#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 2.77 -0.12 5.64 5.36 -1.24 -4.64 117.98 125.76 2nx3 s PHE 4 Ca 0.00 1.11 -0.13 0.00 -0.96 0.00 0.00 56.93 56.95 2nx3 s PHE 4 Cb 0.00 -3.94 -0.05 0.00 -0.34 0.00 0.00 43.02 38.69 2nx3 s PHE 4 CO 0.00 -2.87 0.29 -1.17 -1.46 0.00 0.00 175.22 170.02 2nx3 s LEU 5 N -1.42 4.31 -0.24 6.12 2.96 -0.99 -0.48 118.68 128.94 2nx3 s LEU 5 Ca 0.55 0.60 0.00 0.00 -0.22 0.00 0.00 54.13 55.06 2nx3 s LEU 5 Cb -0.45 -2.37 0.07 0.00 0.50 0.00 0.00 46.19 43.93 2nx3 s LEU 5 CO 0.55 0.19 -0.02 -0.69 -1.32 0.00 0.00 176.35 175.06 2nx3 s VAL 6 N -0.07 1.38 -0.26 1.68 1.01 -0.12 -1.30 120.40 122.71 2nx3 s VAL 6 Ca 0.18 -1.20 -0.12 0.00 0.00 0.00 0.00 61.98 60.84 2nx3 s VAL 6 Cb -0.14 -1.73 -0.05 0.00 0.00 0.00 0.00 36.38 34.47 2nx3 s VAL 6 CO 0.06 -0.19 0.24 -0.63 0.00 0.00 0.00 175.10 174.57 2nx3 s ILE 7 N 1.45 5.29 0.12 2.22 1.01 -0.15 -1.52 121.20 129.61 2nx3 s ILE 7 Ca -0.03 0.30 -0.13 0.00 0.00 0.00 0.00 60.65 60.79 2nx3 s ILE 7 Cb -0.18 -3.57 0.02 0.00 0.01 0.00 0.00 42.46 38.73 2nx3 s ILE 7 CO -0.08 0.26 0.31 0.00 0.00 0.00 0.00 174.94 175.43 2nx3 s ALA 8 N 1.58 -0.58 0.00 9.38 0.00 -0.41 -0.72 121.76 131.00 2nx3 s ALA 8 Ca 0.10 -0.35 0.00 0.00 0.00 0.00 0.00 51.96 51.71 2nx3 s ALA 8 Cb -0.15 0.63 0.00 0.00 0.00 0.00 0.00 23.12 23.60 2nx3 s ALA 8 CO 0.09 -0.60 0.00 0.41 0.00 0.00 0.00 175.76 175.66 2nx3 n GLY 9 N -0.16 -0.53 3.81 0.00 0.00 -1.24 -0.66 105.19 106.42 2nx3 n GLY 9 Ca -0.15 -1.37 -0.33 0.00 0.00 0.00 0.00 46.02 44.17 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 -1.91 4.15 0.11 1.61 0.04 -1.18 -1.22 135.00 136.60 2nx3 s PRO 10 Ca 0.00 1.19 -0.21 0.00 0.04 0.00 0.00 61.00 62.02 2nx3 s PRO 10 Cb 0.00 -2.19 -0.09 0.00 0.04 0.00 0.00 34.50 32.26 2nx3 s PRO 10 CO 0.00 -0.11 1.75 -0.97 0.04 0.00 0.00 177.00 177.71 2nx3 h ASN 11 N 1.89 0.08 -2.84 6.66 -1.24 -1.84 -3.35 115.58 114.94 2nx3 h ASN 11 Ca -0.49 0.01 -0.63 0.00 0.71 0.00 0.00 56.30 55.89 2nx3 h ASN 11 Cb 1.19 -0.01 -0.16 0.00 0.73 0.00 0.00 38.32 40.07 2nx3 h ASN 11 CO 0.61 0.07 -0.78 0.00 -1.29 0.00 0.00 177.43 176.04 2nx3 s ALA 12 N -6.18 2.70 -1.25 1.57 0.00 -1.26 -1.65 121.76 115.69 2nx3 s ALA 12 Ca -0.13 -1.68 -0.13 0.00 0.00 0.00 0.00 51.96 50.02 2nx3 s ALA 12 Cb 0.08 -0.40 0.16 0.00 0.00 0.00 0.00 23.12 22.96 2nx3 s ALA 12 CO 0.68 0.39 1.62 -0.89 0.00 0.00 0.00 175.76 177.55 2nx3 n ILE 13 N -0.08 4.25 -0.29 0.00 5.41 -0.76 -4.76 119.36 123.14 2nx3 n ILE 13 Ca -0.10 -4.55 -0.06 0.00 1.00 0.00 0.00 62.75 59.04 2nx3 n ILE 13 Cb 0.57 -2.43 0.06 0.00 -0.71 0.00 0.00 39.64 37.14 2nx3 n ILE 13 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2nx3 h GLU 14 N 6.67 1.19 -2.35 0.38 5.08 -1.96 -3.41 114.58 120.18 2nx3 h GLU 14 Ca 0.36 -0.23 0.14 0.00 -1.00 0.00 0.00 59.36 58.63 2nx3 h GLU 14 Cb 0.79 -0.19 -0.12 0.00 0.50 0.00 0.00 28.75 29.73 2nx3 h GLU 14 CO 1.40 0.97 0.47 -1.54 -1.00 0.00 0.00 179.01 179.32 2nx3 s SER 15 N -6.37 -0.29 0.15 1.42 1.04 -1.26 -4.97 113.70 103.43 2nx3 s SER 15 Ca -0.12 -0.19 -0.13 0.00 0.48 0.00 0.00 55.95 55.99 2nx3 s SER 15 Cb 0.16 0.44 0.03 0.00 0.10 0.00 0.00 66.02 66.75 2nx3 s SER 15 CO 0.84 -0.77 1.65 1.05 0.98 0.00 0.00 173.24 176.99 2nx3 h GLU 16 N 2.00 0.83 -0.08 4.02 4.11 -1.97 -2.66 114.58 120.83 2nx3 h GLU 16 Ca -0.24 -0.21 0.00 0.00 0.07 0.00 0.00 59.36 58.99 2nx3 h GLU 16 Cb 1.24 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.38 2nx3 h GLU 16 CO 0.29 0.81 0.05 0.93 0.07 0.00 0.00 179.01 181.16 2nx3 h GLU 17 N 0.71 0.09 0.05 1.06 5.08 -1.99 -0.67 114.58 118.92 2nx3 h GLU 17 Ca 0.16 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2nx3 h GLU 17 Cb 0.37 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2nx3 h GLU 17 CO 0.01 0.06 -0.02 1.25 -1.00 0.00 0.00 179.01 179.30 2nx3 h LEU 18 N 0.09 -0.06 -0.53 1.33 5.85 -1.88 -2.09 115.31 118.03 2nx3 h LEU 18 Ca 0.03 -0.46 0.08 0.00 0.84 0.00 0.00 57.88 58.38 2nx3 h LEU 18 Cb 0.01 0.01 -0.06 0.00 0.37 0.00 0.00 40.66 40.99 2nx3 h LEU 18 CO -0.01 0.44 0.17 -0.07 -0.34 0.00 0.00 178.44 178.64 2nx3 h LEU 19 N -0.57 0.14 -0.85 2.25 4.07 -1.06 -1.36 115.31 117.93 2nx3 h LEU 19 Ca -0.01 0.07 -0.09 0.00 0.08 0.00 0.00 57.88 57.94 2nx3 h LEU 19 Cb 0.51 0.07 -0.02 0.00 1.08 0.00 0.00 40.66 42.30 2nx3 h LEU 19 CO 0.01 0.10 -0.13 -0.07 -1.08 0.00 0.00 178.44 177.27 2nx3 h LEU 20 N 0.33 0.71 -0.68 1.67 3.38 -1.20 0.69 115.31 120.21 2nx3 h LEU 20 Ca 0.26 -0.21 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 2nx3 h LEU 20 Cb 0.31 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 2nx3 h LEU 20 CO -0.29 0.86 0.14 0.50 0.09 0.00 0.00 178.44 179.74 2nx3 h LYS 21 N 0.65 1.10 0.04 1.13 3.11 -0.68 0.12 116.57 122.05 2nx3 h LYS 21 Ca 0.11 -0.28 -0.24 0.00 -2.81 0.00 0.00 60.65 57.43 2nx3 h LYS 21 Cb 0.59 -0.14 -0.02 0.00 -1.00 0.00 0.00 32.23 31.67 2nx3 h LYS 21 CO 0.04 0.99 -1.15 0.28 -2.81 0.00 0.00 179.45 176.79 2nx3 h VAL 22 N 1.02 1.56 -0.10 2.00 2.07 -1.06 -3.21 116.25 118.53 2nx3 h VAL 22 Ca 0.21 -3.24 -0.04 0.00 0.82 0.00 0.00 66.70 64.46 2nx3 h VAL 22 Cb 0.40 2.84 -0.01 0.00 -1.52 0.00 0.00 31.29 33.00 2nx3 h VAL 22 CO 0.01 0.91 -0.10 1.23 0.02 0.00 0.00 177.57 179.63 2nx3 h GLY 23 N 2.54 0.17 0.79 2.17 0.00 0.73 -1.15 103.07 108.31 2nx3 h GLY 23 Ca -0.08 -0.09 -0.03 0.00 0.00 0.00 0.00 47.33 47.13 2nx3 h GLY 23 CO 0.15 0.09 -0.00 -2.09 0.00 0.00 0.00 176.54 174.68 2nx3 h GLU 24 N 0.15 0.28 -0.36 4.80 4.81 -0.98 -0.17 114.58 123.11 2nx3 h GLU 24 Ca 0.03 -0.09 -0.09 0.00 -0.13 0.00 0.00 59.36 59.08 2nx3 h GLU 24 Cb 0.28 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 2nx3 h GLU 24 CO 0.02 0.51 -0.17 1.49 -0.73 0.00 0.00 179.01 180.13 2nx3 h GLU 25 N 0.02 0.66 -0.32 1.92 4.57 -1.55 -0.83 114.58 119.04 2nx3 h GLU 25 Ca 0.04 -0.23 -0.02 0.00 -1.18 0.00 0.00 59.36 57.97 2nx3 h GLU 25 Cb 0.39 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.92 2nx3 h GLU 25 CO 0.01 0.80 0.12 0.82 -1.18 0.00 0.00 179.01 179.57 2nx3 h ILE 26 N 0.59 1.19 0.14 2.32 1.08 -1.07 -0.79 117.51 120.97 2nx3 h ILE 26 Ca 0.09 -0.60 0.01 0.00 -0.39 0.00 0.00 64.86 63.97 2nx3 h ILE 26 Cb 0.62 0.99 -0.02 0.00 -3.07 0.00 0.00 36.82 35.34 2nx3 h ILE 26 CO 0.04 0.21 -0.17 0.50 -0.69 0.00 0.00 178.15 178.04 2nx3 h LYS 27 N 0.37 -0.34 -0.83 2.37 1.63 -0.74 -0.77 116.57 118.25 2nx3 h LYS 27 Ca 0.11 0.02 0.15 0.00 -0.85 0.00 0.00 60.65 60.08 2nx3 h LYS 27 Cb 0.21 0.08 -0.10 0.00 -0.60 0.00 0.00 32.23 31.82 2nx3 h LYS 27 CO -0.01 -0.23 0.40 -0.09 -3.45 0.00 0.00 179.45 176.07 2nx3 h ARG 28 N -0.36 0.54 -0.06 1.90 2.43 -0.98 -0.13 114.38 117.73 2nx3 h ARG 28 Ca 0.01 -0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.05 2nx3 h ARG 28 Cb 0.35 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 2nx3 h ARG 28 CO -0.06 0.36 -0.43 -0.07 -1.51 0.00 0.00 179.97 178.25 2nx3 h LEU 29 N 0.56 0.15 -0.90 3.80 3.38 -0.56 -2.35 115.31 119.38 2nx3 h LEU 29 Ca 0.46 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 58.29 2nx3 h LEU 29 Cb 0.68 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 2nx3 h LEU 29 CO -0.39 0.57 -0.35 0.77 0.09 0.00 0.00 178.44 179.13 2nx3 h SER 30 N 0.12 0.00 0.55 -0.43 4.64 0.41 0.33 113.55 119.17 2nx3 h SER 30 Ca 0.01 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.14 2nx3 h SER 30 Cb 0.82 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.90 2nx3 h SER 30 CO 0.06 0.35 -0.85 -0.33 -0.87 0.00 0.00 176.83 175.19 2nx3 h GLU 31 N 0.00 0.21 0.14 4.77 4.39 -0.88 -3.30 114.58 119.90 2nx3 h GLU 31 Ca -0.00 -0.22 -0.31 0.00 0.34 0.00 0.00 59.36 59.17 2nx3 h GLU 31 Cb 0.90 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.61 2nx3 h GLU 31 CO 0.05 0.94 -1.49 -0.22 -1.16 0.00 0.00 179.01 177.12 2nx3 h LYS 32 N 0.12 0.29 -2.71 2.33 3.64 -1.16 -3.39 116.57 115.68 2nx3 h LYS 32 Ca -0.04 -0.49 -0.72 0.00 -1.27 0.00 0.00 60.65 58.13 2nx3 h LYS 32 Cb 1.47 0.18 -0.34 0.00 -0.41 0.00 0.00 32.23 33.13 2nx3 h LYS 32 CO 0.13 1.17 0.13 1.19 -2.27 0.00 0.00 179.45 179.81 2nx3 n PHE 33 N -3.50 3.13 0.31 1.91 3.72 0.08 -4.88 117.46 118.24 2nx3 n PHE 33 Ca -0.16 -3.43 0.19 0.00 -0.05 0.00 0.00 57.45 54.01 2nx3 n PHE 33 Cb 1.05 -0.99 1.02 0.00 -0.94 0.00 0.00 39.48 39.62 2nx3 n PHE 33 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2nx3 h LYS 34 N 5.06 0.00 -0.10 -1.08 6.56 -1.77 -1.15 116.57 124.08 2nx3 h LYS 34 Ca 0.19 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.78 2nx3 h LYS 34 Cb 0.66 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.32 2nx3 h LYS 34 CO 1.07 0.00 0.00 -0.85 -2.06 0.00 0.00 179.45 177.61 2nx3 n GLU 35 N -2.89 1.51 -4.49 3.15 0.00 -1.26 -4.85 120.64 111.81 2nx3 n GLU 35 Ca -0.02 -0.77 -0.32 0.00 0.00 0.00 0.00 57.16 56.05 2nx3 n GLU 35 Cb 0.15 -1.38 -0.11 0.00 0.00 0.00 0.00 31.44 30.10 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 -1.87 3.45 -0.38 3.84 1.01 -0.44 -3.60 120.40 122.40 2nx3 s VAL 36 Ca 0.32 -0.89 -0.12 0.00 0.00 0.00 0.00 61.98 61.30 2nx3 s VAL 36 Cb 0.17 -2.50 0.03 0.00 0.00 0.00 0.00 36.38 34.08 2nx3 s VAL 36 CO 0.26 0.37 0.23 -0.70 0.00 0.00 0.00 175.10 175.25 2nx3 s GLU 37 N -1.46 2.83 -0.12 2.72 2.56 0.37 -4.98 118.70 120.62 2nx3 s GLU 37 Ca 0.17 -1.09 -0.17 0.00 0.00 0.00 0.00 54.97 53.88 2nx3 s GLU 37 Cb -0.11 -3.78 -0.04 0.00 2.00 0.00 0.00 34.13 32.19 2nx3 s GLU 37 CO 0.07 -0.73 0.42 -0.06 -0.56 0.00 0.00 175.26 174.41 2nx3 s PHE 38 N 1.57 3.51 -0.13 5.30 0.08 -1.26 -0.95 117.98 126.10 2nx3 s PHE 38 Ca 0.02 0.81 0.02 0.00 0.12 0.00 0.00 56.93 57.90 2nx3 s PHE 38 Cb -0.19 -2.47 0.02 0.00 -0.57 0.00 0.00 43.02 39.80 2nx3 s PHE 38 CO 0.07 0.22 -0.17 0.08 -0.10 0.00 0.00 175.22 175.32 2nx3 s VAL 39 N 0.46 1.73 -0.09 -0.44 1.01 -0.58 -4.04 120.40 118.46 2nx3 s VAL 39 Ca 0.23 -0.77 -0.29 0.00 0.00 0.00 0.00 61.98 61.16 2nx3 s VAL 39 Cb -0.15 -1.57 -0.02 0.00 0.00 0.00 0.00 36.38 34.65 2nx3 s VAL 39 CO 0.09 0.49 0.96 0.12 0.00 0.00 0.00 175.10 176.75 2nx3 s PHE 40 N 1.07 3.53 0.03 5.22 5.36 0.72 -1.29 117.98 132.62 2nx3 s PHE 40 Ca -0.03 1.55 0.09 0.00 -0.96 0.00 0.00 56.93 57.57 2nx3 s PHE 40 Cb -0.14 -3.13 -0.03 0.00 -0.34 0.00 0.00 43.02 39.38 2nx3 s PHE 40 CO -0.05 -0.17 -0.25 0.21 -1.46 0.00 0.00 175.22 173.50 2nx3 s LYS 41 N 1.78 1.80 -0.29 10.12 2.36 0.17 -1.13 119.74 134.54 2nx3 s LYS 41 Ca 0.47 -1.05 -0.22 0.00 -2.55 0.00 0.00 55.97 52.62 2nx3 s LYS 41 Cb -0.18 -1.92 0.16 0.00 -1.05 0.00 0.00 37.83 34.84 2nx3 s LYS 41 CO 0.19 0.50 1.18 0.45 1.55 0.00 0.00 175.35 179.22 2nx3 s SER 42 N -1.09 -0.29 0.03 1.43 0.15 -1.16 -3.09 113.70 109.68 2nx3 s SER 42 Ca 0.11 0.52 -0.20 0.00 0.70 0.00 0.00 55.95 57.07 2nx3 s SER 42 Cb -0.10 0.72 -0.06 0.00 -1.71 0.00 0.00 66.02 64.88 2nx3 s SER 42 CO 0.01 -0.09 0.60 -0.44 1.20 0.00 0.00 173.24 174.52 2nx3 s SER 43 N 0.50 7.03 0.12 5.45 0.01 -0.66 -4.54 113.70 121.61 2nx3 s SER 43 Ca 0.01 1.23 0.26 0.00 1.31 0.00 0.00 55.95 58.75 2nx3 s SER 43 Cb -0.04 -2.37 0.68 0.00 0.21 0.00 0.00 66.02 64.50 2nx3 s SER 43 CO -0.11 0.17 1.60 2.22 0.41 0.00 0.00 173.24 177.53 2nx3 n PHE 44 N 2.28 0.55 -3.67 2.43 1.16 -1.26 -1.82 117.46 117.13 2nx3 n PHE 44 Ca -0.08 0.16 -0.10 0.00 -1.87 0.00 0.00 57.45 55.57 2nx3 n PHE 44 Cb 0.51 -0.70 -0.09 0.00 -1.61 0.00 0.00 39.48 37.59 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 -4.01 -0.72 -0.87 5.98 2.15 -1.25 -3.84 116.67 114.10 2nx3 s ASP 45 Ca 0.10 1.21 -0.15 0.00 0.43 0.00 0.00 52.55 54.14 2nx3 s ASP 45 Cb 0.14 1.11 0.20 0.00 -0.30 0.00 0.00 42.92 44.07 2nx3 s ASP 45 CO 0.64 -0.21 0.87 -0.54 -0.17 0.00 0.00 175.17 175.75 2nx3 s LYS 46 N 1.31 3.64 0.00 4.34 -0.14 0.25 -4.88 119.74 124.26 2nx3 s LYS 46 Ca -0.08 -2.36 0.30 0.00 -1.36 0.00 0.00 55.97 52.47 2nx3 s LYS 46 Cb -0.06 -4.54 1.47 0.00 -1.68 0.00 0.00 37.83 33.02 2nx3 s LYS 46 CO -0.13 -1.39 1.99 0.00 -0.76 0.00 0.00 175.35 175.06 2nx3 n ALA 47 N 4.45 2.67 -1.89 5.17 0.00 -1.26 -3.96 120.51 125.69 2nx3 n ALA 47 Ca 0.17 -0.27 0.05 0.00 0.00 0.00 0.00 53.44 53.39 2nx3 n ALA 47 Cb 0.47 -1.38 0.11 0.00 0.00 0.00 0.00 19.45 18.64 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 -0.78 1.34 -4.68 0.00 6.94 -1.26 -5.08 115.26 111.74 2nx3 n ASN 48 Ca 0.19 -2.90 -0.36 0.00 -0.02 0.00 0.00 54.58 51.49 2nx3 n ASN 48 Cb 0.23 -0.40 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 -0.46 0.76 -0.18 -3.83 5.12 -1.25 -4.90 116.66 111.92 2nx3 n ARG 49 Ca 0.12 0.32 -0.07 0.00 -1.93 0.00 0.00 57.85 56.29 2nx3 n ARG 49 Cb 0.85 -2.41 0.09 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 0.05 0.94 -3.74 0.55 0.02 -1.98 -3.44 113.55 105.95 2nx3 h SER 50 Ca -0.49 -0.23 -0.68 0.00 -0.84 0.00 0.00 61.79 59.55 2nx3 h SER 50 Cb 1.33 -0.25 -0.19 0.00 0.14 0.00 0.00 62.40 63.44 2nx3 h SER 50 CO 0.50 0.97 -0.77 -0.55 -1.14 0.00 0.00 176.83 175.84 2nx3 s SER 51 N -6.58 4.09 0.47 3.07 0.15 -1.25 -5.00 113.70 108.65 2nx3 s SER 51 Ca -0.11 -0.42 0.32 0.00 0.70 0.00 0.00 55.95 56.44 2nx3 s SER 51 Cb 0.14 -0.71 1.45 0.00 -1.71 0.00 0.00 66.02 65.20 2nx3 s SER 51 CO 0.84 0.21 1.96 -0.29 1.20 0.00 0.00 173.24 177.16 2nx3 h ILE 52 N 3.61 0.00 0.00 6.45 6.09 -1.94 -2.85 117.51 128.87 2nx3 h ILE 52 Ca -0.49 -0.29 -0.19 0.00 -1.37 0.00 0.00 64.86 62.52 2nx3 h ILE 52 Cb 1.16 1.17 -0.03 0.00 0.47 0.00 0.00 36.82 39.60 2nx3 h ILE 52 CO 0.49 0.00 -0.93 0.45 -3.07 0.00 0.00 178.15 175.09 2nx3 h HIS 53 N 0.00 0.00 -4.24 2.19 3.86 -1.96 -3.48 115.15 111.53 2nx3 h HIS 53 Ca 0.00 0.00 -0.52 0.00 -1.16 0.00 0.00 60.37 58.69 2nx3 h HIS 53 Cb 0.33 0.00 0.16 0.00 1.06 0.00 0.00 27.41 28.95 2nx3 h HIS 53 CO 0.00 0.89 0.32 -1.12 0.86 0.00 0.00 177.93 178.89 2nx3 s SER 54 N -6.63 3.98 0.39 2.45 0.01 -1.08 -4.98 113.70 107.85 2nx3 s SER 54 Ca 0.01 2.16 -0.27 0.00 1.31 0.00 0.00 55.95 59.16 2nx3 s SER 54 Cb 0.09 -2.56 -0.09 0.00 0.21 0.00 0.00 66.02 63.67 2nx3 s SER 54 CO 0.80 -2.40 1.35 0.12 0.41 0.00 0.00 173.24 173.52 2nx3 s PHE 55 N -2.41 2.78 0.00 2.43 5.36 -1.26 -4.96 117.98 119.92 2nx3 s PHE 55 Ca 0.69 1.36 0.00 0.00 -0.96 0.00 0.00 56.93 58.01 2nx3 s PHE 55 Cb -0.24 -3.76 0.00 0.00 -0.34 0.00 0.00 43.02 38.68 2nx3 s PHE 55 CO 0.51 -2.29 0.00 0.54 -1.46 0.00 0.00 175.22 172.52 2nx3 n ARG 56 N 0.27 0.00 -0.05 10.12 1.74 -1.26 -4.72 116.66 122.76 2nx3 n ARG 56 Ca 0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 2nx3 n ARG 56 Cb 0.42 -0.96 0.00 0.00 -1.02 0.00 0.00 32.46 30.91 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 3.37 0.97 1.21 -0.13 0.00 -1.26 -0.58 105.19 108.77 2nx3 n GLY 57 Ca 0.00 -1.92 0.08 0.00 0.00 0.00 0.00 46.02 44.18 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 4.08 1.20 0.00 1.61 8.25 -1.26 -5.04 115.22 124.07 2nx3 n HIS 58 Ca 0.00 -0.71 0.00 0.00 -0.26 0.00 0.00 57.72 56.75 2nx3 n HIS 58 Cb 0.00 -0.28 0.00 0.00 1.12 0.00 0.00 29.99 30.83 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 0.31 1.48 0.27 -1.41 0.00 -1.25 -4.41 105.19 100.19 2nx3 n GLY 59 Ca 0.22 -1.80 -0.15 0.00 0.00 0.00 0.00 46.02 44.29 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 -0.59 -0.56 0.99 6.46 -1.98 -2.03 115.31 117.60 2nx3 h LEU 60 Ca 0.00 0.04 0.11 0.00 -0.12 0.00 0.00 57.88 57.91 2nx3 h LEU 60 Cb 0.00 0.18 -0.11 0.00 -0.73 0.00 0.00 40.66 40.00 2nx3 h LEU 60 CO 0.00 -0.37 -0.26 -0.33 -0.62 0.00 0.00 178.44 176.86 2nx3 h GLU 61 N -0.57 -0.12 -0.45 1.25 5.08 -1.97 0.63 114.58 118.43 2nx3 h GLU 61 Ca -0.03 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2nx3 h GLU 61 Cb 0.48 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 2nx3 h GLU 61 CO 0.02 -0.08 0.27 -0.92 -1.00 0.00 0.00 179.01 177.31 2nx3 h TYR 62 N -0.12 0.59 0.14 4.33 3.20 -1.75 -2.58 116.97 120.78 2nx3 h TYR 62 Ca 0.25 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.11 2nx3 h TYR 62 Cb 0.51 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.59 2nx3 h TYR 62 CO -0.56 0.42 -0.07 0.78 -1.64 0.00 0.00 178.16 177.09 2nx3 h GLY 63 N 0.60 -0.20 0.32 1.82 0.00 -0.45 -0.00 103.07 105.15 2nx3 h GLY 63 Ca 0.16 0.08 0.07 0.00 0.00 0.00 0.00 47.33 47.64 2nx3 h GLY 63 CO -0.03 -0.08 -0.10 -2.08 0.00 0.00 0.00 176.54 174.26 2nx3 h VAL 64 N -0.20 0.64 -0.71 4.60 2.07 -0.89 0.19 116.25 121.95 2nx3 h VAL 64 Ca -0.02 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.53 2nx3 h VAL 64 Cb 0.15 0.64 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 2nx3 h VAL 64 CO 0.03 0.00 0.44 0.50 0.02 0.00 0.00 177.57 178.56 2nx3 h LYS 65 N -0.03 0.84 -0.30 1.57 3.64 -1.26 0.23 116.57 121.26 2nx3 h LYS 65 Ca 0.16 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 2nx3 h LYS 65 Cb 0.26 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 2nx3 h LYS 65 CO -0.34 0.55 0.11 0.00 -2.27 0.00 0.00 179.45 177.50 2nx3 h ALA 66 N 1.31 0.39 -0.48 5.00 0.00 0.11 -1.84 119.26 123.75 2nx3 h ALA 66 Ca 0.29 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 2nx3 h ALA 66 Cb 0.03 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2nx3 h ALA 66 CO -0.11 -0.01 0.09 -0.07 0.00 0.00 0.00 179.25 179.15 2nx3 h LEU 67 N 0.33 0.69 -1.46 0.00 3.38 -0.22 -1.98 115.31 116.05 2nx3 h LEU 67 Ca 0.10 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2nx3 h LEU 67 Cb 0.19 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2nx3 h LEU 67 CO -0.01 0.70 0.04 -0.09 0.09 0.00 0.00 178.44 179.17 2nx3 h ARG 68 N 0.71 0.39 -0.32 1.13 2.43 -0.15 -0.74 114.38 117.83 2nx3 h ARG 68 Ca 0.16 -0.06 -0.11 0.00 -0.81 0.00 0.00 59.98 59.15 2nx3 h ARG 68 Cb 0.31 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 2nx3 h ARG 68 CO 0.00 0.39 -0.24 -0.22 -1.51 0.00 0.00 179.97 178.39 2nx3 h LYS 69 N 0.38 0.73 -0.85 0.20 1.63 -0.60 -1.62 116.57 116.44 2nx3 h LYS 69 Ca 0.09 -0.36 -0.00 0.00 -0.85 0.00 0.00 60.65 59.53 2nx3 h LYS 69 Cb 0.20 -0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 31.79 2nx3 h LYS 69 CO 0.00 0.97 0.51 0.28 -3.45 0.00 0.00 179.45 177.76 2nx3 h VAL 70 N 0.50 1.24 -0.12 2.00 2.07 -0.96 0.42 116.25 121.40 2nx3 h VAL 70 Ca 0.06 -0.52 -0.00 0.00 0.82 0.00 0.00 66.70 67.06 2nx3 h VAL 70 Cb 0.80 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 2nx3 h VAL 70 CO 0.06 0.25 0.05 0.50 0.02 0.00 0.00 177.57 178.46 2nx3 h LYS 71 N 1.17 0.17 -0.08 1.57 3.64 -0.98 -0.62 116.57 121.45 2nx3 h LYS 71 Ca 0.30 -0.03 -0.21 0.00 -1.27 0.00 0.00 60.65 59.45 2nx3 h LYS 71 Cb -0.05 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 2nx3 h LYS 71 CO -0.06 0.24 -0.82 0.93 -2.27 0.00 0.00 179.45 177.47 2nx3 h GLU 72 N 0.06 0.55 -0.11 1.90 5.08 -1.10 0.25 114.58 121.21 2nx3 h GLU 72 Ca 0.04 -0.49 -0.16 0.00 -1.00 0.00 0.00 59.36 57.75 2nx3 h GLU 72 Cb 0.13 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 2nx3 h GLU 72 CO -0.00 1.12 -0.61 1.49 -1.00 0.00 0.00 179.01 180.00 2nx3 h GLU 73 N 0.36 0.37 0.00 2.33 4.57 -0.13 -3.36 114.58 118.72 2nx3 h GLU 73 Ca -0.06 -0.26 0.00 0.00 -1.18 0.00 0.00 59.36 57.86 2nx3 h GLU 73 Cb 1.43 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 30.06 2nx3 h GLU 73 CO 0.15 0.87 0.00 1.19 -1.18 0.00 0.00 179.01 180.04 2nx3 n PHE 74 N -3.90 0.00 -2.56 0.92 3.72 -0.24 -5.01 117.46 110.39 2nx3 n PHE 74 Ca -0.03 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.20 2nx3 n PHE 74 Cb 0.63 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.18 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 0.25 -0.30 3.89 1.37 0.00 0.86 -4.96 105.19 106.30 2nx3 n GLY 75 Ca 0.00 -0.13 -0.34 0.00 0.00 0.00 0.00 46.02 45.55 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 -5.06 4.37 0.56 0.99 1.43 -1.21 -5.05 118.68 114.70 2nx3 s LEU 76 Ca 0.11 0.52 -0.17 0.00 -1.03 0.00 0.00 54.13 53.56 2nx3 s LEU 76 Cb -0.05 -2.69 -0.05 0.00 0.03 0.00 0.00 46.19 43.43 2nx3 s LEU 76 CO 0.13 0.25 1.05 -0.54 0.23 0.00 0.00 176.35 177.47 2nx3 s LYS 77 N -1.83 3.46 0.11 1.70 1.02 -1.26 -4.43 119.74 118.51 2nx3 s LYS 77 Ca 0.28 1.25 0.11 0.00 0.02 0.00 0.00 55.97 57.63 2nx3 s LYS 77 Cb -0.13 -2.05 -0.04 0.00 -0.52 0.00 0.00 37.83 35.09 2nx3 s LYS 77 CO 0.17 -0.70 -0.27 0.42 -0.92 0.00 0.00 175.35 174.05 2nx3 s ILE 78 N -2.31 2.23 -0.11 2.17 -1.09 -1.26 -0.20 121.20 120.63 2nx3 s ILE 78 Ca 0.65 -1.69 -0.10 0.00 -2.23 0.00 0.00 60.65 57.28 2nx3 s ILE 78 Cb -0.16 -1.96 0.03 0.00 -1.58 0.00 0.00 42.46 38.78 2nx3 s ILE 78 CO 0.32 0.14 0.29 0.28 -1.23 0.00 0.00 174.94 174.74 2nx3 s THR 79 N -1.01 -0.00 0.14 2.92 -1.32 -0.28 -0.13 115.64 115.95 2nx3 s THR 79 Ca 0.13 0.00 -0.15 0.00 -1.21 0.00 0.00 61.69 60.47 2nx3 s THR 79 Cb -0.10 -0.41 0.03 0.00 -1.51 0.00 0.00 72.50 70.51 2nx3 s THR 79 CO 0.05 0.00 0.40 0.28 -2.21 0.00 0.00 174.62 173.14 2nx3 s THR 80 N 0.17 0.07 0.21 5.08 -1.32 -1.20 -3.00 115.64 115.65 2nx3 s THR 80 Ca -0.00 -0.73 0.03 0.00 -1.21 0.00 0.00 61.69 59.78 2nx3 s THR 80 Cb -0.02 -1.32 -0.03 0.00 -1.51 0.00 0.00 72.50 69.61 2nx3 s THR 80 CO 0.00 -0.30 0.35 1.51 -2.21 0.00 0.00 174.62 173.98 2nx3 s ASP 81 N -2.84 6.34 0.26 8.08 -4.77 -1.26 -1.25 116.67 121.23 2nx3 s ASP 81 Ca 0.06 0.19 0.12 0.00 -3.30 0.00 0.00 52.55 49.62 2nx3 s ASP 81 Cb 0.02 -1.92 -0.05 0.00 -1.09 0.00 0.00 42.92 39.88 2nx3 s ASP 81 CO -0.09 -0.04 -0.21 0.27 0.70 0.00 0.00 175.17 175.80 2nx3 s ILE 82 N -1.90 2.44 0.00 2.11 -4.36 -0.87 -4.77 121.20 113.85 2nx3 s ILE 82 Ca 0.35 -2.33 0.00 0.00 -0.26 0.00 0.00 60.65 58.41 2nx3 s ILE 82 Cb -0.10 -2.26 0.00 0.00 1.25 0.00 0.00 42.46 41.35 2nx3 s ILE 82 CO 0.29 -0.35 0.00 1.41 0.24 0.00 0.00 174.94 176.54 2nx3 n HIS 83 N -0.44 0.00 -3.96 1.37 8.25 -1.26 -4.35 115.22 114.83 2nx3 n HIS 83 Ca -0.07 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.30 2nx3 n HIS 83 Cb 0.59 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.60 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 -1.32 0.40 0.25 -0.41 2.02 -1.26 -5.06 118.70 113.31 2nx3 s GLU 84 Ca 0.00 -0.64 -0.07 0.00 0.02 0.00 0.00 54.97 54.28 2nx3 s GLU 84 Cb 0.00 0.15 0.45 0.00 0.10 0.00 0.00 34.13 34.83 2nx3 s GLU 84 CO 0.00 -0.08 1.62 0.77 0.02 0.00 0.00 175.26 177.59 2nx3 h SER 85 N 4.35 -0.44 0.00 -0.19 0.02 -1.91 -1.56 113.55 113.82 2nx3 h SER 85 Ca -0.32 0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2nx3 h SER 85 Cb 1.20 0.39 0.00 0.00 0.14 0.00 0.00 62.40 64.13 2nx3 h SER 85 CO 0.44 -0.21 0.04 4.11 -1.14 0.00 0.00 176.83 180.07 2nx3 h TRP 86 N 0.07 0.00 0.00 3.45 5.08 -1.97 -2.49 115.95 120.09 2nx3 h TRP 86 Ca 0.43 0.00 -0.07 0.00 1.08 0.00 0.00 58.89 60.32 2nx3 h TRP 86 Cb 0.75 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.90 2nx3 h TRP 86 CO -0.47 0.00 -0.36 1.96 -1.28 0.00 0.00 178.44 178.29 2nx3 h GLN 87 N 0.00 0.00 -0.25 0.12 4.20 -1.71 -3.37 115.11 114.09 2nx3 h GLN 87 Ca 0.00 0.00 0.06 0.00 0.06 0.00 0.00 58.65 58.77 2nx3 h GLN 87 Cb 0.08 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 27.79 2nx3 h GLN 87 CO 0.00 0.34 -0.40 0.00 -0.67 0.00 0.00 178.83 178.10 2nx3 h ALA 88 N 1.66 -0.45 0.57 3.87 0.00 -1.59 -1.90 119.26 121.41 2nx3 h ALA 88 Ca -0.01 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2nx3 h ALA 88 Cb 1.27 0.78 -0.01 0.00 0.00 0.00 0.00 17.79 19.83 2nx3 h ALA 88 CO 0.04 -0.86 -0.37 1.49 0.00 0.00 0.00 179.25 179.55 2nx3 h GLU 89 N -0.39 -0.87 -0.88 0.00 4.81 -1.80 0.86 114.58 116.31 2nx3 h GLU 89 Ca 0.11 0.06 0.09 0.00 -0.13 0.00 0.00 59.36 59.49 2nx3 h GLU 89 Cb 0.59 0.20 -0.06 0.00 0.63 0.00 0.00 28.75 30.11 2nx3 h GLU 89 CO -0.47 -0.58 0.57 -1.00 -0.73 0.00 0.00 179.01 176.80 2nx3 h PRO 90 N -0.90 0.85 -0.25 0.92 0.13 -1.76 -2.37 132.00 128.62 2nx3 h PRO 90 Ca -0.07 -0.05 -0.17 0.00 -0.87 0.00 0.00 66.00 64.85 2nx3 h PRO 90 Cb 0.74 -0.19 0.00 0.00 0.13 0.00 0.00 31.00 31.68 2nx3 h PRO 90 CO 0.05 0.56 -0.49 0.28 -0.23 0.00 0.00 178.00 178.18 2nx3 h VAL 91 N 0.88 1.29 0.00 1.56 2.07 -1.15 -3.09 116.25 117.82 2nx3 h VAL 91 Ca 0.40 -1.69 0.00 0.00 0.82 0.00 0.00 66.70 66.23 2nx3 h VAL 91 Cb 0.38 1.73 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 2nx3 h VAL 91 CO -0.17 0.54 0.19 0.00 0.02 0.00 0.00 177.57 178.15 2nx3 h ALA 92 N 0.64 1.16 0.00 1.67 0.00 -0.28 -1.19 119.26 121.27 2nx3 h ALA 92 Ca 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2nx3 h ALA 92 Cb 1.10 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 2nx3 h ALA 92 CO 0.11 -0.16 -0.08 0.93 0.00 0.00 0.00 179.25 180.05 2nx3 h GLU 93 N 0.00 0.00 0.00 0.00 4.39 -1.48 -3.33 114.58 114.16 2nx3 h GLU 93 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2nx3 h GLU 93 Cb 0.37 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 2nx3 h GLU 93 CO 0.00 0.08 -0.70 0.28 -1.16 0.00 0.00 179.01 177.50 2nx3 n VAL 94 N -3.52 0.00 -2.61 3.13 0.31 -0.55 -5.04 118.33 110.05 2nx3 n VAL 94 Ca -0.02 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.89 2nx3 n VAL 94 Cb 0.20 -0.65 -0.03 0.00 -0.91 0.00 0.00 33.84 32.46 2nx3 n VAL 94 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2nx3 s ALA 95 N -1.70 3.37 0.12 3.52 0.00 -0.63 -4.54 121.76 121.89 2nx3 s ALA 95 Ca 0.00 0.51 0.02 0.00 0.00 0.00 0.00 51.96 52.50 2nx3 s ALA 95 Cb 0.00 -3.44 -0.19 0.00 0.00 0.00 0.00 23.12 19.49 2nx3 s ALA 95 CO 0.00 -0.55 1.26 -0.44 0.00 0.00 0.00 175.76 176.02 2nx3 h ASP 96 N 7.10 0.18 -3.29 0.00 3.32 -0.85 -3.44 116.42 119.45 2nx3 h ASP 96 Ca -0.35 -0.19 -0.54 0.00 0.02 0.00 0.00 57.03 55.98 2nx3 h ASP 96 Cb 1.17 -0.06 -0.35 0.00 0.22 0.00 0.00 39.33 40.31 2nx3 h ASP 96 CO 0.84 1.11 -0.81 -0.63 -1.72 0.00 0.00 179.24 178.03 2nx3 s ILE 97 N -2.79 1.18 -0.23 0.35 1.01 -0.92 -2.54 121.20 117.27 2nx3 s ILE 97 Ca -0.01 -0.44 -0.17 0.00 0.00 0.00 0.00 60.65 60.03 2nx3 s ILE 97 Cb 0.09 -1.12 -0.03 0.00 0.01 0.00 0.00 42.46 41.41 2nx3 s ILE 97 CO 0.84 0.38 0.45 -0.63 0.00 0.00 0.00 174.94 175.98 2nx3 s ILE 98 N 1.14 5.14 -0.08 2.92 -1.09 0.47 -3.26 121.20 126.44 2nx3 s ILE 98 Ca -0.05 0.78 -0.16 0.00 -2.23 0.00 0.00 60.65 58.99 2nx3 s ILE 98 Cb -0.14 -3.77 -0.05 0.00 -1.58 0.00 0.00 42.46 36.92 2nx3 s ILE 98 CO -0.02 0.18 0.42 -1.58 -1.23 0.00 0.00 174.94 172.70 2nx3 s GLN 99 N 1.76 4.18 -0.27 2.79 0.74 -0.38 -0.97 119.66 127.51 2nx3 s GLN 99 Ca 0.20 0.37 -0.08 0.00 0.05 0.00 0.00 55.36 55.90 2nx3 s GLN 99 Cb -0.15 -3.36 -0.02 0.00 1.10 0.00 0.00 33.01 30.58 2nx3 s GLN 99 CO 0.09 0.36 0.08 0.42 -0.55 0.00 0.00 175.29 175.69 2nx3 s ILE 100 N -0.01 4.27 0.51 -2.34 -1.09 0.39 -2.04 121.20 120.89 2nx3 s ILE 100 Ca 0.23 -0.31 -0.22 0.00 -2.23 0.00 0.00 60.65 58.12 2nx3 s ILE 100 Cb -0.15 -3.06 -0.07 0.00 -1.58 0.00 0.00 42.46 37.59 2nx3 s ILE 100 CO 0.10 0.25 1.12 -2.65 -1.23 0.00 0.00 174.94 172.54 2nx3 n PRO 101 N 4.92 1.38 -0.26 2.79 -0.02 -1.26 -1.28 135.00 141.26 2nx3 n PRO 101 Ca -0.16 0.51 0.02 0.00 -2.02 0.00 0.00 63.50 61.86 2nx3 n PRO 101 Cb 0.50 -2.27 0.15 0.00 -0.02 0.00 0.00 33.50 31.87 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 1.25 1.07 0.00 3.55 0.00 -1.88 -1.62 119.26 121.62 2nx3 h ALA 102 Ca -0.48 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.45 2nx3 h ALA 102 Cb 1.33 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 2nx3 h ALA 102 CO 0.55 -0.01 -0.13 0.74 0.00 0.00 0.00 179.25 180.41 2nx3 h PHE 103 N 0.66 0.00 -0.49 0.00 0.04 -1.91 -2.94 116.94 112.30 2nx3 h PHE 103 Ca 0.38 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.15 2nx3 h PHE 103 Cb 0.39 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.54 2nx3 h PHE 103 CO -0.09 0.13 0.00 1.28 -0.60 0.00 0.00 178.31 179.03 2nx3 n LEU 104 N -3.47 4.54 0.08 1.54 4.77 -0.64 -4.60 117.00 119.21 2nx3 n LEU 104 Ca -0.01 -2.66 0.08 0.00 -0.03 0.00 0.00 56.01 53.39 2nx3 n LEU 104 Cb 0.29 -0.55 0.35 0.00 -2.33 0.00 0.00 43.42 41.18 2nx3 n LEU 104 CO 0.30 0.73 0.73 0.00 -1.33 0.00 0.00 177.39 177.82 2nx3 n ARG 106 N -1.89 1.66 -2.65 0.00 5.12 -1.26 -4.90 116.66 112.73 2nx3 n ARG 106 Ca 0.01 -1.62 -0.42 0.00 -1.93 0.00 0.00 57.85 53.89 2nx3 n ARG 106 Cb 0.10 -1.26 -0.03 0.00 -1.16 0.00 0.00 32.46 30.11 2nx3 n ARG 106 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 2nx3 s GLN 107 N -1.02 3.45 0.23 5.56 -1.52 -0.76 -4.90 119.66 120.70 2nx3 s GLN 107 Ca 0.19 -1.00 -0.18 0.00 -1.95 0.00 0.00 55.36 52.43 2nx3 s GLN 107 Cb 0.12 -4.89 0.23 0.00 -0.22 0.00 0.00 33.01 28.25 2nx3 s GLN 107 CO 0.16 -2.08 1.55 1.15 -0.25 0.00 0.00 175.29 175.83 2nx3 h THR 108 N 6.36 0.00 -0.36 -0.19 2.02 -1.90 -0.38 112.91 118.46 2nx3 h THR 108 Ca 0.03 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.23 2nx3 h THR 108 Cb 1.03 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 2nx3 h THR 108 CO 1.31 0.00 0.24 0.44 0.37 0.00 0.00 175.52 177.88 2nx3 h ASP 109 N -0.00 0.34 -0.21 4.18 3.32 -1.99 -0.01 116.42 122.06 2nx3 h ASP 109 Ca 0.34 -0.01 -0.18 0.00 0.02 0.00 0.00 57.03 57.20 2nx3 h ASP 109 Cb 0.59 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.06 2nx3 h ASP 109 CO -0.99 0.24 -0.57 0.25 -1.72 0.00 0.00 179.24 176.46 2nx3 h LEU 110 N 0.40 0.86 0.21 1.55 5.85 -1.46 -2.00 115.31 120.72 2nx3 h LEU 110 Ca 0.14 -0.58 -0.01 0.00 0.84 0.00 0.00 57.88 58.28 2nx3 h LEU 110 Cb 0.08 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.86 2nx3 h LEU 110 CO -0.03 1.28 -0.10 -0.07 -0.34 0.00 0.00 178.44 179.18 2nx3 h LEU 111 N 0.48 -0.23 -1.17 2.25 3.38 -0.90 -2.31 115.31 116.81 2nx3 h LEU 111 Ca -0.01 -0.14 0.07 0.00 0.09 0.00 0.00 57.88 57.89 2nx3 h LEU 111 Cb 1.18 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.94 2nx3 h LEU 111 CO 0.12 0.00 0.58 -0.07 0.09 0.00 0.00 178.44 179.16 2nx3 h LEU 112 N -0.47 0.88 -0.70 1.67 3.38 -1.05 -0.12 115.31 118.89 2nx3 h LEU 112 Ca -0.03 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 2nx3 h LEU 112 Cb 0.36 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 2nx3 h LEU 112 CO 0.05 0.56 0.13 0.00 0.09 0.00 0.00 178.44 179.27 2nx3 h ALA 113 N 1.52 0.93 -0.04 1.53 0.00 -1.25 -1.06 119.26 120.89 2nx3 h ALA 113 Ca 0.38 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2nx3 h ALA 113 Cb 0.21 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2nx3 h ALA 113 CO -0.14 0.67 -0.01 0.00 0.00 0.00 0.00 179.25 179.77 2nx3 h ALA 114 N 1.07 0.05 -0.70 0.00 0.00 -0.75 -3.12 119.26 115.81 2nx3 h ALA 114 Ca 0.21 -0.21 0.07 0.00 0.00 0.00 0.00 54.91 54.99 2nx3 h ALA 114 Cb 0.42 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 2nx3 h ALA 114 CO 0.01 -0.23 0.38 0.00 0.00 0.00 0.00 179.25 179.41 2nx3 h ALA 115 N 0.63 0.96 -0.45 0.00 0.00 -0.96 -2.23 119.26 117.20 2nx3 h ALA 115 Ca 0.01 0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.08 2nx3 h ALA 115 Cb 0.42 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2nx3 h ALA 115 CO 0.00 0.03 0.41 -0.22 0.00 0.00 0.00 179.25 179.48 2nx3 h LYS 116 N 0.68 0.00 0.00 0.00 3.64 -1.13 -1.92 116.57 117.84 2nx3 h LYS 116 Ca 0.33 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 2nx3 h LYS 116 Cb 0.25 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 2nx3 h LYS 116 CO -0.21 0.00 0.00 0.25 -2.27 0.00 0.00 179.45 177.22 2nx3 n THR 117 N -3.95 0.89 -0.24 1.00 -2.24 -0.84 -4.87 114.28 104.04 2nx3 n THR 117 Ca 0.08 0.25 0.00 0.00 -2.27 0.00 0.00 64.05 62.11 2nx3 n THR 117 Cb 0.61 -1.13 0.00 0.00 -2.10 0.00 0.00 70.33 67.71 2nx3 n THR 117 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2nx3 n GLY 118 N -0.04 1.86 3.91 3.38 0.00 -0.72 -5.03 105.19 108.55 2nx3 n GLY 118 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.23 2.63 0.56 1.61 1.81 -1.26 -4.93 118.95 119.14 2nx3 s ARG 119 Ca 0.00 0.08 -0.18 0.00 -1.72 0.00 0.00 55.73 53.91 2nx3 s ARG 119 Cb 0.00 -2.14 -0.05 0.00 -0.45 0.00 0.00 34.95 32.31 2nx3 s ARG 119 CO 0.00 -1.02 1.08 0.00 -0.68 0.00 0.00 175.30 174.69 2nx3 s ALA 120 N -3.22 2.72 -0.06 2.13 0.00 -1.05 -4.76 121.76 117.51 2nx3 s ALA 120 Ca 0.57 0.61 0.02 0.00 0.00 0.00 0.00 51.96 53.17 2nx3 s ALA 120 Cb -0.11 -3.29 0.01 0.00 0.00 0.00 0.00 23.12 19.74 2nx3 s ALA 120 CO 0.47 -0.73 -0.12 0.08 0.00 0.00 0.00 175.76 175.47 2nx3 s VAL 121 N -2.09 1.08 -0.21 0.00 1.01 -0.20 -0.39 120.40 119.59 2nx3 s VAL 121 Ca 0.68 -0.45 -0.00 0.00 0.00 0.00 0.00 61.98 62.21 2nx3 s VAL 121 Cb -0.19 -0.99 0.02 0.00 0.00 0.00 0.00 36.38 35.21 2nx3 s VAL 121 CO 0.30 0.34 -0.13 0.21 0.00 0.00 0.00 175.10 175.82 2nx3 s ASN 122 N 0.66 3.77 -0.25 3.32 2.47 -0.14 -0.45 114.94 124.32 2nx3 s ASN 122 Ca -0.14 -0.72 -0.07 0.00 0.42 0.00 0.00 52.86 52.35 2nx3 s ASN 122 Cb -0.16 -1.58 -0.03 0.00 -1.45 0.00 0.00 41.25 38.04 2nx3 s ASN 122 CO 0.03 -0.05 0.06 -0.69 -3.72 0.00 0.00 177.10 172.73 2nx3 s VAL 123 N 1.32 4.27 0.11 -5.21 1.01 -0.06 -0.46 120.40 121.38 2nx3 s VAL 123 Ca 0.03 -0.19 -0.31 0.00 0.00 0.00 0.00 61.98 61.51 2nx3 s VAL 123 Cb -0.15 -2.99 -0.07 0.00 0.00 0.00 0.00 36.38 33.17 2nx3 s VAL 123 CO -0.08 0.35 1.33 -0.54 0.00 0.00 0.00 175.10 176.15 2nx3 s LYS 124 N 1.57 4.36 0.03 2.72 -0.14 -0.41 -1.24 119.74 126.63 2nx3 s LYS 124 Ca 0.06 1.99 -0.30 0.00 -1.36 0.00 0.00 55.97 56.36 2nx3 s LYS 124 Cb -0.15 -3.27 -0.05 0.00 -1.68 0.00 0.00 37.83 32.68 2nx3 s LYS 124 CO 0.03 -0.36 1.21 0.21 -0.76 0.00 0.00 175.35 175.68 2nx3 s LYS 125 N 0.92 4.40 0.49 1.68 2.20 -0.06 -4.06 119.74 125.32 2nx3 s LYS 125 Ca 0.62 1.76 -0.24 0.00 -0.36 0.00 0.00 55.97 57.75 2nx3 s LYS 125 Cb -0.35 -3.42 -0.07 0.00 -1.51 0.00 0.00 37.83 32.48 2nx3 s LYS 125 CO 0.31 -0.33 1.40 0.20 -0.36 0.00 0.00 175.35 176.57 2nx3 s GLY 126 N 1.23 2.91 0.11 5.54 0.00 -1.24 -4.52 107.32 111.36 2nx3 s GLY 126 Ca 0.58 1.42 0.10 0.00 0.00 0.00 0.00 44.72 46.83 2nx3 s GLY 126 CO 0.27 1.99 1.32 -1.06 0.00 0.00 0.00 173.10 175.63 2nx3 n GLN 127 N -0.57 0.06 -0.00 2.90 3.00 -1.26 -1.24 117.38 120.27 2nx3 n GLN 127 Ca 0.07 0.48 0.08 0.00 -0.01 0.00 0.00 57.00 57.63 2nx3 n GLN 127 Cb 0.43 -1.66 -0.09 0.00 0.00 0.00 0.00 30.24 28.92 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 -1.77 0.00 -3.13 1.08 1.16 -1.26 -1.28 117.46 112.26 2nx3 n PHE 128 Ca 0.00 0.00 -0.39 0.00 -1.87 0.00 0.00 57.45 55.19 2nx3 n PHE 128 Cb 0.06 -0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 37.88 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 4.44 0.41 5.98 2.96 -0.37 -5.06 118.68 124.25 2nx3 s LEU 129 Ca 0.06 1.27 -0.22 0.00 -0.22 0.00 0.00 54.13 55.03 2nx3 s LEU 129 Cb 0.12 -3.04 -0.11 0.00 0.50 0.00 0.00 46.19 43.67 2nx3 s LEU 129 CO 0.68 0.08 0.94 0.00 -1.32 0.00 0.00 176.35 176.73 2nx3 s ALA 130 N -0.21 3.08 0.21 5.97 0.00 -1.26 -4.85 121.76 124.70 2nx3 s ALA 130 Ca 0.34 0.40 -0.09 0.00 0.00 0.00 0.00 51.96 52.61 2nx3 s ALA 130 Cb -0.19 -3.14 0.30 0.00 0.00 0.00 0.00 23.12 20.09 2nx3 s ALA 130 CO 0.19 0.14 1.72 -1.35 0.00 0.00 0.00 175.76 176.47 2nx3 h PRO 131 N 2.11 0.31 0.00 0.00 0.11 -1.97 -1.00 132.00 131.56 2nx3 h PRO 131 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2nx3 h PRO 131 Cb 1.18 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2nx3 h PRO 131 CO 0.62 0.20 0.00 -2.67 -0.21 0.00 0.00 178.00 175.94 2nx3 n TRP 132 N -5.08 0.74 1.16 0.65 2.14 -1.26 -2.33 117.44 113.46 2nx3 n TRP 132 Ca 0.09 0.30 0.14 0.00 2.07 0.00 0.00 57.50 60.10 2nx3 n TRP 132 Cb 0.32 -0.98 0.62 0.00 -0.81 0.00 0.00 31.31 30.46 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 -2.18 0.10 0.03 -0.67 8.00 -0.38 -3.13 116.55 118.32 2nx3 n ASP 133 Ca 0.02 0.13 0.11 0.00 0.71 0.00 0.00 54.79 55.76 2nx3 n ASP 133 Cb 0.21 -0.32 0.46 0.00 -0.02 0.00 0.00 41.12 41.46 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 -1.38 0.56 -0.16 -3.53 -2.24 -0.98 -3.32 114.28 103.22 2nx3 n THR 134 Ca 0.10 0.08 -0.05 0.00 -2.27 0.00 0.00 64.05 61.91 2nx3 n THR 134 Cb 0.31 -0.79 0.05 0.00 -2.10 0.00 0.00 70.33 67.79 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 0.50 0.00 -0.78 3.64 -1.76 -1.84 116.57 116.33 2nx3 h LYS 135 Ca 0.00 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 2nx3 h LYS 135 Cb 0.42 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.13 2nx3 h LYS 135 CO 0.00 0.33 -0.17 -0.91 -2.27 0.00 0.00 179.45 176.44 2nx3 h ASN 136 N 0.52 0.00 -0.31 4.20 2.35 -1.82 -2.20 115.58 118.32 2nx3 h ASN 136 Ca 0.22 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.87 2nx3 h ASN 136 Cb 0.11 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 2nx3 h ASN 136 CO -0.14 0.17 -0.19 0.58 -1.65 0.00 0.00 177.43 176.19 2nx3 h VAL 137 N 0.00 1.29 -0.41 2.81 2.07 -1.50 -2.15 116.25 118.35 2nx3 h VAL 137 Ca -0.00 -1.32 -0.03 0.00 0.82 0.00 0.00 66.70 66.17 2nx3 h VAL 137 Cb 0.48 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 2nx3 h VAL 137 CO 0.02 0.42 0.15 0.58 0.02 0.00 0.00 177.57 178.77 2nx3 h VAL 138 N 0.44 1.20 -0.54 2.57 2.07 -1.13 -2.66 116.25 118.20 2nx3 h VAL 138 Ca 0.06 -0.65 0.06 0.00 0.82 0.00 0.00 66.70 67.00 2nx3 h VAL 138 Cb 0.73 0.85 -0.05 0.00 -1.52 0.00 0.00 31.29 31.30 2nx3 h VAL 138 CO 0.05 0.23 0.25 -0.08 0.02 0.00 0.00 177.57 178.04 2nx3 h GLU 139 N 0.52 0.46 -0.44 1.57 4.81 -1.28 0.97 114.58 121.19 2nx3 h GLU 139 Ca 0.14 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.39 2nx3 h GLU 139 Cb 0.21 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 2nx3 h GLU 139 CO -0.01 0.30 0.18 0.87 -0.73 0.00 0.00 179.01 179.62 2nx3 h LYS 140 N 0.47 0.35 -0.53 1.92 1.57 -1.22 0.21 116.57 119.35 2nx3 h LYS 140 Ca 0.25 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.95 2nx3 h LYS 140 Cb 0.22 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 2nx3 h LYS 140 CO -0.21 0.23 0.07 -0.07 -0.57 0.00 0.00 179.45 178.90 2nx3 h LEU 141 N 0.36 0.80 -0.35 2.94 3.38 -1.02 -1.47 115.31 119.96 2nx3 h LEU 141 Ca 0.20 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 2nx3 h LEU 141 Cb 0.17 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2nx3 h LEU 141 CO -0.18 0.82 -0.21 0.11 0.09 0.00 0.00 178.44 179.06 2nx3 h LYS 142 N 0.80 0.77 -0.96 1.13 1.57 -0.20 -1.24 116.57 118.45 2nx3 h LYS 142 Ca 0.16 -0.35 0.07 0.00 -1.87 0.00 0.00 60.65 58.66 2nx3 h LYS 142 Cb 0.38 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.62 2nx3 h LYS 142 CO 0.01 0.97 0.62 0.35 -0.57 0.00 0.00 179.45 180.83 2nx3 h PHE 143 N 0.55 1.12 0.00 -1.35 3.57 -0.70 -0.93 116.94 119.20 2nx3 h PHE 143 Ca 0.07 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.60 2nx3 h PHE 143 Cb 0.77 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 39.14 2nx3 h PHE 143 CO 0.06 0.58 0.00 0.41 -2.23 0.00 0.00 178.31 177.13 2nx3 n GLY 144 N -1.38 -0.88 0.00 2.40 0.00 -0.58 -4.89 105.19 99.87 2nx3 n GLY 144 Ca 0.15 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 0.65 0.40 3.76 -0.02 0.00 -0.35 -3.66 105.19 105.98 2nx3 n GLY 145 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 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 3.45 -0.07 4.61 0.00 -0.49 -4.91 121.76 122.35 2nx3 s ALA 146 Ca 0.00 1.07 0.03 0.00 0.00 0.00 0.00 51.96 53.06 2nx3 s ALA 146 Cb 0.00 -3.40 -0.07 0.00 0.00 0.00 0.00 23.12 19.65 2nx3 s ALA 146 CO 0.00 -0.39 -0.02 1.63 0.00 0.00 0.00 175.76 176.98 2nx3 n LYS 147 N 1.11 1.84 -3.55 0.00 4.76 -1.26 -4.47 118.16 116.58 2nx3 n LYS 147 Ca -0.00 0.02 -0.41 0.00 -2.87 0.00 0.00 58.31 55.04 2nx3 n LYS 147 Cb 0.43 -1.16 -0.09 0.00 -1.84 0.00 0.00 35.03 32.38 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 -2.15 2.55 -0.08 1.97 2.12 -1.26 -5.07 118.70 116.78 2nx3 s GLU 148 Ca -0.06 -1.66 0.04 0.00 0.36 0.00 0.00 54.97 53.65 2nx3 s GLU 148 Cb 0.02 -3.90 -0.02 0.00 0.26 0.00 0.00 34.13 30.49 2nx3 s GLU 148 CO 0.22 -1.12 -0.19 0.42 -0.54 0.00 0.00 175.26 174.05 2nx3 s ILE 149 N 1.40 2.59 0.07 -3.70 1.01 -1.26 -1.04 121.20 120.28 2nx3 s ILE 149 Ca 0.05 -0.87 0.07 0.00 0.00 0.00 0.00 60.65 59.90 2nx3 s ILE 149 Cb -0.25 -2.01 -0.03 0.00 0.01 0.00 0.00 42.46 40.18 2nx3 s ILE 149 CO 0.01 0.56 -0.19 -0.31 0.00 0.00 0.00 174.94 175.00 2nx3 s TYR 150 N -0.15 1.68 -0.09 3.97 2.02 0.40 -2.65 117.35 122.53 2nx3 s TYR 150 Ca -0.02 -0.40 0.02 0.00 -0.37 0.00 0.00 57.07 56.30 2nx3 s TYR 150 Cb -0.14 -0.96 0.01 0.00 -0.40 0.00 0.00 41.96 40.48 2nx3 s TYR 150 CO 0.04 0.14 -0.16 -0.51 -1.57 0.00 0.00 175.55 173.48 2nx3 s LEU 151 N -1.59 1.78 -0.20 -1.29 1.43 -0.17 -0.88 118.68 117.76 2nx3 s LEU 151 Ca 0.05 -0.41 -0.05 0.00 -1.03 0.00 0.00 54.13 52.69 2nx3 s LEU 151 Cb -0.09 -1.07 -0.02 0.00 0.03 0.00 0.00 46.19 45.03 2nx3 s LEU 151 CO 0.03 0.05 -0.01 -0.89 0.23 0.00 0.00 176.35 175.77 2nx3 s THR 152 N 0.74 3.88 -0.21 5.49 2.01 -0.37 -0.92 115.64 126.25 2nx3 s THR 152 Ca -0.12 -0.34 -0.29 0.00 0.31 0.00 0.00 61.69 61.25 2nx3 s THR 152 Cb -0.16 -2.75 0.01 0.00 0.01 0.00 0.00 72.50 69.60 2nx3 s THR 152 CO 0.03 0.43 1.02 -0.70 -0.69 0.00 0.00 174.62 174.70 2nx3 s GLU 153 N 1.07 4.28 -0.06 4.92 2.56 0.23 -0.88 118.70 130.81 2nx3 s GLU 153 Ca 0.02 1.34 0.11 0.00 0.00 0.00 0.00 54.97 56.44 2nx3 s GLU 153 Cb -0.14 -3.63 0.21 0.00 2.00 0.00 0.00 34.13 32.57 2nx3 s GLU 153 CO 0.01 -0.58 1.10 2.89 -0.56 0.00 0.00 175.26 178.12 2nx3 n ARG 154 N 6.12 0.51 0.00 4.30 1.85 -1.26 -0.60 116.66 127.58 2nx3 n ARG 154 Ca 0.11 -1.86 0.00 0.00 -1.00 0.00 0.00 57.85 55.10 2nx3 n ARG 154 Cb 0.46 -0.78 0.00 0.00 -1.05 0.00 0.00 32.46 31.09 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 -0.40 2.25 3.07 2.89 0.00 -1.26 -3.94 105.19 107.80 2nx3 n GLY 155 Ca 0.07 -1.89 -0.20 0.00 0.00 0.00 0.00 46.02 44.00 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 0.89 -0.08 2.61 2.01 -0.47 -4.24 115.64 113.42 2nx3 s THR 156 Ca 0.00 -0.52 -0.37 0.00 0.31 0.00 0.00 61.69 61.10 2nx3 s THR 156 Cb 0.00 -0.75 -0.15 0.00 0.01 0.00 0.00 72.50 71.60 2nx3 s THR 156 CO 0.00 0.22 1.62 0.41 -0.69 0.00 0.00 174.62 176.18 2nx3 n THR 157 N 2.72 0.22 -3.61 -0.82 -1.04 -0.41 -0.97 114.28 110.37 2nx3 n THR 157 Ca -0.14 -0.04 -0.29 0.00 -2.04 0.00 0.00 64.05 61.54 2nx3 n THR 157 Cb 0.56 -1.23 -0.12 0.00 -1.82 0.00 0.00 70.33 67.72 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 2.34 1.61 0.00 -1.42 5.36 -0.80 -4.81 117.98 120.25 2nx3 s PHE 158 Ca 0.91 -2.24 0.00 0.00 -0.96 0.00 0.00 56.93 54.63 2nx3 s PHE 158 Cb -0.93 -1.53 0.00 0.00 -0.34 0.00 0.00 43.02 40.22 2nx3 s PHE 158 CO 0.54 -0.79 0.00 0.41 -1.46 0.00 0.00 175.22 173.93 2nx3 n GLY 159 N 3.48 -0.66 3.90 13.12 0.00 -1.26 -4.36 105.19 119.42 2nx3 n GLY 159 Ca 0.13 -1.13 -0.33 0.00 0.00 0.00 0.00 46.02 44.68 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 3.55 -1.41 1.61 2.02 -1.26 -4.49 117.35 117.37 2nx3 s TYR 160 Ca 0.00 0.43 -0.13 0.00 -0.37 0.00 0.00 57.07 57.00 2nx3 s TYR 160 Cb 0.00 -1.88 0.10 0.00 -0.40 0.00 0.00 41.96 39.78 2nx3 s TYR 160 CO 0.00 0.62 0.61 0.09 -1.57 0.00 0.00 175.55 175.30 2nx3 n ASN 161 N 0.88 -3.60 -3.64 2.29 4.13 -1.26 -4.94 115.26 109.12 2nx3 n ASN 161 Ca -0.10 -0.61 -0.15 0.00 1.68 0.00 0.00 54.58 55.41 2nx3 n ASN 161 Cb 0.52 -2.96 -0.07 0.00 -1.54 0.00 0.00 39.78 35.73 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 -2.93 -0.39 0.06 6.41 2.47 -1.26 -4.33 114.94 114.96 2nx3 s ASN 162 Ca 0.53 0.28 0.05 0.00 0.42 0.00 0.00 52.86 54.14 2nx3 s ASN 162 Cb -0.28 0.43 -0.03 0.00 -1.45 0.00 0.00 41.25 39.92 2nx3 s ASN 162 CO 0.65 -0.58 -0.14 -0.76 -3.72 0.00 0.00 177.10 172.54 2nx3 s LEU 163 N -1.52 2.23 0.00 3.21 1.43 -1.26 -1.91 118.68 120.85 2nx3 s LEU 163 Ca -0.10 -0.54 0.06 0.00 -1.03 0.00 0.00 54.13 52.52 2nx3 s LEU 163 Cb -0.02 -0.58 -0.02 0.00 0.03 0.00 0.00 46.19 45.60 2nx3 s LEU 163 CO 0.04 -0.01 -0.17 0.54 0.23 0.00 0.00 176.35 176.97 2nx3 s VAL 164 N -1.06 1.37 -0.38 -1.59 0.11 -0.15 -4.85 120.40 113.85 2nx3 s VAL 164 Ca 0.00 -0.85 -0.16 0.00 -2.93 0.00 0.00 61.98 58.04 2nx3 s VAL 164 Cb -0.09 -1.16 0.01 0.00 -1.53 0.00 0.00 36.38 33.60 2nx3 s VAL 164 CO 0.02 0.30 0.40 -0.69 -3.33 0.00 0.00 175.10 171.80 2nx3 s VAL 165 N -0.53 5.13 -0.82 2.04 1.01 -1.26 -1.37 120.40 124.59 2nx3 s VAL 165 Ca 0.06 -0.17 -0.18 0.00 0.00 0.00 0.00 61.98 61.69 2nx3 s VAL 165 Cb -0.07 -3.94 0.15 0.00 0.00 0.00 0.00 36.38 32.52 2nx3 s VAL 165 CO 0.00 -0.27 0.94 -0.62 0.00 0.00 0.00 175.10 175.16 2nx3 s ASP 166 N 1.77 6.55 0.00 3.32 -1.08 -1.26 -4.90 116.67 121.08 2nx3 s ASP 166 Ca 0.12 -2.04 0.00 0.00 -0.52 0.00 0.00 52.55 50.11 2nx3 s ASP 166 Cb -0.17 -2.33 0.00 0.00 -1.46 0.00 0.00 42.92 38.96 2nx3 s ASP 166 CO 0.13 -0.97 0.92 0.49 0.52 0.00 0.00 175.17 176.26 2nx3 n PHE 167 N 5.90 0.00 0.30 -5.34 3.72 -1.26 -1.12 117.46 119.66 2nx3 n PHE 167 Ca 0.13 0.00 0.18 0.00 -0.05 0.00 0.00 57.45 57.71 2nx3 n PHE 167 Cb 0.47 -0.42 0.75 0.00 -0.94 0.00 0.00 39.48 39.34 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 -2.74 114.38 111.61 2nx3 h ARG 168 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 2nx3 h ARG 168 Cb 0.01 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 2nx3 h ARG 168 CO 0.00 0.00 -0.24 0.66 -1.07 0.00 0.00 179.97 179.32 2nx3 h SER 169 N 0.00 0.00 0.49 7.04 4.64 -1.55 -3.05 113.55 121.13 2nx3 h SER 169 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 2nx3 h SER 169 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2nx3 h SER 169 CO 0.00 0.24 -0.24 -0.07 -0.87 0.00 0.00 176.83 175.89 2nx3 h LEU 170 N 0.00 -0.56 -1.18 5.97 4.07 -1.70 0.14 115.31 122.05 2nx3 h LEU 170 Ca -0.00 -0.02 -0.08 0.00 0.08 0.00 0.00 57.88 57.85 2nx3 h LEU 170 Cb 0.72 0.14 -0.01 0.00 1.08 0.00 0.00 40.66 42.59 2nx3 h LEU 170 CO 0.03 -0.34 -0.38 1.55 -1.08 0.00 0.00 178.44 178.22 2nx3 h PRO 171 N -0.74 0.05 0.01 1.13 0.13 -1.74 -2.12 132.00 128.71 2nx3 h PRO 171 Ca -0.07 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.04 2nx3 h PRO 171 Cb 0.54 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.67 2nx3 h PRO 171 CO 0.11 0.43 -0.00 0.82 -0.23 0.00 0.00 178.00 179.12 2nx3 h ILE 172 N 0.04 1.22 -0.01 -3.56 2.04 -1.41 -3.19 117.51 112.65 2nx3 h ILE 172 Ca 0.00 -0.67 -0.11 0.00 1.00 0.00 0.00 64.86 65.09 2nx3 h ILE 172 Cb 0.70 1.67 -0.01 0.00 -0.74 0.00 0.00 36.82 38.44 2nx3 h ILE 172 CO 0.05 0.17 -0.49 0.24 0.00 0.00 0.00 178.15 178.12 2nx3 h MET 173 N -0.29 0.02 0.00 2.37 2.86 -0.94 -2.98 114.93 115.97 2nx3 h MET 173 Ca -0.00 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2nx3 h MET 173 Cb 0.29 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.95 2nx3 h MET 173 CO 0.00 0.51 0.17 -0.22 1.06 0.00 0.00 176.91 178.43 2nx3 h LYS 174 N 0.01 0.00 -0.04 1.72 1.63 -1.37 -1.31 116.57 117.21 2nx3 h LYS 174 Ca -0.00 0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.72 2nx3 h LYS 174 Cb 0.88 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.50 2nx3 h LYS 174 CO 0.06 0.00 -0.31 1.96 -3.45 0.00 0.00 179.45 177.71 2nx3 h GLN 175 N 0.00 0.07 0.00 1.90 4.20 -1.62 -3.31 115.11 116.35 2nx3 h GLN 175 Ca 0.00 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.69 2nx3 h GLN 175 Cb 0.34 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.12 2nx3 h GLN 175 CO 0.00 0.38 -0.44 0.91 -0.67 0.00 0.00 178.83 179.01 2nx3 n TRP 176 N -4.15 0.00 -3.84 2.96 8.01 -0.52 -5.09 117.44 114.81 2nx3 n TRP 176 Ca -0.02 0.00 -0.03 0.00 -1.31 0.00 0.00 57.50 56.14 2nx3 n TRP 176 Cb 0.37 -0.02 0.01 0.00 -2.01 0.00 0.00 31.31 29.66 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 -1.75 -1.58 0.35 6.99 0.00 -1.07 -5.00 121.76 119.69 2nx3 s ALA 177 Ca 0.02 -0.22 -0.26 0.00 0.00 0.00 0.00 51.96 51.51 2nx3 s ALA 177 Cb 0.05 0.72 -0.09 0.00 0.00 0.00 0.00 23.12 23.79 2nx3 s ALA 177 CO 0.29 -1.06 1.01 0.15 0.00 0.00 0.00 175.76 176.15 2nx3 s LYS 178 N -2.46 4.42 -0.15 0.00 1.02 -1.09 -4.20 119.74 117.29 2nx3 s LYS 178 Ca 0.19 1.47 -0.00 0.00 0.02 0.00 0.00 55.97 57.64 2nx3 s LYS 178 Cb -0.02 -2.75 -0.01 0.00 -0.52 0.00 0.00 37.83 34.53 2nx3 s LYS 178 CO 0.05 0.10 -0.13 0.08 -0.92 0.00 0.00 175.35 174.53 2nx3 s VAL 179 N -1.57 2.98 -0.04 3.17 1.01 -1.26 -1.00 120.40 123.68 2nx3 s VAL 179 Ca 0.52 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.84 2nx3 s VAL 179 Cb -0.22 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 33.87 2nx3 s VAL 179 CO 0.28 0.51 -0.06 -0.63 0.00 0.00 0.00 175.10 175.20 2nx3 s ILE 180 N 0.58 3.78 -0.28 2.22 -1.09 -0.10 0.21 121.20 126.52 2nx3 s ILE 180 Ca -0.08 -0.55 -0.08 0.00 -2.23 0.00 0.00 60.65 57.71 2nx3 s ILE 180 Cb -0.16 -2.59 -0.01 0.00 -1.58 0.00 0.00 42.46 38.12 2nx3 s ILE 180 CO 0.03 0.52 0.09 -0.47 -1.23 0.00 0.00 174.94 173.88 2nx3 s TYR 181 N -0.90 3.13 -0.73 3.97 5.04 0.18 -0.60 117.35 127.44 2nx3 s TYR 181 Ca 0.14 -0.68 -0.25 0.00 -2.44 0.00 0.00 57.07 53.84 2nx3 s TYR 181 Cb -0.11 -2.27 0.05 0.00 0.35 0.00 0.00 41.96 39.97 2nx3 s TYR 181 CO 0.04 -0.47 1.18 0.34 -1.34 0.00 0.00 175.55 175.30 2nx3 s ASP 182 N 1.57 6.19 0.39 4.32 -1.08 0.24 -0.87 116.67 127.42 2nx3 s ASP 182 Ca 0.04 -0.71 0.20 0.00 -0.52 0.00 0.00 52.55 51.56 2nx3 s ASP 182 Cb -0.16 -2.51 0.71 0.00 -1.46 0.00 0.00 42.92 39.50 2nx3 s ASP 182 CO 0.04 -1.68 1.75 0.00 0.52 0.00 0.00 175.17 175.79 2nx3 h ALA 183 N 9.85 1.00 0.01 3.66 0.00 -1.32 -3.16 119.26 129.29 2nx3 h ALA 183 Ca -0.25 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.35 2nx3 h ALA 183 Cb 1.05 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2nx3 h ALA 183 CO 1.25 0.43 -0.00 1.79 0.00 0.00 0.00 179.25 182.72 2nx3 h THR 184 N 0.00 1.18 0.00 0.00 1.35 -1.90 -3.37 112.91 110.16 2nx3 h THR 184 Ca -0.00 -1.86 0.00 0.00 -0.55 0.00 0.00 66.41 64.00 2nx3 h THR 184 Cb 0.88 2.21 0.00 0.00 -1.73 0.00 0.00 68.15 69.51 2nx3 h THR 184 CO 0.05 0.39 0.00 1.41 -0.25 0.00 0.00 175.52 177.12 2nx3 n HIS 185 N -4.68 0.43 0.45 4.73 8.25 -1.26 -3.42 115.22 119.73 2nx3 n HIS 185 Ca -0.07 0.13 0.11 0.00 -0.26 0.00 0.00 57.72 57.63 2nx3 n HIS 185 Cb 0.31 -0.71 0.45 0.00 1.12 0.00 0.00 29.99 31.16 2nx3 n HIS 185 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2nx3 n SER 186 N -1.85 0.51 -0.18 0.41 7.64 -1.19 -2.45 113.62 116.51 2nx3 n SER 186 Ca 0.06 0.62 0.02 0.00 1.01 0.00 0.00 58.87 60.57 2nx3 n SER 186 Cb 0.37 -0.73 0.04 0.00 -1.01 0.00 0.00 64.21 62.88 2nx3 n SER 186 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2nx3 n VAL 187 N -2.05 0.90 -2.58 0.44 0.24 -1.22 -4.72 118.33 109.34 2nx3 n VAL 187 Ca 0.03 -0.95 -0.33 0.00 -2.04 0.00 0.00 64.34 61.05 2nx3 n VAL 187 Cb 0.23 0.56 -0.05 0.00 -1.47 0.00 0.00 33.84 33.11 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 -0.93 4.03 -0.56 7.34 -2.07 -1.02 -1.30 119.66 125.16 2nx3 s GLN 188 Ca 0.06 1.07 -0.03 0.00 -1.82 0.00 0.00 55.36 54.65 2nx3 s GLN 188 Cb 0.03 -2.15 0.14 0.00 -1.09 0.00 0.00 33.01 29.95 2nx3 s GLN 188 CO 0.04 -0.20 0.37 -0.51 -1.32 0.00 0.00 175.29 173.67 2nx3 s LEU 189 N -3.64 5.27 0.11 2.60 1.02 -0.50 -4.36 118.68 119.17 2nx3 s LEU 189 Ca 0.61 -2.57 -0.36 0.00 0.02 0.00 0.00 54.13 51.83 2nx3 s LEU 189 Cb -0.10 -1.85 -0.16 0.00 0.02 0.00 0.00 46.19 44.10 2nx3 s LEU 189 CO 0.22 -0.43 1.43 -0.81 0.02 0.00 0.00 176.35 176.78 2nx3 n PRO 190 N 3.87 1.49 -1.53 1.29 -0.04 -1.26 -0.39 135.00 138.43 2nx3 n PRO 190 Ca 0.04 0.54 -0.18 0.00 -0.04 0.00 0.00 63.50 63.86 2nx3 n PRO 190 Cb 0.39 -2.23 -0.08 0.00 -0.04 0.00 0.00 33.50 31.55 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 2.84 1.74 0.20 0.55 0.00 -1.26 -4.31 105.19 104.96 2nx3 n GLY 191 Ca 0.18 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.24 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 -3.37 -0.02 0.00 -0.66 -2.97 103.07 96.05 2nx3 h GLY 192 Ca -0.37 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 46.64 2nx3 h GLY 192 CO 0.55 0.00 0.34 1.04 0.00 0.00 0.00 176.54 178.47 2nx3 n LEU 193 N -4.03 5.86 0.00 3.11 4.77 0.13 -4.83 117.00 122.00 2nx3 n LEU 193 Ca -0.02 -3.47 0.00 0.00 -0.03 0.00 0.00 56.01 52.49 2nx3 n LEU 193 Cb 0.37 -0.75 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 2nx3 n LEU 193 CO 0.37 0.98 0.00 0.61 -1.33 0.00 0.00 177.39 178.02 2nx3 n GLY 194 N -0.75 2.09 1.34 -0.72 0.00 -1.12 -3.76 105.19 102.26 2nx3 n GLY 194 Ca 0.46 -0.17 0.12 0.00 0.00 0.00 0.00 46.02 46.42 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 4.99 3.94 -3.71 1.61 5.75 -1.26 -4.86 116.55 123.01 2nx3 n ASP 195 Ca 0.00 -2.00 -0.11 0.00 -0.01 0.00 0.00 54.79 52.67 2nx3 n ASP 195 Cb 0.00 -0.48 -0.06 0.00 -1.03 0.00 0.00 41.12 39.55 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 -1.00 0.95 0.38 0.11 1.02 -1.25 -3.87 119.74 116.08 2nx3 s LYS 196 Ca 0.48 -0.66 -0.12 0.00 0.02 0.00 0.00 55.97 55.70 2nx3 s LYS 196 Cb 0.25 0.41 -0.07 0.00 -0.52 0.00 0.00 37.83 37.90 2nx3 s LYS 196 CO 0.33 -0.34 0.75 -1.12 -0.92 0.00 0.00 175.35 174.05 2nx3 s SER 197 N -2.54 6.59 0.00 2.83 0.01 -1.26 0.18 113.70 119.51 2nx3 s SER 197 Ca 0.00 1.16 0.00 0.00 1.31 0.00 0.00 55.95 58.43 2nx3 s SER 197 Cb 0.02 -2.33 0.00 0.00 0.21 0.00 0.00 66.02 63.91 2nx3 s SER 197 CO -0.09 -0.34 0.00 0.61 0.41 0.00 0.00 173.24 173.83 2nx3 n GLY 198 N -1.03 4.22 0.00 3.44 0.00 -0.03 -4.62 105.19 107.17 2nx3 n GLY 198 Ca 0.03 -1.97 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 1.52 2.81 -0.02 0.00 -1.26 -1.42 105.19 111.83 2nx3 n GLY 199 Ca 0.00 -0.61 -0.28 0.00 0.00 0.00 0.00 46.02 45.13 2nx3 n GLY 199 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2nx3 n MET 200 N -0.31 1.96 -0.30 1.61 2.81 -0.42 -4.85 117.12 117.62 2nx3 n MET 200 Ca 0.00 -4.52 0.35 0.00 -1.81 0.00 0.00 57.70 51.72 2nx3 n MET 200 Cb 0.00 -2.28 0.71 0.00 -0.71 0.00 0.00 33.22 30.94 2nx3 n MET 200 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 2nx3 h ARG 201 N 5.15 0.00 0.00 0.03 2.43 -1.87 0.42 114.38 120.54 2nx3 h ARG 201 Ca 0.16 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 2nx3 h ARG 201 Cb 0.73 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.28 2nx3 h ARG 201 CO 0.74 0.00 0.00 1.05 -1.51 0.00 0.00 179.97 180.25 2nx3 h GLU 202 N 0.00 0.00 -0.02 0.20 4.11 -1.95 -1.77 114.58 115.15 2nx3 h GLU 202 Ca 0.56 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.99 2nx3 h GLU 202 Cb 2.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.70 2nx3 h GLU 202 CO -0.01 0.00 -0.34 1.19 0.07 0.00 0.00 179.01 179.92 2nx3 n PHE 203 N -2.73 0.00 0.23 2.06 3.72 0.14 -4.59 117.46 116.29 2nx3 n PHE 203 Ca -0.01 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.23 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 2.58 0.23 -0.29 4.37 2.04 -1.41 -2.76 117.51 122.27 2nx3 h ILE 204 Ca 0.00 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 2nx3 h ILE 204 Cb 0.72 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 2nx3 h ILE 204 CO 0.00 0.00 0.03 0.15 0.00 0.00 0.00 178.15 178.33 2nx3 h PHE 205 N -0.78 0.52 -0.56 1.37 3.57 -1.81 -2.69 116.94 116.57 2nx3 h PHE 205 Ca -0.03 -0.08 -0.02 0.00 3.53 0.00 0.00 57.97 61.37 2nx3 h PHE 205 Cb 0.70 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.27 2nx3 h PHE 205 CO -0.21 0.60 0.25 -1.00 -2.23 0.00 0.00 178.31 175.72 2nx3 h PRO 206 N 0.29 0.79 0.00 6.41 0.13 -1.81 -2.28 132.00 135.53 2nx3 h PRO 206 Ca 0.08 -0.10 -0.10 0.00 -0.87 0.00 0.00 66.00 65.01 2nx3 h PRO 206 Cb 0.37 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 31.34 2nx3 h PRO 206 CO 0.01 0.63 -0.47 -0.07 -0.23 0.00 0.00 178.00 177.87 2nx3 h LEU 207 N 0.79 0.00 -0.45 1.56 3.38 -1.45 -2.32 115.31 116.82 2nx3 h LEU 207 Ca 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 2nx3 h LEU 207 Cb 0.11 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2nx3 h LEU 207 CO -0.02 0.47 0.22 0.40 0.09 0.00 0.00 178.44 179.60 2nx3 h ILE 208 N 0.00 1.18 -0.91 1.22 2.04 -1.07 -1.14 117.51 118.82 2nx3 h ILE 208 Ca -0.00 -0.48 0.00 0.00 1.00 0.00 0.00 64.86 65.37 2nx3 h ILE 208 Cb 0.83 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.54 2nx3 h ILE 208 CO 0.06 0.19 0.57 0.03 0.00 0.00 0.00 178.15 179.00 2nx3 h ARG 209 N 0.58 1.23 -0.42 2.37 3.08 -1.10 -1.90 114.38 118.22 2nx3 h ARG 209 Ca 0.15 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 60.11 2nx3 h ARG 209 Cb 0.10 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 2nx3 h ARG 209 CO -0.02 0.84 0.25 0.00 -1.07 0.00 0.00 179.97 179.97 2nx3 h ALA 210 N 1.38 0.53 0.12 0.04 0.00 -0.87 -0.65 119.26 119.82 2nx3 h ALA 210 Ca 0.33 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.19 2nx3 h ALA 210 Cb -0.09 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2nx3 h ALA 210 CO -0.07 0.02 -0.14 0.00 0.00 0.00 0.00 179.25 179.07 2nx3 h ALA 211 N 1.11 -0.26 -0.43 0.00 0.00 -0.55 0.16 119.26 119.31 2nx3 h ALA 211 Ca 0.15 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 2nx3 h ALA 211 Cb 0.00 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2nx3 h ALA 211 CO -0.03 -0.67 -0.11 -0.39 0.00 0.00 0.00 179.25 178.05 2nx3 h VAL 212 N -0.29 1.26 -0.39 0.00 -1.51 -1.32 0.45 116.25 114.45 2nx3 h VAL 212 Ca 0.01 -1.17 -0.01 0.00 -1.23 0.00 0.00 66.70 64.29 2nx3 h VAL 212 Cb 0.29 1.05 -0.02 0.00 -2.13 0.00 0.00 31.29 30.48 2nx3 h VAL 212 CO -0.05 0.40 0.20 0.00 -1.23 0.00 0.00 177.57 176.89 2nx3 h ALA 213 N 1.17 0.50 -0.14 5.19 0.00 -0.83 -2.80 119.26 122.36 2nx3 h ALA 213 Ca 0.12 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2nx3 h ALA 213 Cb 0.59 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2nx3 h ALA 213 CO 0.04 0.05 -0.00 0.28 0.00 0.00 0.00 179.25 179.62 2nx3 h VAL 214 N 0.49 1.25 0.00 0.00 2.07 -0.37 -3.47 116.25 116.23 2nx3 h VAL 214 Ca 0.13 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.82 2nx3 h VAL 214 Cb 0.10 1.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.40 2nx3 h VAL 214 CO -0.02 0.24 0.00 0.61 0.02 0.00 0.00 177.57 178.42 2nx3 n GLY 215 N -0.28 3.23 3.59 2.17 0.00 0.16 -4.85 105.19 109.21 2nx3 n GLY 215 Ca -0.06 -0.95 -0.09 0.00 0.00 0.00 0.00 46.02 44.92 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 -0.36 1.00 -3.60 0.00 8.00 0.13 -4.98 116.55 116.74 2nx3 n ASP 217 Ca -0.06 -0.80 0.01 0.00 0.71 0.00 0.00 54.79 54.65 2nx3 n ASP 217 Cb 0.62 0.43 -0.01 0.00 -0.02 0.00 0.00 41.12 42.14 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 -2.78 -0.40 -0.02 0.44 0.00 -1.06 -2.35 107.32 101.14 2nx3 s GLY 218 Ca 0.15 1.08 0.05 0.00 0.00 0.00 0.00 44.72 45.99 2nx3 s GLY 218 CO 0.67 0.26 -0.16 0.14 0.00 0.00 0.00 173.10 174.02 2nx3 s VAL 219 N -2.22 1.26 -0.16 1.40 1.01 -0.42 -0.64 120.40 120.63 2nx3 s VAL 219 Ca 0.14 -0.66 -0.04 0.00 0.00 0.00 0.00 61.98 61.41 2nx3 s VAL 219 Cb 0.04 -1.06 -0.03 0.00 0.00 0.00 0.00 36.38 35.34 2nx3 s VAL 219 CO -0.05 0.36 -0.03 0.12 0.00 0.00 0.00 175.10 175.50 2nx3 s PHE 220 N -0.24 3.04 -0.24 5.22 5.36 -0.05 -0.98 117.98 130.09 2nx3 s PHE 220 Ca 0.03 -0.30 -0.09 0.00 -0.96 0.00 0.00 56.93 55.62 2nx3 s PHE 220 Cb -0.07 -1.98 0.10 0.00 -0.34 0.00 0.00 43.02 40.73 2nx3 s PHE 220 CO 0.00 -0.04 0.52 0.00 -1.46 0.00 0.00 175.22 174.24 2nx3 s MET 221 N 0.42 0.46 0.34 10.12 0.23 0.10 -0.92 119.30 130.05 2nx3 s MET 221 Ca -0.03 1.16 -0.21 0.00 -1.03 0.00 0.00 55.69 55.58 2nx3 s MET 221 Cb -0.14 0.43 -0.10 0.00 -1.53 0.00 0.00 34.83 33.49 2nx3 s MET 221 CO 0.03 -0.21 0.86 -1.21 -2.03 0.00 0.00 175.02 172.46 2nx3 s GLU 222 N 2.43 4.27 0.08 3.16 2.02 -1.26 -3.62 118.70 125.79 2nx3 s GLU 222 Ca -0.05 1.03 -0.01 0.00 0.02 0.00 0.00 54.97 55.96 2nx3 s GLU 222 Cb -0.11 -2.52 -0.04 0.00 0.10 0.00 0.00 34.13 31.57 2nx3 s GLU 222 CO -0.16 0.16 0.01 -0.08 0.02 0.00 0.00 175.26 175.22 2nx3 s THR 223 N -1.88 0.18 -0.21 3.63 -1.32 -0.36 -1.48 115.64 114.20 2nx3 s THR 223 Ca 0.54 -1.85 -0.27 0.00 -1.21 0.00 0.00 61.69 58.89 2nx3 s THR 223 Cb -0.13 -1.74 0.10 0.00 -1.51 0.00 0.00 72.50 69.22 2nx3 s THR 223 CO 0.18 -0.77 0.87 -2.28 -2.21 0.00 0.00 174.62 170.41 2nx3 s HIS 224 N -3.97 -0.58 0.21 9.09 5.04 -0.74 -3.35 115.29 120.99 2nx3 s HIS 224 Ca 0.14 1.27 -0.10 0.00 -1.54 0.00 0.00 55.06 54.83 2nx3 s HIS 224 Cb 0.08 0.36 0.28 0.00 0.04 0.00 0.00 32.58 33.34 2nx3 s HIS 224 CO -0.05 -0.36 1.69 -1.35 -2.34 0.00 0.00 174.74 172.33 2nx3 h PRO 225 N 3.88 0.19 -2.77 2.88 0.11 -1.96 -2.87 132.00 131.46 2nx3 h PRO 225 Ca -0.26 -0.01 -0.60 0.00 0.11 0.00 0.00 66.00 65.23 2nx3 h PRO 225 Cb 1.16 -0.04 -0.40 0.00 0.11 0.00 0.00 31.00 31.83 2nx3 h PRO 225 CO 0.18 0.13 -0.79 -1.21 -0.21 0.00 0.00 178.00 176.10 2nx3 s GLU 226 N -6.12 1.27 0.34 1.05 2.02 -1.26 -4.55 118.70 111.44 2nx3 s GLU 226 Ca -0.13 -2.16 0.13 0.00 0.02 0.00 0.00 54.97 52.83 2nx3 s GLU 226 Cb 0.18 -2.11 1.04 0.00 0.10 0.00 0.00 34.13 33.33 2nx3 s GLU 226 CO 0.74 -1.25 1.67 -1.00 0.02 0.00 0.00 175.26 175.44 2nx3 h PRO 227 N 6.25 0.35 -0.24 0.39 0.13 -1.85 0.15 132.00 137.19 2nx3 h PRO 227 Ca 0.10 -0.02 0.07 0.00 -0.87 0.00 0.00 66.00 65.28 2nx3 h PRO 227 Cb 0.90 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.94 2nx3 h PRO 227 CO 0.46 0.23 0.19 1.05 -0.23 0.00 0.00 178.00 179.71 2nx3 h GLU 228 N 0.37 0.00 -0.46 0.86 4.11 -1.92 -2.05 114.58 115.48 2nx3 h GLU 228 Ca 0.71 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.14 2nx3 h GLU 228 Cb 1.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.82 2nx3 h GLU 228 CO -0.59 0.00 0.00 1.63 0.07 0.00 0.00 179.01 180.12 2nx3 n LYS 229 N -4.24 2.46 -2.06 1.06 5.02 0.53 -4.97 118.16 115.97 2nx3 n LYS 229 Ca 0.03 -2.23 -0.41 0.00 -2.02 0.00 0.00 58.31 53.68 2nx3 n LYS 229 Cb 0.34 -1.51 -0.02 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 -1.39 3.55 -2.00 7.82 0.00 -0.77 -4.89 121.76 124.08 2nx3 s ALA 230 Ca 0.40 1.30 0.13 0.00 0.00 0.00 0.00 51.96 53.80 2nx3 s ALA 230 Cb 0.23 -3.52 0.80 0.00 0.00 0.00 0.00 23.12 20.62 2nx3 s ALA 230 CO 0.31 -0.71 1.42 1.28 0.00 0.00 0.00 175.76 178.06 2nx3 n LEU 231 N 1.43 0.00 -3.64 0.00 4.77 -1.26 -4.37 117.00 113.93 2nx3 n LEU 231 Ca 0.03 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.93 2nx3 n LEU 231 Cb 0.41 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.43 2nx3 n LEU 231 CO 0.60 0.00 0.50 -0.55 -1.33 0.00 0.00 177.39 176.61 2nx3 s SER 232 N -1.54 -0.73 -1.47 -1.43 0.15 -1.26 -4.35 113.70 103.06 2nx3 s SER 232 Ca 0.20 1.26 -0.11 0.00 0.70 0.00 0.00 55.95 58.00 2nx3 s SER 232 Cb 0.09 1.29 0.06 0.00 -1.71 0.00 0.00 66.02 65.75 2nx3 s SER 232 CO 0.15 -0.21 0.89 0.47 1.20 0.00 0.00 173.24 175.75 2nx3 n ASP 233 N 3.43 -5.20 -0.31 5.45 8.00 -1.26 -4.85 116.55 121.81 2nx3 n ASP 233 Ca -0.17 -0.60 0.14 0.00 0.71 0.00 0.00 54.79 54.87 2nx3 n ASP 233 Cb 0.57 -4.16 0.37 0.00 -0.02 0.00 0.00 41.12 37.88 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 0.99 1.83 0.00 2.24 0.00 -1.81 -1.98 119.26 120.53 2nx3 h ALA 234 Ca -0.55 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2nx3 h ALA 234 Cb 1.36 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2nx3 h ALA 234 CO 0.62 -0.14 0.00 -0.35 0.00 0.00 0.00 179.25 179.38 2nx3 n PRO 235 N -4.64 0.83 0.00 0.00 -0.04 -1.26 -3.63 135.00 126.26 2nx3 n PRO 235 Ca 0.21 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.67 2nx3 n PRO 235 Cb 0.56 -1.28 0.00 0.00 -0.04 0.00 0.00 33.50 32.74 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 0.29 0.00 -2.42 0.52 -2.24 -0.75 -4.03 114.28 105.66 2nx3 n THR 236 Ca 0.00 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.37 2nx3 n THR 236 Cb 0.29 0.88 -0.04 0.00 -2.10 0.00 0.00 70.33 69.37 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 0.00 3.42 0.07 6.98 0.00 -1.21 -4.84 121.76 126.18 2nx3 s ALA 237 Ca 0.00 0.91 -0.25 0.00 0.00 0.00 0.00 51.96 52.62 2nx3 s ALA 237 Cb 0.00 -3.40 -0.06 0.00 0.00 0.00 0.00 23.12 19.66 2nx3 s ALA 237 CO 0.00 -0.32 0.77 -1.17 0.00 0.00 0.00 175.76 175.03 2nx3 s LEU 238 N -0.28 4.48 0.21 0.00 2.96 -0.55 -4.74 118.68 120.77 2nx3 s LEU 238 Ca 0.52 1.49 -0.31 0.00 -0.22 0.00 0.00 54.13 55.60 2nx3 s LEU 238 Cb -0.32 -3.24 -0.11 0.00 0.50 0.00 0.00 46.19 43.02 2nx3 s LEU 238 CO 0.36 0.06 1.66 -2.84 -1.32 0.00 0.00 176.35 174.27 2nx3 s PRO 239 N -0.33 4.15 0.46 0.98 0.02 -1.26 -1.79 135.00 137.23 2nx3 s PRO 239 Ca 0.38 2.54 0.26 0.00 0.02 0.00 0.00 61.00 64.20 2nx3 s PRO 239 Cb -0.21 -3.08 1.30 0.00 0.02 0.00 0.00 34.50 32.52 2nx3 s PRO 239 CO 0.24 -0.69 1.80 1.25 -0.33 0.00 0.00 177.00 179.27 2nx3 h LEU 240 N 6.40 0.24 -0.49 -5.54 5.85 -1.74 0.21 115.31 120.24 2nx3 h LEU 240 Ca -0.44 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.33 2nx3 h LEU 240 Cb 1.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.24 2nx3 h LEU 240 CO 0.91 0.05 0.00 0.77 -0.34 0.00 0.00 178.44 179.83 2nx3 h SER 241 N 0.21 0.00 0.98 1.25 4.64 -1.89 -3.15 113.55 115.59 2nx3 h SER 241 Ca 0.55 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.87 2nx3 h SER 241 Cb 1.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.84 2nx3 h SER 241 CO -0.16 0.00 -0.32 0.00 -0.87 0.00 0.00 176.83 175.48 2nx3 n GLN 242 N -2.37 0.17 -0.05 4.77 6.02 0.74 -4.35 117.38 122.32 2nx3 n GLN 242 Ca 0.03 0.09 -0.09 0.00 -0.01 0.00 0.00 57.00 57.02 2nx3 n GLN 242 Cb 0.32 -1.65 -0.02 0.00 1.02 0.00 0.00 30.24 29.91 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 0.01 -0.02 1.08 4.07 -1.63 -2.65 115.31 116.17 2nx3 h LEU 243 Ca 0.00 0.03 0.03 0.00 0.08 0.00 0.00 57.88 58.03 2nx3 h LEU 243 Cb 0.65 0.05 -0.05 0.00 1.08 0.00 0.00 40.66 42.39 2nx3 h LEU 243 CO 0.00 0.03 -0.26 -0.08 -1.08 0.00 0.00 178.44 177.06 2nx3 h GLU 244 N 0.12 -0.38 -0.91 1.13 4.22 -1.83 0.34 114.58 117.28 2nx3 h GLU 244 Ca 0.10 0.03 0.04 0.00 0.08 0.00 0.00 59.36 59.61 2nx3 h GLU 244 Cb 0.09 0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.37 2nx3 h GLU 244 CO -0.13 -0.25 0.58 0.78 -2.18 0.00 0.00 179.01 177.81 2nx3 h GLY 245 N -0.39 1.34 1.01 1.92 0.00 -1.82 -0.04 103.07 105.09 2nx3 h GLY 245 Ca 0.07 -0.44 -0.11 0.00 0.00 0.00 0.00 47.33 46.85 2nx3 h GLY 245 CO -0.24 0.35 -0.20 -2.22 0.00 0.00 0.00 176.54 174.23 2nx3 h ILE 246 N 1.11 1.28 -0.23 2.60 2.04 -1.04 -2.31 117.51 120.96 2nx3 h ILE 246 Ca 0.37 -1.34 0.01 0.00 1.00 0.00 0.00 64.86 64.90 2nx3 h ILE 246 Cb 0.06 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 2nx3 h ILE 246 CO -0.14 0.44 0.15 0.40 0.00 0.00 0.00 178.15 179.00 2nx3 h ILE 247 N 0.60 1.04 -0.65 -0.67 1.08 0.24 -2.08 117.51 117.07 2nx3 h ILE 247 Ca 0.08 -0.10 0.10 0.00 -0.39 0.00 0.00 64.86 64.55 2nx3 h ILE 247 Cb 0.76 0.72 -0.08 0.00 -3.07 0.00 0.00 36.82 35.15 2nx3 h ILE 247 CO 0.06 0.05 0.26 -0.08 -0.69 0.00 0.00 178.15 177.76 2nx3 h GLU 248 N 0.30 0.44 -0.56 2.37 4.57 -0.93 -1.73 114.58 119.03 2nx3 h GLU 248 Ca 0.09 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.22 2nx3 h GLU 248 Cb -0.02 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.44 2nx3 h GLU 248 CO -0.03 0.29 0.27 0.00 -1.18 0.00 0.00 179.01 178.36 2nx3 h ALA 249 N 1.44 0.72 -0.63 2.92 0.00 -0.92 -1.71 119.26 121.09 2nx3 h ALA 249 Ca 0.33 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 2nx3 h ALA 249 Cb 0.42 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2nx3 h ALA 249 CO -0.32 0.29 0.28 -0.84 0.00 0.00 0.00 179.25 178.66 2nx3 h ILE 250 N 0.75 1.23 -0.93 0.00 3.07 -0.74 -0.30 117.51 120.60 2nx3 h ILE 250 Ca 0.19 -0.68 0.01 0.00 1.55 0.00 0.00 64.86 65.93 2nx3 h ILE 250 Cb 0.12 0.50 -0.05 0.00 -0.27 0.00 0.00 36.82 37.13 2nx3 h ILE 250 CO -0.02 0.27 0.60 -0.07 -1.05 0.00 0.00 178.15 177.88 2nx3 h LEU 251 N 0.87 1.07 -0.61 0.16 3.38 -1.08 0.10 115.31 119.21 2nx3 h LEU 251 Ca 0.21 -0.04 -0.15 0.00 0.09 0.00 0.00 57.88 58.00 2nx3 h LEU 251 Cb 0.17 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2nx3 h LEU 251 CO -0.02 0.79 -0.67 -0.33 0.09 0.00 0.00 178.44 178.30 2nx3 h GLU 252 N 1.26 0.13 -0.04 1.13 5.08 -0.94 -1.59 114.58 119.61 2nx3 h GLU 252 Ca 0.34 -0.10 -0.22 0.00 -1.00 0.00 0.00 59.36 58.38 2nx3 h GLU 252 Cb -0.13 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.15 2nx3 h GLU 252 CO -0.07 0.75 -0.87 0.82 -1.00 0.00 0.00 179.01 178.64 2nx3 h ILE 253 N 0.09 1.37 -0.10 3.13 1.08 -0.65 -3.09 117.51 119.34 2nx3 h ILE 253 Ca -0.01 -2.27 -0.01 0.00 -0.39 0.00 0.00 64.86 62.17 2nx3 h ILE 253 Cb 1.19 2.26 -0.00 0.00 -3.07 0.00 0.00 36.82 37.20 2nx3 h ILE 253 CO 0.10 0.69 0.02 -0.09 -0.69 0.00 0.00 178.15 178.17 2nx3 h ARG 254 N 0.30 0.17 -0.86 2.37 2.43 -0.74 0.23 114.38 118.29 2nx3 h ARG 254 Ca -0.07 -0.05 0.17 0.00 -0.81 0.00 0.00 59.98 59.22 2nx3 h ARG 254 Cb 1.49 -0.02 -0.10 0.00 -0.42 0.00 0.00 29.97 30.91 2nx3 h ARG 254 CO 0.16 0.38 0.42 1.49 -1.51 0.00 0.00 179.97 180.90 2nx3 h GLU 255 N -0.06 0.54 0.22 0.20 4.81 -1.32 0.44 114.58 119.42 2nx3 h GLU 255 Ca 0.03 -0.03 -0.31 0.00 -0.13 0.00 0.00 59.36 58.92 2nx3 h GLU 255 Cb 0.29 -0.12 0.03 0.00 0.63 0.00 0.00 28.75 29.58 2nx3 h GLU 255 CO 0.00 0.36 -1.39 0.28 -0.73 0.00 0.00 179.01 177.53 2nx3 h VAL 256 N 0.55 1.26 0.00 0.32 2.07 -1.44 -3.37 116.25 115.64 2nx3 h VAL 256 Ca 0.49 -2.62 -0.16 0.00 0.82 0.00 0.00 66.70 65.22 2nx3 h VAL 256 Cb 0.77 3.02 -0.02 0.00 -1.52 0.00 0.00 31.29 33.54 2nx3 h VAL 256 CO -0.41 0.79 -0.77 0.00 0.02 0.00 0.00 177.57 177.20 2nx3 h ALA 257 N 0.12 0.52 -1.05 1.67 0.00 -0.60 -3.36 119.26 116.55 2nx3 h ALA 257 Ca -0.25 -0.70 0.28 0.00 0.00 0.00 0.00 54.91 54.23 2nx3 h ALA 257 Cb 2.04 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 19.60 2nx3 h ALA 257 CO 0.23 0.96 0.67 0.66 0.00 0.00 0.00 179.25 181.77 2nx3 h SER 258 N 0.00 0.48 0.41 0.00 4.64 -0.28 0.16 113.55 118.95 2nx3 h SER 258 Ca -0.01 0.10 -0.00 0.00 -0.47 0.00 0.00 61.79 61.41 2nx3 h SER 258 Cb 1.56 0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 63.68 2nx3 h SER 258 CO 0.10 0.06 -0.00 0.07 -0.87 0.00 0.00 176.83 176.19 2nx3 h LYS 259 N 0.40 0.00 -0.00 4.77 2.10 -1.81 -2.47 116.57 119.56 2nx3 h LYS 259 Ca 0.63 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.28 2nx3 h LYS 259 Cb 1.54 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.87 2nx3 h LYS 259 CO -0.35 0.00 -0.68 0.66 -2.00 0.00 0.00 179.45 177.08 2nx3 n TYR 260 N -3.09 0.00 -1.68 0.07 4.01 0.54 -4.95 117.16 112.05 2nx3 n TYR 260 Ca -0.02 0.00 -0.46 0.00 -0.16 0.00 0.00 57.90 57.26 2nx3 n TYR 260 Cb 0.16 -0.06 -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 -1.01 2.38 -1.68 -0.72 4.01 -0.93 -4.87 117.16 114.34 2nx3 n TYR 261 Ca 0.07 0.04 -0.42 0.00 -0.16 0.00 0.00 57.90 57.43 2nx3 n TYR 261 Cb 0.37 -2.64 -0.03 0.00 -0.31 0.00 0.00 39.34 36.73 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 2.68 4.14 0.30 -0.72 8.01 -1.26 -4.90 118.70 126.94 2nx3 s GLU 262 Ca 0.85 2.62 -0.30 0.00 0.01 0.00 0.00 54.97 58.16 2nx3 s GLU 262 Cb -0.63 -4.00 -0.12 0.00 -4.31 0.00 0.00 34.13 25.07 2nx3 s GLU 262 CO 0.43 -0.93 1.44 0.25 0.01 0.00 0.00 175.26 176.46 2nx3 n THR 263 N 5.32 1.39 0.00 3.63 -2.24 -1.26 -5.15 114.28 115.97 2nx3 n THR 263 Ca 0.19 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2nx3 n THR 263 Cb 0.40 -1.70 0.00 0.00 -2.10 0.00 0.00 70.33 66.93 2nx3 n THR 263 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50