#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 3.07 -0.06 5.58 5.36 -1.25 -4.67 117.98 126.01 2nx3 s PHE 4 Ca 0.00 0.87 -0.16 0.00 -0.96 0.00 0.00 56.93 56.68 2nx3 s PHE 4 Cb 0.00 -3.84 -0.05 0.00 -0.34 0.00 0.00 43.02 38.79 2nx3 s PHE 4 CO 0.00 -2.90 0.42 -0.51 -1.46 0.00 0.00 175.22 170.77 2nx3 s LEU 5 N 0.39 4.37 -0.36 6.12 2.01 -0.80 -0.18 118.68 130.24 2nx3 s LEU 5 Ca 0.64 0.86 0.01 0.00 0.01 0.00 0.00 54.13 55.64 2nx3 s LEU 5 Cb -0.42 -2.60 0.11 0.00 0.01 0.00 0.00 46.19 43.29 2nx3 s LEU 5 CO 0.37 0.18 0.14 -0.69 1.01 0.00 0.00 176.35 177.35 2nx3 s VAL 6 N -0.25 1.26 -0.44 -1.59 1.01 -0.88 -0.89 120.40 118.62 2nx3 s VAL 6 Ca 0.24 -1.92 -0.21 0.00 0.00 0.00 0.00 61.98 60.09 2nx3 s VAL 6 Cb -0.16 -1.93 0.02 0.00 0.00 0.00 0.00 36.38 34.32 2nx3 s VAL 6 CO 0.11 -0.74 0.66 -0.63 0.00 0.00 0.00 175.10 174.50 2nx3 s ILE 7 N 1.10 4.81 0.33 2.22 1.01 -0.27 -2.80 121.20 127.59 2nx3 s ILE 7 Ca 0.12 0.15 0.03 0.00 0.00 0.00 0.00 60.65 60.96 2nx3 s ILE 7 Cb -0.20 -4.22 -0.06 0.00 0.01 0.00 0.00 42.46 38.00 2nx3 s ILE 7 CO -0.14 -0.61 0.07 0.00 0.00 0.00 0.00 174.94 174.26 2nx3 s ALA 8 N 2.87 2.37 0.00 9.38 0.00 -1.02 -0.74 121.76 134.61 2nx3 s ALA 8 Ca 0.23 -1.91 0.00 0.00 0.00 0.00 0.00 51.96 50.28 2nx3 s ALA 8 Cb -0.14 0.72 0.00 0.00 0.00 0.00 0.00 23.12 23.70 2nx3 s ALA 8 CO 0.19 -0.33 0.00 0.41 0.00 0.00 0.00 175.76 176.03 2nx3 n GLY 9 N -0.69 3.46 3.77 0.00 0.00 -1.23 -0.92 105.19 109.57 2nx3 n GLY 9 Ca -0.03 -1.64 -0.37 0.00 0.00 0.00 0.00 46.02 43.98 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 -2.24 3.62 0.15 1.61 0.04 -1.14 -0.74 135.00 136.31 2nx3 s PRO 10 Ca 0.00 1.88 -0.17 0.00 0.04 0.00 0.00 61.00 62.74 2nx3 s PRO 10 Cb 0.00 -2.37 0.05 0.00 0.04 0.00 0.00 34.50 32.22 2nx3 s PRO 10 CO 0.00 -0.70 1.71 -0.97 0.04 0.00 0.00 177.00 177.09 2nx3 h ASN 11 N 1.92 -0.11 -3.72 6.66 -1.24 -1.86 -3.37 115.58 113.86 2nx3 h ASN 11 Ca -0.50 0.07 -0.48 0.00 0.71 0.00 0.00 56.30 56.10 2nx3 h ASN 11 Cb 1.26 0.12 -0.18 0.00 0.73 0.00 0.00 38.32 40.25 2nx3 h ASN 11 CO 0.60 -0.02 -0.77 0.00 -1.29 0.00 0.00 177.43 175.94 2nx3 s ALA 12 N -6.18 1.83 -1.28 1.57 0.00 -1.26 -2.07 121.76 114.37 2nx3 s ALA 12 Ca -0.13 -1.43 -0.18 0.00 0.00 0.00 0.00 51.96 50.21 2nx3 s ALA 12 Cb 0.12 -0.14 0.02 0.00 0.00 0.00 0.00 23.12 23.12 2nx3 s ALA 12 CO 0.70 0.18 1.87 -0.89 0.00 0.00 0.00 175.76 177.62 2nx3 n ILE 13 N 0.35 3.37 0.07 0.00 5.41 -0.42 -4.73 119.36 123.41 2nx3 n ILE 13 Ca -0.14 -3.39 -0.13 0.00 1.00 0.00 0.00 62.75 60.09 2nx3 n ILE 13 Cb 0.57 -2.36 -0.08 0.00 -0.71 0.00 0.00 39.64 37.07 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 7.73 -0.12 -2.75 0.38 5.08 -1.96 -3.42 114.58 119.52 2nx3 h GLU 14 Ca 0.42 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.81 2nx3 h GLU 14 Cb 0.83 0.03 -0.13 0.00 0.50 0.00 0.00 28.75 29.98 2nx3 h GLU 14 CO 1.51 0.01 0.29 -1.54 -1.00 0.00 0.00 179.01 178.29 2nx3 s SER 15 N -5.18 -0.51 0.27 1.42 1.04 -1.26 -4.99 113.70 104.48 2nx3 s SER 15 Ca -0.14 0.03 -0.03 0.00 0.48 0.00 0.00 55.95 56.29 2nx3 s SER 15 Cb 0.05 0.54 0.39 0.00 0.10 0.00 0.00 66.02 67.10 2nx3 s SER 15 CO 0.65 -0.85 1.90 -0.33 0.98 0.00 0.00 173.24 175.59 2nx3 h GLU 16 N 2.04 1.17 -0.39 4.02 5.08 -1.97 -0.52 114.58 124.02 2nx3 h GLU 16 Ca -0.30 -0.07 0.03 0.00 -1.00 0.00 0.00 59.36 58.02 2nx3 h GLU 16 Cb 1.28 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 30.25 2nx3 h GLU 16 CO 0.36 0.77 0.26 1.49 -1.00 0.00 0.00 179.01 180.89 2nx3 h GLU 17 N 1.20 0.39 0.07 2.33 4.81 -1.99 -1.66 114.58 119.72 2nx3 h GLU 17 Ca 0.41 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.61 2nx3 h GLU 17 Cb 0.08 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.37 2nx3 h GLU 17 CO -0.14 0.26 -0.03 1.25 -0.73 0.00 0.00 179.01 179.61 2nx3 h LEU 18 N 0.40 -0.08 -2.16 1.64 5.85 -1.51 -2.46 115.31 117.00 2nx3 h LEU 18 Ca 0.16 -0.51 0.02 0.00 0.84 0.00 0.00 57.88 58.39 2nx3 h LEU 18 Cb 0.14 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.19 2nx3 h LEU 18 CO -0.04 0.51 0.05 -0.07 -0.34 0.00 0.00 178.44 178.55 2nx3 h LEU 19 N -0.71 0.00 0.12 2.25 4.07 -1.12 -1.59 115.31 118.32 2nx3 h LEU 19 Ca -0.01 0.00 -0.19 0.00 0.08 0.00 0.00 57.88 57.76 2nx3 h LEU 19 Cb 0.58 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.34 2nx3 h LEU 19 CO 0.02 0.00 -0.82 0.25 -1.08 0.00 0.00 178.44 176.81 2nx3 h LEU 20 N 0.00 0.52 -0.21 1.67 6.46 -1.34 0.56 115.31 122.96 2nx3 h LEU 20 Ca 0.03 -0.91 0.04 0.00 -0.12 0.00 0.00 57.88 56.92 2nx3 h LEU 20 Cb 0.13 -0.17 -0.04 0.00 -0.73 0.00 0.00 40.66 39.85 2nx3 h LEU 20 CO -0.00 1.38 -0.05 0.50 -0.62 0.00 0.00 178.44 179.65 2nx3 h LYS 21 N -0.26 0.01 -0.05 1.25 1.63 -0.97 0.20 116.57 118.37 2nx3 h LYS 21 Ca -0.14 -0.00 -0.17 0.00 -0.85 0.00 0.00 60.65 59.49 2nx3 h LYS 21 Cb 1.61 -0.00 0.01 0.00 -0.60 0.00 0.00 32.23 33.25 2nx3 h LYS 21 CO 0.16 0.01 -0.63 0.28 -3.45 0.00 0.00 179.45 175.81 2nx3 h VAL 22 N 0.01 1.37 -0.17 2.00 2.07 -1.40 -3.18 116.25 116.96 2nx3 h VAL 22 Ca 0.10 -1.99 0.05 0.00 0.82 0.00 0.00 66.70 65.68 2nx3 h VAL 22 Cb 0.15 2.36 -0.01 0.00 -1.52 0.00 0.00 31.29 32.28 2nx3 h VAL 22 CO -0.21 0.60 0.17 1.23 0.02 0.00 0.00 177.57 179.37 2nx3 h GLY 23 N 0.10 0.00 1.96 2.17 0.00 0.46 0.03 103.07 107.79 2nx3 h GLY 23 Ca -0.06 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.09 2nx3 h GLY 23 CO 0.13 0.00 -0.85 -2.09 0.00 0.00 0.00 176.54 173.73 2nx3 h GLU 24 N 0.00 0.03 0.11 4.80 4.81 -0.60 -3.08 114.58 120.65 2nx3 h GLU 24 Ca 0.08 -0.04 -0.25 0.00 -0.13 0.00 0.00 59.36 59.02 2nx3 h GLU 24 Cb 0.41 0.01 0.03 0.00 0.63 0.00 0.00 28.75 29.83 2nx3 h GLU 24 CO -0.00 0.86 -1.03 1.49 -0.73 0.00 0.00 179.01 179.60 2nx3 h GLU 25 N 0.02 0.50 -0.85 1.92 4.57 -1.04 -2.65 114.58 117.06 2nx3 h GLU 25 Ca -0.02 -0.69 0.09 0.00 -1.18 0.00 0.00 59.36 57.56 2nx3 h GLU 25 Cb 1.49 0.23 -0.06 0.00 -0.16 0.00 0.00 28.75 30.26 2nx3 h GLU 25 CO 0.11 1.30 0.55 0.82 -1.18 0.00 0.00 179.01 180.61 2nx3 h ILE 26 N 0.04 0.98 -0.09 2.32 1.08 -1.41 -1.26 117.51 119.18 2nx3 h ILE 26 Ca -0.16 -0.29 -0.02 0.00 -0.39 0.00 0.00 64.86 64.00 2nx3 h ILE 26 Cb 1.75 0.06 -0.00 0.00 -3.07 0.00 0.00 36.82 35.56 2nx3 h ILE 26 CO 0.20 0.16 -0.03 0.50 -0.69 0.00 0.00 178.15 178.28 2nx3 h LYS 27 N 0.85 0.18 -0.17 2.37 1.63 -1.54 0.30 116.57 120.19 2nx3 h LYS 27 Ca 0.38 -0.07 0.04 0.00 -0.85 0.00 0.00 60.65 60.15 2nx3 h LYS 27 Cb 0.37 -0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 31.95 2nx3 h LYS 27 CO -0.15 0.52 -0.09 -0.09 -3.45 0.00 0.00 179.45 176.19 2nx3 h ARG 28 N -0.17 -0.07 -0.85 1.90 2.43 -1.04 0.00 114.38 116.59 2nx3 h ARG 28 Ca 0.02 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.17 2nx3 h ARG 28 Cb 0.46 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.98 2nx3 h ARG 28 CO 0.01 -0.05 0.43 -0.07 -1.51 0.00 0.00 179.97 178.78 2nx3 h LEU 29 N -0.08 1.09 -1.99 3.80 3.38 -1.25 -0.72 115.31 119.54 2nx3 h LEU 29 Ca 0.09 -0.12 0.13 0.00 0.09 0.00 0.00 57.88 58.08 2nx3 h LEU 29 Cb 0.22 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2nx3 h LEU 29 CO -0.22 0.90 0.34 -1.28 0.09 0.00 0.00 178.44 178.27 2nx3 h SER 30 N 1.20 0.01 0.42 -0.43 0.87 0.99 0.13 113.55 116.74 2nx3 h SER 30 Ca 0.30 0.00 -0.31 0.00 -1.23 0.00 0.00 61.79 60.55 2nx3 h SER 30 Cb 0.08 -0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.01 2nx3 h SER 30 CO -0.04 0.00 -1.67 -0.33 -0.53 0.00 0.00 176.83 174.27 2nx3 h GLU 31 N 0.01 0.16 -0.14 2.24 4.39 0.33 -3.37 114.58 118.21 2nx3 h GLU 31 Ca 0.22 -0.28 -0.17 0.00 0.34 0.00 0.00 59.36 59.48 2nx3 h GLU 31 Cb 0.88 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.63 2nx3 h GLU 31 CO -0.00 0.94 -0.61 -0.22 -1.16 0.00 0.00 179.01 177.95 2nx3 h LYS 32 N 0.04 0.47 -3.08 2.33 3.64 0.04 -3.37 116.57 116.64 2nx3 h LYS 32 Ca -0.29 -0.32 -0.63 0.00 -1.27 0.00 0.00 60.65 58.14 2nx3 h LYS 32 Cb 2.01 0.05 -0.41 0.00 -0.41 0.00 0.00 32.23 33.47 2nx3 h LYS 32 CO 0.12 0.94 -0.48 1.19 -2.27 0.00 0.00 179.45 178.94 2nx3 n PHE 33 N -3.91 3.45 0.43 1.91 3.72 0.33 -4.92 117.46 118.47 2nx3 n PHE 33 Ca -0.03 -4.28 0.11 0.00 -0.05 0.00 0.00 57.45 53.20 2nx3 n PHE 33 Cb 0.64 -0.72 0.45 0.00 -0.94 0.00 0.00 39.48 38.91 2nx3 n PHE 33 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2nx3 n LYS 34 N 1.95 0.15 0.00 -1.08 5.02 -1.26 -2.31 118.16 120.64 2nx3 n LYS 34 Ca 0.21 0.38 0.16 0.00 -2.02 0.00 0.00 58.31 57.03 2nx3 n LYS 34 Cb 0.36 -1.79 0.90 0.00 -0.02 0.00 0.00 35.03 34.48 2nx3 n LYS 34 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 2nx3 n GLU 35 N -2.08 0.86 -4.49 1.97 0.00 -1.26 -4.79 120.64 110.84 2nx3 n GLU 35 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 57.16 56.88 2nx3 n GLU 35 Cb 0.22 -1.50 -0.11 0.00 0.00 0.00 0.00 31.44 30.05 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 -2.14 3.22 -0.46 3.84 1.01 -0.98 -3.90 120.40 120.99 2nx3 s VAL 36 Ca 0.43 -1.06 -0.12 0.00 0.00 0.00 0.00 61.98 61.22 2nx3 s VAL 36 Cb 0.22 -2.41 0.08 0.00 0.00 0.00 0.00 36.38 34.27 2nx3 s VAL 36 CO 0.39 0.30 0.34 -0.70 0.00 0.00 0.00 175.10 175.44 2nx3 s GLU 37 N -1.61 2.79 0.23 2.72 2.12 0.75 -4.97 118.70 120.73 2nx3 s GLU 37 Ca 0.17 -1.46 -0.20 0.00 0.36 0.00 0.00 54.97 53.84 2nx3 s GLU 37 Cb -0.11 -3.98 -0.08 0.00 0.26 0.00 0.00 34.13 30.21 2nx3 s GLU 37 CO 0.08 -1.03 0.74 -0.06 -0.54 0.00 0.00 175.26 174.45 2nx3 s PHE 38 N 1.53 3.65 -0.01 5.30 0.08 -1.26 -2.08 117.98 125.19 2nx3 s PHE 38 Ca 0.04 1.42 0.00 0.00 0.12 0.00 0.00 56.93 58.51 2nx3 s PHE 38 Cb -0.24 -2.64 0.01 0.00 -0.57 0.00 0.00 43.02 39.58 2nx3 s PHE 38 CO 0.04 0.32 0.01 0.08 -0.10 0.00 0.00 175.22 175.57 2nx3 s VAL 39 N -1.53 0.04 -0.11 -0.44 1.01 -1.12 -4.23 120.40 114.02 2nx3 s VAL 39 Ca 0.44 0.07 -0.20 0.00 0.00 0.00 0.00 61.98 62.28 2nx3 s VAL 39 Cb -0.17 -0.10 -0.04 0.00 0.00 0.00 0.00 36.38 36.07 2nx3 s VAL 39 CO 0.21 0.06 0.56 0.12 0.00 0.00 0.00 175.10 176.06 2nx3 s PHE 40 N 0.49 3.52 -0.01 5.22 5.36 0.34 -2.44 117.98 130.47 2nx3 s PHE 40 Ca -0.04 1.01 0.06 0.00 -0.96 0.00 0.00 56.93 57.00 2nx3 s PHE 40 Cb -0.06 -2.66 -0.02 0.00 -0.34 0.00 0.00 43.02 39.94 2nx3 s PHE 40 CO -0.01 0.11 -0.21 0.21 -1.46 0.00 0.00 175.22 173.86 2nx3 s LYS 41 N 0.80 1.63 -0.29 10.12 2.36 -0.10 -1.35 119.74 132.91 2nx3 s LYS 41 Ca 0.30 -0.76 -0.23 0.00 -2.55 0.00 0.00 55.97 52.73 2nx3 s LYS 41 Cb -0.16 -1.60 0.17 0.00 -1.05 0.00 0.00 37.83 35.19 2nx3 s LYS 41 CO 0.13 0.44 1.28 0.45 1.55 0.00 0.00 175.35 179.19 2nx3 s SER 42 N -0.57 -0.19 0.05 1.43 0.15 -1.21 -3.60 113.70 109.75 2nx3 s SER 42 Ca 0.08 0.36 -0.16 0.00 0.70 0.00 0.00 55.95 56.92 2nx3 s SER 42 Cb -0.08 0.51 -0.06 0.00 -1.71 0.00 0.00 66.02 64.68 2nx3 s SER 42 CO -0.00 -0.06 0.49 -0.44 1.20 0.00 0.00 173.24 174.42 2nx3 s SER 43 N 0.32 6.91 0.05 5.45 0.01 -0.88 -4.56 113.70 120.99 2nx3 s SER 43 Ca 0.03 1.09 0.25 0.00 1.31 0.00 0.00 55.95 58.63 2nx3 s SER 43 Cb -0.05 -2.30 0.47 0.00 0.21 0.00 0.00 66.02 64.36 2nx3 s SER 43 CO -0.12 0.27 1.40 2.22 0.41 0.00 0.00 173.24 177.41 2nx3 n PHE 44 N 1.61 0.22 -3.63 2.43 1.16 -1.26 -1.31 117.46 116.68 2nx3 n PHE 44 Ca -0.11 0.06 -0.13 0.00 -1.87 0.00 0.00 57.45 55.41 2nx3 n PHE 44 Cb 0.52 -0.43 -0.07 0.00 -1.61 0.00 0.00 39.48 37.89 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 -3.50 -0.76 -0.84 5.98 2.15 -1.25 -3.63 116.67 114.81 2nx3 s ASP 45 Ca 0.09 1.42 -0.11 0.00 0.43 0.00 0.00 52.55 54.38 2nx3 s ASP 45 Cb 0.16 1.42 0.22 0.00 -0.30 0.00 0.00 42.92 44.42 2nx3 s ASP 45 CO 0.70 -0.24 0.77 -0.54 -0.17 0.00 0.00 175.17 175.69 2nx3 s LYS 46 N 0.58 3.53 0.00 4.34 -0.14 0.10 -4.91 119.74 123.24 2nx3 s LYS 46 Ca -0.01 -2.60 0.21 0.00 -1.36 0.00 0.00 55.97 52.21 2nx3 s LYS 46 Cb -0.05 -4.34 0.94 0.00 -1.68 0.00 0.00 37.83 32.71 2nx3 s LYS 46 CO -0.03 -1.27 1.69 0.00 -0.76 0.00 0.00 175.35 174.98 2nx3 n ALA 47 N 3.68 2.00 -2.49 5.17 0.00 -1.26 -3.97 120.51 123.64 2nx3 n ALA 47 Ca 0.15 -0.08 -0.07 0.00 0.00 0.00 0.00 53.44 53.43 2nx3 n ALA 47 Cb 0.44 -1.35 0.04 0.00 0.00 0.00 0.00 19.45 18.59 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 -1.47 2.64 -4.72 0.00 0.23 -1.26 -5.09 115.26 105.59 2nx3 n ASN 48 Ca 0.06 -2.67 -0.33 0.00 -0.53 0.00 0.00 54.58 51.11 2nx3 n ASN 48 Cb 0.24 -0.42 0.11 0.00 -2.08 0.00 0.00 39.78 37.62 2nx3 n ASN 48 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 2nx3 s ARG 49 N -3.44 1.96 0.04 -3.83 1.81 -1.26 -4.94 118.95 109.29 2nx3 s ARG 49 Ca 0.36 1.66 -0.22 0.00 -1.72 0.00 0.00 55.73 55.80 2nx3 s ARG 49 Cb 0.36 -1.82 -0.15 0.00 -0.45 0.00 0.00 34.95 32.89 2nx3 s ARG 49 CO -0.02 -1.95 1.43 0.77 -0.68 0.00 0.00 175.30 174.84 2nx3 h SER 50 N -0.65 0.19 -3.14 0.23 0.02 -1.96 -3.45 113.55 104.78 2nx3 h SER 50 Ca -0.46 -0.35 -0.63 0.00 -0.84 0.00 0.00 61.79 59.50 2nx3 h SER 50 Cb 1.28 -0.05 -0.08 0.00 0.14 0.00 0.00 62.40 63.69 2nx3 h SER 50 CO 0.48 0.50 -0.59 -0.55 -1.14 0.00 0.00 176.83 175.53 2nx3 s SER 51 N -5.75 5.59 0.51 3.07 0.15 -1.19 -4.97 113.70 111.10 2nx3 s SER 51 Ca -0.15 0.00 0.29 0.00 0.70 0.00 0.00 55.95 56.80 2nx3 s SER 51 Cb 0.05 -1.52 1.26 0.00 -1.71 0.00 0.00 66.02 64.10 2nx3 s SER 51 CO 0.71 0.17 1.96 -0.29 1.20 0.00 0.00 173.24 176.98 2nx3 h ILE 52 N 2.51 0.32 -0.36 6.45 6.09 -1.93 -2.52 117.51 128.08 2nx3 h ILE 52 Ca -0.47 -0.74 0.00 0.00 -1.37 0.00 0.00 64.86 62.29 2nx3 h ILE 52 Cb 1.16 1.56 0.00 0.00 0.47 0.00 0.00 36.82 40.01 2nx3 h ILE 52 CO 0.66 0.11 0.00 1.41 -3.07 0.00 0.00 178.15 177.26 2nx3 n HIS 53 N -3.30 0.64 -3.73 2.19 8.25 -1.26 -4.91 115.22 113.10 2nx3 n HIS 53 Ca -0.00 -0.28 -0.33 0.00 -0.26 0.00 0.00 57.72 56.85 2nx3 n HIS 53 Cb 0.33 -0.07 -0.05 0.00 1.12 0.00 0.00 29.99 31.32 2nx3 n HIS 53 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2nx3 s SER 54 N -0.86 6.50 0.32 0.41 0.01 -0.95 -5.06 113.70 114.06 2nx3 s SER 54 Ca 0.26 0.57 -0.29 0.00 1.31 0.00 0.00 55.95 57.79 2nx3 s SER 54 Cb 0.15 -2.09 -0.12 0.00 0.21 0.00 0.00 66.02 64.17 2nx3 s SER 54 CO 0.15 0.17 1.39 0.33 0.41 0.00 0.00 173.24 175.69 2nx3 n PHE 55 N 0.66 2.45 -0.02 2.43 7.35 -1.26 -4.94 117.46 124.13 2nx3 n PHE 55 Ca -0.07 0.46 -0.03 0.00 -0.76 0.00 0.00 57.45 57.05 2nx3 n PHE 55 Cb 0.52 -2.47 -0.02 0.00 0.35 0.00 0.00 39.48 37.86 2nx3 n PHE 55 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2nx3 n ARG 56 N 1.12 0.10 -2.41 -4.13 1.74 -1.26 -4.76 116.66 107.06 2nx3 n ARG 56 Ca 0.06 0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.17 2nx3 n ARG 56 Cb 0.35 -1.02 0.00 0.00 -1.02 0.00 0.00 32.46 30.78 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 3.23 0.02 0.06 -0.13 0.00 -1.26 0.02 105.19 107.13 2nx3 n GLY 57 Ca -0.07 -1.36 0.04 0.00 0.00 0.00 0.00 46.02 44.62 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 0.00 0.00 1.61 8.25 -1.25 -5.05 115.22 127.78 2nx3 n HIS 58 Ca 0.00 -0.60 0.00 0.00 -0.26 0.00 0.00 57.72 56.86 2nx3 n HIS 58 Cb 0.00 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.03 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 -0.76 2.37 0.47 -1.41 0.00 -1.24 -4.51 105.19 100.11 2nx3 n GLY 59 Ca 0.06 -1.85 -0.19 0.00 0.00 0.00 0.00 46.02 44.05 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 -0.99 -0.87 0.99 6.46 -1.99 -0.46 115.31 118.45 2nx3 h LEU 60 Ca 0.00 0.03 0.14 0.00 -0.12 0.00 0.00 57.88 57.92 2nx3 h LEU 60 Cb 0.00 0.26 -0.09 0.00 -0.73 0.00 0.00 40.66 40.10 2nx3 h LEU 60 CO 0.00 -0.66 0.47 -0.33 -0.62 0.00 0.00 178.44 177.30 2nx3 h GLU 61 N -1.26 0.68 -0.66 1.25 5.08 -1.96 0.47 114.58 118.19 2nx3 h GLU 61 Ca -0.12 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.15 2nx3 h GLU 61 Cb 0.90 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.97 2nx3 h GLU 61 CO 0.20 0.45 0.20 -0.92 -1.00 0.00 0.00 179.01 177.93 2nx3 h TYR 62 N 0.70 1.04 0.05 4.33 3.20 -1.77 -2.52 116.97 122.00 2nx3 h TYR 62 Ca 0.46 -0.10 -0.00 0.00 3.14 0.00 0.00 58.73 62.23 2nx3 h TYR 62 Cb 0.59 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.56 2nx3 h TYR 62 CO -0.07 0.83 -0.03 0.78 -1.64 0.00 0.00 178.16 178.04 2nx3 h GLY 63 N 1.06 -0.07 0.98 1.82 0.00 0.15 -1.32 103.07 105.68 2nx3 h GLY 63 Ca 0.21 0.03 0.04 0.00 0.00 0.00 0.00 47.33 47.61 2nx3 h GLY 63 CO -0.01 -0.03 0.59 -2.08 0.00 0.00 0.00 176.54 175.01 2nx3 h VAL 64 N -0.41 1.14 -0.44 4.60 2.07 -0.52 -0.72 116.25 121.98 2nx3 h VAL 64 Ca -0.01 -0.38 -0.11 0.00 0.82 0.00 0.00 66.70 67.03 2nx3 h VAL 64 Cb 0.37 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 2nx3 h VAL 64 CO 0.01 0.20 -0.15 0.50 0.02 0.00 0.00 177.57 178.15 2nx3 h LYS 65 N 1.10 0.87 -0.51 1.57 3.64 -1.42 -0.51 116.57 121.32 2nx3 h LYS 65 Ca 0.36 -0.35 -0.08 0.00 -1.27 0.00 0.00 60.65 59.31 2nx3 h LYS 65 Cb 0.05 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 2nx3 h LYS 65 CO -0.11 1.00 0.01 0.00 -2.27 0.00 0.00 179.45 178.08 2nx3 h ALA 66 N 0.85 1.07 -0.12 5.00 0.00 -0.59 -2.62 119.26 122.85 2nx3 h ALA 66 Ca 0.11 -0.27 -0.19 0.00 0.00 0.00 0.00 54.91 54.56 2nx3 h ALA 66 Cb 0.70 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2nx3 h ALA 66 CO 0.05 0.59 -0.70 -0.07 0.00 0.00 0.00 179.25 179.12 2nx3 h LEU 67 N 0.79 0.62 -1.01 0.00 3.38 -1.04 -3.08 115.31 114.97 2nx3 h LEU 67 Ca 0.15 -0.39 0.08 0.00 0.09 0.00 0.00 57.88 57.82 2nx3 h LEU 67 Cb 0.46 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.95 2nx3 h LEU 67 CO 0.02 1.14 0.64 -0.09 0.09 0.00 0.00 178.44 180.24 2nx3 h ARG 68 N 0.37 1.09 -0.11 1.13 2.43 -0.78 -0.35 114.38 118.16 2nx3 h ARG 68 Ca -0.03 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.08 2nx3 h ARG 68 Cb 1.28 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 30.58 2nx3 h ARG 68 CO 0.13 0.72 0.06 -0.22 -1.51 0.00 0.00 179.97 179.15 2nx3 h LYS 69 N 1.12 0.15 -0.09 0.20 1.63 -1.38 -0.03 116.57 118.16 2nx3 h LYS 69 Ca 0.45 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 60.24 2nx3 h LYS 69 Cb 0.28 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.87 2nx3 h LYS 69 CO -0.20 0.16 0.05 0.28 -3.45 0.00 0.00 179.45 176.28 2nx3 h VAL 70 N 0.10 1.01 -0.39 2.00 2.07 -1.39 0.51 116.25 120.15 2nx3 h VAL 70 Ca 0.04 -0.03 0.02 0.00 0.82 0.00 0.00 66.70 67.55 2nx3 h VAL 70 Cb 0.05 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 2nx3 h VAL 70 CO -0.01 0.02 0.21 0.50 0.02 0.00 0.00 177.57 178.31 2nx3 h LYS 71 N 0.10 0.41 0.14 1.57 3.64 -0.92 -1.61 116.57 119.90 2nx3 h LYS 71 Ca 0.03 -0.02 -0.30 0.00 -1.27 0.00 0.00 60.65 59.08 2nx3 h LYS 71 Cb -0.00 -0.09 0.03 0.00 -0.41 0.00 0.00 32.23 31.76 2nx3 h LYS 71 CO -0.02 0.27 -1.28 0.93 -2.27 0.00 0.00 179.45 177.08 2nx3 h GLU 72 N 0.42 0.59 0.72 1.90 5.08 -0.85 -0.37 114.58 122.07 2nx3 h GLU 72 Ca 0.16 -0.83 -0.04 0.00 -1.00 0.00 0.00 59.36 57.66 2nx3 h GLU 72 Cb 0.05 0.28 0.01 0.00 0.50 0.00 0.00 28.75 29.58 2nx3 h GLU 72 CO -0.10 1.38 -0.34 1.49 -1.00 0.00 0.00 179.01 180.44 2nx3 h GLU 73 N 0.25 -0.93 0.00 2.33 4.81 0.06 -3.34 114.58 117.76 2nx3 h GLU 73 Ca -0.20 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 2nx3 h GLU 73 Cb 1.96 0.21 0.00 0.00 0.63 0.00 0.00 28.75 31.55 2nx3 h GLU 73 CO 0.24 -0.62 -0.69 0.74 -0.73 0.00 0.00 179.01 177.96 2nx3 h PHE 74 N -1.26 0.00 -3.54 0.92 0.04 -1.47 -3.49 116.94 108.15 2nx3 h PHE 74 Ca -0.10 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.57 2nx3 h PHE 74 Cb 0.74 0.00 0.07 0.00 2.20 0.00 0.00 35.95 38.95 2nx3 h PHE 74 CO 0.00 0.00 -0.29 0.41 -0.60 0.00 0.00 178.31 177.83 2nx3 n GLY 75 N 1.26 0.16 3.37 -1.45 0.00 -0.16 -4.99 105.19 103.39 2nx3 n GLY 75 Ca 0.02 -0.15 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 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 -3.68 2.28 0.71 0.99 1.43 -1.14 -5.04 118.68 114.23 2nx3 s LEU 76 Ca 0.07 -0.53 -0.13 0.00 -1.03 0.00 0.00 54.13 52.51 2nx3 s LEU 76 Cb -0.01 -1.36 0.03 0.00 0.03 0.00 0.00 46.19 44.88 2nx3 s LEU 76 CO 0.26 0.27 1.10 -0.54 0.23 0.00 0.00 176.35 177.67 2nx3 s LYS 77 N -1.22 2.54 0.12 1.70 1.02 -1.26 -4.35 119.74 118.29 2nx3 s LYS 77 Ca 0.12 1.28 0.06 0.00 0.02 0.00 0.00 55.97 57.46 2nx3 s LYS 77 Cb -0.10 -1.92 -0.04 0.00 -0.52 0.00 0.00 37.83 35.25 2nx3 s LYS 77 CO 0.03 -1.44 -0.15 0.42 -0.92 0.00 0.00 175.35 173.28 2nx3 s ILE 78 N -2.62 1.41 -0.05 2.17 -1.09 -1.26 -0.50 121.20 119.25 2nx3 s ILE 78 Ca 0.64 -1.68 -0.18 0.00 -2.23 0.00 0.00 60.65 57.19 2nx3 s ILE 78 Cb -0.19 -1.52 0.04 0.00 -1.58 0.00 0.00 42.46 39.20 2nx3 s ILE 78 CO 0.49 -0.35 0.42 0.28 -1.23 0.00 0.00 174.94 174.54 2nx3 s THR 79 N -1.94 0.03 0.11 2.92 -1.32 -0.46 0.74 115.64 115.72 2nx3 s THR 79 Ca 0.08 -0.27 -0.24 0.00 -1.21 0.00 0.00 61.69 60.05 2nx3 s THR 79 Cb -0.06 -0.69 0.07 0.00 -1.51 0.00 0.00 72.50 70.30 2nx3 s THR 79 CO 0.03 -0.15 0.61 0.28 -2.21 0.00 0.00 174.62 173.18 2nx3 s THR 80 N -0.95 0.00 -0.02 5.08 -1.32 -1.20 -3.30 115.64 113.93 2nx3 s THR 80 Ca -0.10 -0.02 -0.15 0.00 -1.21 0.00 0.00 61.69 60.20 2nx3 s THR 80 Cb -0.04 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 69.90 2nx3 s THR 80 CO 0.05 -0.01 0.42 1.51 -2.21 0.00 0.00 174.62 174.37 2nx3 s ASP 81 N -2.41 6.78 0.26 8.08 -4.77 -1.26 -1.60 116.67 121.75 2nx3 s ASP 81 Ca -0.02 0.93 0.06 0.00 -3.30 0.00 0.00 52.55 50.22 2nx3 s ASP 81 Cb -0.01 -2.26 -0.03 0.00 -1.09 0.00 0.00 42.92 39.54 2nx3 s ASP 81 CO -0.08 0.27 0.31 0.27 0.70 0.00 0.00 175.17 176.63 2nx3 s ILE 82 N -0.75 4.77 0.00 2.11 -4.36 -0.58 -4.75 121.20 117.65 2nx3 s ILE 82 Ca 0.24 -1.16 0.00 0.00 -0.26 0.00 0.00 60.65 59.47 2nx3 s ILE 82 Cb -0.16 -3.62 0.00 0.00 1.25 0.00 0.00 42.46 39.93 2nx3 s ILE 82 CO 0.13 -0.31 0.00 1.41 0.24 0.00 0.00 174.94 176.40 2nx3 n HIS 83 N -1.34 0.00 -4.21 1.37 8.25 -1.26 -4.40 115.22 113.62 2nx3 n HIS 83 Ca -0.07 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.22 2nx3 n HIS 83 Cb 0.58 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.55 2nx3 n HIS 83 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2nx3 s GLU 84 N -1.59 0.56 0.33 -0.41 2.02 -1.26 -5.01 118.70 113.34 2nx3 s GLU 84 Ca 0.00 -0.37 0.14 0.00 0.02 0.00 0.00 54.97 54.77 2nx3 s GLU 84 Cb 0.00 -0.51 1.10 0.00 0.10 0.00 0.00 34.13 34.82 2nx3 s GLU 84 CO 0.00 0.13 1.47 0.43 0.02 0.00 0.00 175.26 177.32 2nx3 n SER 85 N 2.58 0.20 0.29 -0.19 7.64 -1.26 -0.01 113.62 122.87 2nx3 n SER 85 Ca -0.15 1.56 0.19 0.00 1.01 0.00 0.00 58.87 61.48 2nx3 n SER 85 Cb 0.57 -0.70 0.91 0.00 -1.01 0.00 0.00 64.21 63.98 2nx3 n SER 85 CO 0.00 0.00 0.00 4.11 -3.01 0.00 0.00 175.04 176.14 2nx3 h TRP 86 N 0.00 0.00 0.00 1.43 5.08 -1.98 -2.49 115.95 117.99 2nx3 h TRP 86 Ca 0.73 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.70 2nx3 h TRP 86 Cb 1.82 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.98 2nx3 h TRP 86 CO -0.15 0.00 0.00 1.96 -1.28 0.00 0.00 178.44 178.97 2nx3 h GLN 87 N 0.00 0.00 0.10 0.12 4.20 -0.86 -3.38 115.11 115.29 2nx3 h GLN 87 Ca 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 2nx3 h GLN 87 Cb 0.25 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.03 2nx3 h GLN 87 CO 0.00 0.00 -0.06 0.00 -0.67 0.00 0.00 178.83 178.10 2nx3 h ALA 88 N 2.32 -0.93 -0.81 3.87 0.00 -1.56 -2.09 119.26 120.06 2nx3 h ALA 88 Ca 0.00 -0.03 0.14 0.00 0.00 0.00 0.00 54.91 55.02 2nx3 h ALA 88 Cb 0.81 0.19 -0.14 0.00 0.00 0.00 0.00 17.79 18.65 2nx3 h ALA 88 CO 0.00 -0.92 -0.33 1.49 0.00 0.00 0.00 179.25 179.49 2nx3 h GLU 89 N -0.15 -0.06 -0.71 0.00 4.22 -1.77 0.92 114.58 117.03 2nx3 h GLU 89 Ca -0.01 0.00 -0.06 0.00 0.08 0.00 0.00 59.36 59.37 2nx3 h GLU 89 Cb 0.12 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 2nx3 h GLU 89 CO 0.01 -0.04 0.21 -1.00 -2.18 0.00 0.00 179.01 176.01 2nx3 h PRO 90 N -0.06 1.10 -0.18 0.92 0.13 -1.76 -3.12 132.00 129.03 2nx3 h PRO 90 Ca 0.31 -0.24 -0.15 0.00 -0.87 0.00 0.00 66.00 65.05 2nx3 h PRO 90 Cb 0.58 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 31.55 2nx3 h PRO 90 CO -0.84 0.95 -0.52 0.28 -0.23 0.00 0.00 178.00 177.64 2nx3 h VAL 91 N 1.04 1.32 -0.07 1.56 2.07 -0.52 -3.04 116.25 118.62 2nx3 h VAL 91 Ca 0.23 -1.76 0.02 0.00 0.82 0.00 0.00 66.70 66.01 2nx3 h VAL 91 Cb 0.32 1.75 -0.00 0.00 -1.52 0.00 0.00 31.29 31.83 2nx3 h VAL 91 CO -0.01 0.54 0.21 0.00 0.02 0.00 0.00 177.57 178.34 2nx3 h ALA 92 N 1.03 1.40 0.00 1.67 0.00 -0.80 -1.00 119.26 121.56 2nx3 h ALA 92 Ca 0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2nx3 h ALA 92 Cb 1.05 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 2nx3 h ALA 92 CO 0.10 -0.24 -0.02 0.93 0.00 0.00 0.00 179.25 180.01 2nx3 h GLU 93 N 0.00 0.00 0.00 0.00 4.39 -1.60 -3.33 114.58 114.04 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 0.45 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 2nx3 h GLU 93 CO -0.00 0.02 -0.90 0.28 -1.16 0.00 0.00 179.01 177.25 2nx3 n VAL 94 N -3.24 0.00 -1.96 3.13 0.31 -0.48 -5.04 118.33 111.04 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 0.15 -1.07 -0.03 0.00 -0.91 0.00 0.00 33.84 31.98 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 -1.97 3.65 0.17 3.52 0.00 -0.61 -4.58 121.76 121.95 2nx3 s ALA 95 Ca 0.00 1.11 0.07 0.00 0.00 0.00 0.00 51.96 53.14 2nx3 s ALA 95 Cb 0.00 -3.71 -0.02 0.00 0.00 0.00 0.00 23.12 19.39 2nx3 s ALA 95 CO 0.00 -1.19 1.39 -0.44 0.00 0.00 0.00 175.76 175.52 2nx3 h ASP 96 N 8.72 0.04 -3.23 0.00 3.32 0.01 -3.43 116.42 121.85 2nx3 h ASP 96 Ca -0.42 -0.03 -0.53 0.00 0.02 0.00 0.00 57.03 56.07 2nx3 h ASP 96 Cb 1.19 -0.01 -0.36 0.00 0.22 0.00 0.00 39.33 40.37 2nx3 h ASP 96 CO 0.93 0.89 -0.81 -0.63 -1.72 0.00 0.00 179.24 177.91 2nx3 s ILE 97 N -3.04 1.08 -0.18 0.35 1.01 -0.89 -2.27 121.20 117.27 2nx3 s ILE 97 Ca -0.00 -0.35 -0.19 0.00 0.00 0.00 0.00 60.65 60.10 2nx3 s ILE 97 Cb 0.11 -1.07 -0.03 0.00 0.01 0.00 0.00 42.46 41.48 2nx3 s ILE 97 CO 0.80 0.37 0.56 -0.63 0.00 0.00 0.00 174.94 176.04 2nx3 s ILE 98 N 1.46 5.09 -0.14 2.92 -1.09 0.33 -3.27 121.20 126.50 2nx3 s ILE 98 Ca 0.01 1.05 -0.07 0.00 -2.23 0.00 0.00 60.65 59.41 2nx3 s ILE 98 Cb -0.13 -3.88 -0.04 0.00 -1.58 0.00 0.00 42.46 36.83 2nx3 s ILE 98 CO -0.06 0.18 0.11 -1.58 -1.23 0.00 0.00 174.94 172.36 2nx3 s GLN 99 N 1.57 3.59 -0.20 2.79 0.74 -0.63 0.00 119.66 127.52 2nx3 s GLN 99 Ca 0.26 -0.21 -0.05 0.00 0.05 0.00 0.00 55.36 55.41 2nx3 s GLN 99 Cb -0.16 -3.18 -0.02 0.00 1.10 0.00 0.00 33.01 30.75 2nx3 s GLN 99 CO 0.10 0.61 -0.01 0.42 -0.55 0.00 0.00 175.29 175.87 2nx3 s ILE 100 N -0.57 3.85 0.88 -2.34 1.09 -0.40 -1.52 121.20 122.20 2nx3 s ILE 100 Ca 0.12 -0.35 -0.12 0.00 -1.10 0.00 0.00 60.65 59.20 2nx3 s ILE 100 Cb -0.12 -2.74 0.09 0.00 -1.06 0.00 0.00 42.46 38.63 2nx3 s ILE 100 CO 0.02 0.43 0.94 -2.65 -0.10 0.00 0.00 174.94 173.57 2nx3 n PRO 101 N 4.35 -0.19 -0.02 2.79 -0.02 -1.26 -1.58 135.00 139.06 2nx3 n PRO 101 Ca -0.17 0.01 -0.09 0.00 -2.02 0.00 0.00 63.50 61.22 2nx3 n PRO 101 Cb 0.52 -2.23 -0.04 0.00 -0.02 0.00 0.00 33.50 31.73 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 -1.44 0.09 0.00 3.55 0.00 -1.90 -2.32 119.26 117.25 2nx3 h ALA 102 Ca -0.44 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 2nx3 h ALA 102 Cb 1.29 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.20 2nx3 h ALA 102 CO 0.41 -0.49 -0.04 0.74 0.00 0.00 0.00 179.25 179.87 2nx3 h PHE 103 N -0.01 0.00 -0.69 0.00 0.04 -1.92 -2.65 116.94 111.71 2nx3 h PHE 103 Ca 0.07 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.84 2nx3 h PHE 103 Cb 0.12 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.27 2nx3 h PHE 103 CO -0.19 0.04 0.00 1.28 -0.60 0.00 0.00 178.31 178.84 2nx3 n LEU 104 N -3.87 3.89 0.09 1.54 4.77 -0.91 -4.51 117.00 117.99 2nx3 n LEU 104 Ca -0.03 -1.91 0.06 0.00 -0.03 0.00 0.00 56.01 54.11 2nx3 n LEU 104 Cb 0.13 -0.46 0.33 0.00 -2.33 0.00 0.00 43.42 41.09 2nx3 n LEU 104 CO 0.29 0.95 0.69 0.00 -1.33 0.00 0.00 177.39 178.00 2nx3 n ARG 106 N -1.91 1.11 -1.84 0.00 5.12 -1.26 -4.90 116.66 112.97 2nx3 n ARG 106 Ca -0.01 -0.04 -0.25 0.00 -1.93 0.00 0.00 57.85 55.62 2nx3 n ARG 106 Cb 0.03 -1.34 -0.05 0.00 -1.16 0.00 0.00 32.46 29.94 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 -2.79 2.20 0.29 5.56 -1.52 -0.73 -4.83 119.66 117.84 2nx3 s GLN 107 Ca 0.03 0.25 -0.03 0.00 -1.95 0.00 0.00 55.36 53.66 2nx3 s GLN 107 Cb 0.13 -4.84 0.61 0.00 -0.22 0.00 0.00 33.01 28.69 2nx3 s GLN 107 CO 0.72 -3.64 1.57 1.15 -0.25 0.00 0.00 175.29 174.83 2nx3 h THR 108 N 7.39 0.02 0.57 -0.19 2.02 -1.90 -2.04 112.91 118.79 2nx3 h THR 108 Ca -0.01 -0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.14 2nx3 h THR 108 Cb 1.05 0.02 0.01 0.00 -1.74 0.00 0.00 68.15 67.48 2nx3 h THR 108 CO 1.14 0.00 -0.27 0.44 0.37 0.00 0.00 175.52 177.20 2nx3 h ASP 109 N 0.01 -0.65 -1.03 4.18 3.32 -1.98 -1.94 116.42 118.32 2nx3 h ASP 109 Ca 0.54 -0.03 0.26 0.00 0.02 0.00 0.00 57.03 57.82 2nx3 h ASP 109 Cb 0.99 0.17 -0.09 0.00 0.22 0.00 0.00 39.33 40.62 2nx3 h ASP 109 CO -0.96 -0.37 0.66 0.25 -1.72 0.00 0.00 179.24 177.10 2nx3 h LEU 110 N -0.91 0.46 0.00 1.55 5.85 -1.75 0.11 115.31 120.62 2nx3 h LEU 110 Ca -0.08 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 2nx3 h LEU 110 Cb 0.64 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.68 2nx3 h LEU 110 CO 0.13 0.10 -0.00 -0.07 -0.34 0.00 0.00 178.44 178.25 2nx3 h LEU 111 N 0.41 -0.00 -1.54 2.25 3.38 -1.37 -2.73 115.31 115.72 2nx3 h LEU 111 Ca 0.59 -0.61 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2nx3 h LEU 111 Cb 1.46 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.19 2nx3 h LEU 111 CO -0.30 0.61 0.13 -0.07 0.09 0.00 0.00 178.44 178.90 2nx3 h LEU 112 N -0.62 0.39 -1.04 1.67 3.38 -0.45 -1.18 115.31 117.46 2nx3 h LEU 112 Ca -0.00 -0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.84 2nx3 h LEU 112 Cb 0.61 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2nx3 h LEU 112 CO 0.00 0.35 -0.43 0.00 0.09 0.00 0.00 178.44 178.45 2nx3 h ALA 113 N 1.71 1.20 0.02 1.53 0.00 -0.85 -1.53 119.26 121.35 2nx3 h ALA 113 Ca 0.11 -0.41 -0.21 0.00 0.00 0.00 0.00 54.91 54.40 2nx3 h ALA 113 Cb 0.08 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2nx3 h ALA 113 CO -0.01 0.57 -0.97 0.00 0.00 0.00 0.00 179.25 178.83 2nx3 h ALA 114 N 1.48 0.41 -0.04 0.00 0.00 -0.98 -3.32 119.26 116.80 2nx3 h ALA 114 Ca 0.00 -0.83 -0.01 0.00 0.00 0.00 0.00 54.91 54.08 2nx3 h ALA 114 Cb 0.80 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 2nx3 h ALA 114 CO 0.06 1.08 -0.01 0.00 0.00 0.00 0.00 179.25 180.38 2nx3 h ALA 115 N 0.96 0.06 -0.90 0.00 0.00 -0.86 -3.20 119.26 115.32 2nx3 h ALA 115 Ca -0.04 -0.20 0.25 0.00 0.00 0.00 0.00 54.91 54.92 2nx3 h ALA 115 Cb 1.68 -0.02 -0.15 0.00 0.00 0.00 0.00 17.79 19.30 2nx3 h ALA 115 CO 0.14 -0.24 0.26 -0.22 0.00 0.00 0.00 179.25 179.19 2nx3 h LYS 116 N -0.26 0.19 0.00 0.00 3.64 -1.38 0.98 116.57 119.74 2nx3 h LYS 116 Ca 0.01 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2nx3 h LYS 116 Cb 0.40 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2nx3 h LYS 116 CO 0.00 0.13 0.30 1.79 -2.27 0.00 0.00 179.45 179.40 2nx3 h THR 117 N 0.20 0.00 0.00 1.00 1.35 -1.66 -3.44 112.91 110.35 2nx3 h THR 117 Ca 0.58 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.44 2nx3 h THR 117 Cb 1.20 0.30 0.00 0.00 -1.73 0.00 0.00 68.15 67.92 2nx3 h THR 117 CO -0.68 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.20 2nx3 n GLY 118 N -1.27 1.23 3.93 5.82 0.00 0.34 -5.00 105.19 110.25 2nx3 n GLY 118 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.13 1.02 0.31 1.61 1.81 -1.26 -4.91 118.95 117.39 2nx3 s ARG 119 Ca 0.00 -0.41 -0.16 0.00 -1.72 0.00 0.00 55.73 53.44 2nx3 s ARG 119 Cb 0.00 -1.93 -0.09 0.00 -0.45 0.00 0.00 34.95 32.48 2nx3 s ARG 119 CO 0.00 -2.13 0.74 0.00 -0.68 0.00 0.00 175.30 173.23 2nx3 s ALA 120 N -3.73 3.33 -0.07 2.13 0.00 -0.96 -4.73 121.76 117.72 2nx3 s ALA 120 Ca 0.71 0.07 0.03 0.00 0.00 0.00 0.00 51.96 52.77 2nx3 s ALA 120 Cb -0.05 -2.78 0.01 0.00 0.00 0.00 0.00 23.12 20.29 2nx3 s ALA 120 CO 0.51 0.33 -0.17 0.08 0.00 0.00 0.00 175.76 176.51 2nx3 s VAL 121 N -1.92 1.50 -0.28 0.00 1.01 -1.10 0.12 120.40 119.73 2nx3 s VAL 121 Ca 0.53 -0.70 -0.00 0.00 0.00 0.00 0.00 61.98 61.81 2nx3 s VAL 121 Cb -0.11 -1.32 0.05 0.00 0.00 0.00 0.00 36.38 35.00 2nx3 s VAL 121 CO 0.18 0.43 -0.05 0.21 0.00 0.00 0.00 175.10 175.87 2nx3 s ASN 122 N 0.48 4.65 -0.17 3.32 2.47 0.10 -1.34 114.94 124.45 2nx3 s ASN 122 Ca -0.15 -1.27 -0.14 0.00 0.42 0.00 0.00 52.86 51.73 2nx3 s ASN 122 Cb -0.16 -1.65 -0.05 0.00 -1.45 0.00 0.00 41.25 37.95 2nx3 s ASN 122 CO 0.05 -0.22 0.29 -0.69 -3.72 0.00 0.00 177.10 172.82 2nx3 s VAL 123 N 1.21 5.30 -0.00 -5.21 1.01 -0.35 -1.27 120.40 121.09 2nx3 s VAL 123 Ca -0.06 0.54 -0.29 0.00 0.00 0.00 0.00 61.98 62.17 2nx3 s VAL 123 Cb -0.19 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 2nx3 s VAL 123 CO -0.03 0.37 0.93 -0.54 0.00 0.00 0.00 175.10 175.83 2nx3 s LYS 124 N 0.60 4.55 -0.15 2.72 -0.14 -0.62 -0.43 119.74 126.28 2nx3 s LYS 124 Ca 0.16 1.34 -0.29 0.00 -1.36 0.00 0.00 55.97 55.81 2nx3 s LYS 124 Cb -0.13 -3.45 -0.03 0.00 -1.68 0.00 0.00 37.83 32.54 2nx3 s LYS 124 CO 0.04 -0.01 1.41 0.21 -0.76 0.00 0.00 175.35 176.24 2nx3 s LYS 125 N 0.91 4.16 0.47 1.68 2.20 -0.02 -4.17 119.74 124.97 2nx3 s LYS 125 Ca 0.49 1.79 -0.22 0.00 -0.36 0.00 0.00 55.97 57.67 2nx3 s LYS 125 Cb -0.21 -3.86 -0.10 0.00 -1.51 0.00 0.00 37.83 32.16 2nx3 s LYS 125 CO 0.27 -0.82 0.88 0.41 -0.36 0.00 0.00 175.35 175.72 2nx3 n GLY 126 N 3.90 -0.56 0.00 5.54 0.00 -1.24 -4.60 105.19 108.23 2nx3 n GLY 126 Ca 0.15 0.04 0.03 0.00 0.00 0.00 0.00 46.02 46.25 2nx3 n GLY 126 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2nx3 n GLN 127 N -0.02 0.08 -0.03 1.61 3.00 -1.26 -1.11 117.38 119.65 2nx3 n GLN 127 Ca 0.11 0.25 0.05 0.00 -0.01 0.00 0.00 57.00 57.39 2nx3 n GLN 127 Cb 0.42 -1.50 0.06 0.00 0.00 0.00 0.00 30.24 29.21 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 -1.32 0.08 -3.56 1.08 1.16 -1.26 -1.39 117.46 112.24 2nx3 n PHE 128 Ca 0.03 -0.10 -0.36 0.00 -1.87 0.00 0.00 57.45 55.15 2nx3 n PHE 128 Cb 0.06 -0.01 -0.06 0.00 -1.61 0.00 0.00 39.48 37.87 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 -0.83 4.40 0.20 5.98 2.96 -0.27 -5.08 118.68 126.04 2nx3 s LEU 129 Ca 0.13 0.84 -0.13 0.00 -0.22 0.00 0.00 54.13 54.75 2nx3 s LEU 129 Cb 0.08 -2.77 -0.07 0.00 0.50 0.00 0.00 46.19 43.93 2nx3 s LEU 129 CO 0.12 0.25 0.58 0.00 -1.32 0.00 0.00 176.35 175.98 2nx3 s ALA 130 N -1.25 3.54 0.21 5.97 0.00 -1.26 -4.89 121.76 124.07 2nx3 s ALA 130 Ca 0.28 -0.15 -0.16 0.00 0.00 0.00 0.00 51.96 51.94 2nx3 s ALA 130 Cb -0.15 -2.53 0.21 0.00 0.00 0.00 0.00 23.12 20.65 2nx3 s ALA 130 CO 0.15 0.45 1.61 -1.35 0.00 0.00 0.00 175.76 176.62 2nx3 h PRO 131 N 3.03 -0.06 0.00 0.00 0.11 -1.98 0.16 132.00 133.26 2nx3 h PRO 131 Ca -0.48 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 2nx3 h PRO 131 Cb 1.18 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 2nx3 h PRO 131 CO 0.67 -0.04 -0.09 0.11 -0.21 0.00 0.00 178.00 178.44 2nx3 h TRP 132 N -0.07 0.00 0.00 0.65 0.09 -1.94 -2.34 115.95 112.35 2nx3 h TRP 132 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.27 2nx3 h TRP 132 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.76 2nx3 h TRP 132 CO -0.58 0.09 0.00 -0.25 0.09 0.00 0.00 178.44 177.79 2nx3 n ASP 133 N -3.70 0.61 0.00 0.11 8.00 0.55 -2.37 116.55 119.74 2nx3 n ASP 133 Ca -0.02 0.69 0.12 0.00 0.71 0.00 0.00 54.79 56.29 2nx3 n ASP 133 Cb 0.20 -0.80 0.56 0.00 -0.02 0.00 0.00 41.12 41.05 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 -2.21 0.22 0.01 -3.53 -2.24 -0.88 -3.60 114.28 102.05 2nx3 n THR 134 Ca 0.01 0.05 -0.10 0.00 -2.27 0.00 0.00 64.05 61.74 2nx3 n THR 134 Cb 0.16 -0.61 -0.04 0.00 -2.10 0.00 0.00 70.33 67.74 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 -0.08 0.00 -0.78 3.64 -1.68 -1.75 116.57 115.92 2nx3 h LYS 135 Ca 0.00 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 2nx3 h LYS 135 Cb 0.44 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.27 2nx3 h LYS 135 CO 0.00 -0.05 -0.16 -0.91 -2.27 0.00 0.00 179.45 176.06 2nx3 h ASN 136 N -0.08 0.00 -0.58 4.20 2.35 -1.81 -1.73 115.58 117.93 2nx3 h ASN 136 Ca 0.06 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.73 2nx3 h ASN 136 Cb 0.17 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 2nx3 h ASN 136 CO -0.13 0.16 0.08 0.58 -1.65 0.00 0.00 177.43 176.46 2nx3 h VAL 137 N 0.00 1.26 -0.35 2.81 2.07 -1.48 -2.15 116.25 118.40 2nx3 h VAL 137 Ca -0.00 -1.02 -0.15 0.00 0.82 0.00 0.00 66.70 66.34 2nx3 h VAL 137 Cb 0.35 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 2nx3 h VAL 137 CO 0.02 0.38 -0.39 0.58 0.02 0.00 0.00 177.57 178.17 2nx3 h VAL 138 N 0.94 1.28 -0.85 2.57 2.07 -0.80 -3.01 116.25 118.45 2nx3 h VAL 138 Ca 0.19 -1.57 -0.02 0.00 0.82 0.00 0.00 66.70 66.12 2nx3 h VAL 138 Cb 0.44 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.60 2nx3 h VAL 138 CO 0.01 0.52 0.45 -0.08 0.02 0.00 0.00 177.57 178.49 2nx3 h GLU 139 N 0.69 1.19 0.62 1.57 4.81 -1.10 -1.58 114.58 120.78 2nx3 h GLU 139 Ca 0.06 -0.15 -0.03 0.00 -0.13 0.00 0.00 59.36 59.11 2nx3 h GLU 139 Cb 0.97 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 30.12 2nx3 h GLU 139 CO 0.09 0.89 -0.35 0.87 -0.73 0.00 0.00 179.01 179.77 2nx3 h LYS 140 N 1.18 -0.88 -0.63 1.92 1.57 -1.35 0.82 116.57 119.21 2nx3 h LYS 140 Ca 0.30 0.06 0.13 0.00 -1.87 0.00 0.00 60.65 59.26 2nx3 h LYS 140 Cb 0.06 0.20 -0.10 0.00 0.08 0.00 0.00 32.23 32.46 2nx3 h LYS 140 CO -0.04 -0.59 0.04 -0.07 -0.57 0.00 0.00 179.45 178.22 2nx3 h LEU 141 N -0.91 -0.20 -0.76 2.94 3.38 -1.39 0.16 115.31 118.52 2nx3 h LEU 141 Ca -0.08 0.15 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 2nx3 h LEU 141 Cb 0.73 0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.69 2nx3 h LEU 141 CO 0.10 -0.09 0.34 0.11 0.09 0.00 0.00 178.44 178.99 2nx3 h LYS 142 N 0.15 1.11 0.00 1.13 1.57 -1.10 -0.43 116.57 119.01 2nx3 h LYS 142 Ca 0.33 -0.18 -0.02 0.00 -1.87 0.00 0.00 60.65 58.91 2nx3 h LYS 142 Cb 0.53 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 2nx3 h LYS 142 CO -0.51 0.89 -0.08 0.35 -0.57 0.00 0.00 179.45 179.52 2nx3 h PHE 143 N 1.08 0.00 0.00 -1.35 3.57 0.13 -1.83 116.94 118.54 2nx3 h PHE 143 Ca 0.26 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.76 2nx3 h PHE 143 Cb 0.16 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.90 2nx3 h PHE 143 CO 0.01 0.08 -0.57 0.41 -2.23 0.00 0.00 178.31 176.02 2nx3 n GLY 144 N -0.96 -1.32 0.00 2.40 0.00 0.34 -4.96 105.19 100.69 2nx3 n GLY 144 Ca -0.02 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.69 2nx3 n GLY 144 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nx3 n GLY 145 N 1.43 1.46 3.74 -0.02 0.00 -0.56 -4.07 105.19 107.17 2nx3 n GLY 145 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 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 3.38 -0.26 4.61 0.00 -0.58 -4.81 121.76 122.10 2nx3 s ALA 146 Ca 0.00 0.17 -0.09 0.00 0.00 0.00 0.00 51.96 52.04 2nx3 s ALA 146 Cb 0.00 -2.92 -0.13 0.00 0.00 0.00 0.00 23.12 20.07 2nx3 s ALA 146 CO 0.00 0.02 -0.31 1.63 0.00 0.00 0.00 175.76 177.10 2nx3 n LYS 147 N 3.17 0.58 -3.41 0.00 4.76 -1.26 -4.42 118.16 117.58 2nx3 n LYS 147 Ca -0.03 0.22 -0.43 0.00 -2.87 0.00 0.00 58.31 55.20 2nx3 n LYS 147 Cb 0.51 -1.47 -0.10 0.00 -1.84 0.00 0.00 35.03 32.14 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 -2.49 3.05 -0.09 1.97 2.12 -1.26 -5.06 118.70 116.94 2nx3 s GLU 148 Ca -0.36 -0.89 0.04 0.00 0.36 0.00 0.00 54.97 54.11 2nx3 s GLU 148 Cb 0.13 -3.96 -0.01 0.00 0.26 0.00 0.00 34.13 30.55 2nx3 s GLU 148 CO 0.50 -0.77 -0.21 0.42 -0.54 0.00 0.00 175.26 174.66 2nx3 s ILE 149 N 1.86 2.37 0.03 -3.70 1.01 -1.26 -2.72 121.20 118.79 2nx3 s ILE 149 Ca 0.08 -0.93 0.08 0.00 0.00 0.00 0.00 60.65 59.88 2nx3 s ILE 149 Cb -0.18 -1.92 -0.02 0.00 0.01 0.00 0.00 42.46 40.34 2nx3 s ILE 149 CO 0.11 0.56 -0.23 -0.31 0.00 0.00 0.00 174.94 175.07 2nx3 s TYR 150 N 0.11 2.02 -0.11 3.97 2.02 -0.45 -2.81 117.35 122.11 2nx3 s TYR 150 Ca -0.10 -0.39 0.02 0.00 -0.37 0.00 0.00 57.07 56.23 2nx3 s TYR 150 Cb -0.16 -1.23 0.01 0.00 -0.40 0.00 0.00 41.96 40.19 2nx3 s TYR 150 CO 0.06 0.07 -0.17 -0.51 -1.57 0.00 0.00 175.55 173.44 2nx3 s LEU 151 N -1.05 1.80 -0.15 -1.29 1.43 -0.33 -1.21 118.68 117.89 2nx3 s LEU 151 Ca 0.09 -0.45 -0.03 0.00 -1.03 0.00 0.00 54.13 52.71 2nx3 s LEU 151 Cb -0.09 -1.15 -0.02 0.00 0.03 0.00 0.00 46.19 44.96 2nx3 s LEU 151 CO 0.01 0.04 -0.06 -0.89 0.23 0.00 0.00 176.35 175.68 2nx3 s THR 152 N 0.87 3.69 -0.16 5.49 2.01 0.43 -0.98 115.64 126.99 2nx3 s THR 152 Ca -0.08 -0.43 -0.23 0.00 0.31 0.00 0.00 61.69 61.26 2nx3 s THR 152 Cb -0.15 -2.60 -0.02 0.00 0.01 0.00 0.00 72.50 69.73 2nx3 s THR 152 CO -0.00 0.50 0.71 -0.70 -0.69 0.00 0.00 174.62 174.44 2nx3 s GLU 153 N 0.35 4.29 -0.02 4.92 2.56 0.50 -0.84 118.70 130.47 2nx3 s GLU 153 Ca -0.06 0.80 0.02 0.00 0.00 0.00 0.00 54.97 55.73 2nx3 s GLU 153 Cb -0.15 -3.55 0.04 0.00 2.00 0.00 0.00 34.13 32.47 2nx3 s GLU 153 CO 0.04 -0.20 0.92 2.89 -0.56 0.00 0.00 175.26 178.35 2nx3 n ARG 154 N 4.81 0.28 0.00 4.30 1.85 -1.26 -0.54 116.66 126.10 2nx3 n ARG 154 Ca 0.00 -1.12 0.00 0.00 -1.00 0.00 0.00 57.85 55.73 2nx3 n ARG 154 Cb 0.50 -0.65 0.00 0.00 -1.05 0.00 0.00 32.46 31.26 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 -0.20 1.95 3.13 2.89 0.00 -1.26 -3.72 105.19 107.98 2nx3 n GLY 155 Ca 0.02 -1.97 -0.18 0.00 0.00 0.00 0.00 46.02 43.89 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 -2.50 1.00 0.06 2.61 2.01 0.22 -4.38 115.64 114.67 2nx3 s THR 156 Ca 0.00 -1.09 -0.30 0.00 0.31 0.00 0.00 61.69 60.61 2nx3 s THR 156 Cb 0.00 -0.94 -0.09 0.00 0.01 0.00 0.00 72.50 71.47 2nx3 s THR 156 CO 0.00 -0.13 1.93 -0.89 -0.69 0.00 0.00 174.62 174.84 2nx3 s THR 157 N -1.04 2.86 -0.52 -0.82 2.01 -0.49 -1.47 115.64 116.17 2nx3 s THR 157 Ca -0.01 0.03 0.03 0.00 0.31 0.00 0.00 61.69 62.05 2nx3 s THR 157 Cb -0.09 -3.02 0.15 0.00 0.01 0.00 0.00 72.50 69.56 2nx3 s THR 157 CO 0.01 -0.00 0.33 0.12 -0.69 0.00 0.00 174.62 174.39 2nx3 s PHE 158 N 3.94 2.53 0.00 4.92 5.36 -0.69 -4.88 117.98 129.16 2nx3 s PHE 158 Ca 0.86 -2.81 0.00 0.00 -0.96 0.00 0.00 56.93 54.03 2nx3 s PHE 158 Cb -0.44 -2.16 0.00 0.00 -0.34 0.00 0.00 43.02 40.08 2nx3 s PHE 158 CO 0.40 -0.72 0.00 0.41 -1.46 0.00 0.00 175.22 173.85 2nx3 n GLY 159 N 2.94 -1.10 3.80 13.12 0.00 -1.26 -4.29 105.19 118.39 2nx3 n GLY 159 Ca 0.14 -1.23 -0.37 0.00 0.00 0.00 0.00 46.02 44.55 2nx3 n GLY 159 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2nx3 s TYR 160 N 0.00 3.60 -1.46 1.61 2.02 -1.26 -4.39 117.35 117.47 2nx3 s TYR 160 Ca 0.00 0.78 -0.09 0.00 -0.37 0.00 0.00 57.07 57.40 2nx3 s TYR 160 Cb 0.00 -2.28 0.04 0.00 -0.40 0.00 0.00 41.96 39.32 2nx3 s TYR 160 CO 0.00 0.48 0.80 0.09 -1.57 0.00 0.00 175.55 175.35 2nx3 n ASN 161 N 2.59 -5.46 -3.75 2.29 5.03 -1.26 -4.98 115.26 109.71 2nx3 n ASN 161 Ca -0.14 -0.47 -0.13 0.00 0.87 0.00 0.00 54.58 54.71 2nx3 n ASN 161 Cb 0.53 -4.39 -0.09 0.00 -1.02 0.00 0.00 39.78 34.81 2nx3 n ASN 161 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 2nx3 s ASN 162 N -2.97 -0.26 0.02 6.41 3.84 -1.26 -4.18 114.94 116.54 2nx3 s ASN 162 Ca 0.47 0.31 0.06 0.00 0.21 0.00 0.00 52.86 53.91 2nx3 s ASN 162 Cb -0.22 0.45 -0.02 0.00 -0.55 0.00 0.00 41.25 40.91 2nx3 s ASN 162 CO 0.58 -0.34 -0.19 -0.76 -2.79 0.00 0.00 177.10 173.59 2nx3 s LEU 163 N -0.82 2.12 0.10 3.21 1.43 -1.26 -1.70 118.68 121.76 2nx3 s LEU 163 Ca -0.09 -0.45 0.09 0.00 -1.03 0.00 0.00 54.13 52.65 2nx3 s LEU 163 Cb -0.04 -0.91 -0.03 0.00 0.03 0.00 0.00 46.19 45.23 2nx3 s LEU 163 CO 0.03 0.16 -0.23 0.54 0.23 0.00 0.00 176.35 177.09 2nx3 s VAL 164 N -0.68 1.89 -0.30 -1.59 0.11 -0.54 -4.87 120.40 114.41 2nx3 s VAL 164 Ca 0.06 -1.54 -0.08 0.00 -2.93 0.00 0.00 61.98 57.49 2nx3 s VAL 164 Cb -0.08 -1.69 0.00 0.00 -1.53 0.00 0.00 36.38 33.08 2nx3 s VAL 164 CO 0.01 0.05 0.12 -0.69 -3.33 0.00 0.00 175.10 171.26 2nx3 s VAL 165 N -1.05 4.30 -0.78 2.04 1.01 -1.26 -0.61 120.40 124.04 2nx3 s VAL 165 Ca 0.09 -0.54 -0.18 0.00 0.00 0.00 0.00 61.98 61.34 2nx3 s VAL 165 Cb -0.10 -3.20 0.14 0.00 0.00 0.00 0.00 36.38 33.22 2nx3 s VAL 165 CO 0.04 0.08 0.91 -0.62 0.00 0.00 0.00 175.10 175.51 2nx3 s ASP 166 N 1.56 6.48 0.24 3.32 2.15 -1.26 -4.91 116.67 124.25 2nx3 s ASP 166 Ca 0.04 -1.91 0.16 0.00 0.43 0.00 0.00 52.55 51.27 2nx3 s ASP 166 Cb -0.17 -2.33 0.87 0.00 -0.30 0.00 0.00 42.92 40.99 2nx3 s ASP 166 CO 0.04 -1.01 1.48 0.49 -0.17 0.00 0.00 175.17 176.01 2nx3 n PHE 167 N 6.03 0.54 0.30 -5.34 3.72 -1.26 -1.23 117.46 120.22 2nx3 n PHE 167 Ca 0.09 0.28 0.18 0.00 -0.05 0.00 0.00 57.45 57.95 2nx3 n PHE 167 Cb 0.46 -0.94 0.98 0.00 -0.94 0.00 0.00 39.48 39.04 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 -2.14 114.38 112.20 2nx3 h ARG 168 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 2nx3 h ARG 168 Cb 0.03 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 2nx3 h ARG 168 CO 0.00 0.03 -0.20 0.66 -1.07 0.00 0.00 179.97 179.39 2nx3 h SER 169 N 0.00 0.00 0.85 7.04 4.64 -1.60 -2.93 113.55 121.55 2nx3 h SER 169 Ca -0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2nx3 h SER 169 Cb 0.12 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.22 2nx3 h SER 169 CO 0.00 0.20 -0.41 -0.07 -0.87 0.00 0.00 176.83 175.69 2nx3 h LEU 170 N 0.00 -0.97 -1.89 5.97 4.07 -1.60 -0.21 115.31 120.69 2nx3 h LEU 170 Ca -0.00 0.03 -0.01 0.00 0.08 0.00 0.00 57.88 57.98 2nx3 h LEU 170 Cb 0.50 0.25 -0.00 0.00 1.08 0.00 0.00 40.66 42.49 2nx3 h LEU 170 CO 0.03 -0.66 -0.04 1.55 -1.08 0.00 0.00 178.44 178.23 2nx3 h PRO 171 N -1.20 0.02 -0.13 1.13 0.13 -1.74 -1.44 132.00 128.77 2nx3 h PRO 171 Ca -0.12 -0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.99 2nx3 h PRO 171 Cb 0.87 -0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.00 2nx3 h PRO 171 CO 0.19 0.06 0.01 0.82 -0.23 0.00 0.00 178.00 178.86 2nx3 h ILE 172 N 0.02 1.23 0.00 -3.56 2.04 -1.32 -3.11 117.51 112.80 2nx3 h ILE 172 Ca 0.00 -0.73 -0.10 0.00 1.00 0.00 0.00 64.86 65.03 2nx3 h ILE 172 Cb 0.09 1.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 2nx3 h ILE 172 CO 0.01 0.21 -0.48 0.24 0.00 0.00 0.00 178.15 178.13 2nx3 h MET 173 N -0.02 0.00 0.00 2.37 2.86 -0.74 -2.95 114.93 116.44 2nx3 h MET 173 Ca 0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2nx3 h MET 173 Cb 0.32 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.98 2nx3 h MET 173 CO 0.00 0.48 0.00 1.17 1.06 0.00 0.00 176.91 179.62 2nx3 n LYS 174 N -3.66 0.07 -0.14 1.72 3.00 -0.57 -2.00 118.16 116.58 2nx3 n LYS 174 Ca -0.01 0.51 -0.04 0.00 -0.00 0.00 0.00 58.31 58.77 2nx3 n LYS 174 Cb 0.55 -1.70 0.15 0.00 0.00 0.00 0.00 35.03 34.03 2nx3 n LYS 174 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.40 179.36 2nx3 h GLN 175 N 0.00 0.86 0.00 1.64 4.20 -1.58 -3.34 115.11 116.89 2nx3 h GLN 175 Ca 0.00 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.50 2nx3 h GLN 175 Cb 0.07 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.73 2nx3 h GLN 175 CO 0.00 0.82 -0.08 -2.67 -0.67 0.00 0.00 178.83 176.22 2nx3 n TRP 176 N -4.24 0.00 -3.60 2.96 2.14 -0.85 -5.10 117.44 108.76 2nx3 n TRP 176 Ca 0.03 -0.55 0.00 0.00 2.07 0.00 0.00 57.50 59.06 2nx3 n TRP 176 Cb 0.27 -0.08 -0.01 0.00 -0.81 0.00 0.00 31.31 30.67 2nx3 n TRP 176 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 2nx3 s ALA 177 N -1.45 -2.33 0.23 -1.67 0.00 -1.10 -4.97 121.76 110.47 2nx3 s ALA 177 Ca 0.13 1.43 -0.30 0.00 0.00 0.00 0.00 51.96 53.22 2nx3 s ALA 177 Cb 0.11 -0.08 -0.09 0.00 0.00 0.00 0.00 23.12 23.06 2nx3 s ALA 177 CO 0.01 -0.79 1.12 0.15 0.00 0.00 0.00 175.76 176.25 2nx3 s LYS 178 N -2.08 4.59 -0.13 0.00 1.02 -1.12 -4.09 119.74 117.93 2nx3 s LYS 178 Ca 0.13 1.79 -0.04 0.00 0.02 0.00 0.00 55.97 57.88 2nx3 s LYS 178 Cb 0.03 -3.23 -0.03 0.00 -0.52 0.00 0.00 37.83 34.08 2nx3 s LYS 178 CO -0.04 0.10 0.00 0.08 -0.92 0.00 0.00 175.35 174.57 2nx3 s VAL 179 N -0.62 4.30 -0.00 3.17 1.01 -1.26 -1.18 120.40 125.81 2nx3 s VAL 179 Ca 0.48 -0.23 0.08 0.00 0.00 0.00 0.00 61.98 62.31 2nx3 s VAL 179 Cb -0.31 -2.86 -0.02 0.00 0.00 0.00 0.00 36.38 33.18 2nx3 s VAL 179 CO 0.38 0.54 -0.25 -0.63 0.00 0.00 0.00 175.10 175.14 2nx3 s ILE 180 N -0.21 2.17 -0.28 2.22 -1.09 -0.15 0.36 121.20 124.22 2nx3 s ILE 180 Ca 0.05 -1.16 -0.08 0.00 -2.23 0.00 0.00 60.65 57.24 2nx3 s ILE 180 Cb -0.12 -1.79 -0.01 0.00 -1.58 0.00 0.00 42.46 38.96 2nx3 s ILE 180 CO 0.02 0.52 0.09 -0.47 -1.23 0.00 0.00 174.94 173.87 2nx3 s TYR 181 N -0.68 3.12 -0.81 3.97 5.04 -0.25 -0.37 117.35 127.37 2nx3 s TYR 181 Ca 0.11 -0.62 -0.25 0.00 -2.44 0.00 0.00 57.07 53.86 2nx3 s TYR 181 Cb -0.10 -2.27 0.05 0.00 0.35 0.00 0.00 41.96 39.99 2nx3 s TYR 181 CO 0.00 -0.45 1.27 0.34 -1.34 0.00 0.00 175.55 175.38 2nx3 s ASP 182 N 1.58 6.27 0.44 4.32 -1.08 0.30 0.04 116.67 128.54 2nx3 s ASP 182 Ca 0.05 -0.86 0.30 0.00 -0.52 0.00 0.00 52.55 51.52 2nx3 s ASP 182 Cb -0.16 -2.54 1.22 0.00 -1.46 0.00 0.00 42.92 39.99 2nx3 s ASP 182 CO 0.04 -1.66 1.88 0.00 0.52 0.00 0.00 175.17 175.95 2nx3 h ALA 183 N 9.85 1.00 0.03 3.66 0.00 -0.47 -3.06 119.26 130.28 2nx3 h ALA 183 Ca -0.14 0.00 -0.38 0.00 0.00 0.00 0.00 54.91 54.39 2nx3 h ALA 183 Cb 1.04 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.77 2nx3 h ALA 183 CO 1.30 0.00 -2.34 0.25 0.00 0.00 0.00 179.25 178.46 2nx3 n THR 184 N -2.77 1.56 0.42 0.00 -2.24 -1.25 -4.47 114.28 105.52 2nx3 n THR 184 Ca 0.01 -0.62 0.12 0.00 -2.27 0.00 0.00 64.05 61.30 2nx3 n THR 184 Cb 0.28 -1.43 0.22 0.00 -2.10 0.00 0.00 70.33 67.30 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 0.02 0.00 0.00 4.78 3.86 -1.90 -3.25 115.15 118.66 2nx3 h HIS 185 Ca -0.53 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.68 2nx3 h HIS 185 Cb 1.96 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.43 2nx3 h HIS 185 CO 0.04 0.00 0.00 0.77 0.86 0.00 0.00 177.93 179.60 2nx3 h SER 186 N 0.00 0.00 -0.39 2.45 0.02 -1.61 -1.73 113.55 112.29 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 0.85 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.39 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 -3.09 1.42 -2.94 2.27 0.24 -1.23 -4.70 118.33 110.31 2nx3 n VAL 187 Ca 0.00 -1.24 -0.40 0.00 -2.04 0.00 0.00 64.34 60.66 2nx3 n VAL 187 Cb 0.29 0.27 -0.05 0.00 -1.47 0.00 0.00 33.84 32.88 2nx3 n VAL 187 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 2nx3 s GLN 188 N -1.56 4.52 -0.46 7.34 0.74 -0.65 -2.56 119.66 127.04 2nx3 s GLN 188 Ca 0.33 1.12 -0.14 0.00 0.05 0.00 0.00 55.36 56.73 2nx3 s GLN 188 Cb 0.21 -3.37 0.07 0.00 1.10 0.00 0.00 33.01 31.02 2nx3 s GLN 188 CO 0.16 0.25 0.36 -0.51 -0.55 0.00 0.00 175.29 175.00 2nx3 s LEU 189 N 0.04 5.49 0.06 3.68 1.43 -0.43 -4.25 118.68 124.69 2nx3 s LEU 189 Ca 0.40 -1.37 -0.38 0.00 -1.03 0.00 0.00 54.13 51.76 2nx3 s LEU 189 Cb -0.21 -2.13 -0.18 0.00 0.03 0.00 0.00 46.19 43.70 2nx3 s LEU 189 CO 0.24 -0.61 1.23 -2.65 0.23 0.00 0.00 176.35 174.78 2nx3 n PRO 190 N 5.13 0.72 -3.60 1.29 -0.02 -1.26 0.25 135.00 137.51 2nx3 n PRO 190 Ca -0.12 0.26 -0.28 0.00 -2.02 0.00 0.00 63.50 61.34 2nx3 n PRO 190 Cb 0.43 -1.84 -0.05 0.00 -0.02 0.00 0.00 33.50 32.02 2nx3 n PRO 190 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2nx3 n GLY 191 N 2.13 -0.34 0.24 -1.23 0.00 -1.26 -4.34 105.19 100.38 2nx3 n GLY 191 Ca 0.19 0.05 -0.06 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.56 0.62 -3.02 -0.02 0.00 -1.31 -2.94 103.07 95.84 2nx3 h GLY 192 Ca -0.39 -0.55 -0.18 0.00 0.00 0.00 0.00 47.33 46.21 2nx3 h GLY 192 CO 0.58 0.50 0.23 1.04 0.00 0.00 0.00 176.54 178.90 2nx3 n LEU 193 N -4.08 4.84 0.00 3.11 4.77 0.20 -4.85 117.00 120.98 2nx3 n LEU 193 Ca -0.01 -2.51 0.00 0.00 -0.03 0.00 0.00 56.01 53.46 2nx3 n LEU 193 Cb 0.46 -0.68 0.00 0.00 -2.33 0.00 0.00 43.42 40.87 2nx3 n LEU 193 CO 0.44 0.69 0.00 0.61 -1.33 0.00 0.00 177.39 177.80 2nx3 n GLY 194 N -0.12 2.22 0.30 -0.72 0.00 -1.11 -3.80 105.19 101.96 2nx3 n GLY 194 Ca 0.30 -0.03 0.01 0.00 0.00 0.00 0.00 46.02 46.30 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 5.95 0.80 -3.59 1.61 5.68 -1.26 -4.81 116.55 120.93 2nx3 n ASP 195 Ca 0.00 -2.03 -0.09 0.00 -0.50 0.00 0.00 54.79 52.17 2nx3 n ASP 195 Cb 0.00 -0.17 -0.05 0.00 -1.14 0.00 0.00 41.12 39.76 2nx3 n ASP 195 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 2nx3 s LYS 196 N -1.72 0.48 1.22 0.11 -2.85 -1.25 -3.19 119.74 112.55 2nx3 s LYS 196 Ca 0.07 0.13 -0.19 0.00 -1.00 0.00 0.00 55.97 54.98 2nx3 s LYS 196 Cb 0.04 0.23 0.29 0.00 -2.06 0.00 0.00 37.83 36.33 2nx3 s LYS 196 CO 0.04 -0.15 1.07 -1.12 0.10 0.00 0.00 175.35 175.29 2nx3 s SER 197 N -1.04 0.71 0.00 0.03 0.01 -1.26 0.60 113.70 112.74 2nx3 s SER 197 Ca 0.00 0.77 0.00 0.00 1.31 0.00 0.00 55.95 58.03 2nx3 s SER 197 Cb -0.01 -1.10 0.00 0.00 0.21 0.00 0.00 66.02 65.12 2nx3 s SER 197 CO -0.01 -4.27 0.00 0.61 0.41 0.00 0.00 173.24 169.98 2nx3 n GLY 198 N -0.45 6.47 0.00 3.44 0.00 0.14 -4.00 105.19 110.79 2nx3 n GLY 198 Ca 0.12 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.38 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 2.67 2.10 2.78 -0.02 0.00 -1.26 -1.31 105.19 110.15 2nx3 n GLY 199 Ca 0.00 -0.78 -0.30 0.00 0.00 0.00 0.00 46.02 44.94 2nx3 n GLY 199 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2nx3 s MET 200 N -2.00 1.08 0.62 1.61 -1.94 -1.06 -4.89 119.30 112.72 2nx3 s MET 200 Ca 0.00 -1.58 0.33 0.00 -1.71 0.00 0.00 55.69 52.74 2nx3 s MET 200 Cb 0.00 -2.36 1.89 0.00 2.01 0.00 0.00 34.83 36.36 2nx3 s MET 200 CO 0.00 -1.04 2.16 -0.09 -0.01 0.00 0.00 175.02 176.04 2nx3 h ARG 201 N 7.50 0.00 0.00 2.03 2.43 -1.89 -2.56 114.38 121.89 2nx3 h ARG 201 Ca -0.08 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 2nx3 h ARG 201 Cb 0.98 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 2nx3 h ARG 201 CO 0.49 0.00 0.00 1.05 -1.51 0.00 0.00 179.97 180.00 2nx3 h GLU 202 N 0.00 0.00 -0.00 0.20 4.11 -1.94 -2.50 114.58 114.45 2nx3 h GLU 202 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.47 2nx3 h GLU 202 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2nx3 h GLU 202 CO -0.00 0.00 -0.91 1.19 0.07 0.00 0.00 179.01 179.36 2nx3 n PHE 203 N -3.00 0.00 0.17 2.06 3.72 -0.96 -4.59 117.46 114.85 2nx3 n PHE 203 Ca -0.02 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.23 2nx3 n PHE 203 Cb 0.10 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.56 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 0.14 0.19 -0.32 4.37 2.04 -1.59 -1.97 117.51 120.37 2nx3 h ILE 204 Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 2nx3 h ILE 204 Cb 0.48 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 2nx3 h ILE 204 CO 0.00 0.00 0.17 0.15 0.00 0.00 0.00 178.15 178.47 2nx3 h PHE 205 N -0.70 0.45 -0.39 1.37 3.57 -1.81 -1.59 116.94 117.83 2nx3 h PHE 205 Ca 0.00 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.54 2nx3 h PHE 205 Cb 0.69 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 39.24 2nx3 h PHE 205 CO -0.30 0.37 0.10 -1.35 -2.23 0.00 0.00 178.31 174.91 2nx3 h PRO 206 N 0.39 0.23 0.00 6.41 0.11 -1.79 -1.59 132.00 135.77 2nx3 h PRO 206 Ca 0.11 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.15 2nx3 h PRO 206 Cb 0.08 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.13 2nx3 h PRO 206 CO -0.02 0.15 -0.27 -0.07 -0.21 0.00 0.00 178.00 177.59 2nx3 h LEU 207 N 0.24 0.00 -0.45 2.35 4.07 -1.26 -2.29 115.31 117.97 2nx3 h LEU 207 Ca 0.18 0.00 -0.16 0.00 0.08 0.00 0.00 57.88 57.99 2nx3 h LEU 207 Cb 0.20 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.93 2nx3 h LEU 207 CO -0.22 0.27 -0.42 0.40 -1.08 0.00 0.00 178.44 177.39 2nx3 h ILE 208 N 0.00 1.28 -0.58 1.22 2.04 -0.57 -1.70 117.51 119.20 2nx3 h ILE 208 Ca -0.00 -1.60 -0.04 0.00 1.00 0.00 0.00 64.86 64.22 2nx3 h ILE 208 Cb 0.67 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 38.18 2nx3 h ILE 208 CO 0.03 0.52 0.18 0.03 0.00 0.00 0.00 178.15 178.92 2nx3 h ARG 209 N 0.68 0.87 -0.31 2.37 3.08 -0.80 -2.60 114.38 117.68 2nx3 h ARG 209 Ca 0.05 -0.16 -0.03 0.00 0.07 0.00 0.00 59.98 59.91 2nx3 h ARG 209 Cb 0.99 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 2nx3 h ARG 209 CO 0.10 0.75 0.07 0.00 -1.07 0.00 0.00 179.97 179.82 2nx3 h ALA 210 N 1.35 0.41 -0.60 0.04 0.00 -1.16 -2.08 119.26 117.21 2nx3 h ALA 210 Ca 0.19 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.99 2nx3 h ALA 210 Cb 0.24 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 2nx3 h ALA 210 CO -0.01 0.08 0.29 0.00 0.00 0.00 0.00 179.25 179.61 2nx3 h ALA 211 N 0.90 0.79 0.00 0.00 0.00 -0.97 0.10 119.26 120.08 2nx3 h ALA 211 Ca 0.10 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.91 2nx3 h ALA 211 Cb 0.30 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2nx3 h ALA 211 CO 0.00 -0.08 -0.65 -0.39 0.00 0.00 0.00 179.25 178.14 2nx3 h VAL 212 N 0.54 1.40 -0.25 0.00 -1.51 -1.42 0.17 116.25 115.17 2nx3 h VAL 212 Ca 0.28 -2.27 -0.08 0.00 -1.23 0.00 0.00 66.70 63.40 2nx3 h VAL 212 Cb 0.24 2.25 -0.01 0.00 -2.13 0.00 0.00 31.29 31.64 2nx3 h VAL 212 CO -0.22 0.64 -0.15 0.00 -1.23 0.00 0.00 177.57 176.61 2nx3 h ALA 213 N 1.35 0.36 0.09 5.19 0.00 -0.75 -3.15 119.26 122.36 2nx3 h ALA 213 Ca -0.01 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 2nx3 h ALA 213 Cb 1.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2nx3 h ALA 213 CO 0.08 0.25 -0.04 0.28 0.00 0.00 0.00 179.25 179.82 2nx3 h VAL 214 N 0.27 1.03 0.00 0.00 2.07 -0.87 -3.47 116.25 115.29 2nx3 h VAL 214 Ca 0.05 -0.45 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2nx3 h VAL 214 Cb 0.67 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 2nx3 h VAL 214 CO 0.04 0.11 0.00 0.61 0.02 0.00 0.00 177.57 178.35 2nx3 n GLY 215 N -0.58 2.60 3.26 2.17 0.00 0.57 -4.85 105.19 108.36 2nx3 n GLY 215 Ca -0.08 -0.92 -0.10 0.00 0.00 0.00 0.00 46.02 44.91 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 -0.21 0.47 -3.61 0.00 8.00 0.16 -4.98 116.55 116.39 2nx3 n ASP 217 Ca -0.03 -0.06 -0.02 0.00 0.71 0.00 0.00 54.79 55.39 2nx3 n ASP 217 Cb 0.64 0.12 -0.01 0.00 -0.02 0.00 0.00 41.12 41.85 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 -3.14 -0.31 0.02 0.44 0.00 -1.14 -1.90 107.32 101.29 2nx3 s GLY 218 Ca 0.10 1.48 0.06 0.00 0.00 0.00 0.00 44.72 46.37 2nx3 s GLY 218 CO 0.68 0.46 -0.16 0.14 0.00 0.00 0.00 173.10 174.22 2nx3 s VAL 219 N -2.24 2.94 -0.22 1.40 1.01 -0.07 -1.09 120.40 122.14 2nx3 s VAL 219 Ca 0.12 -1.04 0.01 0.00 0.00 0.00 0.00 61.98 61.06 2nx3 s VAL 219 Cb 0.01 -2.23 0.03 0.00 0.00 0.00 0.00 36.38 34.20 2nx3 s VAL 219 CO -0.04 0.39 -0.14 0.12 0.00 0.00 0.00 175.10 175.44 2nx3 s PHE 220 N -0.90 2.99 -0.08 5.22 5.36 0.11 -1.11 117.98 129.57 2nx3 s PHE 220 Ca 0.14 -1.80 -0.03 0.00 -0.96 0.00 0.00 56.93 54.29 2nx3 s PHE 220 Cb -0.11 -1.96 0.04 0.00 -0.34 0.00 0.00 43.02 40.66 2nx3 s PHE 220 CO 0.05 -0.80 0.15 0.00 -1.46 0.00 0.00 175.22 173.15 2nx3 s MET 221 N 1.25 0.04 0.29 10.12 0.23 0.08 0.28 119.30 131.60 2nx3 s MET 221 Ca -0.00 0.49 -0.26 0.00 -1.03 0.00 0.00 55.69 54.90 2nx3 s MET 221 Cb -0.16 -0.25 -0.09 0.00 -1.53 0.00 0.00 34.83 32.79 2nx3 s MET 221 CO -0.08 -0.26 0.90 -1.21 -2.03 0.00 0.00 175.02 172.33 2nx3 s GLU 222 N 1.94 4.57 0.17 3.16 2.02 -1.26 -3.50 118.70 125.79 2nx3 s GLU 222 Ca -0.01 1.27 0.02 0.00 0.02 0.00 0.00 54.97 56.27 2nx3 s GLU 222 Cb -0.12 -2.89 -0.05 0.00 0.10 0.00 0.00 34.13 31.17 2nx3 s GLU 222 CO -0.06 0.34 -0.01 -0.08 0.02 0.00 0.00 175.26 175.47 2nx3 s THR 223 N -1.53 0.74 -0.28 3.63 -1.32 0.08 -1.86 115.64 115.10 2nx3 s THR 223 Ca 0.47 -1.99 -0.24 0.00 -1.21 0.00 0.00 61.69 58.73 2nx3 s THR 223 Cb -0.19 -2.08 0.09 0.00 -1.51 0.00 0.00 72.50 68.81 2nx3 s THR 223 CO 0.24 -0.52 0.84 -2.28 -2.21 0.00 0.00 174.62 170.69 2nx3 s HIS 224 N -3.62 -0.70 0.56 9.09 5.04 -0.55 -2.88 115.29 122.23 2nx3 s HIS 224 Ca 0.23 1.65 0.29 0.00 -1.54 0.00 0.00 55.06 55.69 2nx3 s HIS 224 Cb 0.06 0.34 1.76 0.00 0.04 0.00 0.00 32.58 34.77 2nx3 s HIS 224 CO 0.03 -0.34 2.23 -1.00 -2.34 0.00 0.00 174.74 173.32 2nx3 h PRO 225 N 4.99 0.00 -2.00 2.88 0.13 -1.94 -2.03 132.00 134.02 2nx3 h PRO 225 Ca -0.29 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.34 2nx3 h PRO 225 Cb 1.17 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 31.97 2nx3 h PRO 225 CO 0.09 0.02 -0.91 0.39 -0.23 0.00 0.00 178.00 177.36 2nx3 n GLU 226 N -3.83 0.35 -0.36 0.86 1.02 -1.26 -4.62 120.64 112.80 2nx3 n GLU 226 Ca -0.03 -2.95 0.26 0.00 -0.02 0.00 0.00 57.16 54.42 2nx3 n GLU 226 Cb 0.11 -1.55 0.51 0.00 -0.02 0.00 0.00 31.44 30.49 2nx3 n GLU 226 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2nx3 h PRO 227 N 5.19 0.32 -0.82 3.49 0.11 -1.83 -0.51 132.00 137.94 2nx3 h PRO 227 Ca 0.19 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.28 2nx3 h PRO 227 Cb 0.94 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.98 2nx3 h PRO 227 CO 0.33 0.21 0.00 0.39 -0.21 0.00 0.00 178.00 178.72 2nx3 n GLU 228 N -4.80 0.70 0.00 1.05 1.02 -1.26 -2.16 120.64 115.19 2nx3 n GLU 228 Ca 0.30 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.44 2nx3 n GLU 228 Cb 1.02 -1.31 0.00 0.00 -0.02 0.00 0.00 31.44 31.12 2nx3 n GLU 228 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2nx3 n LYS 229 N 0.25 0.00 -1.64 3.49 5.02 -0.20 -5.10 118.16 119.98 2nx3 n LYS 229 Ca 0.00 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.87 2nx3 n LYS 229 Cb 0.21 -0.15 0.00 0.00 -0.02 0.00 0.00 35.03 35.07 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 0.00 0.48 1.67 7.82 0.00 -0.92 -4.85 120.51 124.71 2nx3 n ALA 230 Ca 0.00 0.28 0.15 0.00 0.00 0.00 0.00 53.44 53.87 2nx3 n ALA 230 Cb 0.08 -2.13 0.83 0.00 0.00 0.00 0.00 19.45 18.23 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 0.61 0.00 -3.62 0.00 4.77 -1.26 -4.50 117.00 113.00 2nx3 n LEU 231 Ca 0.08 0.14 -0.15 0.00 -0.03 0.00 0.00 56.01 56.05 2nx3 n LEU 231 Cb 0.38 -0.14 -0.07 0.00 -2.33 0.00 0.00 43.42 41.26 2nx3 n LEU 231 CO 0.59 -0.00 0.34 -0.55 -1.33 0.00 0.00 177.39 176.44 2nx3 s SER 232 N -2.27 -0.62 -1.76 -1.43 0.15 -1.26 -4.58 113.70 101.92 2nx3 s SER 232 Ca 0.37 0.99 -0.19 0.00 0.70 0.00 0.00 55.95 57.83 2nx3 s SER 232 Cb 0.20 0.96 0.18 0.00 -1.71 0.00 0.00 66.02 65.65 2nx3 s SER 232 CO 0.40 -0.38 0.66 0.47 1.20 0.00 0.00 173.24 175.60 2nx3 n ASP 233 N 1.98 -2.42 -0.36 5.45 10.43 -1.26 -4.84 116.55 125.53 2nx3 n ASP 233 Ca -0.16 -1.12 0.02 0.00 2.57 0.00 0.00 54.79 56.11 2nx3 n ASP 233 Cb 0.56 -2.27 0.18 0.00 1.84 0.00 0.00 41.12 41.43 2nx3 n ASP 233 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2nx3 h ALA 234 N 0.89 1.40 0.00 2.24 0.00 -1.80 -1.65 119.26 120.35 2nx3 h ALA 234 Ca -0.60 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2nx3 h ALA 234 Cb 1.39 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2nx3 h ALA 234 CO 0.82 0.46 0.00 -2.30 0.00 0.00 0.00 179.25 178.22 2nx3 n PRO 235 N -4.49 0.35 0.00 0.00 -0.02 -1.26 -2.72 135.00 126.86 2nx3 n PRO 235 Ca 0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 2nx3 n PRO 235 Cb 0.17 -1.10 0.00 0.00 -0.02 0.00 0.00 33.50 32.55 2nx3 n PRO 235 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2nx3 n THR 236 N -0.60 0.05 -2.86 3.45 -2.24 -0.63 -4.01 114.28 107.44 2nx3 n THR 236 Ca 0.02 -0.15 -0.41 0.00 -2.27 0.00 0.00 64.05 61.23 2nx3 n THR 236 Cb 0.01 1.58 -0.04 0.00 -2.10 0.00 0.00 70.33 69.78 2nx3 n THR 236 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nx3 s ALA 237 N -0.05 3.31 0.13 6.98 0.00 -1.10 -4.78 121.76 126.24 2nx3 s ALA 237 Ca 0.00 0.29 -0.30 0.00 0.00 0.00 0.00 51.96 51.95 2nx3 s ALA 237 Cb 0.00 -3.19 -0.06 0.00 0.00 0.00 0.00 23.12 19.86 2nx3 s ALA 237 CO 0.00 -0.30 0.95 -0.51 0.00 0.00 0.00 175.76 175.90 2nx3 s LEU 238 N 1.24 4.52 -0.04 0.00 1.43 -0.78 -4.67 118.68 120.38 2nx3 s LEU 238 Ca 0.44 1.80 -0.29 0.00 -1.03 0.00 0.00 54.13 55.04 2nx3 s LEU 238 Cb -0.19 -3.57 -0.08 0.00 0.03 0.00 0.00 46.19 42.39 2nx3 s LEU 238 CO 0.21 -0.02 2.00 -2.84 0.23 0.00 0.00 176.35 175.93 2nx3 s PRO 239 N -0.20 3.89 0.55 1.29 0.02 -1.26 -1.49 135.00 137.79 2nx3 s PRO 239 Ca 0.45 2.43 0.49 0.00 0.02 0.00 0.00 61.00 64.39 2nx3 s PRO 239 Cb -0.24 -4.20 1.71 0.00 0.02 0.00 0.00 34.50 31.79 2nx3 s PRO 239 CO 0.30 -1.24 1.55 -0.11 -0.33 0.00 0.00 177.00 177.17 2nx3 n LEU 240 N 8.55 0.02 0.16 -5.54 7.94 -0.76 0.33 117.00 127.69 2nx3 n LEU 240 Ca 0.22 1.02 0.00 0.00 -1.11 0.00 0.00 56.01 56.15 2nx3 n LEU 240 Cb 0.42 -0.51 0.25 0.00 0.53 0.00 0.00 43.42 44.11 2nx3 n LEU 240 CO 0.67 -1.03 0.58 0.77 -1.11 0.00 0.00 177.39 177.27 2nx3 h SER 241 N 0.00 0.00 0.78 1.96 4.64 -1.87 -3.07 113.55 115.98 2nx3 h SER 241 Ca 0.94 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.26 2nx3 h SER 241 Cb 3.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 65.79 2nx3 h SER 241 CO -0.05 0.52 -0.16 0.00 -0.87 0.00 0.00 176.83 176.28 2nx3 n GLN 242 N -3.88 0.07 -0.29 4.77 6.02 0.15 -4.17 117.38 120.06 2nx3 n GLN 242 Ca -0.01 -0.02 0.05 0.00 -0.01 0.00 0.00 57.00 57.00 2nx3 n GLN 242 Cb 0.54 -1.50 0.19 0.00 1.02 0.00 0.00 30.24 30.49 2nx3 n GLN 242 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 2nx3 h LEU 243 N 0.05 0.61 -0.17 1.08 5.85 -1.55 -2.52 115.31 118.66 2nx3 h LEU 243 Ca 0.00 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 2nx3 h LEU 243 Cb 0.48 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 2nx3 h LEU 243 CO 0.00 0.32 0.02 -0.08 -0.34 0.00 0.00 178.44 178.35 2nx3 h GLU 244 N 0.72 0.29 -0.95 1.25 4.81 -1.80 -2.17 114.58 116.73 2nx3 h GLU 244 Ca 0.42 -0.08 0.10 0.00 -0.13 0.00 0.00 59.36 59.67 2nx3 h GLU 244 Cb 0.49 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.76 2nx3 h GLU 244 CO -0.30 0.48 0.61 0.78 -0.73 0.00 0.00 179.01 179.85 2nx3 h GLY 245 N 0.06 1.43 0.79 1.92 0.00 -1.73 -1.59 103.07 103.96 2nx3 h GLY 245 Ca 0.05 -0.41 -0.05 0.00 0.00 0.00 0.00 47.33 46.92 2nx3 h GLY 245 CO 0.01 0.22 -0.10 -2.22 0.00 0.00 0.00 176.54 174.45 2nx3 h ILE 246 N 0.98 1.31 -0.80 2.60 1.08 -1.33 -2.08 117.51 119.27 2nx3 h ILE 246 Ca 0.44 -1.17 0.02 0.00 -0.39 0.00 0.00 64.86 63.77 2nx3 h ILE 246 Cb 0.38 1.68 -0.04 0.00 -3.07 0.00 0.00 36.82 35.77 2nx3 h ILE 246 CO -0.20 0.35 0.52 0.40 -0.69 0.00 0.00 178.15 178.53 2nx3 h ILE 247 N 0.08 1.16 -0.55 -0.67 2.04 -0.93 0.38 117.51 119.02 2nx3 h ILE 247 Ca 0.04 -0.36 -0.07 0.00 1.00 0.00 0.00 64.86 65.48 2nx3 h ILE 247 Cb 0.59 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.68 2nx3 h ILE 247 CO 0.03 0.19 0.08 -0.08 0.00 0.00 0.00 178.15 178.37 2nx3 h GLU 248 N 1.03 0.91 -0.10 2.37 4.57 -1.28 -2.25 114.58 119.83 2nx3 h GLU 248 Ca 0.31 -0.25 -0.00 0.00 -1.18 0.00 0.00 59.36 58.24 2nx3 h GLU 248 Cb -0.05 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.43 2nx3 h GLU 248 CO -0.09 0.88 0.05 0.00 -1.18 0.00 0.00 179.01 178.67 2nx3 h ALA 249 N 0.99 0.13 0.00 2.92 0.00 -0.73 -1.83 119.26 120.73 2nx3 h ALA 249 Ca 0.16 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2nx3 h ALA 249 Cb 0.42 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2nx3 h ALA 249 CO 0.01 -0.32 -0.23 -0.84 0.00 0.00 0.00 179.25 177.87 2nx3 h ILE 250 N 0.05 0.95 0.06 0.00 3.07 -0.88 -1.50 117.51 119.25 2nx3 h ILE 250 Ca 0.03 -0.84 -0.25 0.00 1.55 0.00 0.00 64.86 65.36 2nx3 h ILE 250 Cb 0.10 1.48 0.01 0.00 -0.27 0.00 0.00 36.82 38.14 2nx3 h ILE 250 CO -0.00 0.22 -1.08 -0.07 -1.05 0.00 0.00 178.15 176.17 2nx3 h LEU 251 N 0.00 0.51 -0.35 0.16 3.38 -1.21 -0.34 115.31 117.47 2nx3 h LEU 251 Ca -0.00 -0.46 -0.04 0.00 0.09 0.00 0.00 57.88 57.47 2nx3 h LEU 251 Cb 0.46 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2nx3 h LEU 251 CO 0.03 1.30 0.07 -0.33 0.09 0.00 0.00 178.44 179.59 2nx3 h GLU 252 N 0.17 0.57 -0.16 1.13 5.08 -0.95 -0.89 114.58 119.53 2nx3 h GLU 252 Ca -0.11 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.09 2nx3 h GLU 252 Cb 1.75 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.92 2nx3 h GLU 252 CO 0.18 0.64 0.05 0.82 -1.00 0.00 0.00 179.01 179.70 2nx3 h ILE 253 N 0.41 1.18 -0.89 3.13 2.04 -1.29 -2.87 117.51 119.22 2nx3 h ILE 253 Ca 0.11 -0.55 0.06 0.00 1.00 0.00 0.00 64.86 65.48 2nx3 h ILE 253 Cb 0.34 1.25 -0.06 0.00 -0.74 0.00 0.00 36.82 37.61 2nx3 h ILE 253 CO 0.00 0.17 0.56 -0.09 0.00 0.00 0.00 178.15 178.79 2nx3 h ARG 254 N 0.08 0.99 -0.55 2.37 2.43 -0.96 0.91 114.38 119.64 2nx3 h ARG 254 Ca 0.05 -0.06 0.11 0.00 -0.81 0.00 0.00 59.98 59.27 2nx3 h ARG 254 Cb 0.22 -0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 29.51 2nx3 h ARG 254 CO -0.00 0.65 0.37 1.49 -1.51 0.00 0.00 179.97 180.98 2nx3 h GLU 255 N 1.02 0.27 0.05 0.20 4.81 -0.94 0.10 114.58 120.08 2nx3 h GLU 255 Ca 0.38 -0.02 -0.38 0.00 -0.13 0.00 0.00 59.36 59.22 2nx3 h GLU 255 Cb 0.16 -0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.43 2nx3 h GLU 255 CO -0.17 0.18 -2.28 0.28 -0.73 0.00 0.00 179.01 176.29 2nx3 n VAL 256 N -4.45 1.60 0.18 0.32 0.31 -0.68 -4.44 118.33 111.17 2nx3 n VAL 256 Ca 0.09 -0.58 0.03 0.00 -0.01 0.00 0.00 64.34 63.88 2nx3 n VAL 256 Cb 0.42 -1.58 0.33 0.00 -0.91 0.00 0.00 33.84 32.10 2nx3 n VAL 256 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2nx3 h ALA 257 N -0.04 1.15 0.00 3.52 0.00 -0.72 -3.18 119.26 119.99 2nx3 h ALA 257 Ca -0.52 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.00 2nx3 h ALA 257 Cb 1.92 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.64 2nx3 h ALA 257 CO -0.05 0.53 -0.01 0.66 0.00 0.00 0.00 179.25 180.38 2nx3 h SER 258 N 0.00 0.00 0.63 0.00 4.64 -1.19 -1.29 113.55 116.34 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 0.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 2nx3 h SER 258 CO 0.06 0.01 0.00 0.11 -0.87 0.00 0.00 176.83 176.13 2nx3 h LYS 259 N 0.00 0.00 -0.15 4.77 1.57 -1.81 -2.96 116.57 117.99 2nx3 h LYS 259 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2nx3 h LYS 259 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 2nx3 h LYS 259 CO 0.00 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.54 2nx3 n TYR 260 N -2.95 0.19 -1.94 -1.35 4.01 -0.49 -5.02 117.16 109.60 2nx3 n TYR 260 Ca -0.00 -0.25 -0.42 0.00 -0.16 0.00 0.00 57.90 57.07 2nx3 n TYR 260 Cb 0.21 -0.02 -0.03 0.00 -0.31 0.00 0.00 39.34 39.20 2nx3 n TYR 260 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 2nx3 s TYR 261 N -0.88 3.02 0.57 -0.72 2.02 -1.12 -4.97 117.35 115.27 2nx3 s TYR 261 Ca 0.15 0.77 -0.19 0.00 -0.37 0.00 0.00 57.07 57.43 2nx3 s TYR 261 Cb 0.09 -3.91 -0.05 0.00 -0.40 0.00 0.00 41.96 37.69 2nx3 s TYR 261 CO 0.12 -3.20 1.15 -1.21 -1.57 0.00 0.00 175.55 170.84 2nx3 s GLU 262 N 0.48 3.19 -0.09 -0.62 8.01 -1.26 -4.97 118.70 123.43 2nx3 s GLU 262 Ca 0.66 1.65 -0.26 0.00 0.01 0.00 0.00 54.97 57.04 2nx3 s GLU 262 Cb -0.44 -1.98 -0.03 0.00 -4.31 0.00 0.00 34.13 27.38 2nx3 s GLU 262 CO 0.37 -0.99 0.81 0.99 0.01 0.00 0.00 175.26 176.45 2nx3 s THR 263 N -1.77 4.94 0.00 3.63 2.01 -1.26 -5.17 115.64 118.02 2nx3 s THR 263 Ca 0.74 1.65 0.00 0.00 0.31 0.00 0.00 61.69 64.39 2nx3 s THR 263 Cb -0.25 -4.14 0.00 0.00 0.01 0.00 0.00 72.50 68.12 2nx3 s THR 263 CO 0.30 0.14 0.00 -0.38 -0.69 0.00 0.00 174.62 173.99