#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 3.04 -0.03 2.13 5.36 -1.24 -4.68 117.98 122.56 2nx3 s PHE 4 Ca 0.00 1.18 -0.14 0.00 -0.96 0.00 0.00 56.93 57.01 2nx3 s PHE 4 Cb 0.00 -3.76 -0.05 0.00 -0.34 0.00 0.00 43.02 38.87 2nx3 s PHE 4 CO 0.00 -2.32 0.38 -1.17 -1.46 0.00 0.00 175.22 170.65 2nx3 s LEU 5 N -0.87 4.44 -0.23 6.12 2.96 -0.89 -0.91 118.68 129.30 2nx3 s LEU 5 Ca 0.55 0.88 -0.01 0.00 -0.22 0.00 0.00 54.13 55.33 2nx3 s LEU 5 Cb -0.41 -2.53 0.07 0.00 0.50 0.00 0.00 46.19 43.82 2nx3 s LEU 5 CO 0.47 0.29 0.01 -0.69 -1.32 0.00 0.00 176.35 175.11 2nx3 s VAL 6 N -0.85 0.99 -0.22 1.68 1.01 -0.23 -1.58 120.40 121.19 2nx3 s VAL 6 Ca 0.23 -0.96 -0.15 0.00 0.00 0.00 0.00 61.98 61.09 2nx3 s VAL 6 Cb -0.16 -1.44 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 2nx3 s VAL 6 CO 0.12 -0.24 0.36 -0.63 0.00 0.00 0.00 175.10 174.70 2nx3 s ILE 7 N 1.63 5.22 0.09 2.22 1.01 0.04 -1.53 121.20 129.87 2nx3 s ILE 7 Ca -0.01 0.60 -0.15 0.00 0.00 0.00 0.00 60.65 61.09 2nx3 s ILE 7 Cb -0.18 -3.69 0.03 0.00 0.01 0.00 0.00 42.46 38.63 2nx3 s ILE 7 CO -0.10 0.24 0.35 0.00 0.00 0.00 0.00 174.94 175.44 2nx3 s ALA 8 N 1.44 -0.79 0.00 9.38 0.00 -0.64 -0.61 121.76 130.55 2nx3 s ALA 8 Ca 0.16 -0.06 0.00 0.00 0.00 0.00 0.00 51.96 52.07 2nx3 s ALA 8 Cb -0.15 0.52 0.00 0.00 0.00 0.00 0.00 23.12 23.49 2nx3 s ALA 8 CO 0.08 -0.54 0.00 0.41 0.00 0.00 0.00 175.76 175.71 2nx3 n GLY 9 N 0.10 -0.76 3.76 0.00 0.00 -1.19 -0.16 105.19 106.93 2nx3 n GLY 9 Ca -0.17 -1.38 -0.39 0.00 0.00 0.00 0.00 46.02 44.09 2nx3 n GLY 9 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2nx3 s PRO 10 N -1.92 4.60 0.21 1.61 0.04 -1.20 -0.84 135.00 137.50 2nx3 s PRO 10 Ca 0.00 1.57 -0.12 0.00 0.04 0.00 0.00 61.00 62.48 2nx3 s PRO 10 Cb 0.00 -3.01 0.26 0.00 0.04 0.00 0.00 34.50 31.78 2nx3 s PRO 10 CO 0.00 0.24 1.64 -0.97 0.04 0.00 0.00 177.00 177.96 2nx3 h ASN 11 N 3.52 -0.43 -3.27 6.66 -1.24 -1.85 -3.37 115.58 115.60 2nx3 h ASN 11 Ca -0.47 0.17 -0.50 0.00 0.71 0.00 0.00 56.30 56.21 2nx3 h ASN 11 Cb 1.21 0.33 -0.16 0.00 0.73 0.00 0.00 38.32 40.42 2nx3 h ASN 11 CO 0.66 -0.16 -0.76 0.00 -1.29 0.00 0.00 177.43 175.88 2nx3 s ALA 12 N -6.19 2.08 -1.28 1.57 0.00 -1.26 -1.76 121.76 114.92 2nx3 s ALA 12 Ca -0.14 -1.60 -0.17 0.00 0.00 0.00 0.00 51.96 50.05 2nx3 s ALA 12 Cb 0.19 -0.15 0.09 0.00 0.00 0.00 0.00 23.12 23.25 2nx3 s ALA 12 CO 0.73 0.17 1.67 0.42 0.00 0.00 0.00 175.76 178.75 2nx3 s ILE 13 N -2.47 4.34 0.28 0.00 1.01 -0.66 -4.72 121.20 118.97 2nx3 s ILE 13 Ca 0.20 -2.09 0.12 0.00 0.00 0.00 0.00 60.65 58.88 2nx3 s ILE 13 Cb -0.04 -5.13 0.03 0.00 0.01 0.00 0.00 42.46 37.33 2nx3 s ILE 13 CO 0.08 -1.93 1.68 -0.33 0.00 0.00 0.00 174.94 174.44 2nx3 h GLU 14 N 7.47 0.00 -1.20 2.79 5.08 -1.96 -3.41 114.58 123.35 2nx3 h GLU 14 Ca 0.42 0.00 0.35 0.00 -1.00 0.00 0.00 59.36 59.13 2nx3 h GLU 14 Cb 0.87 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.97 2nx3 h GLU 14 CO 1.41 0.52 0.92 -1.54 -1.00 0.00 0.00 179.01 179.32 2nx3 s SER 15 N -6.80 -0.04 0.27 1.42 1.04 -1.26 -5.00 113.70 103.33 2nx3 s SER 15 Ca -0.01 -0.04 0.08 0.00 0.48 0.00 0.00 55.95 56.45 2nx3 s SER 15 Cb 0.13 0.07 0.36 0.00 0.10 0.00 0.00 66.02 66.68 2nx3 s SER 15 CO 0.74 -0.12 1.62 -0.33 0.98 0.00 0.00 173.24 176.13 2nx3 h GLU 16 N 2.00 0.12 -0.48 4.02 5.08 -1.97 -2.97 114.58 120.39 2nx3 h GLU 16 Ca -0.24 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.05 2nx3 h GLU 16 Cb 1.18 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.41 2nx3 h GLU 16 CO 0.27 0.65 0.30 0.93 -1.00 0.00 0.00 179.01 180.16 2nx3 h GLU 17 N 0.09 0.59 -0.24 2.33 3.07 -1.99 -1.41 114.58 117.02 2nx3 h GLU 17 Ca -0.00 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 58.82 2nx3 h GLU 17 Cb 1.02 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.79 2nx3 h GLU 17 CO 0.08 0.39 0.15 1.25 -1.40 0.00 0.00 179.01 179.48 2nx3 h LEU 18 N 0.61 0.29 -0.30 1.33 5.85 -1.92 -0.83 115.31 120.34 2nx3 h LEU 18 Ca 0.18 -0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.89 2nx3 h LEU 18 Cb -0.03 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 2nx3 h LEU 18 CO -0.06 0.25 0.10 -0.07 -0.34 0.00 0.00 178.44 178.32 2nx3 h LEU 19 N 0.30 0.11 -0.78 2.25 4.07 -1.33 -0.22 115.31 119.71 2nx3 h LEU 19 Ca 0.09 0.03 -0.10 0.00 0.08 0.00 0.00 57.88 57.98 2nx3 h LEU 19 Cb 0.01 0.02 -0.02 0.00 1.08 0.00 0.00 40.66 41.76 2nx3 h LEU 19 CO -0.02 0.10 -0.14 -0.07 -1.08 0.00 0.00 178.44 177.23 2nx3 h LEU 20 N 0.23 0.76 -0.43 1.67 3.38 -1.16 1.69 115.31 121.46 2nx3 h LEU 20 Ca 0.13 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 2nx3 h LEU 20 Cb 0.10 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2nx3 h LEU 20 CO -0.14 0.92 0.25 0.50 0.09 0.00 0.00 178.44 180.07 2nx3 h LYS 21 N 0.69 0.59 0.01 1.13 1.63 -0.76 0.11 116.57 119.96 2nx3 h LYS 21 Ca 0.11 -0.06 -0.24 0.00 -0.85 0.00 0.00 60.65 59.61 2nx3 h LYS 21 Cb 0.63 -0.12 0.01 0.00 -0.60 0.00 0.00 32.23 32.15 2nx3 h LYS 21 CO 0.04 0.44 -0.99 0.28 -3.45 0.00 0.00 179.45 175.77 2nx3 h VAL 22 N 0.57 1.36 -0.48 2.00 2.07 -0.68 -3.21 116.25 117.87 2nx3 h VAL 22 Ca 0.15 -2.39 -0.00 0.00 0.82 0.00 0.00 66.70 65.28 2nx3 h VAL 22 Cb 0.01 2.42 -0.02 0.00 -1.52 0.00 0.00 31.29 32.18 2nx3 h VAL 22 CO -0.03 0.72 0.28 1.23 0.02 0.00 0.00 177.57 179.80 2nx3 h GLY 23 N 0.92 0.69 0.92 2.17 0.00 0.28 -1.59 103.07 106.47 2nx3 h GLY 23 Ca -0.10 -0.28 -0.02 0.00 0.00 0.00 0.00 47.33 46.93 2nx3 h GLY 23 CO 0.18 0.27 0.12 -2.09 0.00 0.00 0.00 176.54 175.03 2nx3 h GLU 24 N 0.66 0.48 -0.21 4.80 4.81 -0.78 -0.87 114.58 123.46 2nx3 h GLU 24 Ca 0.17 -0.09 -0.09 0.00 -0.13 0.00 0.00 59.36 59.22 2nx3 h GLU 24 Cb -0.02 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 2nx3 h GLU 24 CO -0.03 0.49 -0.28 1.49 -0.73 0.00 0.00 179.01 179.95 2nx3 h GLU 25 N 0.37 0.41 -0.18 1.92 4.57 -1.45 -0.84 114.58 119.37 2nx3 h GLU 25 Ca 0.11 -0.16 -0.16 0.00 -1.18 0.00 0.00 59.36 57.97 2nx3 h GLU 25 Cb 0.19 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.75 2nx3 h GLU 25 CO -0.01 0.65 -0.55 0.82 -1.18 0.00 0.00 179.01 178.75 2nx3 h ILE 26 N 0.36 1.32 -0.24 2.32 1.08 -1.09 -0.38 117.51 120.89 2nx3 h ILE 26 Ca 0.05 -1.80 -0.04 0.00 -0.39 0.00 0.00 64.86 62.68 2nx3 h ILE 26 Cb 0.68 1.78 -0.01 0.00 -3.07 0.00 0.00 36.82 36.20 2nx3 h ILE 26 CO 0.05 0.56 -0.01 0.50 -0.69 0.00 0.00 178.15 178.56 2nx3 h LYS 27 N 0.41 0.42 -0.51 2.37 1.63 -0.95 0.68 116.57 120.62 2nx3 h LYS 27 Ca 0.01 -0.14 0.04 0.00 -0.85 0.00 0.00 60.65 59.71 2nx3 h LYS 27 Cb 1.09 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 32.64 2nx3 h LYS 27 CO 0.10 0.61 0.26 -0.09 -3.45 0.00 0.00 179.45 176.88 2nx3 h ARG 28 N 0.19 0.50 -0.33 1.90 2.43 -1.00 -0.77 114.38 117.30 2nx3 h ARG 28 Ca 0.07 -0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.10 2nx3 h ARG 28 Cb 0.42 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 2nx3 h ARG 28 CO 0.01 0.33 -0.22 -0.07 -1.51 0.00 0.00 179.97 178.51 2nx3 h LEU 29 N 0.51 0.65 -1.56 3.80 3.38 -0.93 -1.96 115.31 119.20 2nx3 h LEU 29 Ca 0.22 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2nx3 h LEU 29 Cb 0.12 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2nx3 h LEU 29 CO -0.15 0.86 -0.18 0.77 0.09 0.00 0.00 178.44 179.83 2nx3 h SER 30 N 0.57 0.00 1.09 -0.43 4.64 -0.14 0.24 113.55 119.52 2nx3 h SER 30 Ca 0.08 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.22 2nx3 h SER 30 Cb 0.68 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.74 2nx3 h SER 30 CO 0.05 0.18 -0.93 -0.33 -0.87 0.00 0.00 176.83 174.93 2nx3 h GLU 31 N 0.00 0.00 0.19 4.77 4.39 -0.64 -3.34 114.58 119.95 2nx3 h GLU 31 Ca -0.00 0.00 -0.30 0.00 0.34 0.00 0.00 59.36 59.40 2nx3 h GLU 31 Cb 0.52 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.20 2nx3 h GLU 31 CO 0.02 0.75 -1.40 -0.22 -1.16 0.00 0.00 179.01 177.00 2nx3 h LYS 32 N 0.00 0.41 -3.42 2.33 3.64 -0.57 -3.40 116.57 115.55 2nx3 h LYS 32 Ca -0.04 -0.70 -0.73 0.00 -1.27 0.00 0.00 60.65 57.91 2nx3 h LYS 32 Cb 1.66 0.26 -0.33 0.00 -0.41 0.00 0.00 32.23 33.41 2nx3 h LYS 32 CO 0.10 1.33 0.03 -0.06 -2.27 0.00 0.00 179.45 178.59 2nx3 s PHE 33 N -2.54 3.95 0.08 1.91 0.08 0.75 -4.88 117.98 117.34 2nx3 s PHE 33 Ca -0.14 -2.87 0.33 0.00 0.12 0.00 0.00 56.93 54.37 2nx3 s PHE 33 Cb 0.04 -3.42 1.46 0.00 -0.57 0.00 0.00 43.02 40.53 2nx3 s PHE 33 CO 0.87 -0.81 1.99 0.87 -0.10 0.00 0.00 175.22 178.04 2nx3 h LYS 34 N 6.34 0.00 -0.14 0.44 1.79 -1.78 -2.44 116.57 120.77 2nx3 h LYS 34 Ca 0.15 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.62 2nx3 h LYS 34 Cb 0.85 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.50 2nx3 h LYS 34 CO 0.88 0.00 0.00 -0.85 -1.08 0.00 0.00 179.45 178.40 2nx3 n GLU 35 N -2.92 1.39 -4.87 3.15 0.00 -1.26 -4.80 120.64 111.33 2nx3 n GLU 35 Ca 0.00 -0.60 -0.31 0.00 0.00 0.00 0.00 57.16 56.26 2nx3 n GLU 35 Cb 0.25 -1.22 -0.14 0.00 0.00 0.00 0.00 31.44 30.33 2nx3 n GLU 35 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2nx3 s VAL 36 N -1.82 2.37 -0.36 3.84 1.01 -0.92 -3.61 120.40 120.91 2nx3 s VAL 36 Ca 0.19 -1.27 -0.12 0.00 0.00 0.00 0.00 61.98 60.78 2nx3 s VAL 36 Cb 0.10 -1.94 0.02 0.00 0.00 0.00 0.00 36.38 34.55 2nx3 s VAL 36 CO 0.14 0.39 0.22 -0.70 0.00 0.00 0.00 175.10 175.14 2nx3 s GLU 37 N -1.22 3.01 -0.03 2.72 2.12 -0.08 -4.97 118.70 120.24 2nx3 s GLU 37 Ca 0.12 -0.96 -0.15 0.00 0.36 0.00 0.00 54.97 54.35 2nx3 s GLU 37 Cb -0.10 -3.75 -0.05 0.00 0.26 0.00 0.00 34.13 30.49 2nx3 s GLU 37 CO 0.03 -0.63 0.40 -0.06 -0.54 0.00 0.00 175.26 174.46 2nx3 s PHE 38 N 1.60 3.68 -0.11 5.30 0.08 -1.26 -1.07 117.98 126.20 2nx3 s PHE 38 Ca 0.03 0.94 0.01 0.00 0.12 0.00 0.00 56.93 58.03 2nx3 s PHE 38 Cb -0.19 -2.32 0.02 0.00 -0.57 0.00 0.00 43.02 39.97 2nx3 s PHE 38 CO 0.07 0.56 -0.12 0.08 -0.10 0.00 0.00 175.22 175.71 2nx3 s VAL 39 N -0.74 1.27 -0.08 -0.44 1.01 -0.59 -4.18 120.40 116.65 2nx3 s VAL 39 Ca 0.23 -0.48 -0.30 0.00 0.00 0.00 0.00 61.98 61.44 2nx3 s VAL 39 Cb -0.16 -1.20 -0.02 0.00 0.00 0.00 0.00 36.38 35.00 2nx3 s VAL 39 CO 0.12 0.40 1.08 0.12 0.00 0.00 0.00 175.10 176.81 2nx3 s PHE 40 N 1.26 3.41 -0.04 5.22 5.36 0.16 -1.61 117.98 131.74 2nx3 s PHE 40 Ca -0.02 1.47 0.07 0.00 -0.96 0.00 0.00 56.93 57.48 2nx3 s PHE 40 Cb -0.14 -3.27 -0.02 0.00 -0.34 0.00 0.00 43.02 39.25 2nx3 s PHE 40 CO -0.04 -0.61 -0.24 0.21 -1.46 0.00 0.00 175.22 173.08 2nx3 s LYS 41 N 1.99 2.34 -0.29 10.12 2.36 0.77 -0.62 119.74 136.41 2nx3 s LYS 41 Ca 0.51 -0.89 -0.22 0.00 -2.55 0.00 0.00 55.97 52.82 2nx3 s LYS 41 Cb -0.21 -2.14 0.14 0.00 -1.05 0.00 0.00 37.83 34.57 2nx3 s LYS 41 CO 0.20 0.50 1.05 0.45 1.55 0.00 0.00 175.35 179.10 2nx3 s SER 42 N -0.44 -0.43 -0.05 1.43 0.15 -1.14 -3.23 113.70 109.98 2nx3 s SER 42 Ca 0.05 0.78 -0.21 0.00 0.70 0.00 0.00 55.95 57.27 2nx3 s SER 42 Cb -0.12 0.92 -0.04 0.00 -1.71 0.00 0.00 66.02 65.07 2nx3 s SER 42 CO 0.01 -0.13 0.61 -0.44 1.20 0.00 0.00 173.24 174.49 2nx3 s SER 43 N 0.58 6.92 0.01 5.45 0.01 -0.72 -4.52 113.70 121.43 2nx3 s SER 43 Ca -0.01 1.10 0.28 0.00 1.31 0.00 0.00 55.95 58.64 2nx3 s SER 43 Cb -0.05 -2.37 1.07 0.00 0.21 0.00 0.00 66.02 64.89 2nx3 s SER 43 CO -0.10 0.00 1.82 2.22 0.41 0.00 0.00 173.24 177.59 2nx3 n PHE 44 N 3.31 0.05 -3.64 2.43 1.16 -1.26 -1.66 117.46 117.84 2nx3 n PHE 44 Ca -0.05 0.01 -0.08 0.00 -1.87 0.00 0.00 57.45 55.46 2nx3 n PHE 44 Cb 0.51 -0.48 -0.07 0.00 -1.61 0.00 0.00 39.48 37.83 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 -3.08 -0.88 -0.81 5.98 2.15 -1.26 -4.01 116.67 114.76 2nx3 s ASP 45 Ca 0.13 1.45 -0.16 0.00 0.43 0.00 0.00 52.55 54.41 2nx3 s ASP 45 Cb 0.18 1.35 0.18 0.00 -0.30 0.00 0.00 42.92 44.33 2nx3 s ASP 45 CO 0.57 -0.24 0.83 -0.54 -0.17 0.00 0.00 175.17 175.62 2nx3 s LYS 46 N 1.41 3.51 0.00 4.34 -0.14 0.56 -4.87 119.74 124.55 2nx3 s LYS 46 Ca -0.08 -2.13 0.29 0.00 -1.36 0.00 0.00 55.97 52.69 2nx3 s LYS 46 Cb -0.05 -4.52 1.30 0.00 -1.68 0.00 0.00 37.83 32.87 2nx3 s LYS 46 CO -0.16 -1.44 1.91 0.00 -0.76 0.00 0.00 175.35 174.90 2nx3 n ALA 47 N 4.93 2.69 -1.84 5.17 0.00 -1.26 -4.05 120.51 126.14 2nx3 n ALA 47 Ca 0.12 -0.22 0.05 0.00 0.00 0.00 0.00 53.44 53.39 2nx3 n ALA 47 Cb 0.47 -1.38 0.14 0.00 0.00 0.00 0.00 19.45 18.67 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 -1.11 1.47 -4.65 0.00 6.94 -1.26 -5.08 115.26 111.57 2nx3 n ASN 48 Ca 0.14 -3.17 -0.36 0.00 -0.02 0.00 0.00 54.58 51.17 2nx3 n ASN 48 Cb 0.27 -0.44 0.08 0.00 -2.36 0.00 0.00 39.78 37.33 2nx3 n ASN 48 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2nx3 n ARG 49 N -0.61 0.74 -0.19 -3.83 5.12 -1.26 -4.89 116.66 111.74 2nx3 n ARG 49 Ca 0.14 0.31 -0.10 0.00 -1.93 0.00 0.00 57.85 56.27 2nx3 n ARG 49 Cb 0.82 -2.31 0.01 0.00 -1.16 0.00 0.00 32.46 29.83 2nx3 n ARG 49 CO 0.00 0.00 0.00 0.77 -1.93 0.00 0.00 177.63 176.47 2nx3 h SER 50 N 0.08 0.98 -3.53 0.55 0.02 -1.98 -3.44 113.55 106.22 2nx3 h SER 50 Ca -0.49 -0.32 -0.67 0.00 -0.84 0.00 0.00 61.79 59.47 2nx3 h SER 50 Cb 1.34 -0.26 -0.16 0.00 0.14 0.00 0.00 62.40 63.46 2nx3 h SER 50 CO 0.49 1.06 -0.68 -0.55 -1.14 0.00 0.00 176.83 176.01 2nx3 s SER 51 N -6.51 4.79 0.62 3.07 0.15 -1.24 -4.99 113.70 109.58 2nx3 s SER 51 Ca -0.12 -0.08 0.39 0.00 0.70 0.00 0.00 55.95 56.84 2nx3 s SER 51 Cb 0.13 -1.18 2.03 0.00 -1.71 0.00 0.00 66.02 65.29 2nx3 s SER 51 CO 0.85 0.29 2.24 -0.29 1.20 0.00 0.00 173.24 177.53 2nx3 h ILE 52 N 3.75 0.12 0.00 6.45 6.09 -1.94 -2.41 117.51 129.56 2nx3 h ILE 52 Ca -0.49 -0.18 -0.02 0.00 -1.37 0.00 0.00 64.86 62.80 2nx3 h ILE 52 Cb 1.17 1.16 -0.00 0.00 0.47 0.00 0.00 36.82 39.62 2nx3 h ILE 52 CO 0.55 0.01 -0.26 0.45 -3.07 0.00 0.00 178.15 175.83 2nx3 h HIS 53 N 0.00 0.00 -4.24 2.19 3.86 -1.97 -3.47 115.15 111.52 2nx3 h HIS 53 Ca -0.00 0.00 -0.51 0.00 -1.16 0.00 0.00 60.37 58.70 2nx3 h HIS 53 Cb 0.16 0.00 0.10 0.00 1.06 0.00 0.00 27.41 28.73 2nx3 h HIS 53 CO 0.00 0.10 0.36 -1.12 0.86 0.00 0.00 177.93 178.13 2nx3 s SER 54 N -6.12 5.06 0.32 2.45 0.01 -0.91 -4.99 113.70 109.52 2nx3 s SER 54 Ca 0.05 1.89 -0.29 0.00 1.31 0.00 0.00 55.95 58.92 2nx3 s SER 54 Cb 0.06 -2.54 -0.11 0.00 0.21 0.00 0.00 66.02 63.65 2nx3 s SER 54 CO 0.70 -1.66 1.48 0.12 0.41 0.00 0.00 173.24 174.29 2nx3 s PHE 55 N -2.57 2.78 -0.06 2.43 5.36 -1.26 -4.95 117.98 119.72 2nx3 s PHE 55 Ca 0.64 1.06 -0.03 0.00 -0.96 0.00 0.00 56.93 57.65 2nx3 s PHE 55 Cb -0.18 -3.95 -0.03 0.00 -0.34 0.00 0.00 43.02 38.52 2nx3 s PHE 55 CO 0.46 -2.94 -0.08 0.54 -1.46 0.00 0.00 175.22 171.74 2nx3 n ARG 56 N 1.36 0.13 -2.37 10.12 1.74 -1.26 -4.73 116.66 121.66 2nx3 n ARG 56 Ca 0.04 0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.18 2nx3 n ARG 56 Cb 0.39 -0.75 0.00 0.00 -1.02 0.00 0.00 32.46 31.08 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 2.64 -0.34 0.73 -0.13 0.00 -1.26 -0.32 105.19 106.51 2nx3 n GLY 57 Ca -0.12 -1.50 0.08 0.00 0.00 0.00 0.00 46.02 44.48 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 9.00 0.72 0.00 1.61 8.25 -1.26 -5.06 115.22 128.49 2nx3 n HIS 58 Ca 0.00 -0.81 0.00 0.00 -0.26 0.00 0.00 57.72 56.65 2nx3 n HIS 58 Cb 0.00 -0.23 0.00 0.00 1.12 0.00 0.00 29.99 30.88 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 -0.42 1.78 0.12 -1.41 0.00 -1.26 -4.39 105.19 99.61 2nx3 n GLY 59 Ca 0.18 -1.73 -0.08 0.00 0.00 0.00 0.00 46.02 44.39 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 0.10 -0.32 0.99 6.46 -1.99 -2.10 115.31 118.45 2nx3 h LEU 60 Ca 0.00 0.03 0.07 0.00 -0.12 0.00 0.00 57.88 57.86 2nx3 h LEU 60 Cb 0.00 0.02 -0.08 0.00 -0.73 0.00 0.00 40.66 39.87 2nx3 h LEU 60 CO 0.00 0.09 -0.22 -0.08 -0.62 0.00 0.00 178.44 177.61 2nx3 h GLU 61 N 0.20 -0.18 -0.63 1.25 4.81 -1.96 0.48 114.58 118.55 2nx3 h GLU 61 Ca 0.11 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 2nx3 h GLU 61 Cb 0.08 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 2nx3 h GLU 61 CO -0.12 -0.12 0.33 -0.92 -0.73 0.00 0.00 179.01 177.46 2nx3 h TYR 62 N -0.18 0.87 0.02 0.92 3.20 -1.73 -2.54 116.97 117.52 2nx3 h TYR 62 Ca 0.16 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.01 2nx3 h TYR 62 Cb 0.44 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.43 2nx3 h TYR 62 CO -0.41 0.63 -0.01 0.78 -1.64 0.00 0.00 178.16 177.51 2nx3 h GLY 63 N 0.85 -0.03 1.03 1.82 0.00 -0.64 0.13 103.07 106.23 2nx3 h GLY 63 Ca 0.22 0.01 0.02 0.00 0.00 0.00 0.00 47.33 47.58 2nx3 h GLY 63 CO -0.03 -0.01 0.62 -2.08 0.00 0.00 0.00 176.54 175.03 2nx3 h VAL 64 N -0.09 1.21 -0.42 4.60 2.07 -0.91 0.17 116.25 122.89 2nx3 h VAL 64 Ca -0.00 -0.42 -0.09 0.00 0.82 0.00 0.00 66.70 67.01 2nx3 h VAL 64 Cb 0.08 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 29.71 2nx3 h VAL 64 CO 0.00 0.22 -0.07 0.50 0.02 0.00 0.00 177.57 178.24 2nx3 h LYS 65 N 1.23 0.79 -0.41 1.57 3.64 -1.23 0.86 116.57 123.02 2nx3 h LYS 65 Ca 0.35 -0.29 -0.00 0.00 -1.27 0.00 0.00 60.65 59.44 2nx3 h LYS 65 Cb -0.08 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 2nx3 h LYS 65 CO -0.09 0.90 0.24 0.00 -2.27 0.00 0.00 179.45 178.23 2nx3 h ALA 66 N 0.86 0.52 -0.64 5.00 0.00 0.08 -1.77 119.26 123.31 2nx3 h ALA 66 Ca 0.11 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 2nx3 h ALA 66 Cb 0.59 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2nx3 h ALA 66 CO 0.04 0.02 0.10 -0.07 0.00 0.00 0.00 179.25 179.33 2nx3 h LEU 67 N 0.54 1.01 -1.21 0.00 3.38 -0.50 -2.61 115.31 115.91 2nx3 h LEU 67 Ca 0.15 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2nx3 h LEU 67 Cb 0.00 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.45 2nx3 h LEU 67 CO -0.03 1.00 0.50 -0.09 0.09 0.00 0.00 178.44 179.91 2nx3 h ARG 68 N 0.99 1.03 -0.52 1.13 2.43 -0.35 -1.06 114.38 118.03 2nx3 h ARG 68 Ca 0.20 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.25 2nx3 h ARG 68 Cb 0.43 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 2nx3 h ARG 68 CO 0.01 0.69 0.13 -0.22 -1.51 0.00 0.00 179.97 179.07 2nx3 h LYS 69 N 1.05 0.83 0.00 0.20 1.63 -1.03 -0.41 116.57 118.85 2nx3 h LYS 69 Ca 0.28 -0.20 0.00 0.00 -0.85 0.00 0.00 60.65 59.89 2nx3 h LYS 69 Cb -0.10 -0.11 -0.00 0.00 -0.60 0.00 0.00 32.23 31.42 2nx3 h LYS 69 CO -0.06 0.79 -0.02 0.28 -3.45 0.00 0.00 179.45 176.99 2nx3 h VAL 70 N 0.72 0.94 -0.18 2.00 2.07 -1.01 0.31 116.25 121.10 2nx3 h VAL 70 Ca 0.16 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.70 2nx3 h VAL 70 Cb 0.33 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 2nx3 h VAL 70 CO 0.00 0.00 0.06 0.50 0.02 0.00 0.00 177.57 178.15 2nx3 h LYS 71 N -0.04 0.15 -0.37 1.57 3.64 -1.04 -0.87 116.57 119.60 2nx3 h LYS 71 Ca 0.01 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 2nx3 h LYS 71 Cb 0.05 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 2nx3 h LYS 71 CO -0.02 0.10 -0.13 0.93 -2.27 0.00 0.00 179.45 178.06 2nx3 h GLU 72 N 0.15 0.65 0.03 1.90 5.08 -0.86 0.54 114.58 122.07 2nx3 h GLU 72 Ca 0.08 -0.21 -0.22 0.00 -1.00 0.00 0.00 59.36 58.01 2nx3 h GLU 72 Cb 0.05 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 2nx3 h GLU 72 CO -0.08 0.76 -1.02 1.49 -1.00 0.00 0.00 179.01 179.16 2nx3 h GLU 73 N 0.59 0.09 0.00 2.33 4.81 -0.13 -3.38 114.58 118.90 2nx3 h GLU 73 Ca 0.10 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2nx3 h GLU 73 Cb 0.56 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.99 2nx3 h GLU 73 CO 0.04 1.02 0.00 1.19 -0.73 0.00 0.00 179.01 180.53 2nx3 n PHE 74 N -3.46 0.00 -1.98 0.92 3.72 -0.35 -5.01 117.46 111.29 2nx3 n PHE 74 Ca -0.03 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.23 2nx3 n PHE 74 Cb 0.92 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.44 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 0.33 0.37 3.87 1.37 0.00 0.19 -4.96 105.19 106.35 2nx3 n GLY 75 Ca 0.00 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 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 -3.85 4.24 0.50 0.99 1.43 -1.23 -5.04 118.68 115.71 2nx3 s LEU 76 Ca 0.00 0.91 -0.19 0.00 -1.03 0.00 0.00 54.13 53.82 2nx3 s LEU 76 Cb 0.00 -3.46 -0.08 0.00 0.03 0.00 0.00 46.19 42.68 2nx3 s LEU 76 CO 0.00 0.01 1.03 -0.54 0.23 0.00 0.00 176.35 177.08 2nx3 s LYS 77 N -2.49 3.77 0.02 1.70 1.02 -1.26 -4.44 119.74 118.06 2nx3 s LYS 77 Ca 0.43 1.30 0.08 0.00 0.02 0.00 0.00 55.97 57.80 2nx3 s LYS 77 Cb -0.13 -2.09 -0.03 0.00 -0.52 0.00 0.00 37.83 35.06 2nx3 s LYS 77 CO 0.21 -0.45 -0.24 0.42 -0.92 0.00 0.00 175.35 174.37 2nx3 s ILE 78 N -2.10 2.31 0.01 2.17 -1.09 -1.26 0.35 121.20 121.59 2nx3 s ILE 78 Ca 0.66 -1.23 0.01 0.00 -2.23 0.00 0.00 60.65 57.85 2nx3 s ILE 78 Cb -0.15 -1.89 -0.01 0.00 -1.58 0.00 0.00 42.46 38.83 2nx3 s ILE 78 CO 0.22 0.43 -0.03 0.28 -1.23 0.00 0.00 174.94 174.62 2nx3 s THR 79 N -0.77 0.20 0.16 2.92 -1.32 0.20 0.19 115.64 117.22 2nx3 s THR 79 Ca 0.12 -0.36 -0.17 0.00 -1.21 0.00 0.00 61.69 60.07 2nx3 s THR 79 Cb -0.10 -0.22 0.03 0.00 -1.51 0.00 0.00 72.50 70.70 2nx3 s THR 79 CO 0.02 -0.10 0.47 0.28 -2.21 0.00 0.00 174.62 173.07 2nx3 s THR 80 N -0.47 0.04 0.09 5.08 -1.32 -1.17 -2.87 115.64 115.02 2nx3 s THR 80 Ca -0.04 -0.63 0.01 0.00 -1.21 0.00 0.00 61.69 59.83 2nx3 s THR 80 Cb -0.04 -1.34 -0.04 0.00 -1.51 0.00 0.00 72.50 69.57 2nx3 s THR 80 CO -0.00 -0.20 0.21 1.51 -2.21 0.00 0.00 174.62 173.92 2nx3 s ASP 81 N -2.83 6.21 0.32 8.08 -4.77 -1.26 -0.49 116.67 121.92 2nx3 s ASP 81 Ca 0.06 0.19 0.09 0.00 -3.30 0.00 0.00 52.55 49.59 2nx3 s ASP 81 Cb 0.00 -1.86 -0.05 0.00 -1.09 0.00 0.00 42.92 39.92 2nx3 s ASP 81 CO -0.08 0.14 0.04 0.27 0.70 0.00 0.00 175.17 176.24 2nx3 s ILE 82 N -1.56 3.00 0.00 2.11 -4.36 -0.80 -4.76 121.20 114.83 2nx3 s ILE 82 Ca 0.34 -1.88 0.00 0.00 -0.26 0.00 0.00 60.65 58.85 2nx3 s ILE 82 Cb -0.12 -2.85 0.00 0.00 1.25 0.00 0.00 42.46 40.73 2nx3 s ILE 82 CO 0.27 -0.25 0.00 1.41 0.24 0.00 0.00 174.94 176.61 2nx3 n HIS 83 N -0.99 0.00 -3.93 1.37 8.25 -1.26 -4.33 115.22 114.33 2nx3 n HIS 83 Ca -0.04 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.31 2nx3 n HIS 83 Cb 0.61 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.61 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 -0.62 0.36 0.24 -0.41 2.02 -1.26 -5.06 118.70 113.96 2nx3 s GLU 84 Ca 0.00 -0.48 -0.08 0.00 0.02 0.00 0.00 54.97 54.43 2nx3 s GLU 84 Cb 0.00 0.14 0.41 0.00 0.10 0.00 0.00 34.13 34.78 2nx3 s GLU 84 CO 0.00 -0.07 1.64 0.77 0.02 0.00 0.00 175.26 177.62 2nx3 h SER 85 N 4.61 -0.32 -0.20 -0.19 0.02 -1.91 -1.78 113.55 113.78 2nx3 h SER 85 Ca -0.31 0.19 0.06 0.00 -0.84 0.00 0.00 61.79 60.88 2nx3 h SER 85 Cb 1.20 0.33 -0.01 0.00 0.14 0.00 0.00 62.40 64.06 2nx3 h SER 85 CO 0.41 -0.16 0.28 4.11 -1.14 0.00 0.00 176.83 180.33 2nx3 h TRP 86 N 0.11 0.00 0.00 3.45 5.08 -1.97 -2.48 115.95 120.14 2nx3 h TRP 86 Ca 0.40 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.37 2nx3 h TRP 86 Cb 0.69 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.85 2nx3 h TRP 86 CO -0.41 0.00 0.00 1.04 -1.28 0.00 0.00 178.44 177.79 2nx3 n GLN 87 N -3.54 0.11 0.31 0.12 6.02 -0.67 -4.10 117.38 115.64 2nx3 n GLN 87 Ca 0.02 0.17 -0.17 0.00 -0.01 0.00 0.00 57.00 57.01 2nx3 n GLN 87 Cb 0.40 -1.65 -0.09 0.00 1.02 0.00 0.00 30.24 29.93 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 2.66 -0.75 0.13 -1.58 0.00 -1.61 -2.64 119.26 115.47 2nx3 h ALA 88 Ca 0.00 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.77 2nx3 h ALA 88 Cb 0.51 0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 2nx3 h ALA 88 CO 0.00 -0.92 -0.42 1.49 0.00 0.00 0.00 179.25 179.40 2nx3 h GLU 89 N -0.75 -0.64 -0.93 0.00 4.81 -1.81 0.18 114.58 115.44 2nx3 h GLU 89 Ca -0.07 0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.21 2nx3 h GLU 89 Cb 0.58 0.14 -0.05 0.00 0.63 0.00 0.00 28.75 30.06 2nx3 h GLU 89 CO 0.12 -0.42 0.62 -1.00 -0.73 0.00 0.00 179.01 177.59 2nx3 h PRO 90 N -0.66 1.22 -0.35 0.92 0.13 -1.78 -2.68 132.00 128.80 2nx3 h PRO 90 Ca 0.02 -0.07 -0.09 0.00 -0.87 0.00 0.00 66.00 64.99 2nx3 h PRO 90 Cb 0.68 -0.28 -0.02 0.00 0.13 0.00 0.00 31.00 31.52 2nx3 h PRO 90 CO -0.24 0.81 -0.15 0.28 -0.23 0.00 0.00 178.00 178.48 2nx3 h VAL 91 N 1.26 1.25 -0.07 1.56 2.07 -1.17 -2.70 116.25 118.45 2nx3 h VAL 91 Ca 0.34 -1.14 0.02 0.00 0.82 0.00 0.00 66.70 66.74 2nx3 h VAL 91 Cb -0.15 1.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.77 2nx3 h VAL 91 CO -0.07 0.38 0.13 0.00 0.02 0.00 0.00 177.57 178.02 2nx3 h ALA 92 N 1.28 1.46 0.00 1.67 0.00 -0.29 0.13 119.26 123.50 2nx3 h ALA 92 Ca 0.10 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2nx3 h ALA 92 Cb 0.58 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2nx3 h ALA 92 CO 0.04 -0.16 -0.04 0.93 0.00 0.00 0.00 179.25 180.02 2nx3 h GLU 93 N 0.00 0.00 0.00 0.00 4.39 -1.49 -3.31 114.58 114.17 2nx3 h GLU 93 Ca 0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.73 2nx3 h GLU 93 Cb 0.29 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 2nx3 h GLU 93 CO -0.00 0.04 -0.81 1.55 -1.16 0.00 0.00 179.01 178.63 2nx3 n VAL 94 N -3.85 0.00 -2.67 3.13 3.14 -0.45 -5.04 118.33 112.59 2nx3 n VAL 94 Ca -0.03 0.00 -0.43 0.00 -2.96 0.00 0.00 64.34 60.93 2nx3 n VAL 94 Cb 0.13 -0.79 -0.02 0.00 -1.06 0.00 0.00 33.84 32.09 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 -1.81 3.52 0.12 1.55 0.00 -0.10 -4.51 121.76 120.53 2nx3 s ALA 95 Ca 0.00 0.30 -0.03 0.00 0.00 0.00 0.00 51.96 52.22 2nx3 s ALA 95 Cb 0.00 -3.48 -0.14 0.00 0.00 0.00 0.00 23.12 19.50 2nx3 s ALA 95 CO 0.00 -0.79 1.27 -0.44 0.00 0.00 0.00 175.76 175.80 2nx3 h ASP 96 N 7.24 0.47 -3.20 0.00 3.32 -0.57 -3.43 116.42 120.25 2nx3 h ASP 96 Ca -0.26 -0.41 -0.59 0.00 0.02 0.00 0.00 57.03 55.79 2nx3 h ASP 96 Cb 1.11 -0.15 -0.35 0.00 0.22 0.00 0.00 39.33 40.16 2nx3 h ASP 96 CO 0.91 1.23 -0.83 -0.63 -1.72 0.00 0.00 179.24 178.20 2nx3 s ILE 97 N -3.09 1.52 -0.26 0.35 1.01 -0.92 -2.19 121.20 117.63 2nx3 s ILE 97 Ca -0.05 -0.63 -0.14 0.00 0.00 0.00 0.00 60.65 59.83 2nx3 s ILE 97 Cb 0.08 -1.41 -0.04 0.00 0.01 0.00 0.00 42.46 41.11 2nx3 s ILE 97 CO 0.87 0.45 0.34 -0.63 0.00 0.00 0.00 174.94 175.97 2nx3 s ILE 98 N 1.21 5.20 0.05 2.92 1.01 -0.09 -3.04 121.20 128.46 2nx3 s ILE 98 Ca -0.01 0.52 -0.15 0.00 0.00 0.00 0.00 60.65 61.01 2nx3 s ILE 98 Cb -0.14 -3.67 -0.06 0.00 0.01 0.00 0.00 42.46 38.60 2nx3 s ILE 98 CO -0.06 0.19 0.46 -1.58 0.00 0.00 0.00 174.94 173.96 2nx3 s GLN 99 N 1.86 3.96 -0.22 2.79 0.74 0.36 -0.83 119.66 128.31 2nx3 s GLN 99 Ca 0.14 0.46 -0.03 0.00 0.05 0.00 0.00 55.36 55.98 2nx3 s GLN 99 Cb -0.15 -3.15 0.00 0.00 1.10 0.00 0.00 33.01 30.80 2nx3 s GLN 99 CO 0.09 0.64 -0.06 0.42 -0.55 0.00 0.00 175.29 175.83 2nx3 s ILE 100 N -1.18 3.14 0.61 -2.34 -1.09 0.59 -1.90 121.20 119.03 2nx3 s ILE 100 Ca 0.28 -0.64 -0.18 0.00 -2.23 0.00 0.00 60.65 57.88 2nx3 s ILE 100 Cb -0.17 -2.45 -0.05 0.00 -1.58 0.00 0.00 42.46 38.21 2nx3 s ILE 100 CO 0.16 0.39 0.91 -2.65 -1.23 0.00 0.00 174.94 172.53 2nx3 n PRO 101 N 4.76 0.83 -0.14 2.79 -0.02 -1.26 -1.49 135.00 140.47 2nx3 n PRO 101 Ca -0.18 0.32 -0.04 0.00 -2.02 0.00 0.00 63.50 61.58 2nx3 n PRO 101 Cb 0.50 -2.12 0.04 0.00 -0.02 0.00 0.00 33.50 31.90 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 0.41 0.51 0.00 3.55 0.00 -1.89 -1.82 119.26 120.02 2nx3 h ALA 102 Ca -0.48 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.46 2nx3 h ALA 102 Cb 1.37 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 2nx3 h ALA 102 CO 0.50 -0.26 -0.14 0.74 0.00 0.00 0.00 179.25 180.09 2nx3 h PHE 103 N 0.29 0.00 -0.56 0.00 0.04 -1.91 -2.68 116.94 112.12 2nx3 h PHE 103 Ca 0.21 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.98 2nx3 h PHE 103 Cb 0.22 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.37 2nx3 h PHE 103 CO -0.17 0.14 0.00 1.28 -0.60 0.00 0.00 178.31 178.96 2nx3 n LEU 104 N -4.07 3.74 0.04 1.54 4.77 -0.71 -4.59 117.00 117.72 2nx3 n LEU 104 Ca -0.02 -1.88 0.05 0.00 -0.03 0.00 0.00 56.01 54.12 2nx3 n LEU 104 Cb 0.22 -0.48 0.23 0.00 -2.33 0.00 0.00 43.42 41.06 2nx3 n LEU 104 CO 0.33 0.72 0.65 0.00 -1.33 0.00 0.00 177.39 177.77 2nx3 n ARG 106 N -1.71 1.43 -2.45 0.00 1.74 -1.26 -4.92 116.66 109.49 2nx3 n ARG 106 Ca 0.01 -1.29 -0.39 0.00 -0.77 0.00 0.00 57.85 55.41 2nx3 n ARG 106 Cb 0.07 -1.10 -0.03 0.00 -1.02 0.00 0.00 32.46 30.38 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 -0.71 3.21 0.21 5.56 -1.52 -0.93 -4.88 119.66 120.59 2nx3 s GLN 107 Ca 0.07 -0.45 -0.18 0.00 -1.95 0.00 0.00 55.36 52.86 2nx3 s GLN 107 Cb 0.04 -4.69 0.20 0.00 -0.22 0.00 0.00 33.01 28.34 2nx3 s GLN 107 CO 0.06 -2.35 1.59 1.15 -0.25 0.00 0.00 175.29 175.49 2nx3 h THR 108 N 6.50 0.17 -0.51 -0.19 2.02 -1.91 -1.45 112.91 117.54 2nx3 h THR 108 Ca -0.08 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.12 2nx3 h THR 108 Cb 1.04 0.17 -0.03 0.00 -1.74 0.00 0.00 68.15 67.60 2nx3 h THR 108 CO 1.32 0.00 0.34 0.44 0.37 0.00 0.00 175.52 177.99 2nx3 h ASP 109 N -0.09 0.55 -0.34 4.18 3.32 -1.99 -0.24 116.42 121.82 2nx3 h ASP 109 Ca 0.29 -0.01 -0.10 0.00 0.02 0.00 0.00 57.03 57.23 2nx3 h ASP 109 Cb 0.56 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 2nx3 h ASP 109 CO -0.75 0.39 -0.18 0.25 -1.72 0.00 0.00 179.24 177.23 2nx3 h LEU 110 N 0.65 0.74 -0.04 1.55 5.85 -1.65 -0.70 115.31 121.70 2nx3 h LEU 110 Ca 0.20 -0.41 -0.00 0.00 0.84 0.00 0.00 57.88 58.50 2nx3 h LEU 110 Cb -0.01 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 40.82 2nx3 h LEU 110 CO -0.05 0.99 0.02 -0.07 -0.34 0.00 0.00 178.44 178.99 2nx3 h LEU 111 N 0.49 0.05 -0.88 2.25 3.38 -1.05 -2.24 115.31 117.31 2nx3 h LEU 111 Ca 0.07 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 57.97 2nx3 h LEU 111 Cb 0.72 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.41 2nx3 h LEU 111 CO 0.05 0.11 0.57 -0.07 0.09 0.00 0.00 178.44 179.20 2nx3 h LEU 112 N -0.02 1.01 -1.13 1.67 3.38 -1.00 0.26 115.31 119.48 2nx3 h LEU 112 Ca 0.01 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 2nx3 h LEU 112 Cb 0.08 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2nx3 h LEU 112 CO -0.00 0.74 -0.01 0.00 0.09 0.00 0.00 178.44 179.26 2nx3 h ALA 113 N 1.32 1.29 -0.09 1.53 0.00 -0.99 -0.01 119.26 122.31 2nx3 h ALA 113 Ca 0.32 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 2nx3 h ALA 113 Cb -0.13 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.51 2nx3 h ALA 113 CO -0.07 0.48 -0.43 0.00 0.00 0.00 0.00 179.25 179.23 2nx3 h ALA 114 N 1.43 0.17 -0.58 0.00 0.00 -0.93 -3.19 119.26 116.16 2nx3 h ALA 114 Ca 0.12 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 2nx3 h ALA 114 Cb 0.38 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 2nx3 h ALA 114 CO 0.01 0.31 0.32 0.00 0.00 0.00 0.00 179.25 179.89 2nx3 h ALA 115 N 0.46 1.47 0.00 0.00 0.00 -0.64 -2.65 119.26 117.90 2nx3 h ALA 115 Ca -0.03 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2nx3 h ALA 115 Cb 1.08 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2nx3 h ALA 115 CO 0.09 0.44 0.00 -0.22 0.00 0.00 0.00 179.25 179.56 2nx3 h LYS 116 N 0.80 0.00 0.00 0.00 3.64 -0.99 -2.90 116.57 117.13 2nx3 h LYS 116 Ca 0.21 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 2nx3 h LYS 116 Cb 0.02 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2nx3 h LYS 116 CO -0.03 0.00 0.00 1.79 -2.27 0.00 0.00 179.45 178.94 2nx3 h THR 117 N 0.00 0.00 0.00 1.00 1.35 -1.52 -3.47 112.91 110.27 2nx3 h THR 117 Ca 0.00 -0.63 0.00 0.00 -0.55 0.00 0.00 66.41 65.23 2nx3 h THR 117 Cb 0.33 1.60 0.00 0.00 -1.73 0.00 0.00 68.15 68.36 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 0.43 0.94 3.91 5.82 0.00 -1.09 -5.05 105.19 110.14 2nx3 n GLY 118 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.63 2.88 0.65 1.61 1.81 -1.26 -4.93 118.95 119.07 2nx3 s ARG 119 Ca 0.00 0.15 -0.16 0.00 -1.72 0.00 0.00 55.73 54.01 2nx3 s ARG 119 Cb 0.00 -2.18 -0.01 0.00 -0.45 0.00 0.00 34.95 32.31 2nx3 s ARG 119 CO 0.00 -0.83 1.12 0.00 -0.68 0.00 0.00 175.30 174.91 2nx3 s ALA 120 N -3.13 2.49 -0.07 2.13 0.00 -0.93 -4.79 121.76 117.47 2nx3 s ALA 120 Ca 0.55 0.60 0.02 0.00 0.00 0.00 0.00 51.96 53.13 2nx3 s ALA 120 Cb -0.11 -3.33 0.01 0.00 0.00 0.00 0.00 23.12 19.70 2nx3 s ALA 120 CO 0.47 -1.23 -0.11 0.08 0.00 0.00 0.00 175.76 174.98 2nx3 s VAL 121 N -2.25 1.05 -0.22 0.00 1.01 -0.48 -0.91 120.40 118.60 2nx3 s VAL 121 Ca 0.68 -0.42 -0.01 0.00 0.00 0.00 0.00 61.98 62.23 2nx3 s VAL 121 Cb -0.21 -0.98 0.02 0.00 0.00 0.00 0.00 36.38 35.21 2nx3 s VAL 121 CO 0.40 0.34 -0.12 0.21 0.00 0.00 0.00 175.10 175.93 2nx3 s ASN 122 N 0.75 3.85 -0.26 3.32 2.47 -0.01 -0.79 114.94 124.28 2nx3 s ASN 122 Ca -0.13 -0.72 -0.08 0.00 0.42 0.00 0.00 52.86 52.34 2nx3 s ASN 122 Cb -0.15 -1.60 -0.04 0.00 -1.45 0.00 0.00 41.25 38.01 2nx3 s ASN 122 CO 0.03 -0.06 0.11 -0.69 -3.72 0.00 0.00 177.10 172.76 2nx3 s VAL 123 N 1.33 4.64 0.07 -5.21 1.01 -0.31 -0.30 120.40 121.63 2nx3 s VAL 123 Ca 0.03 -0.06 -0.30 0.00 0.00 0.00 0.00 61.98 61.64 2nx3 s VAL 123 Cb -0.15 -3.18 -0.06 0.00 0.00 0.00 0.00 36.38 32.99 2nx3 s VAL 123 CO -0.08 0.32 1.15 -0.54 0.00 0.00 0.00 175.10 175.95 2nx3 s LYS 124 N 1.61 4.48 -0.02 2.72 -0.14 -0.56 -1.23 119.74 126.60 2nx3 s LYS 124 Ca 0.06 1.71 -0.30 0.00 -1.36 0.00 0.00 55.97 56.08 2nx3 s LYS 124 Cb -0.15 -3.35 -0.04 0.00 -1.68 0.00 0.00 37.83 32.60 2nx3 s LYS 124 CO 0.06 -0.17 1.26 0.21 -0.76 0.00 0.00 175.35 175.95 2nx3 s LYS 125 N 0.79 4.34 0.50 1.68 2.20 -0.31 -4.08 119.74 124.86 2nx3 s LYS 125 Ca 0.56 1.78 -0.23 0.00 -0.36 0.00 0.00 55.97 57.72 2nx3 s LYS 125 Cb -0.28 -3.53 -0.07 0.00 -1.51 0.00 0.00 37.83 32.44 2nx3 s LYS 125 CO 0.30 -0.46 1.28 0.41 -0.36 0.00 0.00 175.35 176.52 2nx3 n GLY 126 N 3.43 0.56 0.29 5.54 0.00 -1.24 -4.57 105.19 109.20 2nx3 n GLY 126 Ca 0.11 0.08 0.20 0.00 0.00 0.00 0.00 46.02 46.41 2nx3 n GLY 126 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2nx3 h GLN 127 N 1.61 0.00 -0.00 1.61 7.50 -1.83 -1.30 115.11 122.69 2nx3 h GLN 127 Ca -0.49 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.66 2nx3 h GLN 127 Cb 1.31 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.84 2nx3 h GLN 127 CO 0.58 0.00 -0.63 1.97 -1.50 0.00 0.00 178.83 179.25 2nx3 n PHE 128 N -2.90 0.00 -3.49 2.96 1.16 -1.26 -1.47 117.46 112.46 2nx3 n PHE 128 Ca -0.02 0.00 -0.36 0.00 -1.87 0.00 0.00 57.45 55.20 2nx3 n PHE 128 Cb 0.09 -0.08 -0.06 0.00 -1.61 0.00 0.00 39.48 37.82 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 -2.79 4.38 0.33 5.98 2.96 -0.49 -5.06 118.68 123.99 2nx3 s LEU 129 Ca 0.14 0.92 -0.14 0.00 -0.22 0.00 0.00 54.13 54.83 2nx3 s LEU 129 Cb 0.17 -2.95 -0.08 0.00 0.50 0.00 0.00 46.19 43.83 2nx3 s LEU 129 CO 0.70 0.20 0.72 0.00 -1.32 0.00 0.00 176.35 176.65 2nx3 s ALA 130 N -1.33 3.35 0.33 5.97 0.00 -1.26 -4.88 121.76 123.95 2nx3 s ALA 130 Ca 0.32 -0.02 0.07 0.00 0.00 0.00 0.00 51.96 52.32 2nx3 s ALA 130 Cb -0.15 -2.73 0.74 0.00 0.00 0.00 0.00 23.12 20.98 2nx3 s ALA 130 CO 0.17 0.30 1.86 -1.35 0.00 0.00 0.00 175.76 176.74 2nx3 h PRO 131 N 2.13 0.76 0.00 0.00 0.11 -1.98 -0.96 132.00 132.06 2nx3 h PRO 131 Ca -0.48 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2nx3 h PRO 131 Cb 1.18 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2nx3 h PRO 131 CO 0.65 0.50 0.00 -2.67 -0.21 0.00 0.00 178.00 176.28 2nx3 n TRP 132 N -4.58 0.14 1.52 0.65 2.14 -1.26 -2.91 117.44 113.14 2nx3 n TRP 132 Ca 0.18 0.04 0.14 0.00 2.07 0.00 0.00 57.50 59.93 2nx3 n TRP 132 Cb 0.43 -0.57 0.57 0.00 -0.81 0.00 0.00 31.31 30.92 2nx3 n TRP 132 CO 0.00 0.00 0.00 -0.25 2.07 0.00 0.00 177.69 179.51 2nx3 n ASP 133 N -1.62 1.12 0.10 -0.67 8.00 -0.37 -3.43 116.55 119.68 2nx3 n ASP 133 Ca 0.06 -1.24 0.13 0.00 0.71 0.00 0.00 54.79 54.45 2nx3 n ASP 133 Cb 0.31 0.01 0.43 0.00 -0.02 0.00 0.00 41.12 41.86 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 -0.23 0.55 -0.20 -3.53 -2.24 -1.15 -3.44 114.28 104.05 2nx3 n THR 134 Ca 0.18 -0.21 -0.06 0.00 -2.27 0.00 0.00 64.05 61.69 2nx3 n THR 134 Cb 0.31 -0.63 0.04 0.00 -2.10 0.00 0.00 70.33 67.96 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 0.74 0.00 -0.78 3.64 -1.78 -1.52 116.57 116.87 2nx3 h LYS 135 Ca 0.00 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 2nx3 h LYS 135 Cb 0.68 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.33 2nx3 h LYS 135 CO 0.00 0.49 -0.17 -0.91 -2.27 0.00 0.00 179.45 176.59 2nx3 h ASN 136 N 0.76 0.00 -0.08 4.20 -0.26 -1.82 -2.04 115.58 116.34 2nx3 h ASN 136 Ca 0.22 0.00 -0.04 0.00 -0.56 0.00 0.00 56.30 55.92 2nx3 h ASN 136 Cb -0.06 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.20 2nx3 h ASN 136 CO -0.06 0.17 -0.10 0.58 -1.06 0.00 0.00 177.43 176.96 2nx3 h VAL 137 N 0.00 1.38 -0.94 2.81 2.07 -1.43 -2.66 116.25 117.48 2nx3 h VAL 137 Ca -0.00 -1.30 0.00 0.00 0.82 0.00 0.00 66.70 66.22 2nx3 h VAL 137 Cb 0.47 2.06 -0.05 0.00 -1.52 0.00 0.00 31.29 32.25 2nx3 h VAL 137 CO 0.02 0.36 0.60 0.58 0.02 0.00 0.00 177.57 179.15 2nx3 h VAL 138 N -0.23 1.25 -0.95 2.57 2.07 -1.17 -2.21 116.25 117.58 2nx3 h VAL 138 Ca 0.01 -0.50 0.08 0.00 0.82 0.00 0.00 66.70 67.12 2nx3 h VAL 138 Cb 0.63 -0.11 -0.07 0.00 -1.52 0.00 0.00 31.29 30.23 2nx3 h VAL 138 CO 0.02 0.25 0.61 -0.08 0.02 0.00 0.00 177.57 178.39 2nx3 h GLU 139 N 1.28 0.99 -0.27 1.57 4.81 -1.28 0.13 114.58 121.81 2nx3 h GLU 139 Ca 0.34 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.47 2nx3 h GLU 139 Cb -0.11 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.04 2nx3 h GLU 139 CO -0.07 0.66 0.01 0.87 -0.73 0.00 0.00 179.01 179.74 2nx3 h LYS 140 N 1.02 0.48 -0.85 1.92 1.57 -1.04 -1.04 116.57 118.62 2nx3 h LYS 140 Ca 0.43 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 59.04 2nx3 h LYS 140 Cb 0.30 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 2nx3 h LYS 140 CO -0.18 0.63 0.46 -0.07 -0.57 0.00 0.00 179.45 179.72 2nx3 h LEU 141 N 0.26 1.06 0.05 2.94 3.38 -1.13 0.96 115.31 122.83 2nx3 h LEU 141 Ca 0.08 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 2nx3 h LEU 141 Cb 0.41 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2nx3 h LEU 141 CO 0.01 0.86 -0.02 0.11 0.09 0.00 0.00 178.44 179.49 2nx3 h LYS 142 N 1.18 -0.06 -0.90 1.13 1.57 -0.86 0.11 116.57 118.74 2nx3 h LYS 142 Ca 0.30 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 59.20 2nx3 h LYS 142 Cb 0.04 0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.28 2nx3 h LYS 142 CO -0.05 0.16 0.52 0.35 -0.57 0.00 0.00 179.45 179.87 2nx3 h PHE 143 N -0.28 0.94 0.00 -1.35 3.57 -0.96 0.10 116.94 118.96 2nx3 h PHE 143 Ca -0.01 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2nx3 h PHE 143 Cb 0.25 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.71 2nx3 h PHE 143 CO -0.00 0.33 0.00 0.41 -2.23 0.00 0.00 178.31 176.82 2nx3 n GLY 144 N -1.33 -0.80 0.00 2.40 0.00 0.31 -4.88 105.19 100.90 2nx3 n GLY 144 Ca 0.17 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 0.37 0.57 3.75 -0.02 0.00 0.35 -3.80 105.19 106.41 2nx3 n GLY 145 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.10 4.61 0.00 0.34 -4.90 121.76 123.10 2nx3 s ALA 146 Ca 0.00 0.87 0.02 0.00 0.00 0.00 0.00 51.96 52.85 2nx3 s ALA 146 Cb 0.00 -3.33 -0.08 0.00 0.00 0.00 0.00 23.12 19.71 2nx3 s ALA 146 CO 0.00 -0.16 -0.07 1.63 0.00 0.00 0.00 175.76 177.16 2nx3 n LYS 147 N 1.53 0.71 -3.47 0.00 5.02 -1.26 -4.35 118.16 116.34 2nx3 n LYS 147 Ca -0.00 0.05 -0.43 0.00 -2.02 0.00 0.00 58.31 55.91 2nx3 n LYS 147 Cb 0.45 -1.22 -0.08 0.00 -0.02 0.00 0.00 35.03 34.16 2nx3 n LYS 147 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2nx3 s GLU 148 N -2.22 2.83 -0.07 1.97 2.12 -1.26 -5.06 118.70 117.01 2nx3 s GLU 148 Ca -0.13 -1.42 0.05 0.00 0.36 0.00 0.00 54.97 53.84 2nx3 s GLU 148 Cb 0.04 -4.00 -0.01 0.00 0.26 0.00 0.00 34.13 30.42 2nx3 s GLU 148 CO 0.27 -1.02 -0.24 0.42 -0.54 0.00 0.00 175.26 174.16 2nx3 s ILE 149 N 1.55 1.98 0.08 -3.70 1.01 -1.26 -1.39 121.20 119.47 2nx3 s ILE 149 Ca 0.04 -1.01 0.10 0.00 0.00 0.00 0.00 60.65 59.77 2nx3 s ILE 149 Cb -0.24 -1.69 -0.03 0.00 0.01 0.00 0.00 42.46 40.50 2nx3 s ILE 149 CO 0.05 0.55 -0.26 -0.31 0.00 0.00 0.00 174.94 174.97 2nx3 s TYR 150 N 0.04 2.26 -0.10 3.97 2.02 0.03 -2.65 117.35 122.91 2nx3 s TYR 150 Ca -0.09 -0.40 0.04 0.00 -0.37 0.00 0.00 57.07 56.25 2nx3 s TYR 150 Cb -0.15 -1.30 0.00 0.00 -0.40 0.00 0.00 41.96 40.11 2nx3 s TYR 150 CO 0.05 0.20 -0.24 -0.51 -1.57 0.00 0.00 175.55 173.49 2nx3 s LEU 151 N -1.56 2.11 -0.15 -1.29 1.43 -0.10 -1.16 118.68 117.96 2nx3 s LEU 151 Ca 0.12 -0.56 -0.00 0.00 -1.03 0.00 0.00 54.13 52.66 2nx3 s LEU 151 Cb -0.10 -1.42 -0.01 0.00 0.03 0.00 0.00 46.19 44.70 2nx3 s LEU 151 CO 0.04 0.16 -0.13 -0.89 0.23 0.00 0.00 176.35 175.75 2nx3 s THR 152 N 0.36 2.91 -0.11 5.49 2.01 -0.37 -0.71 115.64 125.23 2nx3 s THR 152 Ca -0.18 -0.69 -0.28 0.00 0.31 0.00 0.00 61.69 60.85 2nx3 s THR 152 Cb -0.18 -2.24 -0.02 0.00 0.01 0.00 0.00 72.50 70.07 2nx3 s THR 152 CO 0.08 0.51 0.94 -0.70 -0.69 0.00 0.00 174.62 174.76 2nx3 s GLU 153 N 0.72 4.41 0.00 4.92 2.56 0.21 -1.16 118.70 130.36 2nx3 s GLU 153 Ca -0.06 1.26 0.19 0.00 0.00 0.00 0.00 54.97 56.36 2nx3 s GLU 153 Cb -0.15 -3.53 0.32 0.00 2.00 0.00 0.00 34.13 32.76 2nx3 s GLU 153 CO 0.02 -0.26 1.12 2.89 -0.56 0.00 0.00 175.26 178.47 2nx3 n ARG 154 N 4.85 0.00 0.00 4.30 1.85 -1.26 -0.13 116.66 126.27 2nx3 n ARG 154 Ca 0.07 -1.74 0.00 0.00 -1.00 0.00 0.00 57.85 55.18 2nx3 n ARG 154 Cb 0.49 -0.12 0.00 0.00 -1.05 0.00 0.00 32.46 31.78 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 0.37 0.72 3.01 2.89 0.00 -1.26 -4.04 105.19 106.88 2nx3 n GLY 155 Ca 0.04 -1.80 -0.18 0.00 0.00 0.00 0.00 46.02 44.08 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 -2.68 0.65 -0.13 2.61 2.01 -0.01 -4.33 115.64 113.76 2nx3 s THR 156 Ca 0.00 -0.39 -0.38 0.00 0.31 0.00 0.00 61.69 61.23 2nx3 s THR 156 Cb 0.00 -0.55 -0.15 0.00 0.01 0.00 0.00 72.50 71.81 2nx3 s THR 156 CO 0.00 0.15 1.67 0.41 -0.69 0.00 0.00 174.62 176.16 2nx3 n THR 157 N 2.79 0.27 -3.62 -0.82 -1.04 -0.54 -1.66 114.28 109.66 2nx3 n THR 157 Ca -0.14 -0.05 -0.29 0.00 -2.04 0.00 0.00 64.05 61.54 2nx3 n THR 157 Cb 0.57 -1.29 -0.12 0.00 -1.82 0.00 0.00 70.33 67.67 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 2.78 1.70 0.00 -1.42 5.36 -0.67 -4.86 117.98 120.87 2nx3 s PHE 158 Ca 0.93 -2.31 0.00 0.00 -0.96 0.00 0.00 56.93 54.59 2nx3 s PHE 158 Cb -0.94 -1.59 0.00 0.00 -0.34 0.00 0.00 43.02 40.15 2nx3 s PHE 158 CO 0.57 -0.78 0.00 0.41 -1.46 0.00 0.00 175.22 173.96 2nx3 n GLY 159 N 3.41 -0.55 3.89 13.12 0.00 -1.26 -4.38 105.19 119.41 2nx3 n GLY 159 Ca 0.14 -1.11 -0.33 0.00 0.00 0.00 0.00 46.02 44.72 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 3.53 -1.56 1.61 2.02 -1.26 -4.49 117.35 117.21 2nx3 s TYR 160 Ca 0.00 0.52 -0.16 0.00 -0.37 0.00 0.00 57.07 57.07 2nx3 s TYR 160 Cb 0.00 -1.96 0.13 0.00 -0.40 0.00 0.00 41.96 39.73 2nx3 s TYR 160 CO 0.00 0.54 0.72 0.09 -1.57 0.00 0.00 175.55 175.34 2nx3 n ASN 161 N 0.62 -3.55 -3.58 2.29 4.13 -1.26 -4.95 115.26 108.97 2nx3 n ASN 161 Ca -0.07 -0.81 -0.17 0.00 1.68 0.00 0.00 54.58 55.22 2nx3 n ASN 161 Cb 0.52 -2.90 -0.06 0.00 -1.54 0.00 0.00 39.78 35.79 2nx3 n ASN 161 CO 0.00 0.00 0.00 0.21 0.28 0.00 0.00 177.26 177.75 2nx3 s ASN 162 N -3.11 -0.54 0.07 6.41 2.47 -1.26 -4.17 114.94 114.80 2nx3 s ASN 162 Ca 0.65 0.53 0.06 0.00 0.42 0.00 0.00 52.86 54.52 2nx3 s ASN 162 Cb -0.35 0.49 -0.03 0.00 -1.45 0.00 0.00 41.25 39.91 2nx3 s ASN 162 CO 0.79 -0.59 -0.17 -0.76 -3.72 0.00 0.00 177.10 172.65 2nx3 s LEU 163 N -1.29 2.25 0.06 3.21 1.43 -1.26 -1.67 118.68 121.41 2nx3 s LEU 163 Ca -0.11 -0.59 0.08 0.00 -1.03 0.00 0.00 54.13 52.48 2nx3 s LEU 163 Cb -0.01 -0.72 -0.03 0.00 0.03 0.00 0.00 46.19 45.46 2nx3 s LEU 163 CO 0.08 0.02 -0.23 0.54 0.23 0.00 0.00 176.35 176.99 2nx3 s VAL 164 N -1.08 1.86 -0.35 -1.59 0.11 -0.67 -4.85 120.40 113.83 2nx3 s VAL 164 Ca 0.03 -1.35 -0.12 0.00 -2.93 0.00 0.00 61.98 57.61 2nx3 s VAL 164 Cb -0.09 -1.62 0.00 0.00 -1.53 0.00 0.00 36.38 33.14 2nx3 s VAL 164 CO 0.03 0.21 0.22 -0.69 -3.33 0.00 0.00 175.10 171.53 2nx3 s VAL 165 N -0.87 4.93 -0.70 2.04 1.01 -1.26 -0.83 120.40 124.72 2nx3 s VAL 165 Ca 0.09 -0.50 -0.20 0.00 0.00 0.00 0.00 61.98 61.37 2nx3 s VAL 165 Cb -0.09 -3.61 0.10 0.00 0.00 0.00 0.00 36.38 32.77 2nx3 s VAL 165 CO 0.03 -0.09 0.91 -0.62 0.00 0.00 0.00 175.10 175.32 2nx3 s ASP 166 N 1.65 6.29 0.07 3.32 -1.08 -1.26 -4.90 116.67 120.76 2nx3 s ASP 166 Ca 0.05 -1.41 0.10 0.00 -0.52 0.00 0.00 52.55 50.76 2nx3 s ASP 166 Cb -0.18 -2.37 0.45 0.00 -1.46 0.00 0.00 42.92 39.36 2nx3 s ASP 166 CO 0.08 -1.23 1.31 0.49 0.52 0.00 0.00 175.17 176.34 2nx3 n PHE 167 N 6.90 0.18 0.30 -5.34 3.72 -1.26 -1.44 117.46 120.52 2nx3 n PHE 167 Ca 0.01 0.08 0.18 0.00 -0.05 0.00 0.00 57.45 57.67 2nx3 n PHE 167 Cb 0.45 -0.63 0.86 0.00 -0.94 0.00 0.00 39.48 39.21 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 0.00 -1.08 3.08 -2.03 -2.33 114.38 112.01 2nx3 h ARG 168 Ca 0.00 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 2nx3 h ARG 168 Cb 0.11 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 2nx3 h ARG 168 CO 0.00 0.00 -0.39 0.66 -1.07 0.00 0.00 179.97 179.17 2nx3 h SER 169 N 0.00 0.00 0.61 7.04 4.64 -1.67 -3.06 113.55 121.10 2nx3 h SER 169 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 2nx3 h SER 169 Cb 0.24 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.34 2nx3 h SER 169 CO 0.00 0.39 -0.29 -0.07 -0.87 0.00 0.00 176.83 175.99 2nx3 h LEU 170 N 0.00 -0.69 -1.57 5.97 4.07 -1.63 -0.74 115.31 120.72 2nx3 h LEU 170 Ca -0.00 0.02 -0.05 0.00 0.08 0.00 0.00 57.88 57.92 2nx3 h LEU 170 Cb 0.78 0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.69 2nx3 h LEU 170 CO 0.05 -0.48 -0.23 1.55 -1.08 0.00 0.00 178.44 178.25 2nx3 h PRO 171 N -0.83 0.00 -0.07 1.13 0.13 -1.73 -2.14 132.00 128.48 2nx3 h PRO 171 Ca -0.08 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.02 2nx3 h PRO 171 Cb 0.63 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.76 2nx3 h PRO 171 CO 0.14 0.23 -0.07 0.82 -0.23 0.00 0.00 178.00 178.89 2nx3 h ILE 172 N 0.00 1.36 0.00 -3.56 2.04 -1.41 -3.20 117.51 112.74 2nx3 h ILE 172 Ca -0.00 -1.20 -0.07 0.00 1.00 0.00 0.00 64.86 64.59 2nx3 h ILE 172 Cb 0.46 2.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.53 2nx3 h ILE 172 CO 0.03 0.33 -0.31 0.24 0.00 0.00 0.00 178.15 178.44 2nx3 h MET 173 N -0.25 0.00 -0.05 2.37 2.86 -1.06 -2.77 114.93 116.03 2nx3 h MET 173 Ca 0.01 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.67 2nx3 h MET 173 Cb 0.57 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.23 2nx3 h MET 173 CO 0.02 0.31 0.07 -0.22 1.06 0.00 0.00 176.91 178.15 2nx3 h LYS 174 N 0.00 0.00 0.00 1.72 1.63 -1.38 -0.46 116.57 118.08 2nx3 h LYS 174 Ca -0.00 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.77 2nx3 h LYS 174 Cb 0.70 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.33 2nx3 h LYS 174 CO 0.04 0.00 -0.14 1.96 -3.45 0.00 0.00 179.45 177.87 2nx3 h GLN 175 N 0.00 0.00 0.00 1.90 4.20 -1.58 -3.32 115.11 116.31 2nx3 h GLN 175 Ca 0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.73 2nx3 h GLN 175 Cb 0.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.95 2nx3 h GLN 175 CO -0.00 0.14 -1.07 0.91 -0.67 0.00 0.00 178.83 178.14 2nx3 n TRP 176 N -3.76 0.00 -3.78 2.96 8.01 -0.23 -5.10 117.44 115.54 2nx3 n TRP 176 Ca -0.02 0.00 -0.05 0.00 -1.31 0.00 0.00 57.50 56.12 2nx3 n TRP 176 Cb 0.24 -0.09 -0.02 0.00 -2.01 0.00 0.00 31.31 29.43 2nx3 n TRP 176 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2nx3 s ALA 177 N -2.20 -1.51 0.42 6.99 0.00 -0.91 -5.01 121.76 119.54 2nx3 s ALA 177 Ca -0.01 -0.00 -0.24 0.00 0.00 0.00 0.00 51.96 51.70 2nx3 s ALA 177 Cb 0.03 0.71 -0.08 0.00 0.00 0.00 0.00 23.12 23.78 2nx3 s ALA 177 CO 0.20 -1.03 1.16 0.15 0.00 0.00 0.00 175.76 176.24 2nx3 s LYS 178 N -3.50 3.95 -0.10 0.00 1.02 -1.08 -4.15 119.74 115.88 2nx3 s LYS 178 Ca 0.12 1.79 0.01 0.00 0.02 0.00 0.00 55.97 57.90 2nx3 s LYS 178 Cb -0.03 -2.57 -0.02 0.00 -0.52 0.00 0.00 37.83 34.69 2nx3 s LYS 178 CO 0.03 -0.39 -0.12 0.08 -0.92 0.00 0.00 175.35 174.03 2nx3 s VAL 179 N -1.48 3.19 -0.04 3.17 1.01 -1.26 -0.92 120.40 124.06 2nx3 s VAL 179 Ca 0.59 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 62.00 2nx3 s VAL 179 Cb -0.29 -2.32 -0.02 0.00 0.00 0.00 0.00 36.38 33.75 2nx3 s VAL 179 CO 0.36 0.55 -0.21 -0.63 0.00 0.00 0.00 175.10 175.17 2nx3 s ILE 180 N -0.05 2.45 -0.26 2.22 1.01 0.11 0.02 121.20 126.71 2nx3 s ILE 180 Ca -0.02 -0.95 -0.10 0.00 0.00 0.00 0.00 60.65 59.58 2nx3 s ILE 180 Cb -0.14 -1.91 -0.05 0.00 0.01 0.00 0.00 42.46 40.38 2nx3 s ILE 180 CO 0.04 0.58 0.15 -0.47 0.00 0.00 0.00 174.94 175.24 2nx3 s TYR 181 N -0.57 3.23 -0.82 3.97 5.04 0.03 -0.62 117.35 127.61 2nx3 s TYR 181 Ca 0.08 0.06 -0.21 0.00 -2.44 0.00 0.00 57.07 54.56 2nx3 s TYR 181 Cb -0.11 -2.31 0.09 0.00 0.35 0.00 0.00 41.96 39.99 2nx3 s TYR 181 CO 0.00 -0.10 1.11 0.34 -1.34 0.00 0.00 175.55 175.56 2nx3 s ASP 182 N 1.44 6.40 0.50 4.32 -1.08 0.82 -0.29 116.67 128.78 2nx3 s ASP 182 Ca 0.07 -1.45 0.27 0.00 -0.52 0.00 0.00 52.55 50.92 2nx3 s ASP 182 Cb -0.15 -2.44 1.29 0.00 -1.46 0.00 0.00 42.92 40.16 2nx3 s ASP 182 CO 0.07 -1.32 1.99 0.00 0.52 0.00 0.00 175.17 176.43 2nx3 h ALA 183 N 9.33 1.15 0.03 3.66 0.00 -1.50 -3.02 119.26 128.90 2nx3 h ALA 183 Ca -0.04 -0.13 -0.28 0.00 0.00 0.00 0.00 54.91 54.45 2nx3 h ALA 183 Cb 1.04 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 2nx3 h ALA 183 CO 1.19 0.18 -1.53 0.25 0.00 0.00 0.00 179.25 179.34 2nx3 n THR 184 N -3.48 1.58 0.42 0.00 -2.24 -1.25 -4.32 114.28 104.99 2nx3 n THR 184 Ca -0.01 -0.19 0.13 0.00 -2.27 0.00 0.00 64.05 61.71 2nx3 n THR 184 Cb 0.31 -1.96 0.45 0.00 -2.10 0.00 0.00 70.33 67.02 2nx3 n THR 184 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 2nx3 h HIS 185 N -0.77 0.00 0.00 4.78 3.86 -1.91 -3.03 115.15 118.08 2nx3 h HIS 185 Ca -0.40 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.81 2nx3 h HIS 185 Cb 1.49 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.96 2nx3 h HIS 185 CO 0.08 0.00 0.00 0.77 0.86 0.00 0.00 177.93 179.64 2nx3 h SER 186 N 0.00 0.00 -0.44 2.45 0.02 -1.67 -2.55 113.55 111.37 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 0.62 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.16 2nx3 h SER 186 CO 0.00 0.00 0.00 1.33 -1.14 0.00 0.00 176.83 177.02 2nx3 n VAL 187 N -3.02 1.59 -3.27 2.27 0.24 -1.15 -4.71 118.33 110.28 2nx3 n VAL 187 Ca 0.01 -1.29 -0.34 0.00 -2.04 0.00 0.00 64.34 60.68 2nx3 n VAL 187 Cb 0.31 0.19 -0.06 0.00 -1.47 0.00 0.00 33.84 32.81 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 -1.73 3.99 -0.71 7.34 -2.07 -0.96 -2.16 119.66 123.36 2nx3 s GLN 188 Ca 0.38 0.55 -0.09 0.00 -1.82 0.00 0.00 55.36 54.38 2nx3 s GLN 188 Cb 0.25 -2.72 0.18 0.00 -1.09 0.00 0.00 33.01 29.63 2nx3 s GLN 188 CO 0.18 0.34 0.59 -0.51 -1.32 0.00 0.00 175.29 174.57 2nx3 s LEU 189 N -2.44 6.06 -0.03 2.60 1.43 -0.69 -4.28 118.68 121.33 2nx3 s LEU 189 Ca 0.45 -2.65 -0.37 0.00 -1.03 0.00 0.00 54.13 50.53 2nx3 s LEU 189 Cb -0.13 -2.06 -0.16 0.00 0.03 0.00 0.00 46.19 43.87 2nx3 s LEU 189 CO 0.20 -0.52 1.53 -0.81 0.23 0.00 0.00 176.35 176.97 2nx3 n PRO 190 N 3.93 1.31 -1.44 1.29 -0.04 -1.26 -1.04 135.00 137.74 2nx3 n PRO 190 Ca 0.08 0.47 -0.15 0.00 -0.04 0.00 0.00 63.50 63.87 2nx3 n PRO 190 Cb 0.43 -2.15 -0.06 0.00 -0.04 0.00 0.00 33.50 31.67 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 3.26 1.45 0.24 0.55 0.00 -1.25 -4.28 105.19 105.16 2nx3 n GLY 191 Ca 0.21 -0.01 -0.01 0.00 0.00 0.00 0.00 46.02 46.21 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 0.45 -4.32 -0.02 0.00 -0.93 -3.15 103.07 95.09 2nx3 h GLY 192 Ca -0.31 -0.32 -0.66 0.00 0.00 0.00 0.00 47.33 46.04 2nx3 h GLY 192 CO 0.45 0.29 0.87 1.04 0.00 0.00 0.00 176.54 179.19 2nx3 n LEU 193 N -4.19 7.45 0.00 3.11 4.77 0.20 -4.82 117.00 123.53 2nx3 n LEU 193 Ca -0.00 -4.37 0.00 0.00 -0.03 0.00 0.00 56.01 51.61 2nx3 n LEU 193 Cb 0.34 -1.04 0.00 0.00 -2.33 0.00 0.00 43.42 40.39 2nx3 n LEU 193 CO 0.40 1.56 0.00 0.61 -1.33 0.00 0.00 177.39 178.64 2nx3 n GLY 194 N -0.55 1.75 1.33 -0.72 0.00 -1.19 -3.23 105.19 102.59 2nx3 n GLY 194 Ca 0.56 0.19 0.09 0.00 0.00 0.00 0.00 46.02 46.86 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 4.66 4.30 -3.94 1.61 5.75 -1.26 -4.89 116.55 122.78 2nx3 n ASP 195 Ca 0.00 -2.41 -0.09 0.00 -0.01 0.00 0.00 54.79 52.28 2nx3 n ASP 195 Cb 0.00 -0.51 -0.05 0.00 -1.03 0.00 0.00 41.12 39.53 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 -1.76 1.53 0.08 0.11 1.02 -1.20 -3.68 119.74 115.84 2nx3 s LYS 196 Ca 0.45 -1.15 -0.08 0.00 0.02 0.00 0.00 55.97 55.21 2nx3 s LYS 196 Cb 0.29 0.49 -0.06 0.00 -0.52 0.00 0.00 37.83 38.04 2nx3 s LYS 196 CO 0.22 -0.64 0.37 -1.12 -0.92 0.00 0.00 175.35 173.26 2nx3 s SER 197 N -2.98 6.57 0.67 2.83 0.01 -1.26 -0.63 113.70 118.92 2nx3 s SER 197 Ca 0.18 0.69 -0.02 0.00 1.31 0.00 0.00 55.95 58.12 2nx3 s SER 197 Cb -0.01 -2.14 0.08 0.00 0.21 0.00 0.00 66.02 64.16 2nx3 s SER 197 CO 0.06 0.16 0.52 0.61 0.41 0.00 0.00 173.24 175.00 2nx3 n GLY 198 N 0.74 0.16 3.44 3.44 0.00 -0.32 -4.65 105.19 108.00 2nx3 n GLY 198 Ca -0.07 -1.91 0.01 0.00 0.00 0.00 0.00 46.02 44.05 2nx3 n GLY 198 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2nx3 s GLY 199 N -3.87 -0.07 -1.08 -0.02 0.00 -1.26 -1.70 107.32 99.32 2nx3 s GLY 199 Ca 0.33 3.16 -0.14 0.00 0.00 0.00 0.00 44.72 48.07 2nx3 s GLY 199 CO 0.22 3.11 1.21 1.06 0.00 0.00 0.00 173.10 178.70 2nx3 s MET 200 N 2.14 3.96 0.57 2.90 -1.94 -0.92 -4.67 119.30 121.35 2nx3 s MET 200 Ca -0.04 -2.56 0.27 0.00 -1.71 0.00 0.00 55.69 51.65 2nx3 s MET 200 Cb -0.05 -4.83 1.56 0.00 2.01 0.00 0.00 34.83 33.52 2nx3 s MET 200 CO -0.17 -1.58 2.06 -0.09 -0.01 0.00 0.00 175.02 175.24 2nx3 h ARG 201 N 7.45 0.00 0.00 2.03 2.43 -1.87 -2.26 114.38 122.16 2nx3 h ARG 201 Ca 0.23 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.39 2nx3 h ARG 201 Cb 0.92 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.47 2nx3 h ARG 201 CO 1.10 0.00 -0.01 1.05 -1.51 0.00 0.00 179.97 180.60 2nx3 h GLU 202 N 0.00 0.00 -0.01 0.20 4.11 -1.94 -2.36 114.58 114.58 2nx3 h GLU 202 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.55 2nx3 h GLU 202 Cb 0.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.87 2nx3 h GLU 202 CO -0.00 0.01 -0.37 1.19 0.07 0.00 0.00 179.01 179.91 2nx3 n PHE 203 N -3.52 0.00 0.25 2.06 3.72 -0.85 -4.53 117.46 114.60 2nx3 n PHE 203 Ca -0.03 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.21 2nx3 n PHE 203 Cb 0.10 -0.03 -0.08 0.00 -0.94 0.00 0.00 39.48 38.53 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 2.33 0.23 -0.03 4.37 2.04 -1.56 -2.39 117.51 122.51 2nx3 h ILE 204 Ca 0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 2nx3 h ILE 204 Cb 0.71 0.23 -0.00 0.00 -0.74 0.00 0.00 36.82 37.02 2nx3 h ILE 204 CO 0.00 0.00 0.02 0.15 0.00 0.00 0.00 178.15 178.32 2nx3 h PHE 205 N -0.81 0.04 -0.48 1.37 3.57 -1.79 -1.80 116.94 117.04 2nx3 h PHE 205 Ca -0.04 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.53 2nx3 h PHE 205 Cb 0.71 -0.01 -0.06 0.00 2.79 0.00 0.00 35.95 39.37 2nx3 h PHE 205 CO -0.19 0.08 0.14 -1.35 -2.23 0.00 0.00 178.31 174.77 2nx3 h PRO 206 N -0.01 0.29 -0.08 6.41 0.11 -1.80 -1.24 132.00 135.68 2nx3 h PRO 206 Ca 0.01 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 66.01 2nx3 h PRO 206 Cb 0.06 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 2nx3 h PRO 206 CO -0.00 0.19 -0.38 -0.07 -0.21 0.00 0.00 178.00 177.53 2nx3 h LEU 207 N 0.30 0.18 -0.86 2.35 3.38 -1.38 -2.16 115.31 117.12 2nx3 h LEU 207 Ca 0.23 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 2nx3 h LEU 207 Cb 0.27 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 2nx3 h LEU 207 CO -0.26 0.55 0.41 0.40 0.09 0.00 0.00 178.44 179.62 2nx3 h ILE 208 N 0.15 1.26 -0.31 1.22 2.04 -0.50 -1.11 117.51 120.26 2nx3 h ILE 208 Ca 0.01 -0.74 -0.08 0.00 1.00 0.00 0.00 64.86 65.06 2nx3 h ILE 208 Cb 0.75 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 2nx3 h ILE 208 CO 0.06 0.32 -0.13 0.03 0.00 0.00 0.00 178.15 178.42 2nx3 h ARG 209 N 1.22 0.54 -0.33 2.37 3.08 -0.66 -2.47 114.38 118.14 2nx3 h ARG 209 Ca 0.29 -0.16 -0.07 0.00 0.07 0.00 0.00 59.98 60.11 2nx3 h ARG 209 Cb 0.12 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 2nx3 h ARG 209 CO -0.04 0.66 -0.06 0.00 -1.07 0.00 0.00 179.97 179.47 2nx3 h ALA 210 N 1.37 0.45 -0.24 0.04 0.00 -0.82 -1.67 119.26 118.38 2nx3 h ALA 210 Ca 0.09 -0.28 0.04 0.00 0.00 0.00 0.00 54.91 54.76 2nx3 h ALA 210 Cb 0.52 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 2nx3 h ALA 210 CO 0.03 0.26 -0.01 0.00 0.00 0.00 0.00 179.25 179.53 2nx3 h ALA 211 N 0.81 0.20 -0.04 0.00 0.00 -0.95 0.89 119.26 120.17 2nx3 h ALA 211 Ca 0.09 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 2nx3 h ALA 211 Cb 0.54 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2nx3 h ALA 211 CO 0.03 -0.43 -0.45 0.28 0.00 0.00 0.00 179.25 178.68 2nx3 h VAL 212 N 0.06 1.32 -0.35 0.00 2.07 -1.45 0.19 116.25 118.09 2nx3 h VAL 212 Ca 0.12 -1.57 -0.16 0.00 0.82 0.00 0.00 66.70 65.91 2nx3 h VAL 212 Cb 0.16 1.80 -0.00 0.00 -1.52 0.00 0.00 31.29 31.72 2nx3 h VAL 212 CO -0.21 0.45 -0.41 0.00 0.02 0.00 0.00 177.57 177.43 2nx3 h ALA 213 N 1.48 0.53 -0.02 1.67 0.00 -0.60 -3.12 119.26 119.19 2nx3 h ALA 213 Ca 0.00 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 2nx3 h ALA 213 Cb 0.82 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 2nx3 h ALA 213 CO 0.06 0.65 -0.02 0.28 0.00 0.00 0.00 179.25 180.22 2nx3 h VAL 214 N 0.71 1.40 0.00 0.00 2.07 -0.67 -3.48 116.25 116.28 2nx3 h VAL 214 Ca 0.05 -1.20 0.00 0.00 0.82 0.00 0.00 66.70 66.37 2nx3 h VAL 214 Cb 1.01 2.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.95 2nx3 h VAL 214 CO 0.10 0.32 0.00 0.61 0.02 0.00 0.00 177.57 178.61 2nx3 n GLY 215 N 0.26 3.08 3.37 2.17 0.00 0.64 -4.83 105.19 109.88 2nx3 n GLY 215 Ca -0.08 -0.97 -0.10 0.00 0.00 0.00 0.00 46.02 44.87 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 -0.24 0.65 -3.65 0.00 8.00 0.10 -4.99 116.55 116.43 2nx3 n ASP 217 Ca -0.06 0.20 0.00 0.00 0.71 0.00 0.00 54.79 55.64 2nx3 n ASP 217 Cb 0.63 -0.08 -0.00 0.00 -0.02 0.00 0.00 41.12 41.65 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 -3.52 -0.34 -0.02 0.44 0.00 -0.94 -2.10 107.32 100.83 2nx3 s GLY 218 Ca 0.08 0.50 0.04 0.00 0.00 0.00 0.00 44.72 45.35 2nx3 s GLY 218 CO 0.68 0.43 -0.16 0.14 0.00 0.00 0.00 173.10 174.19 2nx3 s VAL 219 N -2.59 1.25 -0.27 1.40 1.01 -0.62 -0.79 120.40 119.79 2nx3 s VAL 219 Ca 0.15 -0.66 -0.06 0.00 0.00 0.00 0.00 61.98 61.41 2nx3 s VAL 219 Cb 0.03 -1.06 -0.00 0.00 0.00 0.00 0.00 36.38 35.35 2nx3 s VAL 219 CO -0.02 0.36 0.05 0.12 0.00 0.00 0.00 175.10 175.61 2nx3 s PHE 220 N -0.20 3.09 -0.08 5.22 5.36 0.60 -0.78 117.98 131.19 2nx3 s PHE 220 Ca 0.02 -0.86 -0.01 0.00 -0.96 0.00 0.00 56.93 55.13 2nx3 s PHE 220 Cb -0.08 -2.21 0.03 0.00 -0.34 0.00 0.00 43.02 40.41 2nx3 s PHE 220 CO 0.00 -0.53 -0.04 -1.64 -1.46 0.00 0.00 175.22 171.56 2nx3 s MET 221 N 1.52 1.06 0.19 10.12 -1.94 0.23 -1.34 119.30 129.13 2nx3 s MET 221 Ca 0.04 -0.09 -0.19 0.00 -1.71 0.00 0.00 55.69 53.74 2nx3 s MET 221 Cb -0.16 -1.22 -0.08 0.00 2.01 0.00 0.00 34.83 35.38 2nx3 s MET 221 CO 0.01 -0.24 0.69 -1.21 -0.01 0.00 0.00 175.02 174.26 2nx3 s GLU 222 N 1.67 4.24 0.11 2.03 2.02 -1.26 -3.19 118.70 124.31 2nx3 s GLU 222 Ca 0.02 0.83 -0.00 0.00 0.02 0.00 0.00 54.97 55.84 2nx3 s GLU 222 Cb -0.13 -2.95 -0.04 0.00 0.10 0.00 0.00 34.13 31.11 2nx3 s GLU 222 CO -0.05 0.44 0.01 -0.08 0.02 0.00 0.00 175.26 175.60 2nx3 s THR 223 N -1.45 0.25 -0.24 3.63 -1.32 -0.02 -1.54 115.64 114.95 2nx3 s THR 223 Ca 0.40 -1.89 -0.26 0.00 -1.21 0.00 0.00 61.69 58.74 2nx3 s THR 223 Cb -0.17 -1.86 0.08 0.00 -1.51 0.00 0.00 72.50 69.04 2nx3 s THR 223 CO 0.21 -0.67 0.76 -2.28 -2.21 0.00 0.00 174.62 170.44 2nx3 s HIS 224 N -3.93 -0.72 0.25 9.09 2.46 -0.49 -3.43 115.29 118.52 2nx3 s HIS 224 Ca 0.18 1.68 -0.03 0.00 0.47 0.00 0.00 55.06 57.36 2nx3 s HIS 224 Cb 0.07 0.31 0.43 0.00 -0.13 0.00 0.00 32.58 33.26 2nx3 s HIS 224 CO -0.02 -0.39 1.81 -1.35 -2.47 0.00 0.00 174.74 172.32 2nx3 h PRO 225 N 4.56 0.79 -2.57 2.88 0.11 -1.96 -2.36 132.00 133.44 2nx3 h PRO 225 Ca -0.28 -0.05 -0.59 0.00 0.11 0.00 0.00 66.00 65.19 2nx3 h PRO 225 Cb 1.16 -0.18 -0.39 0.00 0.11 0.00 0.00 31.00 31.70 2nx3 h PRO 225 CO 0.11 0.52 -0.87 -1.21 -0.21 0.00 0.00 178.00 176.34 2nx3 s GLU 226 N -6.01 0.96 0.33 1.05 2.02 -1.26 -4.56 118.70 111.22 2nx3 s GLU 226 Ca -0.12 -1.94 0.10 0.00 0.02 0.00 0.00 54.97 53.03 2nx3 s GLU 226 Cb 0.20 -1.66 0.98 0.00 0.10 0.00 0.00 34.13 33.75 2nx3 s GLU 226 CO 0.79 -1.29 1.63 -1.35 0.02 0.00 0.00 175.26 175.05 2nx3 h PRO 227 N 6.21 0.17 0.00 0.39 0.11 -1.87 0.39 132.00 137.40 2nx3 h PRO 227 Ca 0.16 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.25 2nx3 h PRO 227 Cb 0.92 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.99 2nx3 h PRO 227 CO 0.38 0.11 -0.01 1.05 -0.21 0.00 0.00 178.00 179.32 2nx3 h GLU 228 N 0.18 0.00 -0.03 1.05 4.11 -1.93 -1.88 114.58 116.08 2nx3 h GLU 228 Ca 0.68 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.11 2nx3 h GLU 228 Cb 1.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.81 2nx3 h GLU 228 CO -0.70 0.01 -0.06 1.63 0.07 0.00 0.00 179.01 179.96 2nx3 n LYS 229 N -3.31 2.18 -1.74 1.06 5.02 0.14 -4.98 118.16 116.54 2nx3 n LYS 229 Ca -0.03 -1.80 -0.42 0.00 -2.02 0.00 0.00 58.31 54.04 2nx3 n LYS 229 Cb 0.11 -1.46 -0.01 0.00 -0.02 0.00 0.00 35.03 33.65 2nx3 n LYS 229 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2nx3 n ALA 230 N 1.17 2.20 1.67 7.82 0.00 -0.71 -4.86 120.51 127.80 2nx3 n ALA 230 Ca 0.13 0.37 0.12 0.00 0.00 0.00 0.00 53.44 54.06 2nx3 n ALA 230 Cb 0.58 -2.41 0.71 0.00 0.00 0.00 0.00 19.45 18.33 2nx3 n ALA 230 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2nx3 n LEU 231 N 1.65 0.00 -3.63 0.00 4.77 -1.26 -4.45 117.00 114.08 2nx3 n LEU 231 Ca 0.07 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.96 2nx3 n LEU 231 Cb 0.36 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.39 2nx3 n LEU 231 CO 0.64 0.00 0.79 -0.94 -1.33 0.00 0.00 177.39 176.55 2nx3 s SER 232 N -1.91 -0.39 -1.63 -1.43 1.04 -1.26 -4.39 113.70 103.73 2nx3 s SER 232 Ca 0.36 0.70 -0.03 0.00 0.48 0.00 0.00 55.95 57.46 2nx3 s SER 232 Cb 0.16 0.69 0.00 0.00 0.10 0.00 0.00 66.02 66.97 2nx3 s SER 232 CO 0.28 -0.17 0.36 0.47 0.98 0.00 0.00 173.24 175.16 2nx3 n ASP 233 N 1.85 -6.00 0.00 7.02 8.00 -1.26 -4.83 116.55 121.33 2nx3 n ASP 233 Ca -0.12 -0.18 -0.13 0.00 0.71 0.00 0.00 54.79 55.08 2nx3 n ASP 233 Cb 0.56 -4.89 -0.06 0.00 -0.02 0.00 0.00 41.12 36.71 2nx3 n ASP 233 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2nx3 h ALA 234 N 0.98 -0.62 0.00 2.24 0.00 -1.81 -1.84 119.26 118.21 2nx3 h ALA 234 Ca -0.51 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2nx3 h ALA 234 Cb 1.36 0.81 0.00 0.00 0.00 0.00 0.00 17.79 19.96 2nx3 h ALA 234 CO 0.57 -0.94 0.00 -0.35 0.00 0.00 0.00 179.25 178.52 2nx3 n PRO 235 N -5.44 0.06 -0.00 0.00 -0.04 -1.26 -2.92 135.00 125.40 2nx3 n PRO 235 Ca -0.04 0.11 0.01 0.00 -0.04 0.00 0.00 63.50 63.54 2nx3 n PRO 235 Cb 0.36 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.31 2nx3 n PRO 235 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2nx3 n THR 236 N -1.12 0.00 -2.27 0.52 -2.24 -0.71 -3.96 114.28 104.50 2nx3 n THR 236 Ca 0.01 -0.36 -0.41 0.00 -2.27 0.00 0.00 64.05 61.03 2nx3 n THR 236 Cb 0.01 0.87 -0.03 0.00 -2.10 0.00 0.00 70.33 69.09 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 -1.44 3.47 0.01 6.98 0.00 -1.11 -4.86 121.76 124.81 2nx3 s ALA 237 Ca 0.00 1.10 -0.21 0.00 0.00 0.00 0.00 51.96 52.86 2nx3 s ALA 237 Cb 0.02 -3.42 -0.06 0.00 0.00 0.00 0.00 23.12 19.66 2nx3 s ALA 237 CO 0.10 -0.45 0.61 -0.51 0.00 0.00 0.00 175.76 175.51 2nx3 s LEU 238 N -1.40 4.43 0.19 0.00 1.02 -0.59 -4.79 118.68 117.56 2nx3 s LEU 238 Ca 0.48 1.20 -0.31 0.00 0.02 0.00 0.00 54.13 55.52 2nx3 s LEU 238 Cb -0.36 -2.94 -0.11 0.00 0.02 0.00 0.00 46.19 42.80 2nx3 s LEU 238 CO 0.46 0.12 1.60 -2.16 0.02 0.00 0.00 176.35 176.38 2nx3 s PRO 239 N -0.29 4.19 0.42 1.29 0.04 -1.26 -1.39 135.00 138.00 2nx3 s PRO 239 Ca 0.31 2.44 0.30 0.00 0.04 0.00 0.00 61.00 64.08 2nx3 s PRO 239 Cb -0.19 -3.12 1.46 0.00 0.04 0.00 0.00 34.50 32.70 2nx3 s PRO 239 CO 0.18 -0.63 1.58 1.25 0.04 0.00 0.00 177.00 179.42 2nx3 h LEU 240 N 6.46 0.23 -0.42 -3.56 5.85 -1.66 0.31 115.31 122.52 2nx3 h LEU 240 Ca -0.43 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.47 2nx3 h LEU 240 Cb 1.21 0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.43 2nx3 h LEU 240 CO 0.90 -0.31 0.00 -1.54 -0.34 0.00 0.00 178.44 177.15 2nx3 n SER 241 N -4.88 0.54 -0.10 1.25 3.41 -1.26 -3.03 113.62 109.55 2nx3 n SER 241 Ca 0.40 0.61 0.12 0.00 -0.26 0.00 0.00 58.87 59.74 2nx3 n SER 241 Cb 1.50 -0.73 0.28 0.00 -0.26 0.00 0.00 64.21 65.00 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 -2.07 0.34 0.13 4.33 6.02 0.11 -4.38 117.38 121.86 2nx3 n GLN 242 Ca 0.03 -0.20 -0.14 0.00 -0.01 0.00 0.00 57.00 56.69 2nx3 n GLN 242 Cb 0.26 -1.50 -0.07 0.00 1.02 0.00 0.00 30.24 29.95 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 0.49 -0.25 -0.53 1.08 3.38 -1.65 -2.87 115.31 114.96 2nx3 h LEU 243 Ca 0.00 0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.09 2nx3 h LEU 243 Cb 0.51 0.07 -0.10 0.00 0.09 0.00 0.00 40.66 41.23 2nx3 h LEU 243 CO 0.00 -0.17 -0.07 -0.08 0.09 0.00 0.00 178.44 178.21 2nx3 h GLU 244 N -0.27 0.05 -0.57 1.13 4.22 -1.81 0.02 114.58 117.33 2nx3 h GLU 244 Ca -0.02 -0.00 -0.04 0.00 0.08 0.00 0.00 59.36 59.38 2nx3 h GLU 244 Cb 0.22 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 2nx3 h GLU 244 CO 0.03 0.03 0.22 0.78 -2.18 0.00 0.00 179.01 177.89 2nx3 h GLY 245 N 0.05 0.93 1.00 1.92 0.00 -1.82 -1.70 103.07 103.46 2nx3 h GLY 245 Ca 0.26 -0.51 -0.08 0.00 0.00 0.00 0.00 47.33 47.00 2nx3 h GLY 245 CO -0.50 0.48 -0.02 -2.22 0.00 0.00 0.00 176.54 174.27 2nx3 h ILE 246 N 0.79 1.27 -0.49 2.60 2.04 -1.17 -1.96 117.51 120.60 2nx3 h ILE 246 Ca 0.19 -1.10 -0.01 0.00 1.00 0.00 0.00 64.86 64.94 2nx3 h ILE 246 Cb 0.22 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 2nx3 h ILE 246 CO -0.01 0.38 0.25 0.40 0.00 0.00 0.00 178.15 179.17 2nx3 h ILE 247 N 0.70 1.18 -0.46 -0.67 2.04 -0.90 -1.39 117.51 118.00 2nx3 h ILE 247 Ca 0.13 -0.48 0.07 0.00 1.00 0.00 0.00 64.86 65.58 2nx3 h ILE 247 Cb 0.54 0.60 -0.06 0.00 -0.74 0.00 0.00 36.82 37.17 2nx3 h ILE 247 CO 0.03 0.19 0.11 -0.08 0.00 0.00 0.00 178.15 178.40 2nx3 h GLU 248 N 0.64 0.24 -0.65 2.37 4.57 -1.14 -1.98 114.58 118.64 2nx3 h GLU 248 Ca 0.17 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.31 2nx3 h GLU 248 Cb 0.08 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.59 2nx3 h GLU 248 CO -0.02 0.16 0.30 0.00 -1.18 0.00 0.00 179.01 178.26 2nx3 h ALA 249 N 1.34 0.84 -0.18 2.92 0.00 -0.91 -1.56 119.26 121.71 2nx3 h ALA 249 Ca 0.22 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 2nx3 h ALA 249 Cb 0.27 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2nx3 h ALA 249 CO -0.28 0.42 -0.25 -0.84 0.00 0.00 0.00 179.25 178.30 2nx3 h ILE 250 N 0.90 1.25 -0.21 0.00 -0.00 -0.85 -0.15 117.51 118.45 2nx3 h ILE 250 Ca 0.22 -1.19 -0.07 0.00 -0.00 0.00 0.00 64.86 63.82 2nx3 h ILE 250 Cb 0.15 1.40 -0.00 0.00 -0.00 0.00 0.00 36.82 38.36 2nx3 h ILE 250 CO -0.03 0.37 -0.15 -0.07 -0.00 0.00 0.00 178.15 178.28 2nx3 h LEU 251 N 0.30 0.50 -0.76 0.16 3.38 -1.10 0.15 115.31 117.95 2nx3 h LEU 251 Ca 0.05 -0.44 -0.07 0.00 0.09 0.00 0.00 57.88 57.50 2nx3 h LEU 251 Cb 0.62 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 2nx3 h LEU 251 CO 0.04 0.83 0.11 -0.33 0.09 0.00 0.00 178.44 179.18 2nx3 h GLU 252 N 0.17 1.05 -0.23 1.13 5.08 -1.06 0.17 114.58 120.88 2nx3 h GLU 252 Ca 0.04 -0.27 -0.13 0.00 -1.00 0.00 0.00 59.36 58.00 2nx3 h GLU 252 Cb 0.66 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 2nx3 h GLU 252 CO 0.04 0.96 -0.38 0.82 -1.00 0.00 0.00 179.01 179.45 2nx3 h ILE 253 N 0.99 1.31 -0.73 3.13 2.04 -0.98 -2.97 117.51 120.30 2nx3 h ILE 253 Ca 0.20 -1.58 -0.01 0.00 1.00 0.00 0.00 64.86 64.46 2nx3 h ILE 253 Cb 0.42 1.76 -0.03 0.00 -0.74 0.00 0.00 36.82 38.23 2nx3 h ILE 253 CO 0.01 0.50 0.41 -0.09 0.00 0.00 0.00 178.15 178.97 2nx3 h ARG 254 N 0.38 1.01 -0.62 2.37 2.43 -0.50 0.38 114.38 119.83 2nx3 h ARG 254 Ca 0.02 -0.11 0.13 0.00 -0.81 0.00 0.00 59.98 59.20 2nx3 h ARG 254 Cb 0.97 -0.20 -0.10 0.00 -0.42 0.00 0.00 29.97 30.22 2nx3 h ARG 254 CO 0.09 0.75 0.03 1.49 -1.51 0.00 0.00 179.97 180.81 2nx3 h GLU 255 N 1.01 0.14 0.17 0.20 4.57 -0.54 0.29 114.58 120.42 2nx3 h GLU 255 Ca 0.26 -0.01 -0.33 0.00 -1.18 0.00 0.00 59.36 58.10 2nx3 h GLU 255 Cb 0.03 -0.03 0.01 0.00 -0.16 0.00 0.00 28.75 28.59 2nx3 h GLU 255 CO -0.04 0.09 -1.63 -0.24 -1.18 0.00 0.00 179.01 176.01 2nx3 h VAL 256 N 0.14 1.07 0.00 0.32 3.04 -1.34 -3.37 116.25 116.12 2nx3 h VAL 256 Ca 0.33 -2.65 -0.03 0.00 -1.01 0.00 0.00 66.70 63.34 2nx3 h VAL 256 Cb 0.53 2.81 -0.00 0.00 -2.01 0.00 0.00 31.29 32.61 2nx3 h VAL 256 CO -0.51 0.84 -0.15 0.00 -1.01 0.00 0.00 177.57 176.74 2nx3 h ALA 257 N 0.27 0.96 0.00 3.17 0.00 -0.72 -3.31 119.26 119.62 2nx3 h ALA 257 Ca -0.29 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 2nx3 h ALA 257 Cb 2.08 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.85 2nx3 h ALA 257 CO 0.19 0.18 -0.02 0.66 0.00 0.00 0.00 179.25 180.26 2nx3 h SER 258 N 0.00 0.00 0.24 0.00 4.64 -1.10 -1.34 113.55 115.99 2nx3 h SER 258 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2nx3 h SER 258 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 2nx3 h SER 258 CO 0.02 0.02 0.00 2.29 -0.87 0.00 0.00 176.83 178.29 2nx3 n LYS 259 N -4.18 0.39 0.00 4.77 2.85 -1.25 -2.57 118.16 118.16 2nx3 n LYS 259 Ca -0.03 0.07 0.03 0.00 -1.05 0.00 0.00 58.31 57.34 2nx3 n LYS 259 Cb 0.11 -1.50 -0.01 0.00 -0.65 0.00 0.00 35.03 32.97 2nx3 n LYS 259 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2nx3 n TYR 260 N -1.19 0.00 -1.69 5.58 4.01 -0.51 -5.01 117.16 118.35 2nx3 n TYR 260 Ca 0.11 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.41 2nx3 n TYR 260 Cb 0.12 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.12 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 -0.61 2.50 -2.30 -0.72 4.01 -1.06 -4.93 117.16 114.05 2nx3 n TYR 261 Ca 0.02 0.13 -0.36 0.00 -0.16 0.00 0.00 57.90 57.54 2nx3 n TYR 261 Cb 0.13 -2.62 -0.01 0.00 -0.31 0.00 0.00 39.34 36.54 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 1.30 3.56 -0.27 -0.72 8.01 -1.26 -4.99 118.70 124.33 2nx3 s GLU 262 Ca 0.78 1.63 -0.23 0.00 0.01 0.00 0.00 54.97 57.17 2nx3 s GLU 262 Cb -0.59 -2.16 -0.01 0.00 -4.31 0.00 0.00 34.13 27.06 2nx3 s GLU 262 CO 0.36 -0.69 0.74 0.99 0.01 0.00 0.00 175.26 176.68 2nx3 s THR 263 N -1.72 4.88 -2.50 3.63 2.01 -1.26 -5.16 115.64 115.51 2nx3 s THR 263 Ca 0.69 1.28 0.28 0.00 0.31 0.00 0.00 61.69 64.25 2nx3 s THR 263 Cb -0.24 -4.06 0.55 0.00 0.01 0.00 0.00 72.50 68.76 2nx3 s THR 263 CO 0.28 -0.10 1.75 2.30 -0.69 0.00 0.00 174.62 178.16