 0.00 0.43 0.00 3.15 5.75 0.24 -3.01 115.11 121.67 2gdj h GLN 73 Ca -0.00 -0.40 -0.08 0.00 -0.15 0.00 0.00 58.65 58.02 2gdj h GLN 73 Cb 0.63 0.09 -0.01 0.00 1.07 0.00 0.00 27.48 29.26 2gdj h GLN 73 CO 0.05 1.04 -0.38 -0.09 -2.65 0.00 0.00 178.83 176.80 2gdj h ARG 74 N 0.28 0.00 0.00 1.69 9.65 -0.80 -3.05 114.38 122.15 2gdj h ARG 74 Ca -0.05 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 2gdj h ARG 74 Cb 1.42 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.00 2gdj h ARG 74 CO 0.14 0.38 0.00 0.43 2.80 0.00 0.00 179.97 183.72 2gdj n SER 75 N -3.60 0.45 -0.10 -3.80 7.64 -0.61 -2.69 113.62 110.91 2gdj n SER 75 Ca -0.01 0.58 0.15 0.00 1.01 0.00 0.00 58.87 60.60 2gdj n SER 75 Cb 0.49 -0.68 0.73 0.00 -1.01 0.00 0.00 64.21 63.74 2gdj n SER 75 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2gdj n THR 76 N -1.96 0.00 -2.78 0.44 -2.24 -1.15 -4.56 114.28 102.02 2gdj n THR 76 Ca 0.04 -0.05 -0.43 0.00 -2.27 0.00 0.00 64.05 61.34 2gdj n THR 76 Cb 0.29 -0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 68.26 2gdj n THR 76 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2gdj s VAL 77 N -2.30 4.58 0.27 2.28 1.01 -1.09 -4.93 120.40 120.22 2gdj s VAL 77 Ca 0.35 1.29 0.07 0.00 0.00 0.00 0.00 61.98 63.69 2gdj s VAL 77 Cb 0.21 -4.34 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 2gdj s VAL 77 CO 0.43 -0.52 0.29 -1.66 0.00 0.00 0.00 175.10 173.64 2gdj s TRP 78 N 3.49 3.16 0.06 5.22 1.48 -1.26 -4.82 118.94 126.26 2gdj s TRP 78 Ca 0.39 -0.13 0.08 0.00 -1.06 0.00 0.00 56.10 55.38 2gdj s TRP 78 Cb -0.12 -1.58 -0.03 0.00 -1.16 0.00 0.00 33.47 30.58 2gdj s TRP 78 CO 0.18 0.38 -0.22 0.15 -4.06 0.00 0.00 176.95 173.38 2gdj s LYS 79 N -3.94 1.39 -0.13 3.25 1.02 0.77 -1.11 119.74 120.99 2gdj s LYS 79 Ca 0.36 -1.03 -0.04 0.00 0.02 0.00 0.00 55.97 55.28 2gdj s LYS 79 Cb -0.08 -1.56 -0.03 0.00 -0.52 0.00 0.00 37.83 35.63 2gdj s LYS 79 CO 0.27 0.39 0.01 -1.17 -0.92 0.00 0.00 175.35 173.93 2gdj s LEU 80 N -1.38 3.56 0.28 3.17 2.96 0.59 -0.14 118.68 127.71 2gdj s LEU 80 Ca 0.08 0.06 -0.26 0.00 -0.22 0.00 0.00 54.13 53.79 2gdj s LEU 80 Cb -0.09 -1.85 -0.09 0.00 0.50 0.00 0.00 46.19 44.66 2gdj s LEU 80 CO 0.03 0.27 0.89 -0.55 -1.32 0.00 0.00 176.35 175.67 2gdj s SER 81 N -0.23 7.35 0.00 3.68 0.15 -0.89 0.47 113.70 124.23 2gdj s SER 81 Ca 0.06 1.77 0.26 0.00 0.70 0.00 0.00 55.95 58.74 2gdj s SER 81 Cb -0.12 -2.55 0.71 0.00 -1.71 0.00 0.00 66.02 62.35 2gdj s SER 81 CO 0.02 0.01 1.54 0.35 1.20 0.00 0.00 173.24 176.36 2gdj n THR 82 N 0.82 0.00 -0.99 6.45 -2.24 -1.26 -4.86 114.28 112.19 2gdj n THR 82 Ca -0.00 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 2gdj n THR 82 Cb 0.50 0.52 0.00 0.00 -2.10 0.00 0.00 70.33 69.25 2gdj n THR 82 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2gdj n SER 83 N -0.42 -1.65 -4.17 3.42 7.64 -1.26 -4.74 113.62 112.45 2gdj n SER 83 Ca 0.13 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.68 2gdj n SER 83 Cb 0.37 -0.34 -0.16 0.00 -1.01 0.00 0.00 64.21 63.06 2gdj n SER 83 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2gdj s SER 84 N -2.45 3.29 0.11 6.43 0.15 -1.26 -3.84 113.70 116.13 2gdj s SER 84 Ca 0.00 -0.59 -0.22 0.00 0.70 0.00 0.00 55.95 55.84 2gdj s SER 84 Cb 0.00 -1.50 -0.10 0.00 -1.71 0.00 0.00 66.02 62.71 2gdj s SER 84 CO 0.00 0.03 1.72 0.28 1.20 0.00 0.00 173.24 176.47 2gdj h SER 85 N 7.72 -0.13 -0.02 5.45 0.02 -1.75 -0.84 113.55 124.01 2gdj h SER 85 Ca -0.40 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 60.58 2gdj h SER 85 Cb 1.16 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.76 2gdj h SER 85 CO 0.61 -0.06 -0.01 -0.33 -1.14 0.00 0.00 176.83 175.90 2gdj h GLU 86 N -0.04 -0.01 -0.15 3.45 5.08 -1.82 0.27 114.58 121.37 2gdj h GLU 86 Ca 0.04 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.44 2gdj h GLU 86 Cb 0.10 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.31 2gdj h GLU 86 CO -0.09 -0.01 -0.12 1.25 -1.00 0.00 0.00 179.01 179.05 2gdj h LEU 87 N -0.01 -0.37 -0.53 1.33 5.85 -1.80 -0.13 115.31 119.65 2gdj h LEU 87 Ca 0.01 0.08 0.07 0.00 0.84 0.00 0.00 57.88 58.88 2gdj h LEU 87 Cb 0.03 0.19 -0.06 0.00 0.37 0.00 0.00 40.66 41.19 2gdj h LEU 87 CO -0.03 -0.15 0.22 0.44 -0.34 0.00 0.00 178.44 178.58 2gdj h ASP 88 N -0.13 0.27 -0.03 1.25 3.45 -0.95 -1.35 116.42 118.94 2gdj h ASP 88 Ca 0.09 0.05 0.04 0.00 0.43 0.00 0.00 57.03 57.64 2gdj h ASP 88 Cb 0.26 0.02 -0.05 0.00 -0.56 0.00 0.00 39.33 39.00 2gdj h ASP 88 CO -0.22 0.18 -0.32 -1.28 -1.57 0.00 0.00 179.24 176.03 2gdj h SER 89 N 0.43 -0.96 0.08 6.45 0.87 0.22 0.94 113.55 121.57 2gdj h SER 89 Ca 0.25 0.13 -0.01 0.00 -1.23 0.00 0.00 61.79 60.93 2gdj h SER 89 Cb 0.25 0.39 -0.00 0.00 -0.44 0.00 0.00 62.40 62.59 2gdj h SER 89 CO -0.23 -0.38 -0.07 0.58 -0.53 0.00 0.00 176.83 176.21 2gdj h VAL 90 N -0.46 0.96 0.00 2.23 2.07 -0.69 -1.53 116.25 118.83 2gdj h VAL 90 Ca 0.07 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.36 2gdj h VAL 90 Cb 0.55 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 2gdj h VAL 90 CO -0.28 0.06 0.00 0.18 0.02 0.00 0.00 177.57 177.55 2gdj n LEU 91 N -4.34 0.00 0.00 2.57 4.77 -0.39 -4.84 117.00 114.77 2gdj n LEU 91 Ca -0.03 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 2gdj n LEU 91 Cb 0.15 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 2gdj n LEU 91 CO 0.34 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 2gdj n GLY 92 N 0.85 0.59 0.00 -0.72 0.00 -0.58 -3.83 105.19 101.50 2gdj n GLY 92 Ca 0.17 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2gdj n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gdj n GLY 93 N -2.81 1.26 0.00 -0.02 0.00 0.19 -5.01 105.19 98.80 2gdj n GLY 93 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2gdj n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gdj n GLY 94 N 0.00 0.40 3.71 -0.02 0.00 -1.21 -4.75 105.19 103.31 2gdj n GLY 94 Ca 0.00 -1.31 -0.42 0.00 0.00 0.00 0.00 46.02 44.29 2gdj n GLY 94 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gdj s LEU 95 N 0.00 4.37 0.14 0.99 1.43 0.18 -4.62 118.68 121.17 2gdj s LEU 95 Ca 0.00 2.64 -0.24 0.00 -1.03 0.00 0.00 54.13 55.51 2gdj s LEU 95 Cb 0.00 -3.58 -0.08 0.00 0.03 0.00 0.00 46.19 42.56 2gdj s LEU 95 CO 0.00 -0.89 0.73 -1.61 0.23 0.00 0.00 176.35 174.81 2gdj s GLU 96 N 1.75 4.49 0.64 1.70 2.02 -1.26 -0.30 118.70 127.73 2gdj s GLU 96 Ca 0.73 1.06 -0.11 0.00 0.02 0.00 0.00 54.97 56.68 2gdj s GLU 96 Cb -0.44 -3.26 -0.02 0.00 0.10 0.00 0.00 34.13 30.51 2gdj s GLU 96 CO 0.32 0.58 1.04 -1.54 0.02 0.00 0.00 175.26 175.68 2gdj s SER 97 N -1.11 5.95 -1.69 -0.19 1.04 -0.26 -3.63 113.70 113.81 2gdj s SER 97 Ca 0.34 1.28 0.00 0.00 0.48 0.00 0.00 55.95 58.06 2gdj s SER 97 Cb -0.22 -2.26 0.00 0.00 0.10 0.00 0.00 66.02 63.64 2gdj s SER 97 CO 0.25 -1.02 0.00 0.00 0.98 0.00 0.00 173.24 173.44 2gdj n GLN 98 N -2.81 -1.12 -4.07 4.02 6.02 -0.09 -4.73 117.38 114.60 2gdj n GLN 98 Ca 0.06 1.05 -0.09 0.00 -0.01 0.00 0.00 57.00 58.01 2gdj n GLN 98 Cb 0.55 -5.24 -0.09 0.00 1.02 0.00 0.00 30.24 26.48 2gdj n GLN 98 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2gdj s SER 99 N -2.81 0.28 -0.14 1.08 0.01 -1.24 -4.60 113.70 106.28 2gdj s SER 99 Ca 0.00 -1.05 0.00 0.00 1.31 0.00 0.00 55.95 56.21 2gdj s SER 99 Cb 0.00 0.31 -0.01 0.00 0.21 0.00 0.00 66.02 66.53 2gdj s SER 99 CO 0.00 -0.73 -0.14 -0.69 0.41 0.00 0.00 173.24 172.09 2gdj s VAL 100 N -3.99 2.94 -0.16 3.43 1.01 -1.26 -2.41 120.40 119.96 2gdj s VAL 100 Ca 0.17 -0.69 0.01 0.00 0.00 0.00 0.00 61.98 61.47 2gdj s VAL 100 Cb 0.07 -2.23 0.02 0.00 0.00 0.00 0.00 36.38 34.23 2gdj s VAL 100 CO -0.02 0.52 -0.19 -0.89 0.00 0.00 0.00 175.10 174.51 2gdj s THR 101 N 0.47 1.96 -0.22 3.92 2.01 -0.19 -1.78 115.64 121.81 2gdj s THR 101 Ca -0.10 -0.89 -0.09 0.00 0.31 0.00 0.00 61.69 60.92 2gdj s THR 101 Cb -0.16 -1.76 -0.04 0.00 0.01 0.00 0.00 72.50 70.54 2gdj s THR 101 CO 0.05 0.53 0.12 -0.70 -0.69 0.00 0.00 174.62 173.92 2gdj s GLU 102 N 1.17 4.01 -0.94 4.92 2.12 0.19 -1.99 118.70 128.17 2gdj s GLU 102 Ca 0.01 -0.31 -0.04 0.00 0.36 0.00 0.00 54.97 54.99 2gdj s GLU 102 Cb -0.14 -3.40 0.23 0.00 0.26 0.00 0.00 34.13 31.09 2gdj s GLU 102 CO -0.09 0.13 0.85 -0.06 -0.54 0.00 0.00 175.26 175.55 2gdj s PHE 103 N 0.82 3.98 0.29 5.30 0.40 -0.23 -0.03 117.98 128.51 2gdj s PHE 103 Ca 0.06 -2.94 -0.24 0.00 -0.60 0.00 0.00 56.93 53.21 2gdj s PHE 103 Cb -0.13 -3.39 -0.09 0.00 0.51 0.00 0.00 43.02 39.92 2gdj s PHE 103 CO 0.02 -0.79 0.88 0.00 0.70 0.00 0.00 175.22 176.03 2gdj s ALA 104 N -1.30 3.27 0.12 5.36 0.00 -0.70 -3.32 121.76 125.18 2gdj s ALA 104 Ca 0.28 0.42 -0.24 0.00 0.00 0.00 0.00 51.96 52.42 2gdj s ALA 104 Cb -0.08 -3.08 0.08 0.00 0.00 0.00 0.00 23.12 20.04 2gdj s ALA 104 CO -0.11 0.22 1.13 0.20 0.00 0.00 0.00 175.76 177.19 2gdj s GLY 105 N -1.62 0.05 0.55 0.00 0.00 -0.42 -1.34 107.32 104.55 2gdj s GLY 105 Ca 0.48 -0.25 -0.05 0.00 0.00 0.00 0.00 44.72 44.90 2gdj s GLY 105 CO 0.23 3.75 0.85 -1.34 0.00 0.00 0.00 173.10 176.60 2gdj s VAL 106 N -2.06 3.99 0.12 1.40 -7.23 -1.17 -1.88 120.40 113.56 2gdj s VAL 106 Ca 0.25 0.01 -0.35 0.00 -1.81 0.00 0.00 61.98 60.08 2gdj s VAL 106 Cb -0.02 -3.56 -0.16 0.00 0.56 0.00 0.00 36.38 33.20 2gdj s VAL 106 CO 0.03 -0.55 1.30 0.49 -0.31 0.00 0.00 175.10 176.06 2gdj n PHE 107 N -2.46 1.48 -1.40 2.82 3.72 -1.26 0.05 117.46 120.41 2gdj n PHE 107 Ca 0.03 0.63 -0.14 0.00 -0.05 0.00 0.00 57.45 57.93 2gdj n PHE 107 Cb 0.57 -2.33 -0.06 0.00 -0.94 0.00 0.00 39.48 36.72 2gdj n PHE 107 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2gdj n GLY 108 N 2.40 1.41 0.26 1.37 0.00 -1.26 -4.85 105.19 104.51 2gdj n GLY 108 Ca 0.17 -0.23 0.15 0.00 0.00 0.00 0.00 46.02 46.12 2gdj n GLY 108 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2gdj h SER 109 N 0.00 0.00 0.00 1.61 4.64 -0.74 -3.47 113.55 115.59 2gdj h SER 109 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 2gdj h SER 109 Cb 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 2gdj h SER 109 CO 0.41 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 177.01 2gdj n GLY 110 N 0.30 1.07 0.23 -0.77 0.00 -1.26 -4.65 105.19 100.11 2gdj n GLY 110 Ca 0.01 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.99 2gdj n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gdj h LYS 111 N 1.25 -0.07 -0.35 1.61 1.57 -1.89 -1.29 116.57 117.40 2gdj h LYS 111 Ca 0.00 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 2gdj h LYS 111 Cb 0.00 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 2gdj h LYS 111 CO 0.00 -0.05 -0.16 1.15 -0.57 0.00 0.00 179.45 179.83 2gdj h THR 112 N -0.07 1.25 -0.53 -0.16 2.02 -1.95 -2.58 112.91 110.90 2gdj h THR 112 Ca 0.22 -1.17 -0.00 0.00 0.77 0.00 0.00 66.41 66.22 2gdj h THR 112 Cb 0.40 1.16 -0.03 0.00 -1.74 0.00 0.00 68.15 67.95 2gdj h THR 112 CO -0.50 0.39 0.31 1.56 0.37 0.00 0.00 175.52 177.65 2gdj h GLN 113 N 0.57 0.72 -0.84 6.66 1.08 -1.77 -1.22 115.11 120.32 2gdj h GLN 113 Ca 0.09 -0.07 -0.04 0.00 -1.45 0.00 0.00 58.65 57.19 2gdj h GLN 113 Cb 0.60 -0.15 -0.04 0.00 -0.05 0.00 0.00 27.48 27.84 2gdj h GLN 113 CO 0.04 0.53 0.38 0.82 -0.95 0.00 0.00 178.83 179.65 2gdj h ILE 114 N 0.71 1.26 -0.24 2.54 2.04 -1.00 0.18 117.51 123.01 2gdj h ILE 114 Ca 0.19 -0.76 -0.04 0.00 1.00 0.00 0.00 64.86 65.25 2gdj h ILE 114 Cb 0.00 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.28 2gdj h ILE 114 CO -0.03 0.32 -0.01 0.24 0.00 0.00 0.00 178.15 178.67 2gdj h MET 115 N 1.20 0.35 0.06 2.37 2.86 -1.04 0.80 114.93 121.53 2gdj h MET 115 Ca 0.29 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.86 2gdj h MET 115 Cb 0.15 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.75 2gdj h MET 115 CO -0.03 0.39 -0.03 0.45 1.06 0.00 0.00 176.91 178.75 2gdj h HIS 116 N 0.34 -0.07 -0.85 -0.22 3.86 -0.32 -3.01 115.15 114.89 2gdj h HIS 116 Ca 0.08 -0.00 0.13 0.00 -1.16 0.00 0.00 60.37 59.42 2gdj h HIS 116 Cb 0.25 0.02 -0.06 0.00 1.06 0.00 0.00 27.41 28.68 2gdj h HIS 116 CO 0.01 0.53 0.55 0.37 0.86 0.00 0.00 177.93 180.25 2gdj h GLN 117 N -0.79 0.64 -0.61 2.45 5.75 -0.46 -1.26 115.11 120.84 2gdj h GLN 117 Ca -0.01 -0.04 -0.05 0.00 -0.15 0.00 0.00 58.65 58.41 2gdj h GLN 117 Cb 0.63 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 29.01 2gdj h GLN 117 CO 0.01 0.42 0.18 0.77 -2.65 0.00 0.00 178.83 177.57 2gdj h SER 118 N 0.66 0.85 0.63 -0.69 0.02 -0.86 0.20 113.55 114.37 2gdj h SER 118 Ca 0.42 -0.14 -0.14 0.00 -0.84 0.00 0.00 61.79 61.09 2gdj h SER 118 Cb 0.68 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 2gdj h SER 118 CO -0.18 0.81 -0.66 0.00 -1.14 0.00 0.00 176.83 175.65 2gdj h VAL 120 N 0.02 1.48 0.00 0.00 2.07 -0.78 -3.23 116.25 115.81 2gdj h VAL 120 Ca -0.01 -1.59 -0.01 0.00 0.82 0.00 0.00 66.70 65.91 2gdj h VAL 120 Cb 1.18 2.54 -0.00 0.00 -1.52 0.00 0.00 31.29 33.49 2gdj h VAL 120 CO 0.09 0.40 -0.06 0.78 0.02 0.00 0.00 177.57 178.81 2gdj h ASN 121 N -0.71 0.00 -0.41 0.57 2.35 -0.65 -0.76 115.58 115.97 2gdj h ASN 121 Ca -0.00 0.00 0.09 0.00 -0.55 0.00 0.00 56.30 55.84 2gdj h ASN 121 Cb 0.68 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.03 2gdj h ASN 121 CO 0.00 0.06 0.28 0.25 -1.65 0.00 0.00 177.43 176.37 2gdj h LEU 122 N 0.00 0.14 -0.95 1.61 6.46 -1.47 -0.28 115.31 120.82 2gdj h LEU 122 Ca -0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2gdj h LEU 122 Cb 0.12 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.02 2gdj h LEU 122 CO 0.01 0.09 0.00 0.00 -0.62 0.00 0.00 178.44 177.91 2gdj n GLN 123 N -4.45 1.61 -3.87 1.25 1.13 -0.29 -4.54 117.38 108.21 2gdj n GLN 123 Ca 0.06 -0.93 -0.34 0.00 -1.94 0.00 0.00 57.00 53.86 2gdj n GLN 123 Cb 0.37 -1.29 -0.13 0.00 0.11 0.00 0.00 30.24 29.30 2gdj n GLN 123 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 2gdj s ASN 124 N -1.28 4.94 0.51 1.08 2.47 -0.12 -4.99 114.94 117.56 2gdj s ASN 124 Ca 0.25 -2.39 0.38 0.00 0.42 0.00 0.00 52.86 51.52 2gdj s ASN 124 Cb 0.13 -1.74 1.54 0.00 -1.45 0.00 0.00 41.25 39.73 2gdj s ASN 124 CO 0.19 -0.41 1.70 1.55 -3.72 0.00 0.00 177.10 176.40 2gdj h PRO 125 N 7.46 0.05 0.00 0.43 0.13 -1.80 0.70 132.00 138.97 2gdj h PRO 125 Ca -0.07 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2gdj h PRO 125 Cb 0.99 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2gdj h PRO 125 CO 0.65 0.04 0.00 0.39 -0.23 0.00 0.00 178.00 178.84 2gdj n GLU 126 N -4.25 0.29 -0.14 0.86 1.02 -1.26 -2.60 120.64 114.57 2gdj n GLU 126 Ca 0.34 0.09 0.12 0.00 -0.02 0.00 0.00 57.16 57.69 2gdj n GLU 126 Cb 1.49 -1.50 0.22 0.00 -0.02 0.00 0.00 31.44 31.63 2gdj n GLU 126 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2gdj n PHE 127 N -1.28 0.36 -3.69 -0.32 0.99 0.25 -4.79 117.46 108.98 2gdj n PHE 127 Ca 0.10 -0.18 -0.39 0.00 -0.00 0.00 0.00 57.45 56.98 2gdj n PHE 127 Cb 0.16 0.00 -0.12 0.00 -1.00 0.00 0.00 39.48 38.52 2gdj n PHE 127 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 2gdj s LEU 128 N -1.61 4.27 -0.24 4.37 1.02 -1.07 -2.08 118.68 123.35 2gdj s LEU 128 Ca 0.36 -0.88 -0.14 0.00 0.02 0.00 0.00 54.13 53.49 2gdj s LEU 128 Cb 0.22 -1.94 -0.04 0.00 0.02 0.00 0.00 46.19 44.45 2gdj s LEU 128 CO 0.31 -0.29 0.30 -0.36 0.02 0.00 0.00 176.35 176.33 2gdj s PHE 129 N 1.51 3.31 0.06 0.29 0.08 0.79 -4.92 117.98 119.11 2gdj s PHE 129 Ca 0.02 0.41 -0.24 0.00 0.12 0.00 0.00 56.93 57.23 2gdj s PHE 129 Cb -0.18 -2.44 0.06 0.00 -0.57 0.00 0.00 43.02 39.88 2gdj s PHE 129 CO 0.04 -0.05 0.58 1.52 -0.10 0.00 0.00 175.22 177.21 2gdj s TYR 130 N 1.44 -0.51 -0.31 0.36 -0.85 -1.26 -0.16 117.35 116.06 2gdj s TYR 130 Ca 0.13 0.55 -0.29 0.00 -0.52 0.00 0.00 57.07 56.95 2gdj s TYR 130 Cb -0.15 0.42 0.02 0.00 0.38 0.00 0.00 41.96 42.63 2gdj s TYR 130 CO 0.08 -0.70 1.06 0.34 -1.52 0.00 0.00 175.55 174.80 2gdj s ASP 131 N -2.08 6.94 0.42 -0.18 3.68 -1.26 -4.91 116.67 119.28 2gdj s ASP 131 Ca -0.04 1.06 0.09 0.00 2.13 0.00 0.00 52.55 55.79 2gdj s ASP 131 Cb -0.01 -2.54 0.91 0.00 -1.45 0.00 0.00 42.92 39.84 2gdj s ASP 131 CO -0.03 -0.85 2.05 -0.33 0.13 0.00 0.00 175.17 176.14 2gdj h GLU 132 N 8.03 0.48 0.00 4.34 5.08 -1.96 0.18 114.58 130.74 2gdj h GLU 132 Ca -0.20 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 2gdj h GLU 132 Cb 1.06 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.20 2gdj h GLU 132 CO 1.02 0.32 0.00 0.39 -1.00 0.00 0.00 179.01 179.74 2gdj n GLU 133 N -4.48 0.06 0.00 2.33 1.02 -1.26 -3.20 120.64 115.11 2gdj n GLU 133 Ca 0.04 0.37 0.00 0.00 -0.02 0.00 0.00 57.16 57.54 2gdj n GLU 133 Cb 0.11 -1.64 0.00 0.00 -0.02 0.00 0.00 31.44 29.89 2gdj n GLU 133 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2gdj n ALA 134 N -1.60 1.56 -3.65 0.62 0.00 -0.37 -4.97 120.51 112.11 2gdj n ALA 134 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.17 2gdj n ALA 134 Cb 0.15 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.45 2gdj n ALA 134 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2gdj s VAL 135 N -1.12 0.38 0.46 0.00 1.01 0.50 -4.67 120.40 116.95 2gdj s VAL 135 Ca 0.00 -0.92 -0.23 0.00 0.00 0.00 0.00 61.98 60.82 2gdj s VAL 135 Cb 0.00 -1.22 -0.07 0.00 0.00 0.00 0.00 36.38 35.09 2gdj s VAL 135 CO 0.00 -0.59 1.20 -0.94 0.00 0.00 0.00 175.10 174.77 2gdj s SER 136 N 1.88 6.11 0.52 3.32 1.04 -1.26 -4.39 113.70 120.92 2gdj s SER 136 Ca 0.07 2.40 0.27 0.00 0.48 0.00 0.00 55.95 59.16 2gdj s SER 136 Cb -0.17 -2.61 1.38 0.00 0.10 0.00 0.00 66.02 64.72 2gdj s SER 136 CO -0.26 -0.97 1.94 0.11 0.98 0.00 0.00 173.24 175.04 2gdj h LYS 137 N 2.10 0.06 0.00 4.02 1.57 -1.97 0.44 116.57 122.78 2gdj h LYS 137 Ca -0.49 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.27 2gdj h LYS 137 Cb 1.25 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.55 2gdj h LYS 137 CO 0.60 0.04 -0.06 0.78 -0.57 0.00 0.00 179.45 180.24 2gdj h GLY 138 N 0.06 0.00 2.00 3.86 0.00 -1.97 -1.58 103.07 105.44 2gdj h GLY 138 Ca 0.35 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.55 2gdj h GLY 138 CO -0.03 0.00 -0.62 -2.09 0.00 0.00 0.00 176.54 173.81 2gdj h GLU 139 N 0.00 0.00 -0.27 4.80 4.81 -0.47 -3.28 114.58 120.17 2gdj h GLU 139 Ca -0.00 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 2gdj h GLU 139 Cb 0.31 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.64 2gdj h GLU 139 CO 0.01 0.61 -0.03 1.33 -0.73 0.00 0.00 179.01 180.20 2gdj n VAL 140 N -3.25 2.36 -3.08 0.32 0.24 -0.88 -5.00 118.33 109.03 2gdj n VAL 140 Ca 0.02 -2.25 -0.39 0.00 -2.04 0.00 0.00 64.34 59.67 2gdj n VAL 140 Cb 0.78 -0.28 -0.05 0.00 -1.47 0.00 0.00 33.84 32.82 2gdj n VAL 140 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2gdj s ALA 141 N -3.00 3.43 -1.22 2.33 0.00 -0.65 -4.09 121.76 118.57 2gdj s ALA 141 Ca 0.42 0.18 -0.06 0.00 0.00 0.00 0.00 51.96 52.50 2gdj s ALA 141 Cb 0.36 -2.88 -0.01 0.00 0.00 0.00 0.00 23.12 20.59 2gdj s ALA 141 CO 0.05 0.14 0.76 1.04 0.00 0.00 0.00 175.76 177.75 2gdj n GLN 142 N 2.62 -3.50 -1.99 0.00 6.02 -1.26 -4.86 117.38 114.41 2gdj n GLN 142 Ca -0.05 0.62 -0.35 0.00 -0.01 0.00 0.00 57.00 57.22 2gdj n GLN 142 Cb 0.50 -5.02 0.03 0.00 1.02 0.00 0.00 30.24 26.77 2gdj n GLN 142 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2gdj s PRO 143 N -5.70 3.00 0.03 -1.09 0.04 -1.26 -4.47 135.00 125.55 2gdj s PRO 143 Ca 0.20 1.61 0.01 0.00 0.04 0.00 0.00 61.00 62.87 2gdj s PRO 143 Cb -0.05 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.51 2gdj s PRO 143 CO 0.81 -1.13 -0.06 0.15 0.04 0.00 0.00 177.00 176.81 2gdj s LYS 144 N -3.58 0.43 0.10 4.56 1.02 -0.93 -4.91 119.74 116.42 2gdj s LYS 144 Ca 0.72 -0.60 0.06 0.00 0.02 0.00 0.00 55.97 56.17 2gdj s LYS 144 Cb -0.25 -0.19 -0.04 0.00 -0.52 0.00 0.00 37.83 36.83 2gdj s LYS 144 CO 0.34 0.03 -0.05 0.00 -0.92 0.00 0.00 175.35 174.75 2gdj s ALA 145 N -1.16 3.14 -0.19 5.17 0.00 0.30 -1.38 121.76 127.65 2gdj s ALA 145 Ca -0.09 -1.18 -0.02 0.00 0.00 0.00 0.00 51.96 50.67 2gdj s ALA 145 Cb -0.08 -1.05 -0.01 0.00 0.00 0.00 0.00 23.12 21.98 2gdj s ALA 145 CO -0.00 0.67 -0.09 0.08 0.00 0.00 0.00 175.76 176.42 2gdj s VAL 146 N -1.27 3.07 -0.36 0.00 1.01 0.11 0.07 120.40 123.03 2gdj s VAL 146 Ca 0.24 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.61 2gdj s VAL 146 Cb -0.11 -2.35 0.10 0.00 0.00 0.00 0.00 36.38 34.01 2gdj s VAL 146 CO 0.16 0.47 0.10 -0.47 0.00 0.00 0.00 175.10 175.37 2gdj s TYR 147 N 1.09 3.59 -0.36 5.22 6.04 0.39 -0.06 117.35 133.26 2gdj s TYR 147 Ca 0.00 -2.56 -0.21 0.00 0.04 0.00 0.00 57.07 54.34 2gdj s TYR 147 Cb -0.15 -2.89 0.00 0.00 -1.04 0.00 0.00 41.96 37.89 2gdj s TYR 147 CO -0.02 -0.94 0.66 0.42 -1.54 0.00 0.00 175.55 174.13 2gdj s ILE 148 N 1.06 4.86 -0.39 3.14 1.01 0.26 -1.04 121.20 130.10 2gdj s ILE 148 Ca 0.06 0.60 -0.12 0.00 0.00 0.00 0.00 60.65 61.20 2gdj s ILE 148 Cb -0.21 -4.11 0.03 0.00 0.01 0.00 0.00 42.46 38.19 2gdj s ILE 148 CO -0.05 -0.35 0.24 -0.62 0.00 0.00 0.00 174.94 174.16 2gdj s ASP 149 N 1.81 5.85 0.06 3.58 2.15 0.43 -1.25 116.67 129.30 2gdj s ASP 149 Ca 0.25 -1.02 0.17 0.00 0.43 0.00 0.00 52.55 52.38 2gdj s ASP 149 Cb -0.14 -2.06 -0.14 0.00 -0.30 0.00 0.00 42.92 40.28 2gdj s ASP 149 CO 0.15 -0.43 0.81 0.41 -0.17 0.00 0.00 175.17 175.95 2gdj n THR 150 N 5.04 1.17 0.01 1.71 -1.04 0.24 -1.68 114.28 119.73 2gdj n THR 150 Ca -0.11 -0.69 0.10 0.00 -2.04 0.00 0.00 64.05 61.30 2gdj n THR 150 Cb 0.46 -0.72 -0.13 0.00 -1.82 0.00 0.00 70.33 68.12 2gdj n THR 150 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2gdj n GLU 151 N -2.87 0.65 -2.28 -2.82 -0.58 -1.18 -4.79 120.64 106.77 2gdj n GLU 151 Ca -0.10 -0.10 -0.01 0.00 -0.42 0.00 0.00 57.16 56.53 2gdj n GLU 151 Cb 0.84 -1.60 0.00 0.00 -0.57 0.00 0.00 31.44 30.11 2gdj n GLU 151 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2gdj n GLY 152 N 1.27 0.60 0.65 0.62 0.00 -1.26 -4.96 105.19 102.11 2gdj n GLY 152 Ca -0.05 -0.74 0.12 0.00 0.00 0.00 0.00 46.02 45.34 2gdj n GLY 152 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gdj n THR 153 N -3.34 0.00 -1.82 2.61 -2.24 -1.26 -4.95 114.28 103.29 2gdj n THR 153 Ca -0.01 -0.34 -0.42 0.00 -2.27 0.00 0.00 64.05 61.02 2gdj n THR 153 Cb 0.51 1.28 -0.03 0.00 -2.10 0.00 0.00 70.33 69.99 2gdj n THR 153 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2gdj s PHE 154 N -2.29 2.95 -0.21 4.78 5.36 -1.26 -4.98 117.98 122.33 2gdj s PHE 154 Ca 0.23 0.51 -0.02 0.00 -0.96 0.00 0.00 56.93 56.68 2gdj s PHE 154 Cb 0.19 -4.05 0.06 0.00 -0.34 0.00 0.00 43.02 38.89 2gdj s PHE 154 CO 0.47 -3.88 0.02 1.03 -1.46 0.00 0.00 175.22 171.40 2gdj s ARG 155 N 0.97 0.86 0.33 10.12 1.81 -1.26 -5.00 118.95 126.78 2gdj s ARG 155 Ca 0.72 -0.61 0.24 0.00 -1.72 0.00 0.00 55.73 54.36 2gdj s ARG 155 Cb -0.47 -2.20 1.20 0.00 -0.45 0.00 0.00 34.95 33.03 2gdj s ARG 155 CO 0.33 -0.67 1.72 -1.00 -0.68 0.00 0.00 175.30 175.00 2gdj h PRO 156 N 8.17 0.00 0.00 3.54 0.13 -2.01 -1.95 132.00 139.88 2gdj h PRO 156 Ca -0.16 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.76 2gdj h PRO 156 Cb 1.10 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.20 2gdj h PRO 156 CO 0.37 0.00 -1.00 0.93 -0.23 0.00 0.00 178.00 178.06 2gdj h GLU 157 N 0.00 0.01 0.00 0.86 3.07 -1.99 -2.39 114.58 114.14 2gdj h GLU 157 Ca 0.00 -0.01 -0.10 0.00 -0.50 0.00 0.00 59.36 58.75 2gdj h GLU 157 Cb 0.10 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.99 2gdj h GLU 157 CO 0.00 1.00 -0.46 -0.09 -1.40 0.00 0.00 179.01 178.06 2gdj h ARG 158 N 0.00 0.00 0.00 2.33 9.65 -1.78 -1.23 114.38 123.35 2gdj h ARG 158 Ca -0.01 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.87 2gdj h ARG 158 Cb 1.77 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.35 2gdj h ARG 158 CO 0.13 0.46 -0.00 0.82 2.80 0.00 0.00 179.97 184.18 2gdj h ILE 159 N 0.00 1.28 -0.55 1.20 1.08 -1.47 -0.99 117.51 118.06 2gdj h ILE 159 Ca -0.00 -0.85 0.04 0.00 -0.39 0.00 0.00 64.86 63.65 2gdj h ILE 159 Cb 0.91 1.86 -0.04 0.00 -3.07 0.00 0.00 36.82 36.48 2gdj h ILE 159 CO 0.06 0.22 0.31 0.24 -0.69 0.00 0.00 178.15 178.29 2gdj h MET 160 N -0.37 0.59 -0.32 2.37 2.86 -1.22 0.14 114.93 118.98 2gdj h MET 160 Ca -0.00 -0.04 -0.05 0.00 -2.06 0.00 0.00 59.70 57.56 2gdj h MET 160 Cb 0.36 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 2gdj h MET 160 CO 0.00 0.39 0.02 0.37 1.06 0.00 0.00 176.91 178.75 2gdj h GLN 161 N 0.61 0.56 -0.66 1.72 4.15 -1.18 -0.12 115.11 120.18 2gdj h GLN 161 Ca 0.23 -0.17 -0.08 0.00 0.77 0.00 0.00 58.65 59.40 2gdj h GLN 161 Cb 0.09 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.69 2gdj h GLN 161 CO -0.13 0.68 0.10 0.52 -1.93 0.00 0.00 178.83 178.07 2gdj h MET 162 N 0.37 1.10 0.30 1.69 2.86 -0.94 -2.48 114.93 117.83 2gdj h MET 162 Ca 0.09 -0.30 -0.00 0.00 -2.06 0.00 0.00 59.70 57.43 2gdj h MET 162 Cb 0.42 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 2gdj h MET 162 CO 0.01 1.01 -0.28 0.00 1.06 0.00 0.00 176.91 178.72 2gdj h ALA 163 N 1.06 -0.59 -0.34 6.32 0.00 -0.52 -2.59 119.26 122.60 2gdj h ALA 163 Ca 0.20 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.05 2gdj h ALA 163 Cb 0.45 0.39 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 2gdj h ALA 163 CO 0.01 -0.86 -0.23 0.93 0.00 0.00 0.00 179.25 179.10 2gdj h GLU 164 N -0.60 -0.04 0.00 0.00 3.07 -0.78 0.11 114.58 116.33 2gdj h GLU 164 Ca -0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 2gdj h GLU 164 Cb 0.54 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.46 2gdj h GLU 164 CO -0.05 -0.03 0.00 0.72 -1.40 0.00 0.00 179.01 178.25 2gdj n HIS 165 N -3.87 0.00 0.55 4.33 8.25 -0.95 -1.25 115.22 122.27 2gdj n HIS 165 Ca 0.00 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.52 2gdj n HIS 165 Cb 0.11 -0.32 -0.05 0.00 1.12 0.00 0.00 29.99 30.85 2gdj n HIS 165 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2gdj n ALA 166 N -1.32 3.39 -2.25 -1.41 0.00 0.19 -5.00 120.51 114.10 2gdj n ALA 166 Ca 0.02 -0.36 -0.01 0.00 0.00 0.00 0.00 53.44 53.09 2gdj n ALA 166 Cb 0.04 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.07 2gdj n ALA 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gdj n GLY 167 N 1.21 0.58 3.27 0.00 0.00 -0.17 -5.08 105.19 105.00 2gdj n GLY 167 Ca 0.03 -0.52 -0.20 0.00 0.00 0.00 0.00 46.02 45.32 2gdj n GLY 167 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gdj s ILE 168 N -3.02 1.54 -0.57 -0.61 -1.09 -0.62 -5.03 121.20 111.81 2gdj s ILE 168 Ca 0.01 -1.69 -0.28 0.00 -2.23 0.00 0.00 60.65 56.46 2gdj s ILE 168 Cb -0.00 -1.58 0.02 0.00 -1.58 0.00 0.00 42.46 39.32 2gdj s ILE 168 CO 0.04 -0.28 1.35 -0.62 -1.23 0.00 0.00 174.94 174.19 2gdj s ASP 169 N -2.31 6.23 0.34 3.58 2.15 -1.26 -4.12 116.67 121.28 2gdj s ASP 169 Ca 0.09 0.24 0.11 0.00 0.43 0.00 0.00 52.55 53.42 2gdj s ASP 169 Cb -0.07 -2.55 0.91 0.00 -0.30 0.00 0.00 42.92 40.91 2gdj s ASP 169 CO 0.04 -1.64 1.76 1.23 -0.17 0.00 0.00 175.17 176.39 2gdj h GLY 170 N 12.74 1.65 1.60 2.66 0.00 -1.90 0.24 103.07 120.07 2gdj h GLY 170 Ca -0.26 -0.29 -0.06 0.00 0.00 0.00 0.00 47.33 46.71 2gdj h GLY 170 CO 1.18 -0.15 -0.09 -1.61 0.00 0.00 0.00 176.54 175.86 2gdj h GLN 171 N 0.58 0.48 -0.82 4.80 5.75 -1.97 -2.31 115.11 121.63 2gdj h GLN 171 Ca 0.61 -0.13 -0.01 0.00 -0.15 0.00 0.00 58.65 58.96 2gdj h GLN 171 Cb 1.20 -0.06 -0.04 0.00 1.07 0.00 0.00 27.48 29.65 2gdj h GLN 171 CO -0.39 0.58 0.45 1.15 -2.65 0.00 0.00 178.83 177.98 2gdj h THR 172 N 0.45 1.24 -0.03 2.39 2.02 -0.92 -0.30 112.91 117.76 2gdj h THR 172 Ca 0.09 -0.59 0.00 0.00 0.77 0.00 0.00 66.41 66.68 2gdj h THR 172 Cb 0.44 0.14 -0.00 0.00 -1.74 0.00 0.00 68.15 66.99 2gdj h THR 172 CO 0.02 0.26 0.02 0.58 0.37 0.00 0.00 175.52 176.78 2gdj h VAL 173 N 1.13 1.03 -0.42 3.16 2.07 -1.17 -1.54 116.25 120.51 2gdj h VAL 173 Ca 0.29 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.71 2gdj h VAL 173 Cb 0.02 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 2gdj h VAL 173 CO -0.05 0.02 0.17 -0.07 0.02 0.00 0.00 177.57 177.66 2gdj h LEU 174 N 0.02 0.54 -0.92 2.57 3.38 -1.10 -2.07 115.31 117.72 2gdj h LEU 174 Ca 0.01 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 2gdj h LEU 174 Cb 0.02 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2gdj h LEU 174 CO -0.00 0.50 -0.49 0.44 0.09 0.00 0.00 178.44 178.98 2gdj h ASP 175 N 0.60 0.00 -0.49 -0.43 3.32 -0.65 -3.20 116.42 115.58 2gdj h ASP 175 Ca 0.15 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.16 2gdj h ASP 175 Cb 0.13 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 2gdj h ASP 175 CO -0.01 0.49 0.03 0.59 -1.72 0.00 0.00 179.24 178.61 2gdj n ASN 176 N -3.74 4.95 -3.97 6.45 5.03 -0.62 -4.88 115.26 118.47 2gdj n ASN 176 Ca -0.01 -3.03 -0.27 0.00 0.87 0.00 0.00 54.58 52.14 2gdj n ASN 176 Cb 0.54 -0.65 -0.17 0.00 -1.02 0.00 0.00 39.78 38.48 2gdj n ASN 176 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2gdj s THR 177 N -2.84 1.22 -0.26 3.41 2.01 -0.93 -0.54 115.64 117.71 2gdj s THR 177 Ca 0.51 -0.44 -0.13 0.00 0.31 0.00 0.00 61.69 61.93 2gdj s THR 177 Cb 0.40 -1.18 -0.04 0.00 0.01 0.00 0.00 72.50 71.69 2gdj s THR 177 CO 0.13 0.39 0.31 -0.36 -0.69 0.00 0.00 174.62 174.40 2gdj s PHE 178 N 1.38 3.26 -0.20 4.92 0.40 0.11 -4.92 117.98 122.94 2gdj s PHE 178 Ca 0.00 0.34 -0.03 0.00 -0.60 0.00 0.00 56.93 56.63 2gdj s PHE 178 Cb -0.13 -2.48 -0.01 0.00 0.51 0.00 0.00 43.02 40.90 2gdj s PHE 178 CO -0.06 -0.15 -0.05 0.08 0.70 0.00 0.00 175.22 175.74 2gdj s VAL 179 N 1.80 3.41 -0.14 -0.44 1.01 -1.26 0.15 120.40 124.92 2gdj s VAL 179 Ca 0.13 -0.49 -0.02 0.00 0.00 0.00 0.00 61.98 61.59 2gdj s VAL 179 Cb -0.15 -2.53 -0.02 0.00 0.00 0.00 0.00 36.38 33.68 2gdj s VAL 179 CO 0.09 0.44 -0.08 0.00 0.00 0.00 0.00 175.10 175.56 2gdj s ALA 180 N 1.19 2.83 -0.25 5.51 0.00 -0.20 -4.97 121.76 125.86 2gdj s ALA 180 Ca 0.02 -0.85 -0.18 0.00 0.00 0.00 0.00 51.96 50.95 2gdj s ALA 180 Cb -0.14 -1.40 -0.03 0.00 0.00 0.00 0.00 23.12 21.54 2gdj s ALA 180 CO -0.01 0.22 0.49 0.50 0.00 0.00 0.00 175.76 176.97 2gdj s ARG 181 N 0.36 4.08 -0.10 0.00 6.06 -1.26 -0.42 118.95 127.67 2gdj s ARG 181 Ca -0.07 0.30 0.03 0.00 -2.50 0.00 0.00 55.73 53.48 2gdj s ARG 181 Cb -0.15 -3.64 -0.01 0.00 0.06 0.00 0.00 34.95 31.21 2gdj s ARG 181 CO 0.04 -0.30 -0.18 0.00 -2.50 0.00 0.00 175.30 172.36 2gdj s ALA 182 N 2.15 2.43 -0.78 6.12 0.00 -0.68 -4.97 121.76 126.04 2gdj s ALA 182 Ca 0.21 -0.95 0.15 0.00 0.00 0.00 0.00 51.96 51.36 2gdj s ALA 182 Cb -0.16 -0.98 -0.14 0.00 0.00 0.00 0.00 23.12 21.85 2gdj s ALA 182 CO 0.09 0.33 0.65 0.66 0.00 0.00 0.00 175.76 177.49 2gdj n TYR 183 N 3.26 0.00 -3.91 0.00 4.01 -1.26 -4.31 117.16 114.96 2gdj n TYR 183 Ca -0.18 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.46 2gdj n TYR 183 Cb 0.53 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.50 2gdj n TYR 183 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2gdj s ASN 184 N -2.31 -0.05 0.55 7.72 6.03 -1.26 -4.99 114.94 120.63 2gdj s ASN 184 Ca 0.06 -0.77 0.22 0.00 -1.03 0.00 0.00 52.86 51.34 2gdj s ASN 184 Cb 0.11 0.48 1.45 0.00 -3.03 0.00 0.00 41.25 40.26 2gdj s ASN 184 CO 0.57 -0.95 2.12 0.77 -2.03 0.00 0.00 177.10 177.58 2gdj h SER 185 N 2.43 0.00 0.03 3.54 4.64 -1.96 -2.21 113.55 120.02 2gdj h SER 185 Ca -0.30 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.01 2gdj h SER 185 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2gdj h SER 185 CO 0.44 0.00 -0.01 0.44 -0.87 0.00 0.00 176.83 176.83 2gdj h ASP 186 N 0.00 -0.03 -0.64 4.97 3.32 -1.97 -2.47 116.42 119.59 2gdj h ASP 186 Ca 0.07 -0.44 0.06 0.00 0.02 0.00 0.00 57.03 56.75 2gdj h ASP 186 Cb 0.31 0.01 -0.05 0.00 0.22 0.00 0.00 39.33 39.82 2gdj h ASP 186 CO -0.00 0.43 0.35 0.24 -1.72 0.00 0.00 179.24 178.53 2gdj h MET 187 N -0.50 0.62 0.20 3.56 2.86 -1.88 -0.99 114.93 118.80 2gdj h MET 187 Ca -0.00 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.61 2gdj h MET 187 Cb 0.47 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.95 2gdj h MET 187 CO 0.01 0.41 -0.36 0.37 1.06 0.00 0.00 176.91 178.40 2gdj h GLN 188 N 0.64 -0.61 -0.65 1.72 4.15 -1.40 0.26 115.11 119.22 2gdj h GLN 188 Ca 0.29 0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.75 2gdj h GLN 188 Cb 0.19 0.14 -0.03 0.00 0.21 0.00 0.00 27.48 27.99 2gdj h GLN 188 CO -0.19 -0.41 0.41 0.52 -1.93 0.00 0.00 178.83 177.23 2gdj h MET 189 N -0.64 0.87 -0.09 1.69 2.86 -1.23 -2.02 114.93 116.37 2gdj h MET 189 Ca 0.01 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2gdj h MET 189 Cb 0.63 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 32.10 2gdj h MET 189 CO -0.16 0.60 0.05 1.25 1.06 0.00 0.00 176.91 179.71 2gdj h LEU 190 N 0.88 0.11 -0.70 1.22 5.85 -0.87 -1.34 115.31 120.46 2gdj h LEU 190 Ca 0.23 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.91 2gdj h LEU 190 Cb -0.05 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 40.90 2gdj h LEU 190 CO -0.05 0.17 0.42 -0.26 -0.34 0.00 0.00 178.44 178.39 2gdj h PHE 191 N 0.05 0.78 0.00 1.25 0.05 -0.32 0.53 116.94 119.27 2gdj h PHE 191 Ca 0.03 0.02 -0.03 0.00 3.82 0.00 0.00 57.97 61.81 2gdj h PHE 191 Cb 0.09 -0.25 -0.00 0.00 2.00 0.00 0.00 35.95 37.78 2gdj h PHE 191 CO -0.04 0.41 -0.15 0.00 -0.18 0.00 0.00 178.31 178.35 2gdj h ALA 192 N 1.33 1.43 0.01 2.45 0.00 -1.10 -2.56 119.26 120.82 2gdj h ALA 192 Ca 0.30 -0.14 -0.21 0.00 0.00 0.00 0.00 54.91 54.86 2gdj h ALA 192 Cb 0.11 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2gdj h ALA 192 CO -0.15 0.19 -0.93 0.93 0.00 0.00 0.00 179.25 179.29 2gdj h GLU 193 N 0.00 0.23 0.00 0.00 5.08 0.21 -3.18 114.58 116.92 2gdj h GLU 193 Ca -0.00 -0.27 -0.03 0.00 -1.00 0.00 0.00 59.36 58.06 2gdj h GLU 193 Cb 0.34 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 2gdj h GLU 193 CO 0.02 1.01 -0.13 0.87 -1.00 0.00 0.00 179.01 179.78 2gdj h LYS 194 N 0.12 0.00 -1.13 2.33 1.57 -0.78 -3.16 116.57 115.52 2gdj h LYS 194 Ca -0.06 0.00 0.35 0.00 -1.87 0.00 0.00 60.65 59.07 2gdj h LYS 194 Cb 1.57 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 33.76 2gdj h LYS 194 CO 0.15 0.13 0.71 0.82 -0.57 0.00 0.00 179.45 180.68 2gdj h ILE 195 N 0.00 0.30 -0.27 1.86 2.04 -1.49 0.58 117.51 120.53 2gdj h ILE 195 Ca -0.00 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 2gdj h ILE 195 Cb 0.66 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 2gdj h ILE 195 CO 0.02 0.05 0.13 -0.08 0.00 0.00 0.00 178.15 178.27 2gdj h GLU 196 N 0.25 0.38 -0.51 2.37 4.81 -1.77 -2.21 114.58 117.90 2gdj h GLU 196 Ca 0.73 -0.05 0.08 0.00 -0.13 0.00 0.00 59.36 59.98 2gdj h GLU 196 Cb 1.97 -0.07 -0.07 0.00 0.63 0.00 0.00 28.75 31.21 2gdj h GLU 196 CO -0.44 0.36 0.14 -0.44 -0.73 0.00 0.00 179.01 177.90 2gdj h ASP 197 N 0.30 0.09 -0.57 1.04 3.45 -0.08 0.23 116.42 120.88 2gdj h ASP 197 Ca 0.09 0.08 0.12 0.00 0.43 0.00 0.00 57.03 57.75 2gdj h ASP 197 Cb 0.10 0.09 -0.10 0.00 -0.56 0.00 0.00 39.33 38.85 2gdj h ASP 197 CO -0.01 0.07 -0.09 -0.07 -1.57 0.00 0.00 179.24 177.57 2gdj h LEU 198 N 0.30 -0.44 0.02 1.55 3.38 -0.89 0.26 115.31 119.48 2gdj h LEU 198 Ca 0.25 0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.39 2gdj h LEU 198 Cb 0.32 0.32 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2gdj h LEU 198 CO -0.30 -0.16 -0.01 0.40 0.09 0.00 0.00 178.44 178.46 2gdj h ILE 199 N 0.04 1.06 -0.71 1.22 2.04 -0.63 -1.53 117.51 119.00 2gdj h ILE 199 Ca 0.28 -0.24 0.21 0.00 1.00 0.00 0.00 64.86 66.11 2gdj h ILE 199 Cb 0.44 1.22 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 2gdj h ILE 199 CO -0.56 0.06 0.66 -0.61 0.00 0.00 0.00 178.15 177.70 2gdj h GLN 200 N -0.12 0.00 -0.37 2.37 4.15 0.17 1.22 115.11 122.52 2gdj h GLN 200 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2gdj h GLN 200 Cb 0.12 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.81 2gdj h GLN 200 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 178.83 177.29 2gdj n GLU 201 N -3.80 1.61 -0.70 1.69 1.02 0.69 -4.87 120.64 116.27 2gdj n GLU 201 Ca 0.14 -0.75 0.00 0.00 -0.02 0.00 0.00 57.16 56.54 2gdj n GLU 201 Cb 0.91 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 31.04 2gdj n GLU 201 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2gdj n GLY 202 N 0.65 0.63 3.63 0.62 0.00 0.42 -5.04 105.19 106.11 2gdj n GLY 202 Ca 0.07 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 2gdj n GLY 202 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2gdj s ASN 203 N -2.13 6.57 -1.36 1.61 0.01 -1.05 -4.98 114.94 113.62 2gdj s ASN 203 Ca 0.00 0.70 -0.16 0.00 -0.71 0.00 0.00 52.86 52.69 2gdj s ASN 203 Cb 0.00 -2.33 0.07 0.00 0.41 0.00 0.00 41.25 39.39 2gdj s ASN 203 CO 0.00 -0.36 1.92 -3.20 -1.51 0.00 0.00 177.10 173.95 2gdj n ASN 204 N 5.68 4.54 -4.66 -1.22 5.15 -1.26 -3.99 115.26 119.50 2gdj n ASN 204 Ca -0.01 -2.90 -0.42 0.00 -0.60 0.00 0.00 54.58 50.65 2gdj n ASN 204 Cb 0.49 -1.70 -0.03 0.00 -0.53 0.00 0.00 39.78 38.02 2gdj n ASN 204 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2gdj s ILE 205 N 3.54 3.47 0.00 -1.44 -1.09 -1.26 -2.20 121.20 122.22 2gdj s ILE 205 Ca 0.50 0.59 0.00 0.00 -2.23 0.00 0.00 60.65 59.51 2gdj s ILE 205 Cb 0.08 -3.38 0.00 0.00 -1.58 0.00 0.00 42.46 37.58 2gdj s ILE 205 CO 0.01 -0.05 0.25 0.29 -1.23 0.00 0.00 174.94 174.21 2gdj n LYS 206 N 7.11 0.46 -3.72 2.79 4.76 -0.48 -4.73 118.16 124.35 2gdj n LYS 206 Ca 0.18 -0.25 -0.13 0.00 -2.87 0.00 0.00 58.31 55.23 2gdj n LYS 206 Cb 0.42 -0.71 -0.14 0.00 -1.84 0.00 0.00 35.03 32.77 2gdj n LYS 206 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2gdj s LEU 207 N -0.27 0.42 -0.03 -0.35 2.96 -1.20 -1.69 118.68 118.52 2gdj s LEU 207 Ca 0.00 0.42 0.07 0.00 -0.22 0.00 0.00 54.13 54.40 2gdj s LEU 207 Cb 0.00 0.53 -0.02 0.00 0.50 0.00 0.00 46.19 47.21 2gdj s LEU 207 CO 0.00 -0.17 -0.24 -0.69 -1.32 0.00 0.00 176.35 173.93 2gdj s VAL 208 N 1.44 1.87 -0.07 1.68 1.01 0.26 0.05 120.40 126.65 2gdj s VAL 208 Ca -0.07 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 60.91 2gdj s VAL 208 Cb -0.11 -1.56 0.02 0.00 0.00 0.00 0.00 36.38 34.73 2gdj s VAL 208 CO -0.07 0.53 -0.05 -0.69 0.00 0.00 0.00 175.10 174.81 2gdj s VAL 209 N -0.46 0.70 -0.38 2.92 1.01 0.92 -0.88 120.40 124.22 2gdj s VAL 209 Ca 0.06 -0.16 0.04 0.00 0.00 0.00 0.00 61.98 61.92 2gdj s VAL 209 Cb -0.10 -0.73 0.11 0.00 0.00 0.00 0.00 36.38 35.66 2gdj s VAL 209 CO 0.00 0.28 0.10 -0.63 0.00 0.00 0.00 175.10 174.85 2gdj s ILE 210 N 1.26 2.39 -0.33 2.22 -1.09 -0.06 0.89 121.20 126.47 2gdj s ILE 210 Ca -0.05 -2.54 0.03 0.00 -2.23 0.00 0.00 60.65 55.87 2gdj s ILE 210 Cb -0.14 -2.74 0.09 0.00 -1.58 0.00 0.00 42.46 38.10 2gdj s ILE 210 CO -0.02 -0.64 0.03 -0.62 -1.23 0.00 0.00 174.94 172.46 2gdj s ASP 211 N 0.69 4.75 0.32 3.58 2.15 -0.38 -2.47 116.67 125.31 2gdj s ASP 211 Ca 0.12 -2.01 0.04 0.00 0.43 0.00 0.00 52.55 51.13 2gdj s ASP 211 Cb -0.21 -1.63 0.04 0.00 -0.30 0.00 0.00 42.92 40.83 2gdj s ASP 211 CO -0.06 -0.36 0.36 -1.54 -0.17 0.00 0.00 175.17 173.40 2gdj n SER 212 N 4.31 1.54 -0.03 -0.34 3.41 -1.26 0.79 113.62 122.04 2gdj n SER 212 Ca 0.00 -1.95 -0.19 0.00 -0.26 0.00 0.00 58.87 56.47 2gdj n SER 212 Cb 0.42 -0.15 -0.14 0.00 -0.26 0.00 0.00 64.21 64.09 2gdj n SER 212 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 2gdj n LEU 213 N 0.00 2.41 -0.58 1.04 7.94 -0.65 -4.62 117.00 122.53 2gdj n LEU 213 Ca 0.05 0.16 0.06 0.00 -1.11 0.00 0.00 56.01 55.17 2gdj n LEU 213 Cb 0.34 -0.87 0.10 0.00 0.53 0.00 0.00 43.42 43.52 2gdj n LEU 213 CO 0.21 0.81 0.53 0.35 -1.11 0.00 0.00 177.39 178.18 2gdj n THR 214 N -3.36 0.45 -0.01 1.96 -2.24 -1.26 -4.68 114.28 105.13 2gdj n THR 214 Ca -0.33 -0.72 -0.12 0.00 -2.27 0.00 0.00 64.05 60.60 2gdj n THR 214 Cb 1.04 0.92 -0.08 0.00 -2.10 0.00 0.00 70.33 70.11 2gdj n THR 214 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2gdj h SER 215 N 2.31 0.07 -0.02 3.42 0.02 -1.92 -2.29 113.55 115.14 2gdj h SER 215 Ca 0.00 -0.30 -0.00 0.00 -0.84 0.00 0.00 61.79 60.65 2gdj h SER 215 Cb 0.62 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.14 2gdj h SER 215 CO 0.00 0.35 0.01 0.71 -1.14 0.00 0.00 176.83 176.76 2gdj h THR 216 N -0.21 1.12 -1.01 -2.27 1.35 -1.90 -2.54 112.91 107.45 2gdj h THR 216 Ca 0.01 -0.35 0.09 0.00 -0.55 0.00 0.00 66.41 65.62 2gdj h THR 216 Cb 0.31 1.31 -0.08 0.00 -1.73 0.00 0.00 68.15 67.97 2gdj h THR 216 CO 0.00 0.09 0.64 -0.26 -0.25 0.00 0.00 175.52 175.75 2gdj h PHE 217 N -0.11 1.18 0.25 4.73 -1.00 -1.84 -2.68 116.94 117.47 2gdj h PHE 217 Ca 0.01 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.81 2gdj h PHE 217 Cb 0.14 -0.38 0.00 0.00 3.61 0.00 0.00 35.95 39.32 2gdj h PHE 217 CO -0.03 0.55 -0.12 0.00 -1.61 0.00 0.00 178.31 177.10 2gdj h ARG 218 N 1.10 -0.32 0.00 1.51 3.08 -1.28 -2.81 114.38 115.66 2gdj h ARG 218 Ca 0.46 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.54 2gdj h ARG 218 Cb 0.32 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.44 2gdj h ARG 218 CO -0.22 -0.22 0.06 0.09 -1.07 0.00 0.00 179.97 178.62 2gdj n ASN 219 N -3.04 0.00 -0.03 7.04 3.02 -0.97 -1.50 115.26 119.78 2gdj n ASN 219 Ca -0.04 0.13 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 2gdj n ASN 219 Cb 0.13 -0.13 -0.08 0.00 -0.61 0.00 0.00 39.78 39.08 2gdj n ASN 219 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2gdj n GLU 220 N -1.04 1.29 -4.54 3.52 1.02 -1.02 -5.09 120.64 114.77 2gdj n GLU 220 Ca 0.00 -0.06 -0.30 0.00 -0.02 0.00 0.00 57.16 56.78 2gdj n GLU 220 Cb 0.06 -1.27 -0.07 0.00 -0.02 0.00 0.00 31.44 30.15 2gdj n GLU 220 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2gdj n TYR 221 N -2.13 0.99 0.00 -0.32 4.01 -0.56 -5.11 117.16 114.05 2gdj n TYR 221 Ca -0.09 -2.43 0.00 0.00 -0.16 0.00 0.00 57.90 55.21 2gdj n TYR 221 Cb 0.55 -0.28 0.00 0.00 -0.31 0.00 0.00 39.34 39.31 2gdj n TYR 221 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2gdj n GLY 225 N -0.83 0.23 0.97 2.72 0.00 -1.26 -4.85 105.19 102.18 2gdj n GLY 225 Ca -0.18 0.55 -0.01 0.00 0.00 0.00 0.00 46.02 46.38 2gdj n GLY 225 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2gdj n LYS 226 N 0.00 1.67 0.00 1.61 2.85 -1.26 -4.38 118.16 118.65 2gdj n LYS 226 Ca 0.00 -0.70 0.00 0.00 -1.05 0.00 0.00 58.31 56.56 2gdj n LYS 226 Cb 0.00 -1.53 0.00 0.00 -0.65 0.00 0.00 35.03 32.85 2gdj n LYS 226 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 177.40 178.82 2gdj n LEU 227 N 0.14 0.01 -0.06 -5.58 -0.00 -1.26 -1.91 117.00 108.35 2gdj n LEU 227 Ca 0.09 -0.01 -0.18 0.00 -0.00 0.00 0.00 56.01 55.92 2gdj n LEU 227 Cb 0.57 -0.01 -0.13 0.00 -0.00 0.00 0.00 43.42 43.85 2gdj n LEU 227 CO 0.10 0.00 -1.01 0.00 -0.00 0.00 0.00 177.39 176.48 2gdj n ALA 228 N -0.47 1.22 -0.32 1.47 0.00 -1.26 -3.57 120.51 117.58 2gdj n ALA 228 Ca 0.00 -0.87 -0.02 0.00 0.00 0.00 0.00 53.44 52.54 2gdj n ALA 228 Cb 0.00 -0.44 0.10 0.00 0.00 0.00 0.00 19.45 19.11 2gdj n ALA 228 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2gdj h GLU 229 N 0.03 1.08 0.72 0.00 4.81 -1.75 0.19 114.58 119.66 2gdj h GLU 229 Ca -0.48 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 58.66 2gdj h GLU 229 Cb 2.01 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 31.13 2gdj h GLU 229 CO 0.02 0.72 -0.49 -0.09 -0.73 0.00 0.00 179.01 178.44 2gdj h ARG 230 N 1.11 -1.10 -0.57 1.92 2.43 -1.71 0.11 114.38 116.57 2gdj h ARG 230 Ca 0.33 0.07 0.04 0.00 -0.81 0.00 0.00 59.98 59.62 2gdj h ARG 230 Cb -0.05 0.25 -0.05 0.00 -0.42 0.00 0.00 29.97 29.70 2gdj h ARG 230 CO -0.10 -0.73 0.31 1.96 -1.51 0.00 0.00 179.97 179.91 2gdj h GLN 231 N -1.14 0.58 -0.67 0.20 1.08 -1.56 0.67 115.11 114.27 2gdj h GLN 231 Ca -0.10 -0.04 0.06 0.00 -1.45 0.00 0.00 58.65 57.13 2gdj h GLN 231 Cb 0.93 -0.13 -0.04 0.00 -0.05 0.00 0.00 27.48 28.19 2gdj h GLN 231 CO 0.07 0.39 0.44 0.37 -0.95 0.00 0.00 178.83 179.15 2gdj h GLN 232 N 0.60 0.68 0.04 1.46 -0.00 -0.43 0.98 115.11 118.44 2gdj h GLN 232 Ca 0.25 -0.04 -0.09 0.00 -0.00 0.00 0.00 58.65 58.77 2gdj h GLN 232 Cb 0.12 -0.15 -0.00 0.00 0.00 0.00 0.00 27.48 27.44 2gdj h GLN 232 CO -0.15 0.45 -0.43 -0.22 0.00 0.00 0.00 178.83 178.48 2gdj h LYS 233 N 0.70 0.08 -0.20 1.69 3.64 0.49 -3.12 116.57 119.85 2gdj h LYS 233 Ca 0.29 -0.13 0.04 0.00 -1.27 0.00 0.00 60.65 59.57 2gdj h LYS 233 Cb 0.23 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 2gdj h LYS 233 CO -0.09 1.06 0.14 1.25 -2.27 0.00 0.00 179.45 179.54 2gdj h LEU 234 N -0.82 0.08 -0.53 5.20 5.85 0.51 0.43 115.31 126.03 2gdj h LEU 234 Ca -0.10 -0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.48 2gdj h LEU 234 Cb 1.23 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 2gdj h LEU 234 CO 0.01 0.06 -0.39 1.23 -0.34 0.00 0.00 178.44 179.01 2gdj h GLY 235 N 0.10 0.84 1.89 3.75 0.00 -0.90 -2.35 103.07 106.39 2gdj h GLY 235 Ca 0.09 -0.84 -0.05 0.00 0.00 0.00 0.00 47.33 46.53 2gdj h GLY 235 CO -0.01 0.76 -0.17 -0.09 0.00 0.00 0.00 176.54 177.03 2gdj h ARG 236 N 0.63 0.14 -0.17 4.80 2.43 -0.87 -0.86 114.38 120.48 2gdj h ARG 236 Ca 0.05 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.12 2gdj h ARG 236 Cb 0.94 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.46 2gdj h ARG 236 CO 0.09 0.31 -0.16 1.25 -1.51 0.00 0.00 179.97 179.94 2gdj h HIS 237 N 0.13 0.48 -0.29 2.20 2.76 -1.09 -2.90 115.15 116.45 2gdj h HIS 237 Ca 0.03 -0.15 0.00 0.00 -2.20 0.00 0.00 60.37 58.05 2gdj h HIS 237 Cb 0.38 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.22 2gdj h HIS 237 CO 0.00 0.78 0.19 0.52 -1.30 0.00 0.00 177.93 178.12 2gdj h MET 238 N 0.05 0.38 -0.63 5.26 2.86 -1.06 -0.44 114.93 121.33 2gdj h MET 238 Ca 0.03 -0.02 0.13 0.00 -2.06 0.00 0.00 59.70 57.78 2gdj h MET 238 Cb 0.70 -0.08 -0.11 0.00 0.06 0.00 0.00 31.60 32.17 2gdj h MET 238 CO 0.04 0.25 0.00 0.00 1.06 0.00 0.00 176.91 178.26 2gdj h ALA 239 N 1.11 0.63 -0.16 6.32 0.00 -1.14 0.66 119.26 126.68 2gdj h ALA 239 Ca 0.11 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 2gdj h ALA 239 Cb -0.04 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2gdj h ALA 239 CO -0.03 -0.39 0.06 1.15 0.00 0.00 0.00 179.25 180.04 2gdj h THR 240 N 0.12 1.17 0.34 0.00 2.02 -1.22 -1.52 112.91 113.82 2gdj h THR 240 Ca 0.33 -0.53 -0.00 0.00 0.77 0.00 0.00 66.41 66.98 2gdj h THR 240 Cb 0.54 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 2gdj h THR 240 CO -0.54 0.16 -0.30 -0.07 0.37 0.00 0.00 175.52 175.14 2gdj h LEU 241 N 0.09 -0.78 -0.68 2.58 3.38 0.72 0.89 115.31 121.49 2gdj h LEU 241 Ca 0.05 0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.13 2gdj h LEU 241 Cb 0.21 0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.17 2gdj h LEU 241 CO -0.00 -0.43 0.41 0.78 0.09 0.00 0.00 178.44 179.29 2gdj h ASN 242 N -0.65 0.66 -0.44 -0.43 4.21 0.22 -1.42 115.58 117.73 2gdj h ASN 242 Ca -0.02 0.01 -0.01 0.00 1.21 0.00 0.00 56.30 57.49 2gdj h ASN 242 Cb 0.58 -0.13 -0.02 0.00 -1.12 0.00 0.00 38.32 37.63 2gdj h ASN 242 CO -0.03 0.45 0.25 0.50 -1.29 0.00 0.00 177.43 177.31 2gdj h LYS 243 N 0.80 0.61 -0.38 0.81 3.64 -1.09 -2.60 116.57 118.36 2gdj h LYS 243 Ca 0.29 -0.07 0.08 0.00 -1.27 0.00 0.00 60.65 59.68 2gdj h LYS 243 Cb 0.07 -0.12 -0.09 0.00 -0.41 0.00 0.00 32.23 31.68 2gdj h LYS 243 CO -0.13 0.48 -0.28 -0.07 -2.27 0.00 0.00 179.45 177.18 2gdj h LEU 244 N 0.58 -0.92 -1.23 5.20 4.07 -0.04 -1.02 115.31 121.96 2gdj h LEU 244 Ca 0.16 0.17 0.13 0.00 0.08 0.00 0.00 57.88 58.42 2gdj h LEU 244 Cb 0.03 0.45 -0.07 0.00 1.08 0.00 0.00 40.66 42.15 2gdj h LEU 244 CO -0.03 -0.29 0.58 0.00 -1.08 0.00 0.00 178.44 177.62 2gdj h ALA 245 N 0.88 1.75 0.09 1.53 0.00 -0.93 -1.95 119.26 120.63 2gdj h ALA 245 Ca 0.18 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 2gdj h ALA 245 Cb 0.50 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2gdj h ALA 245 CO -0.50 0.01 -0.04 -0.44 0.00 0.00 0.00 179.25 178.28 2gdj h ASP 246 N 0.77 -0.10 0.32 0.00 3.32 -0.88 -1.87 116.42 117.98 2gdj h ASP 246 Ca 0.45 -0.30 -0.04 0.00 0.02 0.00 0.00 57.03 57.16 2gdj h ASP 246 Cb 0.64 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 2gdj h ASP 246 CO -0.21 0.51 -0.18 -0.07 -1.72 0.00 0.00 179.24 177.57 2gdj h LEU 247 N -0.98 0.00 -2.91 1.55 3.38 -1.21 -2.83 115.31 112.30 2gdj h LEU 247 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2gdj h LEU 247 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2gdj h LEU 247 CO 0.02 0.18 0.00 0.49 0.09 0.00 0.00 178.44 179.22 2gdj n PHE 248 N -3.92 0.55 -3.99 1.13 0.99 -0.74 -5.00 117.46 106.48 2gdj n PHE 248 Ca -0.02 -0.53 -0.31 0.00 -0.00 0.00 0.00 57.45 56.59 2gdj n PHE 248 Cb 0.27 -0.05 -0.02 0.00 -1.00 0.00 0.00 39.48 38.68 2gdj n PHE 248 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 2gdj n ASN 249 N 0.50 -1.62 -4.37 4.37 5.15 -0.86 -4.88 115.26 113.56 2gdj n ASN 249 Ca 0.13 -1.11 -0.19 0.00 -0.60 0.00 0.00 54.58 52.82 2gdj n ASN 249 Cb 0.48 -2.62 -0.10 0.00 -0.53 0.00 0.00 39.78 37.01 2gdj n ASN 249 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2gdj s VAL 251 N -3.07 4.90 -0.15 0.00 1.01 -0.68 -0.91 120.40 121.49 2gdj s VAL 251 Ca 0.26 1.88 -0.01 0.00 0.00 0.00 0.00 61.98 64.11 2gdj s VAL 251 Cb 0.02 -4.24 -0.01 0.00 0.00 0.00 0.00 36.38 32.15 2gdj s VAL 251 CO 0.09 0.15 -0.11 -0.69 0.00 0.00 0.00 175.10 174.53 2gdj s VAL 252 N 1.21 3.08 -0.02 2.92 1.01 -1.01 -0.58 120.40 127.02 2gdj s VAL 252 Ca 0.47 -0.63 0.06 0.00 0.00 0.00 0.00 61.98 61.88 2gdj s VAL 252 Cb -0.19 -2.32 -0.01 0.00 0.00 0.00 0.00 36.38 33.85 2gdj s VAL 252 CO 0.23 0.50 -0.21 -0.76 0.00 0.00 0.00 175.10 174.86 2gdj s LEU 253 N 0.66 2.03 -0.01 3.92 1.43 -0.06 -1.02 118.68 125.64 2gdj s LEU 253 Ca -0.06 -0.40 -0.03 0.00 -1.03 0.00 0.00 54.13 52.62 2gdj s LEU 253 Cb -0.15 -1.12 -0.00 0.00 0.03 0.00 0.00 46.19 44.95 2gdj s LEU 253 CO 0.02 0.25 0.06 0.68 0.23 0.00 0.00 176.35 177.59 2gdj s VAL 254 N -0.43 0.05 0.35 -1.59 -7.23 -0.84 -0.88 120.40 109.82 2gdj s VAL 254 Ca 0.06 -0.37 0.08 0.00 -1.81 0.00 0.00 61.98 59.94 2gdj s VAL 254 Cb -0.09 -0.21 -0.04 0.00 0.56 0.00 0.00 36.38 36.61 2gdj s VAL 254 CO -0.00 -0.21 0.22 0.42 -0.31 0.00 0.00 175.10 175.22 2gdj s THR 255 N -0.63 3.14 -0.27 5.32 -4.23 -1.03 -1.07 115.64 116.86 2gdj s THR 255 Ca -0.07 -1.55 -0.13 0.00 -1.18 0.00 0.00 61.69 58.76 2gdj s THR 255 Cb -0.04 -3.05 0.10 0.00 1.34 0.00 0.00 72.50 70.84 2gdj s THR 255 CO 0.00 -0.15 0.63 0.21 -0.54 0.00 0.00 174.62 174.77 2gdj s ASN 256 N -3.93 -0.93 0.03 3.99 2.47 -1.21 -1.64 114.94 113.72 2gdj s ASN 256 Ca 0.40 1.45 -0.26 0.00 0.42 0.00 0.00 52.86 54.87 2gdj s ASN 256 Cb -0.03 1.65 -0.05 0.00 -1.45 0.00 0.00 41.25 41.36 2gdj s ASN 256 CO 0.24 -0.23 0.79 -1.10 -3.72 0.00 0.00 177.10 173.09 2gdj s GLN 257 N 2.11 4.51 0.00 0.43 -0.21 -1.26 -1.30 119.66 123.94 2gdj s GLN 257 Ca -0.08 1.10 0.00 0.00 0.02 0.00 0.00 55.36 56.40 2gdj s GLN 257 Cb -0.08 -3.38 0.00 0.00 1.00 0.00 0.00 33.01 30.54 2gdj s GLN 257 CO -0.19 0.22 0.00 1.33 -2.12 0.00 0.00 175.29 174.53 2gdj n VAL 258 N 3.03 0.00 -3.36 1.09 0.24 -0.78 -4.90 118.33 113.65 2gdj n VAL 258 Ca -0.01 0.00 -0.40 0.00 -2.04 0.00 0.00 64.34 61.89 2gdj n VAL 258 Cb 0.50 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.79 2gdj n VAL 258 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2gdj s GLY 279 N 0.00 1.87 0.00 7.63 0.00 -1.26 -3.33 107.32 112.23 2gdj s GLY 279 Ca 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 44.72 43.87 2gdj s GLY 279 CO 0.00 1.05 0.00 -2.39 0.00 0.00 0.00 173.10 171.76 2gdj n HIS 280 N 5.41 0.00 -0.42 1.90 -0.00 -1.26 -4.92 115.22 115.93 2gdj n HIS 280 Ca -0.08 0.00 -0.30 0.00 -0.00 0.00 0.00 57.72 57.34 2gdj n HIS 280 Cb 0.50 0.00 0.28 0.00 -0.00 0.00 0.00 29.99 30.77 2gdj n HIS 280 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2gdj s ALA 281 N -2.00 -0.68 0.00 1.59 0.00 -1.26 -5.03 121.76 114.37 2gdj s ALA 281 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.25 2gdj s ALA 281 Cb 0.00 -2.99 0.00 0.00 0.00 0.00 0.00 23.12 20.13 2gdj s ALA 281 CO 0.00 -4.47 0.00 0.00 0.00 0.00 0.00 175.76 171.29 2gdj n ALA 282 N -5.51 0.00 -0.22 0.00 0.00 -1.26 -5.06 120.51 108.46 2gdj n ALA 282 Ca 0.11 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.49 2gdj n ALA 282 Cb 0.59 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.14 2gdj n ALA 282 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gdj h THR 283 N 0.00 1.25 -4.14 0.00 1.03 -1.88 -3.43 112.91 105.74 2gdj h THR 283 Ca 0.00 -0.92 -0.69 0.00 -0.01 0.00 0.00 66.41 64.79 2gdj h THR 283 Cb 0.00 0.56 -0.24 0.00 -1.07 0.00 0.00 68.15 67.40 2gdj h THR 283 CO 0.00 0.35 -0.82 -0.36 -0.01 0.00 0.00 175.52 174.68 2gdj s PHE 284 N -5.29 2.53 -0.06 0.00 0.40 -0.73 -3.78 117.98 111.05 2gdj s PHE 284 Ca -0.11 -0.28 -0.02 0.00 -0.60 0.00 0.00 56.93 55.91 2gdj s PHE 284 Cb 0.15 -1.50 0.04 0.00 0.51 0.00 0.00 43.02 42.21 2gdj s PHE 284 CO 0.83 0.17 0.10 1.03 0.70 0.00 0.00 175.22 178.05 2gdj s ARG 285 N -1.08 -0.03 0.32 0.44 0.52 -0.46 -0.64 118.95 118.01 2gdj s ARG 285 Ca 0.13 0.44 0.09 0.00 -0.52 0.00 0.00 55.73 55.86 2gdj s ARG 285 Cb -0.10 -0.40 -0.05 0.00 0.52 0.00 0.00 34.95 34.92 2gdj s ARG 285 CO 0.02 -0.31 0.04 -0.06 0.02 0.00 0.00 175.30 175.02 2gdj s PHE 286 N 2.12 2.63 -0.12 -0.53 0.40 0.95 -1.56 117.98 121.87 2gdj s PHE 286 Ca 0.03 -0.35 -0.03 0.00 -0.60 0.00 0.00 56.93 55.98 2gdj s PHE 286 Cb -0.12 -1.43 0.05 0.00 0.51 0.00 0.00 43.02 42.02 2gdj s PHE 286 CO -0.04 0.48 0.05 0.12 0.70 0.00 0.00 175.22 176.54 2gdj s PHE 287 N -2.43 0.45 0.23 0.36 5.36 -0.01 -1.73 117.98 120.20 2gdj s PHE 287 Ca 0.35 -0.26 0.05 0.00 -0.96 0.00 0.00 56.93 56.11 2gdj s PHE 287 Cb -0.03 -0.74 -0.03 0.00 -0.34 0.00 0.00 43.02 41.88 2gdj s PHE 287 CO 0.20 -0.41 0.29 0.08 -1.46 0.00 0.00 175.22 173.91 2gdj s VAL 288 N 2.05 4.98 0.31 3.12 1.01 -0.45 -0.64 120.40 130.78 2gdj s VAL 288 Ca 0.03 -1.08 -0.18 0.00 0.00 0.00 0.00 61.98 60.75 2gdj s VAL 288 Cb -0.14 -3.67 0.03 0.00 0.00 0.00 0.00 36.38 32.59 2gdj s VAL 288 CO -0.06 -0.29 0.70 0.00 0.00 0.00 0.00 175.10 175.45 2gdj s ARG 289 N -3.78 1.90 0.53 2.72 1.70 -0.63 -3.07 118.95 118.31 2gdj s ARG 289 Ca 0.33 -1.19 -0.04 0.00 -0.47 0.00 0.00 55.73 54.37 2gdj s ARG 289 Cb -0.09 0.59 -0.00 0.00 -0.57 0.00 0.00 34.95 34.88 2gdj s ARG 289 CO 0.27 -0.86 0.80 0.15 -1.08 0.00 0.00 175.30 174.58 2gdj s LYS 290 N -3.42 3.05 0.00 3.89 1.02 -1.26 -0.47 119.74 122.55 2gdj s LYS 290 Ca 0.14 -0.15 0.00 0.00 0.02 0.00 0.00 55.97 55.98 2gdj s LYS 290 Cb -0.05 -2.39 0.00 0.00 -0.52 0.00 0.00 37.83 34.87 2gdj s LYS 290 CO 0.09 -0.48 0.00 0.41 -0.92 0.00 0.00 175.35 174.45 2gdj n GLY 291 N -2.36 5.33 3.48 -3.33 0.00 -0.83 -4.63 105.19 102.86 2gdj n GLY 291 Ca 0.03 -0.87 -0.42 0.00 0.00 0.00 0.00 46.02 44.75 2gdj n GLY 291 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2gdj s LYS 292 N 4.69 3.20 7.33 1.61 2.47 -1.26 -4.79 119.74 132.99 2gdj s LYS 292 Ca 0.00 -0.78 0.00 0.00 -1.56 0.00 0.00 55.97 53.63 2gdj s LYS 292 Cb 0.00 -4.34 0.00 0.00 -1.46 0.00 0.00 37.83 32.03 2gdj s LYS 292 CO 0.00 -1.92 0.00 0.41 0.16 0.00 0.00 175.35 174.00 2gdj n GLY 293 N 5.44 3.78 0.56 5.54 0.00 -1.26 -2.31 105.19 116.95 2gdj n GLY 293 Ca 0.02 0.21 0.40 0.00 0.00 0.00 0.00 46.02 46.65 2gdj n GLY 293 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2gdj h ASP 294 N 0.00 0.08 -3.37 1.61 3.32 -1.90 -3.43 116.42 112.73 2gdj h ASP 294 Ca 0.00 0.03 -0.57 0.00 0.02 0.00 0.00 57.03 56.51 2gdj h ASP 294 Cb 0.00 0.02 0.12 0.00 0.22 0.00 0.00 39.33 39.69 2gdj h ASP 294 CO 0.00 -0.02 0.44 0.29 -1.72 0.00 0.00 179.24 178.23 2gdj n LYS 295 N -4.24 1.89 -3.89 3.56 4.76 -0.98 -1.09 118.16 118.18 2gdj n LYS 295 Ca 0.33 0.67 -0.11 0.00 -2.87 0.00 0.00 58.31 56.33 2gdj n LYS 295 Cb 1.46 -2.30 -0.11 0.00 -1.84 0.00 0.00 35.03 32.24 2gdj n LYS 295 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2gdj s ARG 296 N -2.06 0.33 -0.30 1.97 1.81 0.15 -1.97 118.95 118.88 2gdj s ARG 296 Ca 0.59 -0.28 0.03 0.00 -1.72 0.00 0.00 55.73 54.36 2gdj s ARG 296 Cb -0.54 0.13 0.08 0.00 -0.45 0.00 0.00 34.95 34.18 2gdj s ARG 296 CO 0.59 -0.07 -0.03 0.08 -0.68 0.00 0.00 175.30 175.20 2gdj s VAL 297 N -0.95 2.22 -0.43 3.52 1.01 0.38 -2.39 120.40 123.76 2gdj s VAL 297 Ca -0.10 -2.00 -0.17 0.00 0.00 0.00 0.00 61.98 59.71 2gdj s VAL 297 Cb -0.06 -2.48 0.03 0.00 0.00 0.00 0.00 36.38 33.86 2gdj s VAL 297 CO 0.00 -0.32 0.42 0.00 0.00 0.00 0.00 175.10 175.21 2gdj s ALA 298 N 1.00 3.44 -0.32 5.51 0.00 -0.33 -1.61 121.76 129.45 2gdj s ALA 298 Ca 0.01 -1.62 -0.14 0.00 0.00 0.00 0.00 51.96 50.21 2gdj s ALA 298 Cb -0.19 -3.04 -0.02 0.00 0.00 0.00 0.00 23.12 19.86 2gdj s ALA 298 CO -0.07 -1.61 0.29 0.21 0.00 0.00 0.00 175.76 174.59 2gdj s LYS 299 N 2.04 3.65 -0.52 0.00 2.47 0.19 -1.32 119.74 126.26 2gdj s LYS 299 Ca 0.10 -0.43 -0.24 0.00 -1.56 0.00 0.00 55.97 53.85 2gdj s LYS 299 Cb -0.18 -3.77 0.04 0.00 -1.46 0.00 0.00 37.83 32.46 2gdj s LYS 299 CO 0.12 -0.41 0.88 -1.17 0.16 0.00 0.00 175.35 174.93 2gdj s LEU 300 N 1.88 4.21 0.00 5.43 1.98 -0.16 -0.83 118.68 131.19 2gdj s LEU 300 Ca 0.09 -0.32 0.12 0.00 -2.89 0.00 0.00 54.13 51.13 2gdj s LEU 300 Cb -0.17 -2.85 0.17 0.00 0.66 0.00 0.00 46.19 44.00 2gdj s LEU 300 CO 0.11 -1.12 1.01 0.00 -1.89 0.00 0.00 176.35 174.46 2gdj n TYR 301 N 7.17 0.17 -3.64 5.38 4.11 -0.60 -2.42 117.16 127.33 2gdj n TYR 301 Ca 0.01 -0.17 -0.03 0.00 -0.00 0.00 0.00 57.90 57.71 2gdj n TYR 301 Cb 0.47 -0.01 -0.05 0.00 -0.00 0.00 0.00 39.34 39.75 2gdj n TYR 301 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 2gdj s ASP 302 N -0.98 -1.05 -0.13 9.48 2.15 -1.21 -4.95 116.67 119.99 2gdj s ASP 302 Ca 0.17 1.52 -0.30 0.00 0.43 0.00 0.00 52.55 54.37 2gdj s ASP 302 Cb 0.11 1.94 0.11 0.00 -0.30 0.00 0.00 42.92 44.77 2gdj s ASP 302 CO 0.15 -0.22 0.89 -0.94 -0.17 0.00 0.00 175.17 174.88 2gdj s SER 303 N 2.40 -0.48 0.17 -0.34 1.04 -1.25 -1.36 113.70 113.89 2gdj s SER 303 Ca -0.07 0.55 0.23 0.00 0.48 0.00 0.00 55.95 57.13 2gdj s SER 303 Cb -0.09 0.43 0.89 0.00 0.10 0.00 0.00 66.02 67.35 2gdj s SER 303 CO -0.19 -0.42 1.69 -0.81 0.98 0.00 0.00 173.24 174.49 2gdj n PRO 304 N 0.89 0.15 0.00 4.02 -0.04 -1.26 -4.21 135.00 134.55 2gdj n PRO 304 Ca -0.13 0.31 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 2gdj n PRO 304 Cb 0.57 -1.75 0.00 0.00 -0.04 0.00 0.00 33.50 32.28 2gdj n PRO 304 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 2gdj n HIS 305 N -2.03 0.00 -4.27 0.54 1.44 -1.26 -5.10 115.22 104.54 2gdj n HIS 305 Ca 0.03 0.00 -0.29 0.00 -2.01 0.00 0.00 57.72 55.45 2gdj n HIS 305 Cb 0.27 0.03 -0.11 0.00 0.12 0.00 0.00 29.99 30.30 2gdj n HIS 305 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2gdj s LEU 306 N 0.00 2.85 0.58 2.39 1.43 -1.26 -5.13 118.68 119.53 2gdj s LEU 306 Ca 0.00 -0.49 -0.10 0.00 -1.03 0.00 0.00 54.13 52.50 2gdj s LEU 306 Cb 0.00 -1.66 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 2gdj s LEU 306 CO 0.00 0.17 0.97 -2.16 0.23 0.00 0.00 176.35 175.57 2gdj s PRO 307 N -2.20 3.63 0.14 1.29 0.04 -1.26 -4.58 135.00 132.06 2gdj s PRO 307 Ca 0.20 0.66 -0.31 0.00 0.04 0.00 0.00 61.00 61.58 2gdj s PRO 307 Cb -0.11 -2.15 -0.09 0.00 0.04 0.00 0.00 34.50 32.19 2gdj s PRO 307 CO 0.12 -0.45 1.54 -0.51 0.04 0.00 0.00 177.00 177.74 2gdj s ASP 308 N -4.02 6.64 0.23 6.66 1.01 -1.26 -4.95 116.67 120.98 2gdj s ASP 308 Ca 0.54 2.53 -0.13 0.00 0.71 0.00 0.00 52.55 56.21 2gdj s ASP 308 Cb -0.11 -2.59 -0.00 0.00 1.01 0.00 0.00 42.92 41.23 2gdj s ASP 308 CO 0.49 -0.80 0.46 0.00 0.21 0.00 0.00 175.17 175.53 2gdj s ALA 309 N 1.37 -0.27 -0.06 5.23 0.00 -1.02 -5.01 121.76 122.00 2gdj s ALA 309 Ca 0.69 -0.82 0.05 0.00 0.00 0.00 0.00 51.96 51.88 2gdj s ALA 309 Cb -0.42 1.03 -0.00 0.00 0.00 0.00 0.00 23.12 23.73 2gdj s ALA 309 CO 0.31 -0.82 -0.22 -1.21 0.00 0.00 0.00 175.76 173.82 2gdj s GLU 310 N -4.00 2.42 -0.00 0.00 2.02 -1.26 -0.99 118.70 116.89 2gdj s GLU 310 Ca 0.21 -0.79 0.05 0.00 0.02 0.00 0.00 54.97 54.46 2gdj s GLU 310 Cb -0.00 -1.99 -0.03 0.00 0.10 0.00 0.00 34.13 32.21 2gdj s GLU 310 CO 0.07 0.27 -0.16 0.00 0.02 0.00 0.00 175.26 175.47 2gdj s ALA 311 N 0.07 2.65 -0.05 5.21 0.00 -0.43 -4.99 121.76 124.21 2gdj s ALA 311 Ca -0.08 -1.09 0.06 0.00 0.00 0.00 0.00 51.96 50.85 2gdj s ALA 311 Cb -0.14 -0.86 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 2gdj s ALA 311 CO 0.05 0.57 -0.25 0.42 0.00 0.00 0.00 175.76 176.55 2gdj s ILE 312 N -0.85 2.01 0.31 0.00 1.01 -1.26 -1.19 121.20 121.23 2gdj s ILE 312 Ca 0.14 -1.05 -0.13 0.00 0.00 0.00 0.00 60.65 59.61 2gdj s ILE 312 Cb -0.11 -1.70 0.02 0.00 0.01 0.00 0.00 42.46 40.68 2gdj s ILE 312 CO 0.04 0.56 0.60 0.72 0.00 0.00 0.00 174.94 176.86 2gdj s PHE 313 N -0.22 0.35 0.21 3.97 -0.12 -1.01 -4.63 117.98 116.53 2gdj s PHE 313 Ca -0.02 -0.78 0.04 0.00 -0.05 0.00 0.00 56.93 56.12 2gdj s PHE 313 Cb -0.13 0.39 -0.05 0.00 -0.63 0.00 0.00 43.02 42.60 2gdj s PHE 313 CO 0.03 -1.22 -0.04 -0.98 -0.05 0.00 0.00 175.22 172.96 2gdj s ARG 314 N -3.36 1.26 -0.15 1.99 1.70 -1.05 0.34 118.95 119.69 2gdj s ARG 314 Ca 0.20 -1.61 -0.00 0.00 -0.47 0.00 0.00 55.73 53.85 2gdj s ARG 314 Cb -0.03 -0.65 -0.01 0.00 -0.57 0.00 0.00 34.95 33.70 2gdj s ARG 314 CO 0.12 -0.04 -0.13 0.42 -1.08 0.00 0.00 175.30 174.59 2gdj s ILE 315 N -3.37 2.92 0.13 4.99 1.01 -0.25 -1.68 121.20 124.96 2gdj s ILE 315 Ca 0.25 -0.69 0.02 0.00 0.00 0.00 0.00 60.65 60.23 2gdj s ILE 315 Cb 0.04 -2.24 -0.01 0.00 0.01 0.00 0.00 42.46 40.26 2gdj s ILE 315 CO 0.06 0.51 0.08 0.35 0.00 0.00 0.00 174.94 175.95 2gdj n THR 316 N 3.90 0.00 0.75 2.92 -2.24 -0.58 -4.71 114.28 114.31 2gdj n THR 316 Ca -0.19 -0.87 0.04 0.00 -2.27 0.00 0.00 64.05 60.77 2gdj n THR 316 Cb 0.52 0.39 0.27 0.00 -2.10 0.00 0.00 70.33 69.41 2gdj n THR 316 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2gdj n GLU 317 N -0.27 0.37 -0.01 -0.78 -0.00 -1.26 -0.88 120.64 117.82 2gdj n GLU 317 Ca 0.01 0.00 0.09 0.00 -0.00 0.00 0.00 57.16 57.26 2gdj n GLU 317 Cb 0.22 -1.38 -0.13 0.00 -0.00 0.00 0.00 31.44 30.15 2gdj n GLU 317 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2gdj n LYS 318 N -0.88 0.57 0.00 3.44 5.02 -1.26 -4.68 118.16 120.37 2gdj n LYS 318 Ca 0.07 -0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 2gdj n LYS 318 Cb 0.03 -1.41 0.00 0.00 -0.02 0.00 0.00 35.03 33.63 2gdj n LYS 318 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2gdj n GLY 319 N 1.50 0.21 3.76 0.72 0.00 -0.05 -4.45 105.19 106.88 2gdj n GLY 319 Ca -0.03 -1.95 -0.39 0.00 0.00 0.00 0.00 46.02 43.65 2gdj n GLY 319 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gdj s ILE 320 N 0.00 3.67 0.08 -0.61 1.09 -1.26 -1.53 121.20 122.64 2gdj s ILE 320 Ca 0.00 1.58 -0.19 0.00 -1.10 0.00 0.00 60.65 60.94 2gdj s ILE 320 Cb 0.00 -3.97 0.04 0.00 -1.06 0.00 0.00 42.46 37.48 2gdj s ILE 320 CO 0.00 0.30 0.45 0.00 -0.10 0.00 0.00 174.94 175.59 2gdj s GLN 321 N -1.64 1.02 0.00 2.79 -2.07 -0.67 -4.68 119.66 114.41 2gdj s GLN 321 Ca 0.47 -0.45 0.00 0.00 -1.82 0.00 0.00 55.36 53.56 2gdj s GLN 321 Cb -0.28 0.46 0.00 0.00 -1.09 0.00 0.00 33.01 32.09 2gdj s GLN 321 CO 0.36 -0.38 0.00 -0.25 -1.32 0.00 0.00 175.29 173.70