#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nx3 s PHE 4 N 0.00 3.57 -0.12 5.58 5.36 -1.26 -4.80 117.98 126.32 2nx3 s PHE 4 Ca 0.00 1.58 -0.10 0.00 -0.96 0.00 0.00 56.93 57.45 2nx3 s PHE 4 Cb 0.00 -3.30 -0.05 0.00 -0.34 0.00 0.00 43.02 39.34 2nx3 s PHE 4 CO 0.00 -0.68 0.20 -1.17 -1.46 0.00 0.00 175.22 172.11 2nx3 s LEU 5 N -0.36 4.35 -0.29 6.12 1.98 -0.71 0.79 118.68 130.57 2nx3 s LEU 5 Ca 0.50 0.52 -0.03 0.00 -2.89 0.00 0.00 54.13 52.23 2nx3 s LEU 5 Cb -0.30 -2.20 0.10 0.00 0.66 0.00 0.00 46.19 44.45 2nx3 s LEU 5 CO 0.35 0.31 0.11 -0.69 -1.89 0.00 0.00 176.35 174.55 2nx3 s VAL 6 N -0.60 0.30 -0.43 1.68 1.01 -0.66 -0.50 120.40 121.20 2nx3 s VAL 6 Ca 0.15 -0.97 -0.20 0.00 0.00 0.00 0.00 61.98 60.97 2nx3 s VAL 6 Cb -0.13 -1.22 0.02 0.00 0.00 0.00 0.00 36.38 35.05 2nx3 s VAL 6 CO 0.05 -0.68 0.60 -0.63 0.00 0.00 0.00 175.10 174.44 2nx3 s ILE 7 N 1.91 4.88 0.43 2.22 1.01 -0.20 -2.52 121.20 128.93 2nx3 s ILE 7 Ca 0.09 0.06 0.03 0.00 0.00 0.00 0.00 60.65 60.83 2nx3 s ILE 7 Cb -0.16 -4.17 -0.02 0.00 0.01 0.00 0.00 42.46 38.12 2nx3 s ILE 7 CO -0.31 -0.55 0.10 0.00 0.00 0.00 0.00 174.94 174.18 2nx3 s ALA 8 N 2.69 3.19 0.00 9.38 0.00 -0.85 -1.04 121.76 135.13 2nx3 s ALA 8 Ca 0.21 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 51.09 2nx3 s ALA 8 Cb -0.15 0.58 0.00 0.00 0.00 0.00 0.00 23.12 23.56 2nx3 s ALA 8 CO 0.18 -0.26 0.00 0.41 0.00 0.00 0.00 175.76 176.08 2nx3 n GLY 9 N -0.99 1.59 3.77 0.00 0.00 -1.25 0.10 105.19 108.41 2nx3 n GLY 9 Ca -0.09 -2.04 -0.38 0.00 0.00 0.00 0.00 46.02 43.51 2nx3 n GLY 9 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2nx3 s PRO 10 N -1.31 4.07 0.08 1.61 0.02 -1.16 -1.35 135.00 136.96 2nx3 s PRO 10 Ca 0.00 1.73 -0.28 0.00 0.02 0.00 0.00 61.00 62.47 2nx3 s PRO 10 Cb 0.00 -2.62 -0.16 0.00 0.02 0.00 0.00 34.50 31.74 2nx3 s PRO 10 CO 0.00 -0.28 1.67 -0.97 -0.33 0.00 0.00 177.00 177.10 2nx3 h ASN 11 N 2.56 -0.45 -4.26 2.53 -1.24 -1.83 -3.30 115.58 109.58 2nx3 h ASN 11 Ca -0.49 0.02 -0.69 0.00 0.71 0.00 0.00 56.30 55.86 2nx3 h ASN 11 Cb 1.23 0.13 -0.26 0.00 0.73 0.00 0.00 38.32 40.15 2nx3 h ASN 11 CO 0.62 -0.30 -0.86 0.00 -1.29 0.00 0.00 177.43 175.60 2nx3 s ALA 12 N -6.11 2.33 -1.18 1.57 0.00 -1.26 -0.21 121.76 116.89 2nx3 s ALA 12 Ca -0.15 -1.23 -0.22 0.00 0.00 0.00 0.00 51.96 50.36 2nx3 s ALA 12 Cb 0.05 -0.56 -0.06 0.00 0.00 0.00 0.00 23.12 22.55 2nx3 s ALA 12 CO 0.64 0.54 1.90 0.42 0.00 0.00 0.00 175.76 179.26 2nx3 s ILE 13 N -0.80 3.63 0.21 0.00 1.01 0.68 -4.68 121.20 121.24 2nx3 s ILE 13 Ca 0.12 -1.03 0.18 0.00 0.00 0.00 0.00 60.65 59.92 2nx3 s ILE 13 Cb -0.10 -4.63 0.13 0.00 0.01 0.00 0.00 42.46 37.87 2nx3 s ILE 13 CO 0.02 -1.15 1.76 -0.33 0.00 0.00 0.00 174.94 175.24 2nx3 h GLU 14 N 9.52 0.00 0.00 2.79 5.08 -1.96 -3.40 114.58 126.61 2nx3 h GLU 14 Ca 0.24 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 2nx3 h GLU 14 Cb 0.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.18 2nx3 h GLU 14 CO 1.26 0.37 0.00 -1.13 -1.00 0.00 0.00 179.01 178.51 2nx3 n SER 15 N -3.62 0.00 0.30 1.42 3.41 -1.26 -4.99 113.62 108.89 2nx3 n SER 15 Ca -0.01 0.00 0.19 0.00 -0.26 0.00 0.00 58.87 58.79 2nx3 n SER 15 Cb 0.49 0.00 1.02 0.00 -0.26 0.00 0.00 64.21 65.46 2nx3 n SER 15 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 2nx3 h GLU 16 N 0.00 0.00 -0.34 4.33 4.11 -1.94 0.19 114.58 120.93 2nx3 h GLU 16 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2nx3 h GLU 16 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2nx3 h GLU 16 CO 0.00 0.00 0.21 1.49 0.07 0.00 0.00 179.01 180.78 2nx3 h GLU 17 N 0.00 0.46 0.36 1.06 4.81 -1.98 0.10 114.58 119.38 2nx3 h GLU 17 Ca 0.02 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 2nx3 h GLU 17 Cb 0.20 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.48 2nx3 h GLU 17 CO -0.00 0.33 -0.17 1.25 -0.73 0.00 0.00 179.01 179.68 2nx3 h LEU 18 N 0.45 -0.41 -0.61 1.64 5.85 -1.04 -0.80 115.31 120.39 2nx3 h LEU 18 Ca 0.12 -0.08 0.13 0.00 0.84 0.00 0.00 57.88 58.89 2nx3 h LEU 18 Cb -0.02 0.11 -0.10 0.00 0.37 0.00 0.00 40.66 41.01 2nx3 h LEU 18 CO -0.02 -0.16 -0.00 -0.07 -0.34 0.00 0.00 178.44 177.84 2nx3 h LEU 19 N -0.65 -0.28 -0.57 2.25 3.38 -1.13 0.19 115.31 118.50 2nx3 h LEU 19 Ca -0.05 0.15 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 2nx3 h LEU 19 Cb 0.46 0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 2nx3 h LEU 19 CO 0.08 -0.11 0.07 -0.07 0.09 0.00 0.00 178.44 178.49 2nx3 h LEU 20 N 0.11 0.93 0.07 1.67 3.38 -0.72 1.01 115.31 121.76 2nx3 h LEU 20 Ca 0.32 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2nx3 h LEU 20 Cb 0.51 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2nx3 h LEU 20 CO -0.53 0.97 -0.06 0.50 0.09 0.00 0.00 178.44 179.41 2nx3 h LYS 21 N 0.86 -0.14 -0.26 1.13 3.64 0.10 0.16 116.57 122.06 2nx3 h LYS 21 Ca 0.17 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.50 2nx3 h LYS 21 Cb 0.45 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 2nx3 h LYS 21 CO 0.02 -0.09 -0.07 0.28 -2.27 0.00 0.00 179.45 177.32 2nx3 h VAL 22 N -0.14 1.28 -0.28 2.00 2.07 -0.93 -2.20 116.25 118.06 2nx3 h VAL 22 Ca 0.00 -1.08 0.08 0.00 0.82 0.00 0.00 66.70 66.52 2nx3 h VAL 22 Cb 0.14 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 2nx3 h VAL 22 CO -0.02 0.34 0.43 1.23 0.02 0.00 0.00 177.57 179.57 2nx3 h GLY 23 N 0.25 0.00 0.47 2.17 0.00 0.15 -0.20 103.07 105.91 2nx3 h GLY 23 Ca 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.38 2nx3 h GLY 23 CO 0.03 0.00 -0.16 -2.09 0.00 0.00 0.00 176.54 174.32 2nx3 h GLU 24 N 0.00 -0.43 -0.86 4.80 4.81 -0.04 -2.33 114.58 120.53 2nx3 h GLU 24 Ca 0.13 0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.45 2nx3 h GLU 24 Cb 0.99 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 30.41 2nx3 h GLU 24 CO -0.00 -0.13 0.54 1.49 -0.73 0.00 0.00 179.01 180.17 2nx3 h GLU 25 N -0.99 0.96 -0.26 1.92 4.57 -1.02 -1.51 114.58 118.26 2nx3 h GLU 25 Ca -0.05 -0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 58.08 2nx3 h GLU 25 Cb 0.50 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 2nx3 h GLU 25 CO 0.08 0.64 0.16 0.82 -1.18 0.00 0.00 179.01 179.52 2nx3 h ILE 26 N 0.99 1.09 -0.73 2.32 2.04 -1.27 -1.41 117.51 120.54 2nx3 h ILE 26 Ca 0.37 -0.21 0.11 0.00 1.00 0.00 0.00 64.86 66.13 2nx3 h ILE 26 Cb 0.14 0.77 -0.08 0.00 -0.74 0.00 0.00 36.82 36.91 2nx3 h ILE 26 CO -0.16 0.09 0.35 0.50 0.00 0.00 0.00 178.15 178.92 2nx3 h LYS 27 N 0.33 0.56 0.06 2.37 1.63 -0.81 0.38 116.57 121.09 2nx3 h LYS 27 Ca 0.09 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.86 2nx3 h LYS 27 Cb 0.01 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.51 2nx3 h LYS 27 CO -0.02 0.37 -0.06 -0.09 -3.45 0.00 0.00 179.45 176.20 2nx3 h ARG 28 N 0.57 -0.13 -0.08 1.90 2.43 -0.70 -2.02 114.38 116.35 2nx3 h ARG 28 Ca 0.37 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.49 2nx3 h ARG 28 Cb 0.44 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 2nx3 h ARG 28 CO -0.30 -0.08 -0.20 -0.07 -1.51 0.00 0.00 179.97 177.81 2nx3 h LEU 29 N -0.13 0.13 -1.94 3.80 3.38 -0.54 -1.84 115.31 118.16 2nx3 h LEU 29 Ca 0.00 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2nx3 h LEU 29 Cb 0.12 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 2nx3 h LEU 29 CO -0.01 0.34 -0.11 -1.28 0.09 0.00 0.00 178.44 177.47 2nx3 h SER 30 N 0.13 0.00 0.42 -0.43 0.87 0.43 0.34 113.55 115.31 2nx3 h SER 30 Ca 0.02 0.00 -0.30 0.00 -1.23 0.00 0.00 61.79 60.28 2nx3 h SER 30 Cb 0.43 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.34 2nx3 h SER 30 CO 0.03 0.11 -1.80 -0.62 -0.53 0.00 0.00 176.83 174.02 2nx3 n GLU 31 N -3.60 0.64 0.09 2.24 -0.58 -0.75 -4.09 120.64 114.59 2nx3 n GLU 31 Ca -0.02 0.26 -0.07 0.00 -0.42 0.00 0.00 57.16 56.91 2nx3 n GLU 31 Cb 0.23 -1.76 -0.03 0.00 -0.57 0.00 0.00 31.44 29.32 2nx3 n GLU 31 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 2nx3 h LYS 32 N 0.00 0.09 -2.36 3.49 3.64 -0.94 -3.35 116.57 117.14 2nx3 h LYS 32 Ca -0.32 -0.11 -0.65 0.00 -1.27 0.00 0.00 60.65 58.30 2nx3 h LYS 32 Cb 2.04 0.03 -0.38 0.00 -0.41 0.00 0.00 32.23 33.51 2nx3 h LYS 32 CO 0.07 0.92 -0.23 1.19 -2.27 0.00 0.00 179.45 179.14 2nx3 n PHE 33 N -3.56 3.37 0.09 1.91 3.72 0.07 -4.87 117.46 118.18 2nx3 n PHE 33 Ca -0.02 -3.73 0.05 0.00 -0.05 0.00 0.00 57.45 53.71 2nx3 n PHE 33 Cb 0.84 -0.73 0.29 0.00 -0.94 0.00 0.00 39.48 38.94 2nx3 n PHE 33 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2nx3 n LYS 34 N 0.77 0.07 0.09 -1.08 4.76 -1.26 -0.93 118.16 120.58 2nx3 n LYS 34 Ca 0.30 0.55 0.00 0.00 -2.87 0.00 0.00 58.31 56.29 2nx3 n LYS 34 Cb 0.38 -1.78 -0.03 0.00 -1.84 0.00 0.00 35.03 31.77 2nx3 n LYS 34 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 2nx3 h GLU 35 N 0.00 0.00 -6.44 1.97 4.57 -1.90 -3.46 114.58 109.32 2nx3 h GLU 35 Ca 0.00 0.00 -0.54 0.00 -1.18 0.00 0.00 59.36 57.64 2nx3 h GLU 35 Cb 0.09 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.65 2nx3 h GLU 35 CO 0.00 0.52 -0.07 0.08 -1.18 0.00 0.00 179.01 178.35 2nx3 s VAL 36 N -2.90 4.87 -0.44 0.32 1.01 -0.11 -3.99 120.40 119.15 2nx3 s VAL 36 Ca 0.01 0.67 -0.10 0.00 0.00 0.00 0.00 61.98 62.56 2nx3 s VAL 36 Cb 0.08 -3.66 0.09 0.00 0.00 0.00 0.00 36.38 32.89 2nx3 s VAL 36 CO 0.78 0.02 0.31 -0.70 0.00 0.00 0.00 175.10 175.51 2nx3 s GLU 37 N -2.54 2.64 0.42 2.72 2.12 0.24 -4.95 118.70 119.34 2nx3 s GLU 37 Ca 0.45 -1.54 -0.13 0.00 0.36 0.00 0.00 54.97 54.12 2nx3 s GLU 37 Cb -0.12 -3.88 -0.07 0.00 0.26 0.00 0.00 34.13 30.31 2nx3 s GLU 37 CO 0.20 -1.04 0.82 -0.06 -0.54 0.00 0.00 175.26 174.64 2nx3 s PHE 38 N 1.44 3.45 -0.15 5.30 0.08 -1.26 -1.65 117.98 125.19 2nx3 s PHE 38 Ca 0.04 1.18 -0.08 0.00 0.12 0.00 0.00 56.93 58.19 2nx3 s PHE 38 Cb -0.24 -2.55 0.06 0.00 -0.57 0.00 0.00 43.02 39.72 2nx3 s PHE 38 CO 0.02 -0.13 0.36 0.08 -0.10 0.00 0.00 175.22 175.45 2nx3 s VAL 39 N -2.36 -0.03 0.03 -0.44 1.01 -1.05 -4.37 120.40 113.19 2nx3 s VAL 39 Ca 0.54 0.11 -0.27 0.00 0.00 0.00 0.00 61.98 62.35 2nx3 s VAL 39 Cb -0.10 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.69 2nx3 s VAL 39 CO 0.29 0.04 0.87 0.12 0.00 0.00 0.00 175.10 176.42 2nx3 s PHE 40 N 1.36 3.70 0.03 5.22 5.36 0.29 -2.00 117.98 131.93 2nx3 s PHE 40 Ca -0.09 1.58 0.06 0.00 -0.96 0.00 0.00 56.93 57.52 2nx3 s PHE 40 Cb -0.09 -2.97 -0.02 0.00 -0.34 0.00 0.00 43.02 39.60 2nx3 s PHE 40 CO -0.12 0.14 -0.18 0.21 -1.46 0.00 0.00 175.22 173.81 2nx3 s LYS 41 N 0.44 1.29 -0.30 10.12 2.36 0.12 -0.57 119.74 133.20 2nx3 s LYS 41 Ca 0.45 -0.80 -0.25 0.00 -2.55 0.00 0.00 55.97 52.82 2nx3 s LYS 41 Cb -0.21 -1.33 0.20 0.00 -1.05 0.00 0.00 37.83 35.44 2nx3 s LYS 41 CO 0.25 0.35 1.48 0.45 1.55 0.00 0.00 175.35 179.43 2nx3 s SER 42 N -0.93 -0.02 -0.14 1.43 0.15 -1.17 -3.01 113.70 110.02 2nx3 s SER 42 Ca 0.06 0.03 -0.08 0.00 0.70 0.00 0.00 55.95 56.66 2nx3 s SER 42 Cb -0.08 0.04 -0.04 0.00 -1.71 0.00 0.00 66.02 64.23 2nx3 s SER 42 CO 0.01 -0.01 0.15 -0.44 1.20 0.00 0.00 173.24 174.15 2nx3 s SER 43 N 0.02 6.36 0.15 5.45 0.01 0.70 -4.50 113.70 121.89 2nx3 s SER 43 Ca 0.08 0.43 0.26 0.00 1.31 0.00 0.00 55.95 58.02 2nx3 s SER 43 Cb -0.05 -2.08 0.72 0.00 0.21 0.00 0.00 66.02 64.82 2nx3 s SER 43 CO -0.17 0.34 1.65 2.22 0.41 0.00 0.00 173.24 177.70 2nx3 n PHE 44 N 2.41 0.66 -3.65 2.43 1.16 -1.26 -0.23 117.46 118.99 2nx3 n PHE 44 Ca -0.19 0.19 -0.05 0.00 -1.87 0.00 0.00 57.45 55.54 2nx3 n PHE 44 Cb 0.54 -0.77 -0.06 0.00 -1.61 0.00 0.00 39.48 37.58 2nx3 n PHE 44 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 2nx3 s ASP 45 N -4.17 -1.01 -0.90 5.98 2.15 -1.23 -3.40 116.67 114.10 2nx3 s ASP 45 Ca 0.10 1.52 -0.21 0.00 0.43 0.00 0.00 52.55 54.39 2nx3 s ASP 45 Cb 0.14 1.75 0.10 0.00 -0.30 0.00 0.00 42.92 44.61 2nx3 s ASP 45 CO 0.63 -0.23 1.17 -0.54 -0.17 0.00 0.00 175.17 176.03 2nx3 s LYS 46 N 2.17 3.50 0.00 4.34 -0.14 0.55 -4.84 119.74 125.32 2nx3 s LYS 46 Ca -0.08 -1.42 0.23 0.00 -1.36 0.00 0.00 55.97 53.34 2nx3 s LYS 46 Cb -0.08 -4.87 1.10 0.00 -1.68 0.00 0.00 37.83 32.30 2nx3 s LYS 46 CO -0.19 -1.89 1.75 0.00 -0.76 0.00 0.00 175.35 174.27 2nx3 n ALA 47 N 7.34 2.14 -2.42 5.17 0.00 -1.26 -3.92 120.51 127.56 2nx3 n ALA 47 Ca 0.20 -0.10 -0.09 0.00 0.00 0.00 0.00 53.44 53.46 2nx3 n ALA 47 Cb 0.49 -1.38 0.05 0.00 0.00 0.00 0.00 19.45 18.61 2nx3 n ALA 47 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2nx3 n ASN 48 N -1.37 2.84 -4.70 0.00 0.23 -1.26 -5.09 115.26 105.91 2nx3 n ASN 48 Ca 0.09 -2.81 -0.31 0.00 -0.53 0.00 0.00 54.58 51.02 2nx3 n ASN 48 Cb 0.22 -0.41 0.15 0.00 -2.08 0.00 0.00 39.78 37.65 2nx3 n ASN 48 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 2nx3 s ARG 49 N -3.39 1.34 -0.06 -3.83 1.81 -1.25 -4.96 118.95 108.61 2nx3 s ARG 49 Ca 0.38 1.38 -0.24 0.00 -1.72 0.00 0.00 55.73 55.52 2nx3 s ARG 49 Cb 0.36 -1.78 -0.26 0.00 -0.45 0.00 0.00 34.95 32.83 2nx3 s ARG 49 CO -0.02 -2.35 0.96 0.77 -0.68 0.00 0.00 175.30 173.98 2nx3 h SER 50 N -1.66 0.29 -2.91 0.23 0.02 -1.98 -3.45 113.55 104.08 2nx3 h SER 50 Ca -0.44 -0.86 -0.63 0.00 -0.84 0.00 0.00 61.79 59.02 2nx3 h SER 50 Cb 1.26 -0.09 -0.07 0.00 0.14 0.00 0.00 62.40 63.64 2nx3 h SER 50 CO 0.45 1.11 -0.36 -0.55 -1.14 0.00 0.00 176.83 176.34 2nx3 s SER 51 N -6.52 6.53 0.38 3.07 0.15 -1.20 -4.96 113.70 111.14 2nx3 s SER 51 Ca -0.15 0.62 0.27 0.00 0.70 0.00 0.00 55.95 57.39 2nx3 s SER 51 Cb 0.01 -2.15 1.31 0.00 -1.71 0.00 0.00 66.02 63.47 2nx3 s SER 51 CO 0.77 0.32 1.82 -0.29 1.20 0.00 0.00 173.24 177.05 2nx3 h ILE 52 N 4.05 0.00 -0.33 6.45 6.09 -1.93 -2.21 117.51 129.63 2nx3 h ILE 52 Ca -0.51 -0.15 0.00 0.00 -1.37 0.00 0.00 64.86 62.83 2nx3 h ILE 52 Cb 1.21 0.86 0.00 0.00 0.47 0.00 0.00 36.82 39.36 2nx3 h ILE 52 CO 0.63 0.00 0.00 1.41 -3.07 0.00 0.00 178.15 177.12 2nx3 n HIS 53 N -2.47 0.43 -3.61 2.19 8.25 -1.26 -4.96 115.22 113.78 2nx3 n HIS 53 Ca -0.00 -0.22 -0.31 0.00 -0.26 0.00 0.00 57.72 56.93 2nx3 n HIS 53 Cb 0.14 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.21 2nx3 n HIS 53 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2nx3 s SER 54 N -1.41 6.50 0.37 0.41 0.01 -0.83 -5.05 113.70 113.69 2nx3 s SER 54 Ca 0.35 0.63 -0.26 0.00 1.31 0.00 0.00 55.95 57.98 2nx3 s SER 54 Cb 0.20 -2.11 -0.12 0.00 0.21 0.00 0.00 66.02 64.20 2nx3 s SER 54 CO 0.28 0.01 1.04 0.33 0.41 0.00 0.00 173.24 175.31 2nx3 n PHE 55 N -0.09 1.34 0.00 2.43 7.35 -1.26 -4.93 117.46 122.29 2nx3 n PHE 55 Ca -0.02 0.61 0.00 0.00 -0.76 0.00 0.00 57.45 57.27 2nx3 n PHE 55 Cb 0.52 -2.26 0.00 0.00 0.35 0.00 0.00 39.48 38.09 2nx3 n PHE 55 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2nx3 n ARG 56 N 0.41 2.29 0.00 -4.13 1.74 -1.26 -4.75 116.66 110.96 2nx3 n ARG 56 Ca 0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.17 2nx3 n ARG 56 Cb 0.36 -0.85 0.00 0.00 -1.02 0.00 0.00 32.46 30.95 2nx3 n ARG 56 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2nx3 n GLY 57 N 2.37 0.91 0.53 -0.13 0.00 -1.26 -0.33 105.19 107.27 2nx3 n GLY 57 Ca 0.00 -1.95 0.07 0.00 0.00 0.00 0.00 46.02 44.14 2nx3 n GLY 57 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2nx3 n HIS 58 N 7.51 0.00 0.00 1.61 8.25 -1.22 -5.03 115.22 126.34 2nx3 n HIS 58 Ca 0.00 -1.08 0.00 0.00 -0.26 0.00 0.00 57.72 56.38 2nx3 n HIS 58 Cb 0.00 -0.19 0.00 0.00 1.12 0.00 0.00 29.99 30.92 2nx3 n HIS 58 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2nx3 n GLY 59 N -0.92 0.07 0.29 -1.41 0.00 -1.25 -4.20 105.19 97.77 2nx3 n GLY 59 Ca 0.15 -1.58 0.07 0.00 0.00 0.00 0.00 46.02 44.66 2nx3 n GLY 59 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2nx3 h LEU 60 N 0.00 0.20 0.34 0.99 6.46 -1.99 -0.54 115.31 120.77 2nx3 h LEU 60 Ca 0.00 -0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 57.74 2nx3 h LEU 60 Cb 0.00 -0.05 0.00 0.00 -0.73 0.00 0.00 40.66 39.88 2nx3 h LEU 60 CO 0.00 0.14 -0.16 -0.08 -0.62 0.00 0.00 178.44 177.72 2nx3 h GLU 61 N 0.23 -0.44 -0.86 1.25 4.81 -1.98 -1.00 114.58 116.61 2nx3 h GLU 61 Ca 0.08 0.03 0.21 0.00 -0.13 0.00 0.00 59.36 59.56 2nx3 h GLU 61 Cb 0.05 0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.47 2nx3 h GLU 61 CO -0.02 -0.29 0.59 -0.92 -0.73 0.00 0.00 179.01 177.64 2nx3 h TYR 62 N -0.59 0.32 0.00 0.92 3.20 -1.70 -2.20 116.97 116.92 2nx3 h TYR 62 Ca -0.05 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.83 2nx3 h TYR 62 Cb 0.35 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.52 2nx3 h TYR 62 CO 0.09 0.09 0.00 0.41 -1.64 0.00 0.00 178.16 177.10 2nx3 n GLY 63 N -1.59 -2.21 0.48 1.82 0.00 -0.22 -1.93 105.19 101.55 2nx3 n GLY 63 Ca 0.18 0.00 0.29 0.00 0.00 0.00 0.00 46.02 46.49 2nx3 n GLY 63 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2nx3 h VAL 64 N 0.00 0.38 0.44 1.61 2.07 -1.02 -1.62 116.25 118.10 2nx3 h VAL 64 Ca 0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 2nx3 h VAL 64 Cb 0.00 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 2nx3 h VAL 64 CO 0.00 0.00 -0.21 0.50 0.02 0.00 0.00 177.57 177.88 2nx3 h LYS 65 N 0.00 -0.57 -0.77 1.57 3.64 -1.28 -2.46 116.57 116.70 2nx3 h LYS 65 Ca 0.43 0.04 0.13 0.00 -1.27 0.00 0.00 60.65 59.97 2nx3 h LYS 65 Cb 1.91 0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 33.80 2nx3 h LYS 65 CO -0.00 -0.38 0.51 0.00 -2.27 0.00 0.00 179.45 177.30 2nx3 h ALA 66 N -1.69 1.94 -0.65 5.00 0.00 -0.62 -0.87 119.26 122.38 2nx3 h ALA 66 Ca -0.06 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 2nx3 h ALA 66 Cb 0.45 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2nx3 h ALA 66 CO 0.10 -0.13 0.17 -0.07 0.00 0.00 0.00 179.25 179.32 2nx3 h LEU 67 N 0.56 0.95 -0.16 0.00 3.38 -1.39 -2.18 115.31 116.47 2nx3 h LEU 67 Ca 0.37 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 58.13 2nx3 h LEU 67 Cb 0.66 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2nx3 h LEU 67 CO -0.14 0.91 -0.01 0.03 0.09 0.00 0.00 178.44 179.32 2nx3 h ARG 68 N 0.97 0.29 -0.97 1.13 3.08 -0.69 -0.23 114.38 117.96 2nx3 h ARG 68 Ca 0.21 -0.09 0.23 0.00 0.07 0.00 0.00 59.98 60.40 2nx3 h ARG 68 Cb 0.32 -0.02 -0.07 0.00 0.08 0.00 0.00 29.97 30.28 2nx3 h ARG 68 CO -0.00 0.52 0.64 -0.22 -1.07 0.00 0.00 179.97 179.83 2nx3 h LYS 69 N 0.03 0.36 0.14 0.04 1.63 -1.07 0.66 116.57 118.36 2nx3 h LYS 69 Ca 0.04 -0.02 -0.29 0.00 -0.85 0.00 0.00 60.65 59.53 2nx3 h LYS 69 Cb 0.39 -0.08 0.01 0.00 -0.60 0.00 0.00 32.23 31.95 2nx3 h LYS 69 CO 0.01 0.24 -1.33 0.28 -3.45 0.00 0.00 179.45 175.19 2nx3 h VAL 70 N 0.37 1.40 -0.31 2.00 2.07 -1.10 -2.62 116.25 118.07 2nx3 h VAL 70 Ca 0.52 -2.97 -0.16 0.00 0.82 0.00 0.00 66.70 64.91 2nx3 h VAL 70 Cb 1.36 2.92 -0.00 0.00 -1.52 0.00 0.00 31.29 34.05 2nx3 h VAL 70 CO -0.20 0.87 -0.46 0.50 0.02 0.00 0.00 177.57 178.30 2nx3 h LYS 71 N 0.08 0.82 0.07 1.57 3.64 0.14 -1.11 116.57 121.78 2nx3 h LYS 71 Ca -0.17 -0.46 -0.25 0.00 -1.27 0.00 0.00 60.65 58.50 2nx3 h LYS 71 Cb 2.01 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 33.85 2nx3 h LYS 71 CO 0.21 1.10 -1.15 1.05 -2.27 0.00 0.00 179.45 178.39 2nx3 h GLU 72 N 0.65 0.15 0.00 1.90 4.11 0.01 0.07 114.58 121.47 2nx3 h GLU 72 Ca 0.04 -0.25 -0.20 0.00 0.07 0.00 0.00 59.36 59.01 2nx3 h GLU 72 Cb 1.04 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.35 2nx3 h GLU 72 CO 0.10 1.11 -1.12 1.49 0.07 0.00 0.00 179.01 180.66 2nx3 h GLU 73 N 0.04 0.00 0.00 1.06 4.81 -1.50 -3.38 114.58 115.61 2nx3 h GLU 73 Ca -0.08 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 2nx3 h GLU 73 Cb 1.88 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.26 2nx3 h GLU 73 CO 0.17 0.70 -1.22 1.19 -0.73 0.00 0.00 179.01 179.12 2nx3 n PHE 74 N -3.20 0.00 -1.21 0.92 3.72 -0.42 -5.02 117.46 112.26 2nx3 n PHE 74 Ca -0.05 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.28 2nx3 n PHE 74 Cb 0.92 -0.15 -0.03 0.00 -0.94 0.00 0.00 39.48 39.27 2nx3 n PHE 74 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2nx3 n GLY 75 N 1.97 0.93 3.83 1.37 0.00 0.01 -4.99 105.19 108.30 2nx3 n GLY 75 Ca -0.01 -0.63 -0.36 0.00 0.00 0.00 0.00 46.02 45.03 2nx3 n GLY 75 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2nx3 s LEU 76 N -1.64 4.34 0.79 0.99 1.43 -1.25 -5.04 118.68 118.31 2nx3 s LEU 76 Ca 0.00 1.23 -0.11 0.00 -1.03 0.00 0.00 54.13 54.22 2nx3 s LEU 76 Cb 0.00 -3.41 0.07 0.00 0.03 0.00 0.00 46.19 42.88 2nx3 s LEU 76 CO 0.00 0.07 1.11 -0.54 0.23 0.00 0.00 176.35 177.22 2nx3 s LYS 77 N -1.96 2.05 0.14 1.70 1.02 -1.26 -4.52 119.74 116.91 2nx3 s LYS 77 Ca 0.40 1.28 0.07 0.00 0.02 0.00 0.00 55.97 57.75 2nx3 s LYS 77 Cb -0.16 -1.87 -0.04 0.00 -0.52 0.00 0.00 37.83 35.25 2nx3 s LYS 77 CO 0.20 -1.81 -0.17 0.42 -0.92 0.00 0.00 175.35 173.07 2nx3 s ILE 78 N -2.77 1.62 -0.12 2.17 -1.09 -1.26 -0.55 121.20 119.20 2nx3 s ILE 78 Ca 0.63 -1.77 -0.11 0.00 -2.23 0.00 0.00 60.65 57.17 2nx3 s ILE 78 Cb -0.19 -1.67 0.03 0.00 -1.58 0.00 0.00 42.46 39.05 2nx3 s ILE 78 CO 0.55 -0.31 0.31 0.28 -1.23 0.00 0.00 174.94 174.54 2nx3 s THR 79 N -1.91 -0.00 0.13 2.92 -1.32 0.27 0.10 115.64 115.82 2nx3 s THR 79 Ca 0.11 0.01 -0.17 0.00 -1.21 0.00 0.00 61.69 60.43 2nx3 s THR 79 Cb -0.06 -0.44 0.04 0.00 -1.51 0.00 0.00 72.50 70.53 2nx3 s THR 79 CO 0.05 0.00 0.42 0.28 -2.21 0.00 0.00 174.62 173.17 2nx3 s THR 80 N 0.22 0.06 -0.09 5.08 -1.32 -1.22 -3.03 115.64 115.34 2nx3 s THR 80 Ca -0.00 -0.50 -0.06 0.00 -1.21 0.00 0.00 61.69 59.91 2nx3 s THR 80 Cb -0.03 -1.14 -0.04 0.00 -1.51 0.00 0.00 72.50 69.78 2nx3 s THR 80 CO -0.00 -0.28 0.14 1.51 -2.21 0.00 0.00 174.62 173.78 2nx3 s ASP 81 N -2.78 6.32 0.22 8.08 -4.77 -1.26 -1.68 116.67 120.80 2nx3 s ASP 81 Ca 0.03 0.42 0.05 0.00 -3.30 0.00 0.00 52.55 49.75 2nx3 s ASP 81 Cb 0.01 -2.02 -0.03 0.00 -1.09 0.00 0.00 42.92 39.79 2nx3 s ASP 81 CO -0.12 0.38 0.33 0.27 0.70 0.00 0.00 175.17 176.72 2nx3 s ILE 82 N -1.08 5.18 0.00 2.11 -4.36 -0.90 -4.84 121.20 117.30 2nx3 s ILE 82 Ca 0.18 -0.98 0.00 0.00 -0.26 0.00 0.00 60.65 59.58 2nx3 s ILE 82 Cb -0.12 -3.78 0.00 0.00 1.25 0.00 0.00 42.46 39.81 2nx3 s ILE 82 CO 0.07 -0.29 0.00 1.41 0.24 0.00 0.00 174.94 176.37 2nx3 n HIS 83 N -1.22 0.00 -4.24 1.37 8.25 -1.26 -4.40 115.22 113.71 2nx3 n HIS 83 Ca -0.09 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.19 2nx3 n HIS 83 Cb 0.57 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.55 2nx3 n HIS 83 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2nx3 s GLU 84 N -1.79 0.81 0.49 -0.41 2.02 -1.26 -5.04 118.70 113.53 2nx3 s GLU 84 Ca 0.00 -0.79 0.36 0.00 0.02 0.00 0.00 54.97 54.56 2nx3 s GLU 84 Cb 0.00 -0.79 1.51 0.00 0.10 0.00 0.00 34.13 34.95 2nx3 s GLU 84 CO 0.00 0.19 1.67 0.77 0.02 0.00 0.00 175.26 177.91 2nx3 h SER 85 N 4.72 0.14 0.00 -0.19 0.02 -1.91 -0.20 113.55 116.12 2nx3 h SER 85 Ca -0.38 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 2nx3 h SER 85 Cb 1.19 0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.77 2nx3 h SER 85 CO 0.43 -0.05 0.00 -2.67 -1.14 0.00 0.00 176.83 173.39 2nx3 n TRP 86 N -4.34 0.00 1.01 3.45 4.27 -1.26 -3.27 117.44 117.29 2nx3 n TRP 86 Ca 0.35 0.00 0.11 0.00 -3.89 0.00 0.00 57.50 54.07 2nx3 n TRP 86 Cb 1.48 0.00 0.03 0.00 -1.36 0.00 0.00 31.31 31.46 2nx3 n TRP 86 CO 0.00 0.00 0.00 1.04 -2.29 0.00 0.00 177.69 176.44 2nx3 n GLN 87 N -0.98 1.44 0.00 -2.67 6.02 -0.09 -4.52 117.38 116.60 2nx3 n GLN 87 Ca 0.20 -1.19 -0.00 0.00 -0.01 0.00 0.00 57.00 56.00 2nx3 n GLN 87 Cb 0.09 -1.48 -0.00 0.00 1.02 0.00 0.00 30.24 29.87 2nx3 n GLN 87 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2nx3 h ALA 88 N 4.06 -0.62 -0.57 -1.58 0.00 -1.73 -1.65 119.26 117.17 2nx3 h ALA 88 Ca 0.00 -0.00 0.09 0.00 0.00 0.00 0.00 54.91 54.99 2nx3 h ALA 88 Cb 0.80 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.49 2nx3 h ALA 88 CO 0.00 -0.62 -0.43 1.49 0.00 0.00 0.00 179.25 179.68 2nx3 h GLU 89 N -0.01 -0.22 -0.05 0.00 4.22 -1.82 0.95 114.58 117.65 2nx3 h GLU 89 Ca -0.00 0.02 0.01 0.00 0.08 0.00 0.00 59.36 59.46 2nx3 h GLU 89 Cb 0.01 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2nx3 h GLU 89 CO 0.00 -0.15 -0.01 -1.00 -2.18 0.00 0.00 179.01 175.68 2nx3 h PRO 90 N -0.23 0.01 -0.23 0.92 0.13 -1.79 -2.93 132.00 127.88 2nx3 h PRO 90 Ca 0.18 -0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.24 2nx3 h PRO 90 Cb 0.56 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.68 2nx3 h PRO 90 CO -0.68 0.00 -0.13 0.28 -0.23 0.00 0.00 178.00 177.24 2nx3 h VAL 91 N 0.01 1.21 0.00 1.56 2.07 -0.42 -2.51 116.25 118.17 2nx3 h VAL 91 Ca 0.02 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.61 2nx3 h VAL 91 Cb 0.03 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2nx3 h VAL 91 CO -0.04 0.30 0.00 0.00 0.02 0.00 0.00 177.57 177.85 2nx3 n ALA 92 N -2.48 1.35 -0.04 1.67 0.00 0.32 -2.10 120.51 119.22 2nx3 n ALA 92 Ca 0.00 -0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 2nx3 n ALA 92 Cb 0.30 -1.01 -0.08 0.00 0.00 0.00 0.00 19.45 18.67 2nx3 n ALA 92 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2nx3 h GLU 93 N 0.00 0.53 0.00 0.00 4.39 -1.51 -3.39 114.58 114.60 2nx3 h GLU 93 Ca 0.00 -0.38 -0.27 0.00 0.34 0.00 0.00 59.36 59.05 2nx3 h GLU 93 Cb 0.00 0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 28.67 2nx3 h GLU 93 CO 0.00 1.00 -2.02 1.55 -1.16 0.00 0.00 179.01 178.38 2nx3 n VAL 94 N -4.28 1.02 -2.54 3.13 3.14 -0.89 -4.99 118.33 112.92 2nx3 n VAL 94 Ca -0.07 -0.53 -0.42 0.00 -2.96 0.00 0.00 64.34 60.36 2nx3 n VAL 94 Cb 0.55 -0.83 -0.03 0.00 -1.06 0.00 0.00 33.84 32.47 2nx3 n VAL 94 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2nx3 s ALA 95 N -2.36 3.43 0.14 1.55 0.00 -0.96 -4.49 121.76 119.07 2nx3 s ALA 95 Ca -0.14 0.58 -0.04 0.00 0.00 0.00 0.00 51.96 52.36 2nx3 s ALA 95 Cb 0.05 -3.47 -0.06 0.00 0.00 0.00 0.00 23.12 19.64 2nx3 s ALA 95 CO 0.53 -0.64 1.33 -0.44 0.00 0.00 0.00 175.76 176.54 2nx3 h ASP 96 N 7.23 0.52 -3.31 0.00 3.32 0.32 -3.44 116.42 121.07 2nx3 h ASP 96 Ca -0.35 -0.40 -0.54 0.00 0.02 0.00 0.00 57.03 55.76 2nx3 h ASP 96 Cb 1.17 -0.16 -0.35 0.00 0.22 0.00 0.00 39.33 40.21 2nx3 h ASP 96 CO 0.85 1.19 -0.82 -0.63 -1.72 0.00 0.00 179.24 178.11 2nx3 s ILE 97 N -3.35 1.21 -0.27 0.35 1.09 -1.03 -2.87 121.20 116.33 2nx3 s ILE 97 Ca -0.06 -0.47 -0.19 0.00 -1.10 0.00 0.00 60.65 58.83 2nx3 s ILE 97 Cb 0.09 -1.14 -0.02 0.00 -1.06 0.00 0.00 42.46 40.33 2nx3 s ILE 97 CO 0.86 0.38 0.56 -0.63 -0.10 0.00 0.00 174.94 176.01 2nx3 s ILE 98 N 1.06 5.03 -0.05 2.92 1.01 0.29 -3.44 121.20 128.01 2nx3 s ILE 98 Ca -0.07 0.93 -0.18 0.00 0.00 0.00 0.00 60.65 61.34 2nx3 s ILE 98 Cb -0.15 -3.87 -0.05 0.00 0.01 0.00 0.00 42.46 38.40 2nx3 s ILE 98 CO -0.01 0.04 0.49 -1.58 0.00 0.00 0.00 174.94 173.88 2nx3 s GLN 99 N 2.39 4.23 -0.29 2.79 0.74 -0.68 -0.62 119.66 128.22 2nx3 s GLN 99 Ca 0.23 0.52 -0.07 0.00 0.05 0.00 0.00 55.36 56.09 2nx3 s GLN 99 Cb -0.16 -3.35 -0.00 0.00 1.10 0.00 0.00 33.01 30.60 2nx3 s GLN 99 CO 0.09 0.36 0.08 0.42 -0.55 0.00 0.00 175.29 175.70 2nx3 s ILE 100 N -0.07 4.09 0.46 -2.34 -1.09 -0.34 -2.11 121.20 119.79 2nx3 s ILE 100 Ca 0.27 -0.56 -0.23 0.00 -2.23 0.00 0.00 60.65 57.90 2nx3 s ILE 100 Cb -0.16 -3.06 -0.09 0.00 -1.58 0.00 0.00 42.46 37.56 2nx3 s ILE 100 CO 0.13 0.14 1.02 -2.65 -1.23 0.00 0.00 174.94 172.35 2nx3 n PRO 101 N 4.89 1.31 -0.09 2.79 -0.02 -1.26 -1.03 135.00 141.59 2nx3 n PRO 101 Ca -0.15 0.48 -0.07 0.00 -2.02 0.00 0.00 63.50 61.74 2nx3 n PRO 101 Cb 0.49 -2.09 -0.01 0.00 -0.02 0.00 0.00 33.50 31.86 2nx3 n PRO 101 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2nx3 h ALA 102 N 1.38 -0.09 -0.05 3.55 0.00 -1.89 -0.73 119.26 121.43 2nx3 h ALA 102 Ca -0.46 0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.57 2nx3 h ALA 102 Cb 1.34 0.57 -0.00 0.00 0.00 0.00 0.00 17.79 19.70 2nx3 h ALA 102 CO 0.56 -0.66 0.05 0.74 0.00 0.00 0.00 179.25 179.94 2nx3 h PHE 103 N -0.22 0.00 -0.62 0.00 0.04 -1.91 -1.95 116.94 112.27 2nx3 h PHE 103 Ca 0.17 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.94 2nx3 h PHE 103 Cb 0.49 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.64 2nx3 h PHE 103 CO -0.46 0.00 0.00 1.28 -0.60 0.00 0.00 178.31 178.53 2nx3 n LEU 104 N -3.88 3.77 0.06 1.54 4.77 -0.36 -4.60 117.00 118.30 2nx3 n LEU 104 Ca -0.02 -1.87 0.04 0.00 -0.03 0.00 0.00 56.01 54.14 2nx3 n LEU 104 Cb 0.14 -0.41 0.22 0.00 -2.33 0.00 0.00 43.42 41.04 2nx3 n LEU 104 CO 0.28 0.91 0.63 0.00 -1.33 0.00 0.00 177.39 177.88 2nx3 n ARG 106 N -1.78 1.19 -2.41 0.00 1.74 -1.26 -4.91 116.66 109.24 2nx3 n ARG 106 Ca -0.01 -1.29 -0.37 0.00 -0.77 0.00 0.00 57.85 55.42 2nx3 n ARG 106 Cb 0.04 -1.14 -0.03 0.00 -1.02 0.00 0.00 32.46 30.31 2nx3 n ARG 106 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2nx3 s GLN 107 N -0.74 3.29 0.08 5.56 -1.52 -0.56 -4.89 119.66 120.87 2nx3 s GLN 107 Ca 0.10 -0.93 -0.15 0.00 -1.95 0.00 0.00 55.36 52.44 2nx3 s GLN 107 Cb 0.06 -5.28 -0.03 0.00 -0.22 0.00 0.00 33.01 27.54 2nx3 s GLN 107 CO 0.09 -2.58 0.99 2.41 -0.25 0.00 0.00 175.29 175.94 2nx3 n THR 108 N 7.17 -0.32 -0.05 -0.19 -1.04 -1.26 -0.28 114.28 118.30 2nx3 n THR 108 Ca 0.36 1.54 0.16 0.00 -2.04 0.00 0.00 64.05 64.07 2nx3 n THR 108 Cb 0.49 -1.94 0.60 0.00 -1.82 0.00 0.00 70.33 67.67 2nx3 n THR 108 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 2nx3 h ASP 109 N 0.00 0.18 0.18 8.00 3.32 -1.99 0.18 116.42 126.29 2nx3 h ASP 109 Ca 0.08 0.01 -0.13 0.00 0.02 0.00 0.00 57.03 57.01 2nx3 h ASP 109 Cb 0.19 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 2nx3 h ASP 109 CO -0.45 0.10 -0.46 0.25 -1.72 0.00 0.00 179.24 176.96 2nx3 h LEU 110 N 0.20 0.37 0.01 1.55 5.85 -1.02 -1.30 115.31 120.97 2nx3 h LEU 110 Ca 0.27 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 2nx3 h LEU 110 Cb 0.81 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.74 2nx3 h LEU 110 CO -0.05 0.78 -0.00 -0.07 -0.34 0.00 0.00 178.44 178.76 2nx3 h LEU 111 N 0.28 -0.01 -1.76 2.25 3.38 -0.63 -2.83 115.31 115.99 2nx3 h LEU 111 Ca 0.02 -0.65 0.04 0.00 0.09 0.00 0.00 57.88 57.38 2nx3 h LEU 111 Cb 0.92 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 2nx3 h LEU 111 CO 0.08 0.65 0.23 -0.07 0.09 0.00 0.00 178.44 179.42 2nx3 h LEU 112 N -0.67 0.27 -0.39 1.67 3.38 -1.16 -0.52 115.31 117.89 2nx3 h LEU 112 Ca -0.00 -0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 2nx3 h LEU 112 Cb 0.66 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2nx3 h LEU 112 CO 0.00 0.18 -0.11 0.00 0.09 0.00 0.00 178.44 178.60 2nx3 h ALA 113 N 1.81 0.54 0.00 1.53 0.00 -1.23 -1.81 119.26 120.10 2nx3 h ALA 113 Ca 0.15 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.62 2nx3 h ALA 113 Cb 0.19 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2nx3 h ALA 113 CO -0.03 0.42 -0.53 0.00 0.00 0.00 0.00 179.25 179.11 2nx3 h ALA 114 N 0.83 0.90 -0.14 0.00 0.00 -1.11 -3.21 119.26 116.52 2nx3 h ALA 114 Ca 0.10 -0.48 -0.22 0.00 0.00 0.00 0.00 54.91 54.31 2nx3 h ALA 114 Cb 0.64 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.35 2nx3 h ALA 114 CO 0.04 0.66 -0.77 0.00 0.00 0.00 0.00 179.25 179.19 2nx3 h ALA 115 N 1.47 0.37 -0.45 0.00 0.00 -0.95 -3.26 119.26 116.44 2nx3 h ALA 115 Ca -0.01 -0.60 -0.04 0.00 0.00 0.00 0.00 54.91 54.26 2nx3 h ALA 115 Cb 1.09 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 2nx3 h ALA 115 CO 0.07 0.70 0.11 -0.22 0.00 0.00 0.00 179.25 179.90 2nx3 h LYS 116 N 0.50 0.67 0.00 0.00 3.64 -1.34 -2.20 116.57 117.84 2nx3 h LYS 116 Ca -0.05 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.21 2nx3 h LYS 116 Cb 1.39 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 2nx3 h LYS 116 CO 0.15 0.61 0.09 1.79 -2.27 0.00 0.00 179.45 179.82 2nx3 h THR 117 N 0.65 0.00 0.00 1.00 1.35 -1.60 -3.45 112.91 110.87 2nx3 h THR 117 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.01 2nx3 h THR 117 Cb 0.25 0.49 0.00 0.00 -1.73 0.00 0.00 68.15 67.16 2nx3 h THR 117 CO -0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2nx3 n GLY 118 N -1.27 2.22 3.65 5.82 0.00 -0.83 -5.03 105.19 109.75 2nx3 n GLY 118 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 2nx3 n GLY 118 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2nx3 s ARG 119 N -0.34 -0.59 0.16 1.61 1.81 -1.26 -4.89 118.95 115.45 2nx3 s ARG 119 Ca 0.00 0.04 -0.20 0.00 -1.72 0.00 0.00 55.73 53.85 2nx3 s ARG 119 Cb 0.00 -1.66 -0.08 0.00 -0.45 0.00 0.00 34.95 32.76 2nx3 s ARG 119 CO 0.00 -3.31 0.66 0.00 -0.68 0.00 0.00 175.30 171.97 2nx3 s ALA 120 N -3.09 3.49 -0.13 2.13 0.00 -1.14 -4.74 121.76 118.28 2nx3 s ALA 120 Ca 0.70 0.12 0.01 0.00 0.00 0.00 0.00 51.96 52.79 2nx3 s ALA 120 Cb -0.11 -2.75 -0.00 0.00 0.00 0.00 0.00 23.12 20.26 2nx3 s ALA 120 CO 0.56 0.36 -0.18 0.08 0.00 0.00 0.00 175.76 176.58 2nx3 s VAL 121 N -1.34 2.54 -0.34 0.00 1.01 -0.84 0.11 120.40 121.54 2nx3 s VAL 121 Ca 0.37 -0.83 -0.04 0.00 0.00 0.00 0.00 61.98 61.48 2nx3 s VAL 121 Cb -0.18 -2.04 0.06 0.00 0.00 0.00 0.00 36.38 34.22 2nx3 s VAL 121 CO 0.21 0.53 0.09 0.21 0.00 0.00 0.00 175.10 176.15 2nx3 s ASN 122 N 0.53 5.13 -0.19 3.32 2.47 0.21 -1.37 114.94 125.03 2nx3 s ASN 122 Ca -0.11 -1.44 -0.20 0.00 0.42 0.00 0.00 52.86 51.52 2nx3 s ASN 122 Cb -0.16 -1.79 -0.03 0.00 -1.45 0.00 0.00 41.25 37.81 2nx3 s ASN 122 CO 0.04 -0.36 0.58 -0.69 -3.72 0.00 0.00 177.10 172.95 2nx3 s VAL 123 N 1.27 5.07 -0.08 -5.21 1.01 -0.49 -1.20 120.40 120.77 2nx3 s VAL 123 Ca -0.00 1.09 -0.30 0.00 0.00 0.00 0.00 61.98 62.77 2nx3 s VAL 123 Cb -0.21 -3.90 -0.02 0.00 0.00 0.00 0.00 36.38 32.25 2nx3 s VAL 123 CO -0.01 0.16 1.11 -0.54 0.00 0.00 0.00 175.10 175.83 2nx3 s LYS 124 N 1.64 4.38 0.04 2.72 -0.14 -0.20 -0.62 119.74 127.58 2nx3 s LYS 124 Ca 0.27 1.55 -0.31 0.00 -1.36 0.00 0.00 55.97 56.12 2nx3 s LYS 124 Cb -0.16 -3.55 -0.07 0.00 -1.68 0.00 0.00 37.83 32.38 2nx3 s LYS 124 CO 0.10 -0.39 1.44 0.21 -0.76 0.00 0.00 175.35 175.95 2nx3 s LYS 125 N 2.11 4.28 0.49 1.68 2.20 -0.37 -3.99 119.74 126.15 2nx3 s LYS 125 Ca 0.52 2.05 -0.23 0.00 -0.36 0.00 0.00 55.97 57.95 2nx3 s LYS 125 Cb -0.22 -3.49 -0.07 0.00 -1.51 0.00 0.00 37.83 32.54 2nx3 s LYS 125 CO 0.20 -0.56 1.23 0.41 -0.36 0.00 0.00 175.35 176.27 2nx3 n GLY 126 N 3.66 0.42 0.12 5.54 0.00 -1.25 -4.59 105.19 109.09 2nx3 n GLY 126 Ca 0.13 0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.34 2nx3 n GLY 126 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2nx3 n GLN 127 N -0.47 0.15 0.00 1.61 3.00 -1.26 -1.66 117.38 118.75 2nx3 n GLN 127 Ca 0.09 0.47 0.10 0.00 -0.01 0.00 0.00 57.00 57.65 2nx3 n GLN 127 Cb 0.42 -1.84 0.07 0.00 0.00 0.00 0.00 30.24 28.89 2nx3 n GLN 127 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.06 179.03 2nx3 n PHE 128 N -2.14 0.00 -3.84 1.08 1.16 -1.26 -1.80 117.46 110.66 2nx3 n PHE 128 Ca 0.01 0.00 -0.37 0.00 -1.87 0.00 0.00 57.45 55.22 2nx3 n PHE 128 Cb 0.16 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 37.97 2nx3 n PHE 128 CO 0.00 0.00 0.00 -1.17 -1.87 0.00 0.00 176.76 173.72 2nx3 s LEU 129 N -1.81 4.40 0.42 5.98 2.96 -0.67 -5.08 118.68 124.88 2nx3 s LEU 129 Ca 0.22 0.52 -0.13 0.00 -0.22 0.00 0.00 54.13 54.52 2nx3 s LEU 129 Cb 0.17 -2.12 -0.07 0.00 0.50 0.00 0.00 46.19 44.66 2nx3 s LEU 129 CO 0.30 0.40 0.82 0.00 -1.32 0.00 0.00 176.35 176.56 2nx3 s ALA 130 N -1.02 3.27 0.16 5.97 0.00 -1.26 -4.86 121.76 124.01 2nx3 s ALA 130 Ca 0.16 -0.05 -0.21 0.00 0.00 0.00 0.00 51.96 51.86 2nx3 s ALA 130 Cb -0.12 -2.83 0.05 0.00 0.00 0.00 0.00 23.12 20.22 2nx3 s ALA 130 CO 0.05 -0.01 1.64 -1.35 0.00 0.00 0.00 175.76 176.09 2nx3 h PRO 131 N 1.34 -0.17 0.00 0.00 0.11 -1.98 -1.72 132.00 129.58 2nx3 h PRO 131 Ca -0.47 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2nx3 h PRO 131 Cb 1.18 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2nx3 h PRO 131 CO 0.63 -0.11 0.00 0.11 -0.21 0.00 0.00 178.00 178.42 2nx3 h TRP 132 N -0.18 0.00 -0.00 0.65 0.09 -1.94 -2.21 115.95 112.35 2nx3 h TRP 132 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.13 2nx3 h TRP 132 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.66 2nx3 h TRP 132 CO -0.39 0.00 -0.09 -0.25 0.09 0.00 0.00 178.44 177.80 2nx3 n ASP 133 N -2.30 0.40 0.06 0.11 8.00 -0.65 -3.21 116.55 118.96 2nx3 n ASP 133 Ca 0.00 -0.52 0.12 0.00 0.71 0.00 0.00 54.79 55.11 2nx3 n ASP 133 Cb 0.13 -0.10 0.48 0.00 -0.02 0.00 0.00 41.12 41.61 2nx3 n ASP 133 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2nx3 n THR 134 N -1.00 0.47 -0.02 -3.53 -2.24 -0.83 -3.51 114.28 103.61 2nx3 n THR 134 Ca 0.15 -0.04 -0.09 0.00 -2.27 0.00 0.00 64.05 61.79 2nx3 n THR 134 Cb 0.27 -0.69 -0.04 0.00 -2.10 0.00 0.00 70.33 67.77 2nx3 n THR 134 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2nx3 h LYS 135 N 0.00 -0.02 -0.30 -0.78 3.64 -1.76 -1.47 116.57 115.88 2nx3 h LYS 135 Ca 0.00 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 2nx3 h LYS 135 Cb 0.54 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.35 2nx3 h LYS 135 CO 0.00 -0.01 0.02 -0.91 -2.27 0.00 0.00 179.45 176.27 2nx3 h ASN 136 N -0.02 0.42 -0.99 4.20 2.35 -1.82 -1.04 115.58 118.67 2nx3 h ASN 136 Ca 0.08 -0.07 0.04 0.00 -0.55 0.00 0.00 56.30 55.80 2nx3 h ASN 136 Cb 0.13 -0.11 -0.06 0.00 0.05 0.00 0.00 38.32 38.34 2nx3 h ASN 136 CO -0.17 0.48 0.65 0.58 -1.65 0.00 0.00 177.43 177.32 2nx3 h VAL 137 N 0.44 1.17 -0.13 2.81 2.07 -1.43 -0.64 116.25 120.54 2nx3 h VAL 137 Ca 0.10 -0.43 -0.20 0.00 0.82 0.00 0.00 66.70 66.99 2nx3 h VAL 137 Cb 0.27 -0.20 0.01 0.00 -1.52 0.00 0.00 31.29 29.85 2nx3 h VAL 137 CO 0.01 0.23 -0.72 0.58 0.02 0.00 0.00 177.57 177.69 2nx3 h VAL 138 N 1.25 1.30 -0.46 2.57 2.07 -0.82 -3.04 116.25 119.13 2nx3 h VAL 138 Ca 0.40 -1.95 0.09 0.00 0.82 0.00 0.00 66.70 66.06 2nx3 h VAL 138 Cb 0.01 2.07 -0.02 0.00 -1.52 0.00 0.00 31.29 31.82 2nx3 h VAL 138 CO -0.13 0.61 0.32 -0.08 0.02 0.00 0.00 177.57 178.31 2nx3 h GLU 139 N 0.41 0.22 -0.15 1.57 4.81 -0.36 0.92 114.58 122.00 2nx3 h GLU 139 Ca -0.05 -0.01 -0.14 0.00 -0.13 0.00 0.00 59.36 59.02 2nx3 h GLU 139 Cb 1.35 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.69 2nx3 h GLU 139 CO 0.15 0.14 -0.46 0.87 -0.73 0.00 0.00 179.01 178.98 2nx3 h LYS 140 N 0.22 0.58 -0.62 1.92 1.57 -1.10 -2.15 116.57 116.98 2nx3 h LYS 140 Ca 0.21 -0.42 -0.07 0.00 -1.87 0.00 0.00 60.65 58.51 2nx3 h LYS 140 Cb 0.55 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 2nx3 h LYS 140 CO -0.04 1.04 0.12 -0.07 -0.57 0.00 0.00 179.45 179.93 2nx3 h LEU 141 N 0.22 0.96 -0.70 2.94 3.38 -1.12 -1.08 115.31 119.91 2nx3 h LEU 141 Ca -0.01 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.66 2nx3 h LEU 141 Cb 1.08 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.55 2nx3 h LEU 141 CO 0.10 0.96 0.25 0.11 0.09 0.00 0.00 178.44 179.95 2nx3 h LYS 142 N 0.92 1.07 -0.24 1.13 1.57 -0.89 0.55 116.57 120.68 2nx3 h LYS 142 Ca 0.19 -0.21 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 2nx3 h LYS 142 Cb 0.39 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 2nx3 h LYS 142 CO 0.01 0.91 -0.01 0.35 -0.57 0.00 0.00 179.45 180.13 2nx3 h PHE 143 N 1.02 0.37 -0.09 -1.35 3.57 -1.06 -2.51 116.94 116.88 2nx3 h PHE 143 Ca 0.23 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.70 2nx3 h PHE 143 Cb 0.26 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 38.89 2nx3 h PHE 143 CO 0.02 0.39 0.00 0.41 -2.23 0.00 0.00 178.31 176.90 2nx3 n GLY 144 N -1.03 -0.17 0.14 2.40 0.00 -0.44 -4.91 105.19 101.18 2nx3 n GLY 144 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.69 2nx3 n GLY 144 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nx3 n GLY 145 N 1.05 0.96 3.77 -0.02 0.00 -0.94 -3.64 105.19 106.36 2nx3 n GLY 145 Ca 0.17 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 2nx3 n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nx3 s ALA 146 N -2.00 3.40 -0.08 4.61 0.00 0.13 -4.87 121.76 122.96 2nx3 s ALA 146 Ca 0.00 0.45 0.03 0.00 0.00 0.00 0.00 51.96 52.44 2nx3 s ALA 146 Cb 0.00 -3.05 -0.07 0.00 0.00 0.00 0.00 23.12 20.01 2nx3 s ALA 146 CO 0.00 0.26 -0.03 1.63 0.00 0.00 0.00 175.76 177.62 2nx3 n LYS 147 N 1.51 1.42 -3.72 0.00 4.76 -1.26 -4.45 118.16 116.42 2nx3 n LYS 147 Ca -0.04 0.03 -0.38 0.00 -2.87 0.00 0.00 58.31 55.05 2nx3 n LYS 147 Cb 0.48 -1.17 -0.11 0.00 -1.84 0.00 0.00 35.03 32.39 2nx3 n LYS 147 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 2nx3 s GLU 148 N -2.16 2.31 -0.08 1.97 2.12 -1.26 -5.08 118.70 116.51 2nx3 s GLU 148 Ca -0.08 -1.62 0.02 0.00 0.36 0.00 0.00 54.97 53.66 2nx3 s GLU 148 Cb 0.02 -3.62 -0.02 0.00 0.26 0.00 0.00 34.13 30.77 2nx3 s GLU 148 CO 0.23 -0.98 -0.15 0.42 -0.54 0.00 0.00 175.26 174.24 2nx3 s ILE 149 N 1.27 2.98 0.11 -3.70 1.01 -1.26 -1.98 121.20 119.63 2nx3 s ILE 149 Ca 0.04 -0.73 0.08 0.00 0.00 0.00 0.00 60.65 60.04 2nx3 s ILE 149 Cb -0.23 -2.19 -0.04 0.00 0.01 0.00 0.00 42.46 40.02 2nx3 s ILE 149 CO -0.01 0.57 -0.19 -0.31 0.00 0.00 0.00 174.94 174.99 2nx3 s TYR 150 N -0.29 1.71 -0.10 3.97 2.02 -0.47 -2.50 117.35 121.69 2nx3 s TYR 150 Ca 0.02 -0.44 0.01 0.00 -0.37 0.00 0.00 57.07 56.29 2nx3 s TYR 150 Cb -0.13 -0.92 0.02 0.00 -0.40 0.00 0.00 41.96 40.53 2nx3 s TYR 150 CO 0.03 0.21 -0.12 -0.51 -1.57 0.00 0.00 175.55 173.58 2nx3 s LEU 151 N -2.05 1.56 -0.22 -1.29 1.43 -0.11 -1.40 118.68 116.60 2nx3 s LEU 151 Ca 0.07 -0.35 -0.05 0.00 -1.03 0.00 0.00 54.13 52.77 2nx3 s LEU 151 Cb -0.09 -0.93 -0.02 0.00 0.03 0.00 0.00 46.19 45.18 2nx3 s LEU 151 CO 0.04 -0.01 -0.00 -0.89 0.23 0.00 0.00 176.35 175.72 2nx3 s THR 152 N 1.07 3.78 -0.11 5.49 2.01 0.21 -0.66 115.64 127.42 2nx3 s THR 152 Ca -0.06 -0.36 -0.30 0.00 0.31 0.00 0.00 61.69 61.28 2nx3 s THR 152 Cb -0.15 -2.73 -0.02 0.00 0.01 0.00 0.00 72.50 69.62 2nx3 s THR 152 CO -0.02 0.40 1.18 -0.70 -0.69 0.00 0.00 174.62 174.80 2nx3 s GLU 153 N 1.35 4.31 -0.03 4.92 2.56 0.69 -1.24 118.70 131.27 2nx3 s GLU 153 Ca 0.04 1.60 0.13 0.00 0.00 0.00 0.00 54.97 56.74 2nx3 s GLU 153 Cb -0.15 -3.63 0.23 0.00 2.00 0.00 0.00 34.13 32.59 2nx3 s GLU 153 CO 0.00 -0.53 1.10 2.89 -0.56 0.00 0.00 175.26 178.16 2nx3 n ARG 154 N 5.73 0.26 0.00 4.30 1.85 -1.26 -0.27 116.66 127.27 2nx3 n ARG 154 Ca 0.12 -1.74 0.00 0.00 -1.00 0.00 0.00 57.85 55.23 2nx3 n ARG 154 Cb 0.46 -0.50 0.00 0.00 -1.05 0.00 0.00 32.46 31.37 2nx3 n ARG 154 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2nx3 n GLY 155 N -0.05 1.72 3.15 2.89 0.00 -1.26 -4.01 105.19 107.63 2nx3 n GLY 155 Ca 0.06 -1.84 -0.19 0.00 0.00 0.00 0.00 46.02 44.05 2nx3 n GLY 155 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nx3 s THR 156 N -2.94 1.07 -0.04 2.61 2.01 0.07 -4.39 115.64 114.03 2nx3 s THR 156 Ca 0.00 -1.10 -0.31 0.00 0.31 0.00 0.00 61.69 60.58 2nx3 s THR 156 Cb 0.00 -1.00 -0.10 0.00 0.01 0.00 0.00 72.50 71.41 2nx3 s THR 156 CO 0.00 -0.10 1.98 0.41 -0.69 0.00 0.00 174.62 176.22 2nx3 n THR 157 N 1.67 0.65 -3.77 -0.82 -1.04 -0.74 -0.73 114.28 109.49 2nx3 n THR 157 Ca -0.19 -0.17 -0.29 0.00 -2.04 0.00 0.00 64.05 61.36 2nx3 n THR 157 Cb 0.55 -2.18 -0.13 0.00 -1.82 0.00 0.00 70.33 66.75 2nx3 n THR 157 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 2nx3 s PHE 158 N 4.83 2.33 0.00 -1.42 5.36 -0.25 -4.85 117.98 123.98 2nx3 s PHE 158 Ca 0.92 -2.65 0.00 0.00 -0.96 0.00 0.00 56.93 54.24 2nx3 s PHE 158 Cb -0.52 -2.13 0.00 0.00 -0.34 0.00 0.00 43.02 40.02 2nx3 s PHE 158 CO 0.45 -0.76 0.00 0.41 -1.46 0.00 0.00 175.22 173.86 2nx3 n GLY 159 N 3.34 -0.83 3.83 13.12 0.00 -1.26 -4.28 105.19 119.11 2nx3 n GLY 159 Ca 0.09 -1.18 -0.38 0.00 0.00 0.00 0.00 46.02 44.55 2nx3 n GLY 159 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2nx3 s TYR 160 N 0.00 3.71 -1.45 1.61 2.02 -1.26 -4.37 117.35 117.61 2nx3 s TYR 160 Ca 0.00 0.96 -0.11 0.00 -0.37 0.00 0.00 57.07 57.54 2nx3 s TYR 160 Cb 0.00 -2.28 0.05 0.00 -0.40 0.00 0.00 41.96 39.33 2nx3 s TYR 160 CO 0.00 0.62 1.07 0.09 -1.57 0.00 0.00 175.55 175.76 2nx3 n ASN 161 N 1.96 -5.41 -3.57 2.29 5.03 -1.26 -4.97 115.26 109.32 2nx3 n ASN 161 Ca -0.14 -0.67 -0.16 0.00 0.87 0.00 0.00 54.58 54.48 2nx3 n ASN 161 Cb 0.52 -4.41 -0.06 0.00 -1.02 0.00 0.00 39.78 34.81 2nx3 n ASN 161 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 2nx3 s ASN 162 N -3.35 -0.69 0.07 6.41 2.47 -1.26 -4.20 114.94 114.40 2nx3 s ASN 162 Ca 0.61 1.04 0.07 0.00 0.42 0.00 0.00 52.86 55.00 2nx3 s ASN 162 Cb -0.29 0.96 -0.03 0.00 -1.45 0.00 0.00 41.25 40.43 2nx3 s ASN 162 CO 0.78 -0.43 -0.19 -0.76 -3.72 0.00 0.00 177.10 172.79 2nx3 s LEU 163 N -0.45 2.24 0.04 3.21 1.43 -1.26 -1.10 118.68 122.80 2nx3 s LEU 163 Ca -0.05 -0.60 0.07 0.00 -1.03 0.00 0.00 54.13 52.51 2nx3 s LEU 163 Cb -0.02 -0.80 -0.02 0.00 0.03 0.00 0.00 46.19 45.37 2nx3 s LEU 163 CO 0.05 0.06 -0.19 0.54 0.23 0.00 0.00 176.35 177.04 2nx3 s VAL 164 N -1.05 1.49 -0.37 -1.59 0.11 0.09 -4.82 120.40 114.26 2nx3 s VAL 164 Ca 0.05 -1.14 -0.14 0.00 -2.93 0.00 0.00 61.98 57.82 2nx3 s VAL 164 Cb -0.09 -1.31 -0.00 0.00 -1.53 0.00 0.00 36.38 33.45 2nx3 s VAL 164 CO 0.03 0.14 0.29 -0.69 -3.33 0.00 0.00 175.10 171.54 2nx3 s VAL 165 N -0.82 5.24 -0.75 2.04 1.01 -1.26 -0.75 120.40 125.11 2nx3 s VAL 165 Ca 0.06 -0.32 -0.19 0.00 0.00 0.00 0.00 61.98 61.52 2nx3 s VAL 165 Cb -0.08 -3.83 0.12 0.00 0.00 0.00 0.00 36.38 32.59 2nx3 s VAL 165 CO 0.02 -0.15 0.91 -0.62 0.00 0.00 0.00 175.10 175.26 2nx3 s ASP 166 N 1.72 6.39 0.00 3.32 -1.08 -1.26 -4.89 116.67 120.87 2nx3 s ASP 166 Ca 0.07 -1.68 0.03 0.00 -0.52 0.00 0.00 52.55 50.45 2nx3 s ASP 166 Cb -0.18 -2.35 0.12 0.00 -1.46 0.00 0.00 42.92 39.05 2nx3 s ASP 166 CO 0.11 -1.11 1.08 0.49 0.52 0.00 0.00 175.17 176.26 2nx3 n PHE 167 N 6.45 0.00 0.29 -5.34 3.72 -1.26 -1.21 117.46 120.10 2nx3 n PHE 167 Ca 0.05 0.00 0.17 0.00 -0.05 0.00 0.00 57.45 57.62 2nx3 n PHE 167 Cb 0.46 -0.49 0.84 0.00 -0.94 0.00 0.00 39.48 39.35 2nx3 n PHE 167 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2nx3 h ARG 168 N 0.00 0.00 -0.55 -1.08 3.08 -2.03 -2.85 114.38 110.96 2nx3 h ARG 168 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 2nx3 h ARG 168 Cb 0.05 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.07 2nx3 h ARG 168 CO 0.00 0.06 0.17 0.66 -1.07 0.00 0.00 179.97 179.79 2nx3 h SER 169 N 0.00 0.75 0.39 7.04 4.64 -1.58 -2.91 113.55 121.88 2nx3 h SER 169 Ca -0.00 -0.12 -0.01 0.00 -0.47 0.00 0.00 61.79 61.19 2nx3 h SER 169 Cb 0.31 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.18 2nx3 h SER 169 CO 0.01 0.72 -0.46 -0.07 -0.87 0.00 0.00 176.83 176.16 2nx3 h LEU 170 N 0.80 -1.27 -0.93 5.97 4.07 -1.72 0.14 115.31 122.36 2nx3 h LEU 170 Ca 0.18 0.11 0.00 0.00 0.08 0.00 0.00 57.88 58.25 2nx3 h LEU 170 Cb 0.23 0.43 0.00 0.00 1.08 0.00 0.00 40.66 42.40 2nx3 h LEU 170 CO -0.01 -0.58 0.00 -0.81 -1.08 0.00 0.00 178.44 175.96 2nx3 n PRO 171 N -5.17 0.15 -0.04 1.13 -0.04 -1.21 -1.89 135.00 127.93 2nx3 n PRO 171 Ca -0.10 0.51 -0.20 0.00 -0.04 0.00 0.00 63.50 63.66 2nx3 n PRO 171 Cb 0.41 -1.87 -0.13 0.00 -0.04 0.00 0.00 33.50 31.86 2nx3 n PRO 171 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2nx3 h ILE 172 N 0.00 1.12 0.00 0.52 2.04 -1.15 -3.37 117.51 116.67 2nx3 h ILE 172 Ca 0.00 -2.32 -0.09 0.00 1.00 0.00 0.00 64.86 63.45 2nx3 h ILE 172 Cb 0.19 2.68 -0.01 0.00 -0.74 0.00 0.00 36.82 38.94 2nx3 h ILE 172 CO 0.00 0.57 -0.41 0.24 0.00 0.00 0.00 178.15 178.55 2nx3 h MET 173 N -0.62 0.00 0.00 2.37 2.86 -0.66 -2.92 114.93 115.95 2nx3 h MET 173 Ca -0.27 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 2nx3 h MET 173 Cb 1.50 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.16 2nx3 h MET 173 CO -0.03 0.41 0.06 -0.22 1.06 0.00 0.00 176.91 178.20 2nx3 h LYS 174 N 0.00 0.00 0.00 1.72 3.64 -1.54 -2.10 116.57 118.29 2nx3 h LYS 174 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2nx3 h LYS 174 Cb 0.87 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 2nx3 h LYS 174 CO 0.05 0.00 0.00 1.04 -2.27 0.00 0.00 179.45 178.27 2nx3 n GLN 175 N -2.88 0.02 -0.12 1.90 6.02 -1.10 -3.72 117.38 117.49 2nx3 n GLN 175 Ca -0.03 0.32 0.00 0.00 -0.01 0.00 0.00 57.00 57.29 2nx3 n GLN 175 Cb 0.12 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.88 2nx3 n GLN 175 CO 0.00 0.00 0.00 -2.67 -1.01 0.00 0.00 177.06 173.38 2nx3 n TRP 176 N -1.47 0.00 -3.61 1.08 2.14 -0.80 -5.14 117.44 109.64 2nx3 n TRP 176 Ca 0.02 0.00 -0.02 0.00 2.07 0.00 0.00 57.50 59.57 2nx3 n TRP 176 Cb 0.10 0.10 -0.01 0.00 -0.81 0.00 0.00 31.31 30.69 2nx3 n TRP 176 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 2nx3 s ALA 177 N 0.00 -2.12 0.06 -1.67 0.00 -1.15 -4.97 121.76 111.90 2nx3 s ALA 177 Ca 0.00 1.21 -0.30 0.00 0.00 0.00 0.00 51.96 52.87 2nx3 s ALA 177 Cb 0.00 0.09 -0.05 0.00 0.00 0.00 0.00 23.12 23.16 2nx3 s ALA 177 CO 0.00 -0.78 1.04 0.15 0.00 0.00 0.00 175.76 176.17 2nx3 s LYS 178 N -2.46 4.56 -0.19 0.00 1.02 -1.04 -4.20 119.74 117.44 2nx3 s LYS 178 Ca 0.11 1.54 -0.10 0.00 0.02 0.00 0.00 55.97 57.54 2nx3 s LYS 178 Cb 0.01 -3.40 -0.05 0.00 -0.52 0.00 0.00 37.83 33.88 2nx3 s LYS 178 CO -0.04 -0.03 0.15 0.08 -0.92 0.00 0.00 175.35 174.59 2nx3 s VAL 179 N 0.68 5.41 0.00 3.17 1.01 -1.26 -0.93 120.40 128.47 2nx3 s VAL 179 Ca 0.52 0.24 0.08 0.00 0.00 0.00 0.00 61.98 62.81 2nx3 s VAL 179 Cb -0.24 -3.48 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 2nx3 s VAL 179 CO 0.29 0.45 -0.23 -0.63 0.00 0.00 0.00 175.10 174.99 2nx3 s ILE 180 N 0.22 2.33 -0.19 2.22 -1.09 0.17 -0.52 121.20 124.33 2nx3 s ILE 180 Ca 0.10 -1.13 -0.05 0.00 -2.23 0.00 0.00 60.65 57.33 2nx3 s ILE 180 Cb -0.11 -1.88 -0.03 0.00 -1.58 0.00 0.00 42.46 38.86 2nx3 s ILE 180 CO -0.01 0.49 0.01 -0.47 -1.23 0.00 0.00 174.94 173.74 2nx3 s TYR 181 N -0.72 3.08 -0.68 3.97 5.04 -0.33 -0.22 117.35 127.48 2nx3 s TYR 181 Ca 0.11 -0.33 -0.22 0.00 -2.44 0.00 0.00 57.07 54.19 2nx3 s TYR 181 Cb -0.10 -2.08 0.07 0.00 0.35 0.00 0.00 41.96 40.20 2nx3 s TYR 181 CO 0.01 -0.15 0.99 0.34 -1.34 0.00 0.00 175.55 175.40 2nx3 s ASP 182 N 0.84 6.21 0.39 4.32 -1.08 0.63 -0.23 116.67 127.75 2nx3 s ASP 182 Ca 0.01 -1.05 0.18 0.00 -0.52 0.00 0.00 52.55 51.17 2nx3 s ASP 182 Cb -0.14 -2.42 0.81 0.00 -1.46 0.00 0.00 42.92 39.70 2nx3 s ASP 182 CO 0.02 -1.43 1.81 0.00 0.52 0.00 0.00 175.17 176.09 2nx3 h ALA 183 N 9.54 1.15 0.08 3.66 0.00 -1.12 -3.13 119.26 129.44 2nx3 h ALA 183 Ca -0.25 -0.31 -0.26 0.00 0.00 0.00 0.00 54.91 54.09 2nx3 h ALA 183 Cb 1.07 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2nx3 h ALA 183 CO 1.18 0.43 -1.33 1.79 0.00 0.00 0.00 179.25 181.32 2nx3 h THR 184 N 0.00 1.02 -0.00 0.00 1.35 -1.87 -3.39 112.91 110.03 2nx3 h THR 184 Ca -0.00 -2.35 0.00 0.00 -0.55 0.00 0.00 66.41 63.51 2nx3 h THR 184 Cb 0.75 2.64 0.00 0.00 -1.73 0.00 0.00 68.15 69.81 2nx3 h THR 184 CO 0.04 0.64 -0.18 1.41 -0.25 0.00 0.00 175.52 177.18 2nx3 n HIS 185 N -4.04 0.00 0.23 4.73 8.25 -1.26 -3.48 115.22 119.67 2nx3 n HIS 185 Ca -0.26 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.32 2nx3 n HIS 185 Cb 0.84 -0.35 0.45 0.00 1.12 0.00 0.00 29.99 32.05 2nx3 n HIS 185 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 2nx3 h SER 186 N 0.12 0.00 -0.36 0.41 0.02 -1.68 -2.96 113.55 109.10 2nx3 h SER 186 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2nx3 h SER 186 Cb 0.46 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.00 2nx3 h SER 186 CO 0.00 0.13 0.00 1.33 -1.14 0.00 0.00 176.83 177.15 2nx3 n VAL 187 N -3.22 1.81 -2.54 2.27 0.24 -1.23 -4.71 118.33 110.95 2nx3 n VAL 187 Ca 0.01 -1.46 -0.29 0.00 -2.04 0.00 0.00 64.34 60.56 2nx3 n VAL 187 Cb 0.43 0.06 -0.01 0.00 -1.47 0.00 0.00 33.84 32.85 2nx3 n VAL 187 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2nx3 s GLN 188 N -2.06 3.63 -0.46 7.34 -2.07 -1.12 -2.90 119.66 122.02 2nx3 s GLN 188 Ca 0.38 0.40 -0.01 0.00 -1.82 0.00 0.00 55.36 54.31 2nx3 s GLN 188 Cb 0.27 -2.31 0.12 0.00 -1.09 0.00 0.00 33.01 30.00 2nx3 s GLN 188 CO 0.14 -0.23 0.24 -0.51 -1.32 0.00 0.00 175.29 173.60 2nx3 s LEU 189 N -4.57 5.08 -0.00 2.60 1.43 0.18 -4.22 118.68 119.18 2nx3 s LEU 189 Ca 0.50 -2.33 -0.35 0.00 -1.03 0.00 0.00 54.13 50.92 2nx3 s LEU 189 Cb -0.10 -1.78 -0.13 0.00 0.03 0.00 0.00 46.19 44.20 2nx3 s LEU 189 CO 0.43 -0.45 1.70 -0.81 0.23 0.00 0.00 176.35 177.45 2nx3 n PRO 190 N 4.15 1.95 -1.53 1.29 -0.04 -1.26 -0.89 135.00 138.68 2nx3 n PRO 190 Ca 0.02 0.71 -0.18 0.00 -0.04 0.00 0.00 63.50 64.00 2nx3 n PRO 190 Cb 0.40 -2.49 -0.08 0.00 -0.04 0.00 0.00 33.50 31.29 2nx3 n PRO 190 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2nx3 n GLY 191 N 3.84 1.74 0.24 0.55 0.00 -1.26 -4.17 105.19 106.13 2nx3 n GLY 191 Ca 0.21 -0.06 0.16 0.00 0.00 0.00 0.00 46.02 46.33 2nx3 n GLY 191 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2nx3 h GLY 192 N 0.00 0.00 -2.17 -0.02 0.00 -1.02 -2.96 103.07 96.90 2nx3 h GLY 192 Ca -0.37 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 46.76 2nx3 h GLY 192 CO 0.54 0.00 -0.05 1.04 0.00 0.00 0.00 176.54 178.07 2nx3 n LEU 193 N -2.73 4.28 0.00 3.11 4.77 0.29 -4.76 117.00 121.96 2nx3 n LEU 193 Ca -0.00 -3.80 0.00 0.00 -0.03 0.00 0.00 56.01 52.18 2nx3 n LEU 193 Cb 0.17 -0.65 0.00 0.00 -2.33 0.00 0.00 43.42 40.61 2nx3 n LEU 193 CO 0.20 1.27 0.00 0.61 -1.33 0.00 0.00 177.39 178.15 2nx3 n GLY 194 N -1.13 1.83 0.87 -0.72 0.00 -1.12 -3.56 105.19 101.37 2nx3 n GLY 194 Ca 0.35 -0.25 0.08 0.00 0.00 0.00 0.00 46.02 46.20 2nx3 n GLY 194 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2nx3 n ASP 195 N 4.85 3.77 -3.79 1.61 5.75 -1.26 -4.90 116.55 122.59 2nx3 n ASP 195 Ca 0.00 -2.86 -0.13 0.00 -0.01 0.00 0.00 54.79 51.79 2nx3 n ASP 195 Cb 0.00 -0.50 -0.10 0.00 -1.03 0.00 0.00 41.12 39.49 2nx3 n ASP 195 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2nx3 s LYS 196 N -2.55 0.46 0.50 0.11 1.02 -1.23 -3.27 119.74 114.77 2nx3 s LYS 196 Ca 0.40 0.04 -0.18 0.00 0.02 0.00 0.00 55.97 56.25 2nx3 s LYS 196 Cb 0.31 0.21 -0.08 0.00 -0.52 0.00 0.00 37.83 37.74 2nx3 s LYS 196 CO 0.10 -0.10 0.98 -1.12 -0.92 0.00 0.00 175.35 174.29 2nx3 s SER 197 N -0.62 6.66 0.00 2.83 0.01 -1.26 0.11 113.70 121.43 2nx3 s SER 197 Ca -0.07 1.61 0.00 0.00 1.31 0.00 0.00 55.95 58.80 2nx3 s SER 197 Cb -0.04 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.67 2nx3 s SER 197 CO 0.02 -0.56 0.00 0.61 0.41 0.00 0.00 173.24 173.72 2nx3 n GLY 198 N -1.33 7.51 0.00 3.44 0.00 -0.14 -4.58 105.19 110.08 2nx3 n GLY 198 Ca 0.07 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.07 2nx3 n GLY 198 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nx3 n GLY 199 N 5.00 0.35 2.54 -0.02 0.00 -1.26 -0.64 105.19 111.15 2nx3 n GLY 199 Ca 0.00 -1.19 -0.29 0.00 0.00 0.00 0.00 46.02 44.54 2nx3 n GLY 199 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2nx3 s MET 200 N -2.00 0.27 0.08 1.61 0.23 -1.14 -4.91 119.30 113.43 2nx3 s MET 200 Ca 0.00 -0.68 0.05 0.00 -1.03 0.00 0.00 55.69 54.03 2nx3 s MET 200 Cb 0.00 -1.22 0.27 0.00 -1.53 0.00 0.00 34.83 32.35 2nx3 s MET 200 CO 0.00 -1.05 1.13 2.89 -2.03 0.00 0.00 175.02 175.96 2nx3 n ARG 201 N 5.04 0.03 0.30 3.16 0.00 -1.25 -2.24 116.66 121.70 2nx3 n ARG 201 Ca -0.03 0.51 0.20 0.00 -0.00 0.00 0.00 57.85 58.53 2nx3 n ARG 201 Cb 0.41 -1.63 0.98 0.00 -0.00 0.00 0.00 32.46 32.22 2nx3 n ARG 201 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.63 178.68 2nx3 h GLU 202 N 0.00 0.00 -0.10 2.89 4.11 -1.94 -2.58 114.58 116.96 2nx3 h GLU 202 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2nx3 h GLU 202 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2nx3 h GLU 202 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 179.01 180.27 2nx3 n PHE 203 N -2.99 0.11 -0.01 2.06 3.72 -0.95 -4.66 117.46 114.73 2nx3 n PHE 203 Ca -0.02 -0.07 -0.12 0.00 -0.05 0.00 0.00 57.45 57.19 2nx3 n PHE 203 Cb 0.15 -0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.61 2nx3 n PHE 203 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 2nx3 h ILE 204 N 3.35 1.27 0.26 4.37 2.04 -1.64 -2.95 117.51 124.20 2nx3 h ILE 204 Ca 0.00 -0.82 -0.01 0.00 1.00 0.00 0.00 64.86 65.03 2nx3 h ILE 204 Cb 0.74 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.56 2nx3 h ILE 204 CO 0.00 0.22 -0.13 0.15 0.00 0.00 0.00 178.15 178.40 2nx3 h PHE 205 N -0.24 -0.33 -0.59 1.37 3.57 -1.83 -2.37 116.94 116.52 2nx3 h PHE 205 Ca 0.01 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.62 2nx3 h PHE 205 Cb 0.36 0.11 -0.11 0.00 2.79 0.00 0.00 35.95 39.09 2nx3 h PHE 205 CO 0.04 -0.06 -0.13 -1.35 -2.23 0.00 0.00 178.31 174.58 2nx3 h PRO 206 N -0.57 0.01 0.00 6.41 0.11 -1.85 0.94 132.00 137.06 2nx3 h PRO 206 Ca -0.04 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.02 2nx3 h PRO 206 Cb 0.41 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.52 2nx3 h PRO 206 CO 0.06 0.01 -0.25 -0.07 -0.21 0.00 0.00 178.00 177.53 2nx3 h LEU 207 N 0.01 0.00 -0.22 2.35 3.38 -1.52 -2.19 115.31 117.12 2nx3 h LEU 207 Ca 0.29 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.24 2nx3 h LEU 207 Cb 0.44 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2nx3 h LEU 207 CO -0.60 0.25 0.07 0.40 0.09 0.00 0.00 178.44 178.66 2nx3 h ILE 208 N 0.00 1.19 -0.83 1.22 2.04 -0.30 -0.35 117.51 120.48 2nx3 h ILE 208 Ca -0.00 -0.61 0.05 0.00 1.00 0.00 0.00 64.86 65.30 2nx3 h ILE 208 Cb 0.55 1.17 -0.06 0.00 -0.74 0.00 0.00 36.82 37.75 2nx3 h ILE 208 CO 0.03 0.20 0.52 0.03 0.00 0.00 0.00 178.15 178.93 2nx3 h ARG 209 N 0.19 0.94 -0.29 2.37 3.08 -0.82 -1.73 114.38 118.12 2nx3 h ARG 209 Ca 0.07 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.07 2nx3 h ARG 209 Cb 0.24 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 2nx3 h ARG 209 CO -0.00 0.62 0.17 0.00 -1.07 0.00 0.00 179.97 179.69 2nx3 h ALA 210 N 1.38 0.36 -0.41 0.04 0.00 -1.00 -0.54 119.26 119.09 2nx3 h ALA 210 Ca 0.35 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.29 2nx3 h ALA 210 Cb 0.12 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 2nx3 h ALA 210 CO -0.15 -0.20 0.19 0.00 0.00 0.00 0.00 179.25 179.09 2nx3 h ALA 211 N 1.12 0.51 -0.16 0.00 0.00 -0.23 0.21 119.26 120.71 2nx3 h ALA 211 Ca 0.11 0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.88 2nx3 h ALA 211 Cb -0.01 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2nx3 h ALA 211 CO -0.04 -0.18 -0.61 -0.39 0.00 0.00 0.00 179.25 178.03 2nx3 h VAL 212 N 0.39 1.33 -0.86 0.00 -1.51 -1.21 -0.63 116.25 113.75 2nx3 h VAL 212 Ca 0.18 -1.89 -0.03 0.00 -1.23 0.00 0.00 66.70 63.74 2nx3 h VAL 212 Cb 0.11 1.86 -0.04 0.00 -2.13 0.00 0.00 31.29 31.10 2nx3 h VAL 212 CO -0.14 0.58 0.42 0.00 -1.23 0.00 0.00 177.57 177.20 2nx3 h ALA 213 N 0.94 1.11 -0.20 5.19 0.00 -0.70 -2.72 119.26 122.87 2nx3 h ALA 213 Ca -0.00 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 2nx3 h ALA 213 Cb 1.16 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 2nx3 h ALA 213 CO 0.11 0.67 -0.23 0.28 0.00 0.00 0.00 179.25 180.08 2nx3 h VAL 214 N 1.23 1.33 0.00 0.00 2.07 -0.85 -3.47 116.25 116.56 2nx3 h VAL 214 Ca 0.30 -1.41 0.00 0.00 0.82 0.00 0.00 66.70 66.41 2nx3 h VAL 214 Cb 0.10 1.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 2nx3 h VAL 214 CO -0.04 0.43 0.00 0.61 0.02 0.00 0.00 177.57 178.59 2nx3 n GLY 215 N 0.23 2.45 3.19 2.17 0.00 -0.25 -4.80 105.19 108.18 2nx3 n GLY 215 Ca -0.05 -0.82 -0.10 0.00 0.00 0.00 0.00 46.02 45.05 2nx3 n GLY 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nx3 n ASP 217 N -0.11 0.61 -3.61 0.00 8.00 0.32 -4.98 116.55 116.77 2nx3 n ASP 217 Ca -0.06 0.01 -0.03 0.00 0.71 0.00 0.00 54.79 55.42 2nx3 n ASP 217 Cb 0.63 0.20 -0.02 0.00 -0.02 0.00 0.00 41.12 41.91 2nx3 n ASP 217 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2nx3 s GLY 218 N -3.44 -0.30 -0.05 0.44 0.00 -1.15 -1.73 107.32 101.09 2nx3 s GLY 218 Ca 0.08 1.51 0.04 0.00 0.00 0.00 0.00 44.72 46.34 2nx3 s GLY 218 CO 0.71 0.48 -0.16 0.14 0.00 0.00 0.00 173.10 174.28 2nx3 s VAL 219 N -2.33 2.94 -0.29 1.40 1.01 0.34 -1.19 120.40 122.29 2nx3 s VAL 219 Ca 0.11 -0.77 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 2nx3 s VAL 219 Cb 0.00 -2.14 0.04 0.00 0.00 0.00 0.00 36.38 34.28 2nx3 s VAL 219 CO -0.04 0.59 -0.01 0.12 0.00 0.00 0.00 175.10 175.75 2nx3 s PHE 220 N -0.63 3.21 -0.08 5.22 5.36 0.68 -1.03 117.98 130.72 2nx3 s PHE 220 Ca 0.09 -1.78 -0.03 0.00 -0.96 0.00 0.00 56.93 54.25 2nx3 s PHE 220 Cb -0.11 -2.10 0.05 0.00 -0.34 0.00 0.00 43.02 40.52 2nx3 s PHE 220 CO 0.01 -0.78 0.15 0.00 -1.46 0.00 0.00 175.22 173.14 2nx3 s MET 221 N 1.27 0.03 0.23 10.12 0.23 -0.21 -0.55 119.30 130.43 2nx3 s MET 221 Ca -0.04 0.54 -0.26 0.00 -1.03 0.00 0.00 55.69 54.90 2nx3 s MET 221 Cb -0.19 -0.28 -0.09 0.00 -1.53 0.00 0.00 34.83 32.75 2nx3 s MET 221 CO -0.02 -0.30 0.86 -1.21 -2.03 0.00 0.00 175.02 172.33 2nx3 s GLU 222 N 2.19 4.62 0.29 3.16 2.02 -1.26 -3.83 118.70 125.89 2nx3 s GLU 222 Ca 0.02 1.26 0.03 0.00 0.02 0.00 0.00 54.97 56.30 2nx3 s GLU 222 Cb -0.12 -3.11 -0.06 0.00 0.10 0.00 0.00 34.13 30.95 2nx3 s GLU 222 CO -0.06 0.46 0.08 -0.08 0.02 0.00 0.00 175.26 175.69 2nx3 s THR 223 N -1.32 0.86 -0.24 3.63 -1.32 -0.45 -2.36 115.64 114.45 2nx3 s THR 223 Ca 0.42 -2.00 -0.27 0.00 -1.21 0.00 0.00 61.69 58.63 2nx3 s THR 223 Cb -0.22 -2.71 0.12 0.00 -1.51 0.00 0.00 72.50 68.18 2nx3 s THR 223 CO 0.27 0.00 0.97 -2.28 -2.21 0.00 0.00 174.62 171.37 2nx3 s HIS 224 N -3.52 -0.49 0.18 9.09 5.04 -0.76 -3.67 115.29 121.16 2nx3 s HIS 224 Ca 0.37 1.09 -0.16 0.00 -1.54 0.00 0.00 55.06 54.82 2nx3 s HIS 224 Cb 0.08 0.38 0.13 0.00 0.04 0.00 0.00 32.58 33.21 2nx3 s HIS 224 CO 0.15 -0.29 1.67 -1.35 -2.34 0.00 0.00 174.74 172.57 2nx3 h PRO 225 N 3.78 0.02 -2.69 2.88 0.11 -1.94 -2.84 132.00 131.32 2nx3 h PRO 225 Ca -0.26 -0.00 -0.60 0.00 0.11 0.00 0.00 66.00 65.25 2nx3 h PRO 225 Cb 1.17 -0.00 -0.39 0.00 0.11 0.00 0.00 31.00 31.88 2nx3 h PRO 225 CO 0.17 0.01 -0.82 -1.21 -0.21 0.00 0.00 178.00 175.94 2nx3 s GLU 226 N -6.21 1.17 0.42 1.05 2.02 -1.26 -4.44 118.70 111.45 2nx3 s GLU 226 Ca -0.14 -2.11 0.23 0.00 0.02 0.00 0.00 54.97 52.97 2nx3 s GLU 226 Cb 0.15 -1.95 1.23 0.00 0.10 0.00 0.00 34.13 33.67 2nx3 s GLU 226 CO 0.71 -1.27 1.73 -1.00 0.02 0.00 0.00 175.26 175.45 2nx3 h PRO 227 N 6.18 0.27 0.00 0.39 0.13 -1.85 0.19 132.00 137.30 2nx3 h PRO 227 Ca 0.13 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2nx3 h PRO 227 Cb 0.90 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 31.97 2nx3 h PRO 227 CO 0.43 0.18 -0.01 0.93 -0.23 0.00 0.00 178.00 179.30 2nx3 h GLU 228 N 0.27 0.00 -0.40 0.86 4.39 -1.92 -1.10 114.58 116.68 2nx3 h GLU 228 Ca 0.65 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.35 2nx3 h GLU 228 Cb 1.87 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.52 2nx3 h GLU 228 CO -0.31 0.01 0.00 1.63 -1.16 0.00 0.00 179.01 179.18 2nx3 n LYS 229 N -3.36 2.61 -1.84 2.33 5.02 0.66 -5.01 118.16 118.57 2nx3 n LYS 229 Ca -0.03 -2.12 -0.36 0.00 -2.02 0.00 0.00 58.31 53.78 2nx3 n LYS 229 Cb 0.10 -1.34 0.05 0.00 -0.02 0.00 0.00 35.03 33.82 2nx3 n LYS 229 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2nx3 s ALA 230 N -1.03 2.43 -2.59 7.82 0.00 -0.42 -4.92 121.76 123.06 2nx3 s ALA 230 Ca 0.29 1.08 0.27 0.00 0.00 0.00 0.00 51.96 53.60 2nx3 s ALA 230 Cb 0.15 -3.50 0.76 0.00 0.00 0.00 0.00 23.12 20.54 2nx3 s ALA 230 CO 0.20 -1.42 1.58 1.28 0.00 0.00 0.00 175.76 177.41 2nx3 n LEU 231 N -1.84 1.91 -3.63 0.00 4.77 -1.26 -4.63 117.00 112.31 2nx3 n LEU 231 Ca 0.15 -0.63 -0.11 0.00 -0.03 0.00 0.00 56.01 55.38 2nx3 n LEU 231 Cb 0.49 -0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.50 2nx3 n LEU 231 CO 0.46 0.32 0.50 -0.55 -1.33 0.00 0.00 177.39 176.79 2nx3 s SER 232 N -2.04 -0.69 -1.23 -1.43 0.15 -1.26 -4.47 113.70 102.73 2nx3 s SER 232 Ca 0.34 1.28 0.00 0.00 0.70 0.00 0.00 55.95 58.27 2nx3 s SER 232 Cb 0.21 1.30 0.00 0.00 -1.71 0.00 0.00 66.02 65.81 2nx3 s SER 232 CO 0.34 -0.22 0.00 0.47 1.20 0.00 0.00 173.24 175.03 2nx3 n ASP 233 N 2.85 -4.17 -0.19 5.45 10.43 -1.26 -4.83 116.55 124.82 2nx3 n ASP 233 Ca -0.15 0.19 -0.03 0.00 2.57 0.00 0.00 54.79 57.37 2nx3 n ASP 233 Cb 0.56 -3.57 0.04 0.00 1.84 0.00 0.00 41.12 39.99 2nx3 n ASP 233 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2nx3 h ALA 234 N 0.95 0.23 0.00 2.24 0.00 -1.82 -0.52 119.26 120.34 2nx3 h ALA 234 Ca -0.32 0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2nx3 h ALA 234 Cb 1.19 0.57 0.00 0.00 0.00 0.00 0.00 17.79 19.56 2nx3 h ALA 234 CO 0.39 -0.52 0.08 -2.30 0.00 0.00 0.00 179.25 176.90 2nx3 n PRO 235 N -5.43 0.08 -0.08 0.00 -0.02 -1.26 -2.05 135.00 126.25 2nx3 n PRO 235 Ca 0.06 0.56 0.02 0.00 -2.02 0.00 0.00 63.50 62.12 2nx3 n PRO 235 Cb 0.33 -1.85 0.07 0.00 -0.02 0.00 0.00 33.50 32.03 2nx3 n PRO 235 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2nx3 n THR 236 N -1.95 0.99 -3.08 3.45 -2.24 -0.22 -3.92 114.28 107.32 2nx3 n THR 236 Ca -0.01 -1.00 -0.39 0.00 -2.27 0.00 0.00 64.05 60.38 2nx3 n THR 236 Cb 0.10 0.50 -0.05 0.00 -2.10 0.00 0.00 70.33 68.78 2nx3 n THR 236 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nx3 s ALA 237 N -1.00 3.39 0.04 6.98 0.00 -0.87 -4.79 121.76 125.51 2nx3 s ALA 237 Ca 0.10 0.13 -0.25 0.00 0.00 0.00 0.00 51.96 51.95 2nx3 s ALA 237 Cb 0.05 -2.90 -0.05 0.00 0.00 0.00 0.00 23.12 20.22 2nx3 s ALA 237 CO 0.07 0.02 0.76 -0.51 0.00 0.00 0.00 175.76 176.10 2nx3 s LEU 238 N 0.28 4.45 0.65 0.00 2.01 -0.99 -4.74 118.68 120.33 2nx3 s LEU 238 Ca 0.36 1.43 -0.17 0.00 0.01 0.00 0.00 54.13 55.75 2nx3 s LEU 238 Cb -0.18 -3.21 -0.03 0.00 0.01 0.00 0.00 46.19 42.77 2nx3 s LEU 238 CO 0.19 0.02 0.91 -2.65 1.01 0.00 0.00 176.35 175.83 2nx3 n PRO 239 N 2.81 0.70 -0.00 1.29 -0.02 -1.26 -1.83 135.00 136.69 2nx3 n PRO 239 Ca -0.03 0.29 -0.02 0.00 -2.02 0.00 0.00 63.50 61.72 2nx3 n PRO 239 Cb 0.50 -2.14 0.25 0.00 -0.02 0.00 0.00 33.50 32.09 2nx3 n PRO 239 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2nx3 h LEU 240 N 0.16 0.51 0.00 2.45 5.85 -1.71 -2.89 115.31 119.67 2nx3 h LEU 240 Ca -0.48 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.11 2nx3 h LEU 240 Cb 1.36 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.25 2nx3 h LEU 240 CO 0.49 0.65 0.00 -1.54 -0.34 0.00 0.00 178.44 177.70 2nx3 n SER 241 N -4.21 0.00 -0.00 1.25 3.41 -1.26 -2.83 113.62 109.97 2nx3 n SER 241 Ca 0.01 -0.10 0.10 0.00 -0.26 0.00 0.00 58.87 58.62 2nx3 n SER 241 Cb 0.31 -0.22 -0.13 0.00 -0.26 0.00 0.00 64.21 63.91 2nx3 n SER 241 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nx3 n GLN 242 N -1.22 0.39 -0.18 4.33 6.02 -1.09 -4.50 117.38 121.13 2nx3 n GLN 242 Ca 0.09 -0.07 -0.03 0.00 -0.01 0.00 0.00 57.00 56.99 2nx3 n GLN 242 Cb 0.12 -1.48 0.07 0.00 1.02 0.00 0.00 30.24 29.98 2nx3 n GLN 242 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2nx3 h LEU 243 N 0.00 0.26 0.20 1.08 3.38 -1.64 -2.31 115.31 116.28 2nx3 h LEU 243 Ca 0.00 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2nx3 h LEU 243 Cb 0.65 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 2nx3 h LEU 243 CO 0.00 0.18 -0.22 -0.08 0.09 0.00 0.00 178.44 178.41 2nx3 h GLU 244 N 0.42 -0.44 -0.16 1.13 4.81 -1.80 -0.56 114.58 117.98 2nx3 h GLU 244 Ca 0.25 0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.56 2nx3 h GLU 244 Cb 0.25 0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.68 2nx3 h GLU 244 CO -0.23 -0.30 -0.15 0.78 -0.73 0.00 0.00 179.01 178.39 2nx3 h GLY 245 N -0.46 -0.04 0.78 1.92 0.00 -1.79 -1.00 103.07 102.47 2nx3 h GLY 245 Ca 0.00 0.18 0.06 0.00 0.00 0.00 0.00 47.33 47.57 2nx3 h GLY 245 CO -0.06 -0.15 0.65 -2.22 0.00 0.00 0.00 176.54 174.76 2nx3 h ILE 246 N -0.17 1.11 -0.40 2.60 5.03 -1.29 -0.90 117.51 123.49 2nx3 h ILE 246 Ca 0.11 -0.41 -0.07 0.00 -0.12 0.00 0.00 64.86 64.37 2nx3 h ILE 246 Cb 0.32 -0.19 -0.02 0.00 -3.03 0.00 0.00 36.82 33.90 2nx3 h ILE 246 CO -0.26 0.22 -0.04 0.40 -0.68 0.00 0.00 178.15 177.78 2nx3 h ILE 247 N 1.19 1.23 -0.30 -0.67 2.04 -0.38 -0.89 117.51 119.74 2nx3 h ILE 247 Ca 0.42 -0.99 -0.09 0.00 1.00 0.00 0.00 64.86 65.20 2nx3 h ILE 247 Cb 0.14 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 2nx3 h ILE 247 CO -0.16 0.34 -0.17 -0.08 0.00 0.00 0.00 178.15 178.08 2nx3 h GLU 248 N 0.62 0.64 -0.58 2.37 4.57 -0.19 -2.58 114.58 119.43 2nx3 h GLU 248 Ca 0.12 -0.29 0.02 0.00 -1.18 0.00 0.00 59.36 58.03 2nx3 h GLU 248 Cb 0.46 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.00 2nx3 h GLU 248 CO 0.02 0.88 0.37 0.00 -1.18 0.00 0.00 179.01 179.10 2nx3 h ALA 249 N 0.74 0.75 -0.68 2.92 0.00 -0.89 -2.25 119.26 119.85 2nx3 h ALA 249 Ca 0.06 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2nx3 h ALA 249 Cb 0.70 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2nx3 h ALA 249 CO 0.05 0.13 0.45 0.82 0.00 0.00 0.00 179.25 180.70 2nx3 h ILE 250 N 0.75 1.17 -0.51 0.00 2.04 -1.08 -1.92 117.51 117.97 2nx3 h ILE 250 Ca 0.22 -0.31 -0.09 0.00 1.00 0.00 0.00 64.86 65.68 2nx3 h ILE 250 Cb -0.03 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.20 2nx3 h ILE 250 CO -0.07 0.17 -0.05 -0.07 0.00 0.00 0.00 178.15 178.13 2nx3 h LEU 251 N 0.92 0.87 -0.27 1.44 3.38 -1.15 -0.86 115.31 119.64 2nx3 h LEU 251 Ca 0.25 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2nx3 h LEU 251 Cb -0.10 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.41 2nx3 h LEU 251 CO -0.05 0.95 -0.07 -0.33 0.09 0.00 0.00 178.44 179.03 2nx3 h GLU 252 N 0.81 0.52 -0.39 1.13 5.08 -1.17 -0.51 114.58 120.04 2nx3 h GLU 252 Ca 0.14 -0.20 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 2nx3 h GLU 252 Cb 0.55 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 2nx3 h GLU 252 CO 0.03 0.73 0.05 0.82 -1.00 0.00 0.00 179.01 179.65 2nx3 h ILE 253 N 0.26 1.24 -0.22 3.13 2.04 -1.29 -2.29 117.51 120.39 2nx3 h ILE 253 Ca 0.07 -0.89 -0.04 0.00 1.00 0.00 0.00 64.86 65.00 2nx3 h ILE 253 Cb 0.55 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.68 2nx3 h ILE 253 CO 0.03 0.30 -0.04 -0.09 0.00 0.00 0.00 178.15 178.35 2nx3 h ARG 254 N 0.50 0.33 0.07 2.37 2.43 -1.13 0.46 114.38 119.41 2nx3 h ARG 254 Ca 0.12 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.22 2nx3 h ARG 254 Cb 0.38 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 2nx3 h ARG 254 CO 0.01 0.40 -0.03 1.49 -1.51 0.00 0.00 179.97 180.32 2nx3 h GLU 255 N 0.32 -0.09 -0.06 0.20 4.81 -0.57 -1.21 114.58 117.99 2nx3 h GLU 255 Ca 0.07 0.01 -0.19 0.00 -0.13 0.00 0.00 59.36 59.12 2nx3 h GLU 255 Cb 0.28 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 2nx3 h GLU 255 CO 0.01 0.02 -0.78 0.28 -0.73 0.00 0.00 179.01 177.81 2nx3 h VAL 256 N -0.17 1.39 0.10 0.32 2.07 -1.10 -3.36 116.25 115.50 2nx3 h VAL 256 Ca -0.01 -2.23 -0.29 0.00 0.82 0.00 0.00 66.70 64.99 2nx3 h VAL 256 Cb 0.14 2.20 -0.01 0.00 -1.52 0.00 0.00 31.29 32.09 2nx3 h VAL 256 CO 0.01 0.67 -1.45 0.00 0.02 0.00 0.00 177.57 176.82 2nx3 h ALA 257 N 0.90 0.30 -1.23 1.67 0.00 -0.91 -3.35 119.26 116.63 2nx3 h ALA 257 Ca -0.04 -1.09 0.36 0.00 0.00 0.00 0.00 54.91 54.13 2nx3 h ALA 257 Cb 1.37 0.22 -0.05 0.00 0.00 0.00 0.00 17.79 19.33 2nx3 h ALA 257 CO 0.13 1.17 0.95 0.66 0.00 0.00 0.00 179.25 182.16 2nx3 h SER 258 N 0.06 0.00 -0.08 0.00 4.64 -1.37 0.74 113.55 117.54 2nx3 h SER 258 Ca -0.21 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.14 2nx3 h SER 258 Cb 1.98 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 64.07 2nx3 h SER 258 CO 0.16 0.00 0.08 0.50 -0.87 0.00 0.00 176.83 176.70 2nx3 h LYS 259 N 0.00 0.00 0.00 4.77 3.64 -1.79 -2.76 116.57 120.43 2nx3 h LYS 259 Ca 0.59 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.97 2nx3 h LYS 259 Cb 2.48 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 34.30 2nx3 h LYS 259 CO -0.01 0.00 -0.98 0.66 -2.27 0.00 0.00 179.45 176.85 2nx3 n TYR 260 N -4.01 0.00 -1.55 1.91 4.01 0.26 -4.99 117.16 112.79 2nx3 n TYR 260 Ca -0.01 0.00 -0.50 0.00 -0.16 0.00 0.00 57.90 57.23 2nx3 n TYR 260 Cb 0.18 -0.08 -0.04 0.00 -0.31 0.00 0.00 39.34 39.09 2nx3 n TYR 260 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2nx3 n TYR 261 N -1.53 1.03 -2.15 -0.72 4.01 -1.04 -4.83 117.16 111.92 2nx3 n TYR 261 Ca 0.02 0.76 -0.41 0.00 -0.16 0.00 0.00 57.90 58.10 2nx3 n TYR 261 Cb 0.30 -2.22 -0.03 0.00 -0.31 0.00 0.00 39.34 37.08 2nx3 n TYR 261 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 2nx3 s GLU 262 N -0.40 4.34 -0.07 -0.72 8.01 -1.26 -4.98 118.70 123.62 2nx3 s GLU 262 Ca 0.74 2.12 -0.28 0.00 0.01 0.00 0.00 54.97 57.57 2nx3 s GLU 262 Cb -0.91 -3.18 -0.02 0.00 -4.31 0.00 0.00 34.13 25.70 2nx3 s GLU 262 CO 0.53 -0.34 0.91 -0.08 0.01 0.00 0.00 175.26 176.30 2nx3 s THR 263 N 0.31 4.87 -2.74 3.63 -1.32 -1.26 -5.15 115.64 113.99 2nx3 s THR 263 Ca 0.59 1.87 0.26 0.00 -1.21 0.00 0.00 61.69 63.21 2nx3 s THR 263 Cb -0.38 -4.24 0.38 0.00 -1.51 0.00 0.00 72.50 66.75 2nx3 s THR 263 CO 0.37 0.10 1.51 2.30 -2.21 0.00 0.00 174.62 176.70