#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 3.18 -0.15 5.64 5.36 -1.25 -4.85 117.98 125.91 2nx3 s PHE 4 Ca 0.00 1.53 -0.07 0.00 -0.96 0.00 0.00 56.93 57.43 2nx3 s PHE 4 Cb 0.00 -3.50 -0.04 0.00 -0.34 0.00 0.00 43.02 39.14 2nx3 s PHE 4 CO 0.00 -1.38 0.08 -1.17 -1.46 0.00 0.00 175.22 171.29 2nx3 s LEU 5 N -1.94 3.97 -0.28 6.12 0.20 -0.71 -1.38 118.68 124.66 2nx3 s LEU 5 Ca 0.50 0.20 0.00 0.00 0.69 0.00 0.00 54.13 55.53 2nx3 s LEU 5 Cb -0.35 -1.98 0.08 0.00 -0.43 0.00 0.00 46.19 43.51 2nx3 s LEU 5 CO 0.46 0.27 0.04 -0.69 -0.29 0.00 0.00 176.35 176.13 2nx3 s VAL 6 N -0.17 1.25 -0.23 1.68 1.01 -0.73 -1.16 120.40 122.04 2nx3 s VAL 6 Ca 0.08 -1.38 -0.16 0.00 0.00 0.00 0.00 61.98 60.52 2nx3 s VAL 6 Cb -0.12 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 2nx3 s VAL 6 CO 0.01 -0.43 0.39 -0.63 0.00 0.00 0.00 175.10 174.44 2nx3 s ILE 7 N 1.47 5.18 0.15 2.22 1.01 -0.22 -1.79 121.20 129.22 2nx3 s ILE 7 Ca 0.04 0.66 -0.14 0.00 0.00 0.00 0.00 60.65 61.21 2nx3 s ILE 7 Cb -0.18 -3.72 0.02 0.00 0.01 0.00 0.00 42.46 38.59 2nx3 s ILE 7 CO -0.14 0.20 0.38 0.00 0.00 0.00 0.00 174.94 175.38 2nx3 s ALA 8 N 1.66 -0.60 0.00 9.38 0.00 -1.00 -0.64 121.76 130.56 2nx3 s ALA 8 Ca 0.17 -0.39 0.00 0.00 0.00 0.00 0.00 51.96 51.75 2nx3 s ALA 8 Cb -0.15 0.75 0.00 0.00 0.00 0.00 0.00 23.12 23.72 2nx3 s ALA 8 CO 0.09 -0.67 0.00 0.41 0.00 0.00 0.00 175.76 175.58 2nx3 n GLY 9 N -0.23 0.03 3.77 0.00 0.00 -1.22 -1.48 105.19 106.06 2nx3 n GLY 9 Ca -0.12 -1.69 -0.39 0.00 0.00 0.00 0.00 46.02 43.82 2nx3 n GLY 9 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2nx3 s PRO 10 N -1.83 4.04 0.08 1.61 0.02 -1.18 -1.52 135.00 136.22 2nx3 s PRO 10 Ca 0.00 2.03 -0.24 0.00 0.02 0.00 0.00 61.00 62.80 2nx3 s PRO 10 Cb 0.00 -2.76 -0.16 0.00 0.02 0.00 0.00 34.50 31.60 2nx3 s PRO 10 CO 0.00 -0.39 1.68 -0.97 -0.33 0.00 0.00 177.00 176.99 2nx3 h ASN 11 N 2.74 -0.10 -4.41 2.53 -1.24 -1.85 -3.33 115.58 109.92 2nx3 h ASN 11 Ca -0.49 -0.04 -0.39 0.00 0.71 0.00 0.00 56.30 56.09 2nx3 h ASN 11 Cb 1.24 0.03 -0.20 0.00 0.73 0.00 0.00 38.32 40.11 2nx3 h ASN 11 CO 0.63 -0.03 -0.77 0.00 -1.29 0.00 0.00 177.43 175.97 2nx3 s ALA 12 N -5.99 1.19 -0.85 1.57 0.00 -1.26 -1.93 121.76 114.49 2nx3 s ALA 12 Ca -0.14 -1.06 -0.25 0.00 0.00 0.00 0.00 51.96 50.52 2nx3 s ALA 12 Cb 0.05 -0.07 -0.00 0.00 0.00 0.00 0.00 23.12 23.10 2nx3 s ALA 12 CO 0.65 0.12 1.68 0.42 0.00 0.00 0.00 175.76 178.64 2nx3 s ILE 13 N -1.56 3.61 -0.12 0.00 1.01 0.29 -4.75 121.20 119.68 2nx3 s ILE 13 Ca 0.00 -0.25 0.14 0.00 0.00 0.00 0.00 60.65 60.55 2nx3 s ILE 13 Cb -0.08 -4.44 -0.02 0.00 0.01 0.00 0.00 42.46 37.93 2nx3 s ILE 13 CO 0.02 -1.37 1.27 -0.33 0.00 0.00 0.00 174.94 174.54 2nx3 h GLU 14 N 11.39 0.00 -1.25 2.79 5.08 -1.98 -3.39 114.58 127.22 2nx3 h GLU 14 Ca -0.00 0.00 0.29 0.00 -1.00 0.00 0.00 59.36 58.65 2nx3 h GLU 14 Cb 1.04 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 30.09 2nx3 h GLU 14 CO 1.29 0.51 0.90 -1.54 -1.00 0.00 0.00 179.01 179.16 2nx3 s SER 15 N -6.33 -0.08 0.30 1.42 1.04 -1.26 -4.98 113.70 103.82 2nx3 s SER 15 Ca 0.02 0.01 0.26 0.00 0.48 0.00 0.00 55.95 56.71 2nx3 s SER 15 Cb 0.08 0.08 0.87 0.00 0.10 0.00 0.00 66.02 67.14 2nx3 s SER 15 CO 0.77 -0.12 1.76 -0.08 0.98 0.00 0.00 173.24 176.54 2nx3 h GLU 16 N 2.01 0.00 -0.08 4.02 4.81 -1.96 -2.51 114.58 120.86 2nx3 h GLU 16 Ca -0.06 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.01 2nx3 h GLU 16 Cb 1.15 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 2nx3 h GLU 16 CO 0.21 0.00 -0.65 1.49 -0.73 0.00 0.00 179.01 179.33 2nx3 h GLU 17 N 0.00 0.32 0.01 1.92 4.81 -2.00 -2.91 114.58 116.73 2nx3 h GLU 17 Ca 0.00 -0.23 -0.09 0.00 -0.13 0.00 0.00 59.36 58.91 2nx3 h GLU 17 Cb 0.63 0.04 0.01 0.00 0.63 0.00 0.00 28.75 30.06 2nx3 h GLU 17 CO 0.00 0.86 -0.35 1.25 -0.73 0.00 0.00 179.01 180.04 2nx3 h LEU 18 N 0.23 0.29 0.08 1.64 5.85 -1.84 -2.91 115.31 118.64 2nx3 h LEU 18 Ca -0.01 -0.80 0.02 0.00 0.84 0.00 0.00 57.88 57.93 2nx3 h LEU 18 Cb 1.19 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 2nx3 h LEU 18 CO 0.11 1.06 -0.31 -0.07 -0.34 0.00 0.00 178.44 178.88 2nx3 h LEU 19 N -0.44 -0.91 -1.71 2.25 4.07 -1.52 -0.08 115.31 116.97 2nx3 h LEU 19 Ca -0.05 0.11 -0.04 0.00 0.08 0.00 0.00 57.88 57.99 2nx3 h LEU 19 Cb 1.12 0.35 -0.01 0.00 1.08 0.00 0.00 40.66 43.21 2nx3 h LEU 19 CO 0.07 -0.39 -0.18 -0.07 -1.08 0.00 0.00 178.44 176.79 2nx3 h LEU 20 N -0.51 0.00 0.17 1.67 3.38 -1.66 0.70 115.31 119.07 2nx3 h LEU 20 Ca 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2nx3 h LEU 20 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2nx3 h LEU 20 CO -0.21 0.18 -0.08 0.50 0.09 0.00 0.00 178.44 178.92 2nx3 h LYS 21 N 0.00 -0.22 0.05 1.13 1.63 -1.11 -1.90 116.57 116.15 2nx3 h LYS 21 Ca -0.00 0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.81 2nx3 h LYS 21 Cb 0.38 0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.06 2nx3 h LYS 21 CO 0.02 0.08 -0.02 0.28 -3.45 0.00 0.00 179.45 176.36 2nx3 h VAL 22 N -0.53 1.30 -0.80 2.00 2.07 -0.77 -3.11 116.25 116.42 2nx3 h VAL 22 Ca -0.02 -1.28 0.23 0.00 0.82 0.00 0.00 66.70 66.45 2nx3 h VAL 22 Cb 0.40 2.12 -0.03 0.00 -1.52 0.00 0.00 31.29 32.26 2nx3 h VAL 22 CO 0.04 0.31 0.74 1.23 0.02 0.00 0.00 177.57 179.92 2nx3 h GLY 23 N -0.65 0.00 0.94 2.17 0.00 0.35 0.37 103.07 106.25 2nx3 h GLY 23 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.23 2nx3 h GLY 23 CO 0.01 0.00 -0.16 -2.09 0.00 0.00 0.00 176.54 174.30 2nx3 h GLU 24 N 0.00 0.68 -0.20 4.80 4.81 -1.26 0.26 114.58 123.67 2nx3 h GLU 24 Ca 0.38 -0.30 -0.05 0.00 -0.13 0.00 0.00 59.36 59.25 2nx3 h GLU 24 Cb 1.86 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 31.22 2nx3 h GLU 24 CO -0.00 0.90 -0.08 1.49 -0.73 0.00 0.00 179.01 180.59 2nx3 h GLU 25 N 0.45 0.41 -0.68 1.92 4.57 -0.36 -1.81 114.58 119.08 2nx3 h GLU 25 Ca 0.07 -0.17 0.05 0.00 -1.18 0.00 0.00 59.36 58.13 2nx3 h GLU 25 Cb 0.70 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.23 2nx3 h GLU 25 CO 0.05 0.68 0.45 0.82 -1.18 0.00 0.00 179.01 179.83 2nx3 h ILE 26 N 0.12 1.05 -0.69 2.32 2.04 -1.30 0.14 117.51 121.19 2nx3 h ILE 26 Ca 0.05 -0.26 -0.06 0.00 1.00 0.00 0.00 64.86 65.59 2nx3 h ILE 26 Cb 0.55 0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 2nx3 h ILE 26 CO 0.03 0.14 0.21 0.50 0.00 0.00 0.00 178.15 179.02 2nx3 h LYS 27 N 0.75 1.08 -0.49 2.37 1.63 -0.60 -0.15 116.57 121.16 2nx3 h LYS 27 Ca 0.28 -0.24 -0.13 0.00 -0.85 0.00 0.00 60.65 59.72 2nx3 h LYS 27 Cb 0.17 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.64 2nx3 h LYS 27 CO -0.09 0.94 -0.21 -0.09 -3.45 0.00 0.00 179.45 176.55 2nx3 h ARG 28 N 1.02 1.00 -0.26 1.90 2.43 -0.21 -2.38 114.38 117.88 2nx3 h ARG 28 Ca 0.22 -0.43 -0.05 0.00 -0.81 0.00 0.00 59.98 58.91 2nx3 h ARG 28 Cb 0.31 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.81 2nx3 h ARG 28 CO -0.01 1.11 -0.06 -0.07 -1.51 0.00 0.00 179.97 179.43 2nx3 h LEU 29 N 0.86 0.39 -0.62 3.80 3.38 -0.44 0.38 115.31 123.06 2nx3 h LEU 29 Ca 0.11 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2nx3 h LEU 29 Cb 0.79 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.44 2nx3 h LEU 29 CO 0.07 0.50 0.00 0.77 0.09 0.00 0.00 178.44 179.87 2nx3 h SER 30 N 0.40 0.00 0.20 -0.43 4.64 -0.76 -0.79 113.55 116.81 2nx3 h SER 30 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2nx3 h SER 30 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2nx3 h SER 30 CO 0.02 0.00 -0.25 -0.62 -0.87 0.00 0.00 176.83 175.11 2nx3 n GLU 31 N -2.65 0.93 -0.04 4.77 -0.58 0.07 -4.10 120.64 119.05 2nx3 n GLU 31 Ca 0.03 -0.57 -0.04 0.00 -0.42 0.00 0.00 57.16 56.16 2nx3 n GLU 31 Cb 0.35 -1.49 -0.05 0.00 -0.57 0.00 0.00 31.44 29.69 2nx3 n GLU 31 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 2nx3 n LYS 32 N -0.54 2.18 -3.68 3.49 4.81 -0.86 -4.81 118.16 118.75 2nx3 n LYS 32 Ca 0.13 0.01 -0.35 0.00 -0.87 0.00 0.00 58.31 57.23 2nx3 n LYS 32 Cb 0.36 -1.17 -0.07 0.00 0.02 0.00 0.00 35.03 34.16 2nx3 n LYS 32 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 2nx3 s PHE 33 N -2.16 3.82 0.40 5.64 0.08 -0.34 -4.91 117.98 120.50 2nx3 s PHE 33 Ca -0.06 -3.05 0.22 0.00 0.12 0.00 0.00 56.93 54.16 2nx3 s PHE 33 Cb 0.02 -3.17 1.19 0.00 -0.57 0.00 0.00 43.02 40.49 2nx3 s PHE 33 CO 0.25 -0.72 2.00 0.87 -0.10 0.00 0.00 175.22 177.52 2nx3 h LYS 34 N 6.01 0.00 -0.05 0.44 1.79 -1.85 -2.26 116.57 120.65 2nx3 h LYS 34 Ca 0.14 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.61 2nx3 h LYS 34 Cb 0.82 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.47 2nx3 h LYS 34 CO 0.83 0.18 0.00 -0.85 -1.08 0.00 0.00 179.45 178.53 2nx3 n GLU 35 N -3.86 1.24 -4.45 3.15 0.00 -1.26 -4.80 120.64 110.66 2nx3 n GLU 35 Ca -0.02 -0.36 -0.34 0.00 0.00 0.00 0.00 57.16 56.44 2nx3 n GLU 35 Cb 0.28 -1.33 -0.10 0.00 0.00 0.00 0.00 31.44 30.29 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 -1.93 4.06 -0.72 3.84 1.01 -0.85 -3.91 120.40 121.90 2nx3 s VAL 36 Ca 0.30 -0.33 -0.12 0.00 0.00 0.00 0.00 61.98 61.82 2nx3 s VAL 36 Cb 0.14 -2.71 0.19 0.00 0.00 0.00 0.00 36.38 34.00 2nx3 s VAL 36 CO 0.23 0.58 0.64 -0.70 0.00 0.00 0.00 175.10 175.85 2nx3 s GLU 37 N -0.61 3.24 0.52 2.72 2.12 -0.48 -4.99 118.70 121.22 2nx3 s GLU 37 Ca 0.10 -2.30 -0.19 0.00 0.36 0.00 0.00 54.97 52.94 2nx3 s GLU 37 Cb -0.12 -4.25 -0.07 0.00 0.26 0.00 0.00 34.13 29.95 2nx3 s GLU 37 CO 0.02 -1.27 1.05 -0.06 -0.54 0.00 0.00 175.26 174.46 2nx3 s PHE 38 N 0.46 2.95 -0.22 5.30 0.08 -1.26 -1.78 117.98 123.51 2nx3 s PHE 38 Ca 0.14 1.56 -0.03 0.00 0.12 0.00 0.00 56.93 58.72 2nx3 s PHE 38 Cb -0.16 -3.08 0.11 0.00 -0.57 0.00 0.00 43.02 39.31 2nx3 s PHE 38 CO -0.05 -0.98 0.27 0.08 -0.10 0.00 0.00 175.22 174.44 2nx3 s VAL 39 N -2.06 -0.41 0.14 -0.44 1.01 -0.74 -4.44 120.40 113.46 2nx3 s VAL 39 Ca 0.67 -0.13 -0.31 0.00 0.00 0.00 0.00 61.98 62.21 2nx3 s VAL 39 Cb -0.17 -0.74 -0.09 0.00 0.00 0.00 0.00 36.38 35.38 2nx3 s VAL 39 CO 0.24 -0.20 1.50 0.12 0.00 0.00 0.00 175.10 176.76 2nx3 s PHE 40 N 2.39 3.12 0.06 5.22 5.36 -0.81 -2.39 117.98 130.94 2nx3 s PHE 40 Ca 0.09 0.75 0.06 0.00 -0.96 0.00 0.00 56.93 56.87 2nx3 s PHE 40 Cb -0.16 -3.83 -0.03 0.00 -0.34 0.00 0.00 43.02 38.67 2nx3 s PHE 40 CO -0.14 -3.01 -0.16 0.21 -1.46 0.00 0.00 175.22 170.65 2nx3 s LYS 41 N 1.16 1.02 -0.29 10.12 2.36 -0.55 -1.88 119.74 131.69 2nx3 s LYS 41 Ca 0.68 -0.90 -0.23 0.00 -2.55 0.00 0.00 55.97 52.97 2nx3 s LYS 41 Cb -0.41 -1.09 0.18 0.00 -1.05 0.00 0.00 37.83 35.46 2nx3 s LYS 41 CO 0.31 0.26 1.31 0.45 1.55 0.00 0.00 175.35 179.24 2nx3 s SER 42 N -1.41 -0.15 0.04 1.43 0.15 -1.17 -3.09 113.70 109.50 2nx3 s SER 42 Ca 0.03 0.28 -0.17 0.00 0.70 0.00 0.00 55.95 56.78 2nx3 s SER 42 Cb -0.09 0.46 -0.06 0.00 -1.71 0.00 0.00 66.02 64.62 2nx3 s SER 42 CO 0.02 -0.05 0.50 -0.44 1.20 0.00 0.00 173.24 174.48 2nx3 s SER 43 N 0.31 6.96 0.12 5.45 0.01 -0.81 -4.53 113.70 121.21 2nx3 s SER 43 Ca 0.03 1.14 0.24 0.00 1.31 0.00 0.00 55.95 58.67 2nx3 s SER 43 Cb -0.04 -2.31 0.37 0.00 0.21 0.00 0.00 66.02 64.24 2nx3 s SER 43 CO -0.13 0.29 1.34 2.22 0.41 0.00 0.00 173.24 177.38 2nx3 n PHE 44 N 1.77 0.55 -3.65 2.43 1.16 -1.26 -0.55 117.46 117.91 2nx3 n PHE 44 Ca -0.12 0.16 -0.07 0.00 -1.87 0.00 0.00 57.45 55.56 2nx3 n PHE 44 Cb 0.51 -0.65 -0.07 0.00 -1.61 0.00 0.00 39.48 37.66 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 -4.19 -0.87 -0.86 5.98 2.15 -1.25 -3.53 116.67 114.09 2nx3 s ASP 45 Ca 0.07 1.39 -0.17 0.00 0.43 0.00 0.00 52.55 54.27 2nx3 s ASP 45 Cb 0.13 1.45 0.15 0.00 -0.30 0.00 0.00 42.92 44.36 2nx3 s ASP 45 CO 0.72 -0.23 0.98 -0.54 -0.17 0.00 0.00 175.17 175.93 2nx3 s LYS 46 N 1.89 3.54 0.03 4.34 -0.14 0.14 -4.88 119.74 124.65 2nx3 s LYS 46 Ca -0.09 -1.90 0.27 0.00 -1.36 0.00 0.00 55.97 52.89 2nx3 s LYS 46 Cb -0.07 -4.69 1.11 0.00 -1.68 0.00 0.00 37.83 32.49 2nx3 s LYS 46 CO -0.18 -1.61 1.85 0.00 -0.76 0.00 0.00 175.35 174.65 2nx3 n ALA 47 N 5.80 2.23 -1.54 5.17 0.00 -1.26 -3.94 120.51 126.96 2nx3 n ALA 47 Ca 0.17 -0.08 0.01 0.00 0.00 0.00 0.00 53.44 53.54 2nx3 n ALA 47 Cb 0.48 -1.44 0.21 0.00 0.00 0.00 0.00 19.45 18.69 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 -1.60 2.04 -4.54 0.00 0.23 -1.26 -5.06 115.26 105.06 2nx3 n ASN 48 Ca 0.06 -3.86 -0.34 0.00 -0.53 0.00 0.00 54.58 49.92 2nx3 n ASN 48 Cb 0.33 -0.58 0.11 0.00 -2.08 0.00 0.00 39.78 37.56 2nx3 n ASN 48 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2nx3 n ARG 49 N -1.12 0.07 -0.02 -3.83 5.12 -1.25 -4.92 116.66 110.69 2nx3 n ARG 49 Ca 0.25 0.08 -0.15 0.00 -1.93 0.00 0.00 57.85 56.10 2nx3 n ARG 49 Cb 0.84 -2.08 -0.10 0.00 -1.16 0.00 0.00 32.46 29.96 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 -0.95 0.33 -3.62 0.55 0.02 -1.98 -3.45 113.55 104.45 2nx3 h SER 50 Ca -0.45 -0.71 -0.67 0.00 -0.84 0.00 0.00 61.79 59.12 2nx3 h SER 50 Cb 1.31 -0.10 -0.17 0.00 0.14 0.00 0.00 62.40 63.58 2nx3 h SER 50 CO 0.41 0.99 -0.72 -0.55 -1.14 0.00 0.00 176.83 175.82 2nx3 s SER 51 N -6.38 4.48 0.57 3.07 0.15 -1.24 -5.00 113.70 109.34 2nx3 s SER 51 Ca -0.15 -0.26 0.37 0.00 0.70 0.00 0.00 55.95 56.61 2nx3 s SER 51 Cb 0.02 -0.95 1.78 0.00 -1.71 0.00 0.00 66.02 65.17 2nx3 s SER 51 CO 0.76 0.24 2.11 -0.29 1.20 0.00 0.00 173.24 177.26 2nx3 h ILE 52 N 3.53 0.00 -0.07 6.45 6.09 -1.96 -1.87 117.51 129.70 2nx3 h ILE 52 Ca -0.48 -0.25 0.00 0.00 -1.37 0.00 0.00 64.86 62.75 2nx3 h ILE 52 Cb 1.17 1.21 0.00 0.00 0.47 0.00 0.00 36.82 39.67 2nx3 h ILE 52 CO 0.53 0.00 0.00 1.41 -3.07 0.00 0.00 178.15 177.02 2nx3 n HIS 53 N -2.99 0.08 -3.43 2.19 8.25 -1.26 -4.88 115.22 113.19 2nx3 n HIS 53 Ca -0.01 -0.04 -0.33 0.00 -0.26 0.00 0.00 57.72 57.08 2nx3 n HIS 53 Cb 0.19 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.24 2nx3 n HIS 53 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2nx3 s SER 54 N -1.52 6.66 0.71 0.41 0.01 -0.70 -5.05 113.70 114.21 2nx3 s SER 54 Ca 0.27 0.93 -0.16 0.00 1.31 0.00 0.00 55.95 58.30 2nx3 s SER 54 Cb 0.13 -2.23 -0.01 0.00 0.21 0.00 0.00 66.02 64.13 2nx3 s SER 54 CO 0.22 -0.02 0.85 0.33 0.41 0.00 0.00 173.24 175.03 2nx3 n PHE 55 N 0.12 0.29 0.00 2.43 7.35 -1.26 -4.95 117.46 121.43 2nx3 n PHE 55 Ca -0.01 0.39 0.00 0.00 -0.76 0.00 0.00 57.45 57.07 2nx3 n PHE 55 Cb 0.52 -2.04 0.00 0.00 0.35 0.00 0.00 39.48 38.31 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 -1.48 0.00 -1.27 -4.13 1.74 -1.26 -4.80 116.66 105.46 2nx3 n ARG 56 Ca 0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 2nx3 n ARG 56 Cb 0.49 -0.46 0.00 0.00 -1.02 0.00 0.00 32.46 31.47 2nx3 n ARG 56 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2nx3 n GLY 57 N 2.11 0.23 1.84 -0.13 0.00 -1.26 -0.69 105.19 107.30 2nx3 n GLY 57 Ca 0.00 -1.69 -0.21 0.00 0.00 0.00 0.00 46.02 44.12 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 8.89 2.38 -0.27 1.61 8.25 -1.23 -5.02 115.22 129.82 2nx3 n HIS 58 Ca 0.00 -2.24 0.02 0.00 -0.26 0.00 0.00 57.72 55.24 2nx3 n HIS 58 Cb 0.00 -0.62 -0.01 0.00 1.12 0.00 0.00 29.99 30.48 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 -0.87 -2.88 0.31 -1.41 0.00 -1.25 -3.70 105.19 95.39 2nx3 n GLY 59 Ca 0.45 -1.30 0.07 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.13 0.34 0.86 0.99 6.46 -1.98 -2.12 115.31 119.72 2nx3 h LEU 60 Ca -0.02 -0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.69 2nx3 h LEU 60 Cb 0.22 -0.08 0.01 0.00 -0.73 0.00 0.00 40.66 40.08 2nx3 h LEU 60 CO 0.01 0.24 -0.41 1.05 -0.62 0.00 0.00 178.44 178.70 2nx3 h GLU 61 N 0.39 -1.11 -0.55 1.25 9.09 -1.97 0.61 114.58 122.29 2nx3 h GLU 61 Ca 0.15 0.08 0.08 0.00 0.05 0.00 0.00 59.36 59.71 2nx3 h GLU 61 Cb 0.11 0.25 -0.03 0.00 -1.65 0.00 0.00 28.75 27.43 2nx3 h GLU 61 CO -0.03 -0.74 0.37 -0.92 0.05 0.00 0.00 179.01 177.73 2nx3 h TYR 62 N -1.22 0.43 0.00 2.06 3.20 -1.61 -2.55 116.97 117.28 2nx3 h TYR 62 Ca -0.12 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.76 2nx3 h TYR 62 Cb 0.88 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 39.01 2nx3 h TYR 62 CO 0.02 0.22 0.00 0.41 -1.64 0.00 0.00 178.16 177.17 2nx3 n GLY 63 N -1.51 -1.62 0.50 1.82 0.00 -0.81 -0.56 105.19 103.01 2nx3 n GLY 63 Ca 0.08 0.00 0.38 0.00 0.00 0.00 0.00 46.02 46.48 2nx3 n GLY 63 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2nx3 h VAL 64 N 0.00 0.16 0.16 1.61 2.07 -0.88 0.93 116.25 120.31 2nx3 h VAL 64 Ca 0.00 -0.03 -0.30 0.00 0.82 0.00 0.00 66.70 67.18 2nx3 h VAL 64 Cb 0.00 0.06 0.03 0.00 -1.52 0.00 0.00 31.29 29.86 2nx3 h VAL 64 CO 0.00 0.02 -1.31 0.50 0.02 0.00 0.00 177.57 176.79 2nx3 h LYS 65 N 0.09 0.51 -0.76 1.57 3.11 -1.50 -2.54 116.57 117.04 2nx3 h LYS 65 Ca 0.80 -0.77 -0.05 0.00 -2.81 0.00 0.00 60.65 57.82 2nx3 h LYS 65 Cb 2.64 0.27 -0.03 0.00 -1.00 0.00 0.00 32.23 34.10 2nx3 h LYS 65 CO -0.32 1.35 0.27 0.00 -2.81 0.00 0.00 179.45 177.95 2nx3 h ALA 66 N 0.33 0.99 -0.14 5.00 0.00 0.33 -2.29 119.26 123.48 2nx3 h ALA 66 Ca -0.20 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.40 2nx3 h ALA 66 Cb 2.00 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 19.48 2nx3 h ALA 66 CO 0.24 0.65 -0.38 -0.07 0.00 0.00 0.00 179.25 179.69 2nx3 h LEU 67 N 1.12 0.32 -1.69 0.00 3.38 -0.86 -2.45 115.31 115.13 2nx3 h LEU 67 Ca 0.25 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 2nx3 h LEU 67 Cb 0.26 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 2nx3 h LEU 67 CO -0.01 0.68 0.00 -0.09 0.09 0.00 0.00 178.44 179.10 2nx3 h ARG 68 N 0.26 0.19 -0.27 1.13 2.43 -0.97 -0.98 114.38 116.17 2nx3 h ARG 68 Ca 0.03 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 2nx3 h ARG 68 Cb 0.79 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.30 2nx3 h ARG 68 CO 0.06 0.21 -0.07 -0.22 -1.51 0.00 0.00 179.97 178.45 2nx3 h LYS 69 N 0.19 0.52 -0.70 0.20 1.63 -1.10 -3.00 116.57 114.31 2nx3 h LYS 69 Ca 0.05 -0.20 -0.01 0.00 -0.85 0.00 0.00 60.65 59.63 2nx3 h LYS 69 Cb 0.13 -0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 31.70 2nx3 h LYS 69 CO 0.00 0.73 0.39 0.28 -3.45 0.00 0.00 179.45 177.41 2nx3 h VAL 70 N 0.27 1.21 -0.07 2.00 2.07 -1.28 -1.68 116.25 118.77 2nx3 h VAL 70 Ca 0.07 -0.52 -0.11 0.00 0.82 0.00 0.00 66.70 66.95 2nx3 h VAL 70 Cb 0.54 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 2nx3 h VAL 70 CO 0.03 0.23 -0.10 1.17 0.02 0.00 0.00 177.57 178.92 2nx3 n LYS 71 N -4.50 1.48 0.03 1.57 4.81 -0.44 -2.96 118.16 118.14 2nx3 n LYS 71 Ca 0.06 -0.56 0.00 0.00 -0.87 0.00 0.00 58.31 56.93 2nx3 n LYS 71 Cb 0.08 -1.45 0.00 0.00 0.02 0.00 0.00 35.03 33.68 2nx3 n LYS 71 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 2nx3 n GLU 72 N 1.77 0.00 0.18 1.64 0.00 -0.82 -4.66 120.64 118.75 2nx3 n GLU 72 Ca 0.20 0.00 0.06 0.00 0.00 0.00 0.00 57.16 57.41 2nx3 n GLU 72 Cb 0.66 0.00 0.53 0.00 0.00 0.00 0.00 31.44 32.63 2nx3 n GLU 72 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 2nx3 h GLU 73 N 0.00 0.14 -0.00 5.31 4.81 -1.45 -2.99 114.58 120.40 2nx3 h GLU 73 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2nx3 h GLU 73 Cb 0.00 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.35 2nx3 h GLU 73 CO 0.00 0.17 -0.26 1.19 -0.73 0.00 0.00 179.01 179.37 2nx3 n PHE 74 N -4.44 0.00 -3.68 0.92 3.72 -1.16 -5.03 117.46 107.79 2nx3 n PHE 74 Ca -0.01 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.11 2nx3 n PHE 74 Cb 0.15 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.72 2nx3 n PHE 74 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2nx3 n GLY 75 N 1.06 -0.82 3.51 1.37 0.00 -1.13 -4.99 105.19 104.19 2nx3 n GLY 75 Ca 0.02 0.39 -0.30 0.00 0.00 0.00 0.00 46.02 46.12 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 -6.47 2.78 0.86 0.99 1.43 -1.25 -4.95 118.68 112.07 2nx3 s LEU 76 Ca 0.35 -0.45 -0.11 0.00 -1.03 0.00 0.00 54.13 52.89 2nx3 s LEU 76 Cb -0.12 -1.62 0.11 0.00 0.03 0.00 0.00 46.19 44.59 2nx3 s LEU 76 CO 0.85 0.21 1.10 -0.54 0.23 0.00 0.00 176.35 178.20 2nx3 s LYS 77 N -1.89 1.54 0.13 1.70 1.02 -1.26 -4.31 119.74 116.67 2nx3 s LYS 77 Ca 0.18 1.20 0.05 0.00 0.02 0.00 0.00 55.97 57.41 2nx3 s LYS 77 Cb -0.11 -1.81 -0.04 0.00 -0.52 0.00 0.00 37.83 35.35 2nx3 s LYS 77 CO 0.09 -2.15 -0.11 0.42 -0.92 0.00 0.00 175.35 172.68 2nx3 s ILE 78 N -2.81 1.18 -0.23 2.17 -1.09 -1.26 -1.92 121.20 117.24 2nx3 s ILE 78 Ca 0.64 -1.87 -0.18 0.00 -2.23 0.00 0.00 60.65 57.00 2nx3 s ILE 78 Cb -0.19 -1.65 0.06 0.00 -1.58 0.00 0.00 42.46 39.10 2nx3 s ILE 78 CO 0.57 -0.60 0.59 0.28 -1.23 0.00 0.00 174.94 174.55 2nx3 s THR 79 N -2.77 -0.00 0.14 2.92 -1.32 -0.79 -0.22 115.64 113.61 2nx3 s THR 79 Ca 0.12 0.01 -0.15 0.00 -1.21 0.00 0.00 61.69 60.46 2nx3 s THR 79 Cb -0.01 -0.83 0.03 0.00 -1.51 0.00 0.00 72.50 70.18 2nx3 s THR 79 CO 0.01 0.00 0.40 0.28 -2.21 0.00 0.00 174.62 173.11 2nx3 s THR 80 N 0.69 0.07 -0.09 5.08 -1.32 -1.18 -3.07 115.64 115.83 2nx3 s THR 80 Ca -0.03 -0.72 -0.05 0.00 -1.21 0.00 0.00 61.69 59.68 2nx3 s THR 80 Cb -0.05 -1.31 -0.04 0.00 -1.51 0.00 0.00 72.50 69.59 2nx3 s THR 80 CO -0.05 -0.30 0.14 1.51 -2.21 0.00 0.00 174.62 173.72 2nx3 s ASP 81 N -2.83 6.27 0.23 8.08 -4.77 -1.25 -1.32 116.67 121.08 2nx3 s ASP 81 Ca 0.05 0.40 0.06 0.00 -3.30 0.00 0.00 52.55 49.77 2nx3 s ASP 81 Cb 0.02 -1.99 -0.03 0.00 -1.09 0.00 0.00 42.92 39.82 2nx3 s ASP 81 CO -0.09 0.37 0.23 0.27 0.70 0.00 0.00 175.17 176.65 2nx3 s ILE 82 N -1.10 4.69 0.00 2.11 -4.36 -0.87 -4.73 121.20 116.94 2nx3 s ILE 82 Ca 0.18 -1.23 0.00 0.00 -0.26 0.00 0.00 60.65 59.34 2nx3 s ILE 82 Cb -0.12 -3.52 0.00 0.00 1.25 0.00 0.00 42.46 40.07 2nx3 s ILE 82 CO 0.08 -0.31 0.00 1.41 0.24 0.00 0.00 174.94 176.36 2nx3 n HIS 83 N -1.11 0.00 -3.72 1.37 8.25 -1.26 -4.35 115.22 114.39 2nx3 n HIS 83 Ca -0.08 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.24 2nx3 n HIS 83 Cb 0.57 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.59 2nx3 n HIS 83 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2nx3 s GLU 84 N -0.77 0.61 0.00 -0.41 2.02 -1.26 -5.07 118.70 113.82 2nx3 s GLU 84 Ca 0.00 0.27 0.00 0.00 0.02 0.00 0.00 54.97 55.26 2nx3 s GLU 84 Cb 0.00 0.29 0.00 0.00 0.10 0.00 0.00 34.13 34.52 2nx3 s GLU 84 CO 0.00 -0.13 0.48 0.43 0.02 0.00 0.00 175.26 176.06 2nx3 n SER 85 N 2.08 0.00 0.19 -0.19 7.64 -1.26 -0.90 113.62 121.18 2nx3 n SER 85 Ca -0.17 0.48 0.06 0.00 1.01 0.00 0.00 58.87 60.25 2nx3 n SER 85 Cb 0.57 -0.19 0.10 0.00 -1.01 0.00 0.00 64.21 63.67 2nx3 n SER 85 CO 0.00 0.00 0.00 -2.67 -3.01 0.00 0.00 175.04 169.36 2nx3 n TRP 86 N -1.97 0.00 0.76 1.43 4.27 -1.26 0.87 117.44 121.54 2nx3 n TRP 86 Ca 0.00 0.00 0.13 0.00 -3.89 0.00 0.00 57.50 53.74 2nx3 n TRP 86 Cb 0.00 -0.06 0.48 0.00 -1.36 0.00 0.00 31.31 30.37 2nx3 n TRP 86 CO 0.00 0.00 0.00 1.04 -2.29 0.00 0.00 177.69 176.44 2nx3 n GLN 87 N -2.56 0.17 0.36 -2.67 6.02 -0.08 -4.08 117.38 114.54 2nx3 n GLN 87 Ca 0.05 0.14 -0.17 0.00 -0.01 0.00 0.00 57.00 57.00 2nx3 n GLN 87 Cb 1.06 -1.70 -0.09 0.00 1.02 0.00 0.00 30.24 30.54 2nx3 n GLN 87 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2nx3 h ALA 88 N 2.69 -0.90 0.37 -1.58 0.00 0.33 -3.02 119.26 117.16 2nx3 h ALA 88 Ca 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 2nx3 h ALA 88 Cb 0.65 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 2nx3 h ALA 88 CO 0.00 -0.98 -0.30 0.93 0.00 0.00 0.00 179.25 178.90 2nx3 h GLU 89 N -0.95 -0.65 -0.70 0.00 5.08 -1.78 -0.43 114.58 115.15 2nx3 h GLU 89 Ca -0.09 0.04 0.06 0.00 -1.00 0.00 0.00 59.36 58.38 2nx3 h GLU 89 Cb 0.70 0.15 -0.06 0.00 0.50 0.00 0.00 28.75 30.04 2nx3 h GLU 89 CO 0.15 -0.44 0.40 -1.00 -1.00 0.00 0.00 179.01 177.12 2nx3 h PRO 90 N -0.68 0.70 -0.14 2.33 0.13 -1.76 -2.73 132.00 129.85 2nx3 h PRO 90 Ca -0.03 -0.04 -0.18 0.00 -0.87 0.00 0.00 66.00 64.88 2nx3 h PRO 90 Cb 0.59 -0.16 -0.00 0.00 0.13 0.00 0.00 31.00 31.56 2nx3 h PRO 90 CO -0.02 0.46 -0.67 -0.39 -0.23 0.00 0.00 178.00 177.16 2nx3 h VAL 91 N 0.72 1.33 0.00 1.56 -1.51 -1.50 -3.18 116.25 113.67 2nx3 h VAL 91 Ca 0.32 -1.96 0.00 0.00 -1.23 0.00 0.00 66.70 63.82 2nx3 h VAL 91 Cb 0.20 1.94 0.00 0.00 -2.13 0.00 0.00 31.29 31.30 2nx3 h VAL 91 CO -0.19 0.61 0.00 0.00 -1.23 0.00 0.00 177.57 176.76 2nx3 n ALA 92 N -2.54 1.43 0.09 5.19 0.00 -0.17 -0.89 120.51 123.63 2nx3 n ALA 92 Ca -0.04 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.45 2nx3 n ALA 92 Cb 0.67 -1.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.05 2nx3 n ALA 92 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2nx3 n GLU 93 N -0.11 0.99 -0.04 0.00 1.02 -1.20 -4.69 120.64 116.61 2nx3 n GLU 93 Ca 0.00 -0.08 -0.05 0.00 -0.02 0.00 0.00 57.16 57.01 2nx3 n GLU 93 Cb 0.01 -1.19 -0.06 0.00 -0.02 0.00 0.00 31.44 30.18 2nx3 n GLU 93 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86 2nx3 n VAL 94 N -1.74 0.56 -3.88 2.62 3.14 -0.06 -5.03 118.33 113.94 2nx3 n VAL 94 Ca -0.01 -0.29 -0.33 0.00 -2.96 0.00 0.00 64.34 60.75 2nx3 n VAL 94 Cb 0.25 -0.82 -0.05 0.00 -1.06 0.00 0.00 33.84 32.16 2nx3 n VAL 94 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2nx3 s ALA 95 N -2.20 3.95 -0.04 1.55 0.00 -0.92 -4.54 121.76 119.57 2nx3 s ALA 95 Ca -0.08 -0.75 0.09 0.00 0.00 0.00 0.00 51.96 51.21 2nx3 s ALA 95 Cb 0.03 -1.90 -0.24 0.00 0.00 0.00 0.00 23.12 21.01 2nx3 s ALA 95 CO 0.29 0.75 0.69 -0.44 0.00 0.00 0.00 175.76 177.05 2nx3 h ASP 96 N 3.62 0.08 -3.17 0.00 3.32 -0.94 -3.44 116.42 115.88 2nx3 h ASP 96 Ca -0.48 -0.16 -0.65 0.00 0.02 0.00 0.00 57.03 55.76 2nx3 h ASP 96 Cb 1.18 -0.03 -0.36 0.00 0.22 0.00 0.00 39.33 40.35 2nx3 h ASP 96 CO 0.71 1.14 -0.84 -0.63 -1.72 0.00 0.00 179.24 177.89 2nx3 s ILE 97 N -2.60 1.91 -0.29 0.35 1.01 -0.95 -0.31 121.20 120.31 2nx3 s ILE 97 Ca -0.07 -0.92 -0.20 0.00 0.00 0.00 0.00 60.65 59.46 2nx3 s ILE 97 Cb 0.08 -1.78 -0.01 0.00 0.01 0.00 0.00 42.46 40.75 2nx3 s ILE 97 CO 0.82 0.44 0.62 -0.63 0.00 0.00 0.00 174.94 176.19 2nx3 s ILE 98 N 1.33 4.96 -0.13 2.92 1.01 0.29 -3.08 121.20 128.50 2nx3 s ILE 98 Ca 0.03 0.90 -0.13 0.00 0.00 0.00 0.00 60.65 61.46 2nx3 s ILE 98 Cb -0.14 -3.97 -0.05 0.00 0.01 0.00 0.00 42.46 38.32 2nx3 s ILE 98 CO -0.11 -0.09 0.29 -1.58 0.00 0.00 0.00 174.94 173.45 2nx3 s GLN 99 N 2.55 4.10 -0.19 2.79 0.74 -0.43 -0.75 119.66 128.47 2nx3 s GLN 99 Ca 0.25 0.11 -0.05 0.00 0.05 0.00 0.00 55.36 55.72 2nx3 s GLN 99 Cb -0.15 -3.36 -0.03 0.00 1.10 0.00 0.00 33.01 30.57 2nx3 s GLN 99 CO 0.11 0.38 0.01 0.42 -0.55 0.00 0.00 175.29 175.66 2nx3 s ILE 100 N 0.05 4.14 0.49 -2.34 1.09 -0.22 -2.06 121.20 122.35 2nx3 s ILE 100 Ca 0.17 -0.25 -0.23 0.00 -1.10 0.00 0.00 60.65 59.24 2nx3 s ILE 100 Cb -0.13 -2.87 -0.08 0.00 -1.06 0.00 0.00 42.46 38.32 2nx3 s ILE 100 CO 0.05 0.44 1.16 -2.65 -0.10 0.00 0.00 174.94 173.83 2nx3 n PRO 101 N 4.05 1.49 -0.24 2.79 -0.02 -1.26 -1.99 135.00 139.83 2nx3 n PRO 101 Ca -0.17 0.54 0.04 0.00 -2.02 0.00 0.00 63.50 61.89 2nx3 n PRO 101 Cb 0.52 -2.30 0.16 0.00 -0.02 0.00 0.00 33.50 31.86 2nx3 n PRO 101 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2nx3 h ALA 102 N 1.43 0.96 0.00 3.55 0.00 -1.89 0.49 119.26 123.79 2nx3 h ALA 102 Ca -0.48 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 2nx3 h ALA 102 Cb 1.32 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 2nx3 h ALA 102 CO 0.56 -0.22 -0.08 0.74 0.00 0.00 0.00 179.25 180.25 2nx3 h PHE 103 N 0.41 0.00 -0.47 0.00 0.04 -1.91 -2.71 116.94 112.30 2nx3 h PHE 103 Ca 0.38 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 61.02 2nx3 h PHE 103 Cb 0.56 0.00 -0.08 0.00 2.20 0.00 0.00 35.95 38.63 2nx3 h PHE 103 CO -0.18 0.08 0.09 1.28 -0.60 0.00 0.00 178.31 178.98 2nx3 n LEU 104 N -3.48 4.81 0.00 1.54 4.77 0.12 -4.57 117.00 120.20 2nx3 n LEU 104 Ca -0.02 -3.27 0.11 0.00 -0.03 0.00 0.00 56.01 52.80 2nx3 n LEU 104 Cb 0.22 -0.65 0.63 0.00 -2.33 0.00 0.00 43.42 41.30 2nx3 n LEU 104 CO 0.28 0.86 0.87 0.00 -1.33 0.00 0.00 177.39 178.07 2nx3 n ARG 106 N -1.12 2.60 -2.44 0.00 5.12 -1.26 -4.91 116.66 114.65 2nx3 n ARG 106 Ca 0.14 -0.41 -0.38 0.00 -1.93 0.00 0.00 57.85 55.27 2nx3 n ARG 106 Cb 0.12 -0.92 -0.03 0.00 -1.16 0.00 0.00 32.46 30.48 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 -0.96 3.42 0.09 5.56 -1.52 -1.12 -4.89 119.66 120.24 2nx3 s GLN 107 Ca 0.04 -1.20 -0.18 0.00 -1.95 0.00 0.00 55.36 52.07 2nx3 s GLN 107 Cb 0.04 -5.34 -0.04 0.00 -0.22 0.00 0.00 33.01 27.45 2nx3 s GLN 107 CO 0.13 -2.57 0.98 2.41 -0.25 0.00 0.00 175.29 175.99 2nx3 n THR 108 N 7.01 -0.40 -0.30 -0.19 -1.04 -1.26 -0.56 114.28 117.54 2nx3 n THR 108 Ca 0.39 1.53 0.05 0.00 -2.04 0.00 0.00 64.05 63.97 2nx3 n THR 108 Cb 0.49 -1.90 0.19 0.00 -1.82 0.00 0.00 70.33 67.29 2nx3 n THR 108 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 2nx3 h ASP 109 N 0.00 0.67 -0.38 8.00 3.32 -1.98 0.23 116.42 126.27 2nx3 h ASP 109 Ca 0.09 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 2nx3 h ASP 109 Cb 0.24 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 2nx3 h ASP 109 CO -0.55 0.36 0.23 0.25 -1.72 0.00 0.00 179.24 177.81 2nx3 h LEU 110 N 0.77 0.47 0.05 1.55 5.85 -1.21 0.65 115.31 123.45 2nx3 h LEU 110 Ca 0.43 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 59.12 2nx3 h LEU 110 Cb 0.45 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.37 2nx3 h LEU 110 CO -0.28 0.38 -0.02 -0.07 -0.34 0.00 0.00 178.44 178.10 2nx3 h LEU 111 N 0.55 -0.06 -0.87 2.25 3.38 -0.52 -2.93 115.31 117.11 2nx3 h LEU 111 Ca 0.14 -0.55 0.14 0.00 0.09 0.00 0.00 57.88 57.71 2nx3 h LEU 111 Cb -0.00 0.02 -0.09 0.00 0.09 0.00 0.00 40.66 40.67 2nx3 h LEU 111 CO -0.03 0.66 0.48 -0.07 0.09 0.00 0.00 178.44 179.58 2nx3 h LEU 112 N -0.93 0.62 -0.13 1.67 3.38 -0.51 -0.49 115.31 118.91 2nx3 h LEU 112 Ca -0.01 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2nx3 h LEU 112 Cb 0.60 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2nx3 h LEU 112 CO 0.01 0.28 0.09 0.00 0.09 0.00 0.00 178.44 178.91 2nx3 h ALA 113 N 1.55 0.17 -0.18 1.53 0.00 -0.96 -0.40 119.26 120.96 2nx3 h ALA 113 Ca 0.47 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.30 2nx3 h ALA 113 Cb 0.61 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2nx3 h ALA 113 CO -0.34 -0.34 -0.18 0.00 0.00 0.00 0.00 179.25 178.39 2nx3 h ALA 114 N 1.04 1.35 0.28 0.00 0.00 -1.14 -3.17 119.26 117.61 2nx3 h ALA 114 Ca 0.05 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2nx3 h ALA 114 Cb -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2nx3 h ALA 114 CO -0.01 0.44 -0.13 0.00 0.00 0.00 0.00 179.25 179.55 2nx3 h ALA 115 N 1.52 -0.37 -1.11 0.00 0.00 -0.69 -3.23 119.26 115.39 2nx3 h ALA 115 Ca 0.05 -0.20 0.31 0.00 0.00 0.00 0.00 54.91 55.08 2nx3 h ALA 115 Cb 0.50 0.14 -0.10 0.00 0.00 0.00 0.00 17.79 18.33 2nx3 h ALA 115 CO 0.03 -0.48 0.72 1.57 0.00 0.00 0.00 179.25 181.09 2nx3 h LYS 116 N -0.83 0.29 -0.01 0.00 2.10 -0.74 0.13 116.57 117.52 2nx3 h LYS 116 Ca -0.04 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.60 2nx3 h LYS 116 Cb 0.51 -0.07 -0.00 0.00 -0.90 0.00 0.00 32.23 31.78 2nx3 h LYS 116 CO 0.06 0.19 0.24 1.79 -2.00 0.00 0.00 179.45 179.74 2nx3 h THR 117 N 0.30 0.01 0.00 0.07 1.35 -1.56 -3.45 112.91 109.63 2nx3 h THR 117 Ca 0.65 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.51 2nx3 h THR 117 Cb 1.79 0.76 0.00 0.00 -1.73 0.00 0.00 68.15 68.97 2nx3 h THR 117 CO -0.31 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.57 2nx3 n GLY 118 N -1.19 3.06 3.45 5.82 0.00 0.47 -5.03 105.19 111.76 2nx3 n GLY 118 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 2nx3 n GLY 118 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2nx3 s ARG 119 N -0.31 -1.48 0.31 1.61 3.00 -1.26 -4.83 118.95 115.99 2nx3 s ARG 119 Ca 0.00 0.60 -0.27 0.00 0.00 0.00 0.00 55.73 56.06 2nx3 s ARG 119 Cb 0.00 -1.51 -0.09 0.00 0.00 0.00 0.00 34.95 33.35 2nx3 s ARG 119 CO 0.00 -4.04 0.98 0.00 0.00 0.00 0.00 175.30 172.25 2nx3 s ALA 120 N -2.44 3.25 -0.13 2.13 0.00 0.58 -4.74 121.76 120.41 2nx3 s ALA 120 Ca 0.68 0.63 0.01 0.00 0.00 0.00 0.00 51.96 53.28 2nx3 s ALA 120 Cb -0.22 -3.22 -0.01 0.00 0.00 0.00 0.00 23.12 19.67 2nx3 s ALA 120 CO 0.63 0.07 -0.15 0.08 0.00 0.00 0.00 175.76 176.39 2nx3 s VAL 121 N -1.45 2.81 -0.23 0.00 1.01 -0.60 0.10 120.40 122.04 2nx3 s VAL 121 Ca 0.48 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.72 2nx3 s VAL 121 Cb -0.23 -2.16 0.06 0.00 0.00 0.00 0.00 36.38 34.05 2nx3 s VAL 121 CO 0.29 0.53 -0.04 0.21 0.00 0.00 0.00 175.10 176.09 2nx3 s ASN 122 N 0.39 3.76 -0.22 3.32 2.47 0.07 -0.87 114.94 123.86 2nx3 s ASN 122 Ca -0.12 -1.15 -0.09 0.00 0.42 0.00 0.00 52.86 51.92 2nx3 s ASN 122 Cb -0.16 -1.12 -0.04 0.00 -1.45 0.00 0.00 41.25 38.48 2nx3 s ASN 122 CO 0.06 -0.25 0.11 -0.69 -3.72 0.00 0.00 177.10 172.62 2nx3 s VAL 123 N 1.44 5.01 -0.05 -5.21 1.01 -0.56 -1.06 120.40 120.98 2nx3 s VAL 123 Ca -0.05 0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.68 2nx3 s VAL 123 Cb -0.19 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.85 2nx3 s VAL 123 CO -0.07 0.38 1.15 -0.54 0.00 0.00 0.00 175.10 176.03 2nx3 s LYS 124 N 0.91 4.38 0.00 2.72 -0.14 -0.84 -1.49 119.74 125.29 2nx3 s LYS 124 Ca 0.06 1.62 -0.30 0.00 -1.36 0.00 0.00 55.97 55.98 2nx3 s LYS 124 Cb -0.13 -3.53 -0.07 0.00 -1.68 0.00 0.00 37.83 32.41 2nx3 s LYS 124 CO 0.03 -0.39 1.65 0.21 -0.76 0.00 0.00 175.35 176.08 2nx3 s LYS 125 N 2.04 4.20 0.33 1.68 2.20 -0.26 -3.94 119.74 125.98 2nx3 s LYS 125 Ca 0.54 2.24 -0.29 0.00 -0.36 0.00 0.00 55.97 58.11 2nx3 s LYS 125 Cb -0.24 -3.81 -0.11 0.00 -1.51 0.00 0.00 37.83 32.16 2nx3 s LYS 125 CO 0.22 -0.78 1.56 0.41 -0.36 0.00 0.00 175.35 176.40 2nx3 n GLY 126 N 4.05 1.31 0.06 5.54 0.00 -1.25 -4.58 105.19 110.33 2nx3 n GLY 126 Ca 0.16 0.40 0.02 0.00 0.00 0.00 0.00 46.02 46.61 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 1.42 0.03 0.00 1.61 3.00 -1.26 0.66 117.38 122.85 2nx3 n GLN 127 Ca 0.05 0.40 0.06 0.00 -0.01 0.00 0.00 57.00 57.51 2nx3 n GLN 127 Cb 0.38 -1.82 -0.02 0.00 0.00 0.00 0.00 30.24 28.78 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 -1.57 0.00 -3.39 1.08 1.16 -1.26 -0.79 117.46 112.69 2nx3 n PHE 128 Ca -0.00 0.00 -0.38 0.00 -1.87 0.00 0.00 57.45 55.20 2nx3 n PHE 128 Cb 0.23 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.04 2nx3 n PHE 128 CO 0.00 0.00 0.00 -1.17 -1.87 0.00 0.00 176.76 173.72 2nx3 s LEU 129 N -1.99 4.45 0.26 5.98 2.96 0.21 -5.05 118.68 125.51 2nx3 s LEU 129 Ca 0.09 1.03 -0.25 0.00 -0.22 0.00 0.00 54.13 54.78 2nx3 s LEU 129 Cb 0.10 -2.70 -0.09 0.00 0.50 0.00 0.00 46.19 43.99 2nx3 s LEU 129 CO 0.36 0.24 0.86 0.00 -1.32 0.00 0.00 176.35 176.50 2nx3 s ALA 130 N -0.74 3.31 0.39 5.97 0.00 -1.26 -4.82 121.76 124.60 2nx3 s ALA 130 Ca 0.26 0.41 0.14 0.00 0.00 0.00 0.00 51.96 52.77 2nx3 s ALA 130 Cb -0.17 -3.05 0.98 0.00 0.00 0.00 0.00 23.12 20.88 2nx3 s ALA 130 CO 0.14 0.24 1.85 -1.00 0.00 0.00 0.00 175.76 176.99 2nx3 h PRO 131 N 3.50 0.50 0.00 0.00 0.13 -1.97 -1.11 132.00 133.05 2nx3 h PRO 131 Ca -0.47 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2nx3 h PRO 131 Cb 1.19 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2nx3 h PRO 131 CO 0.65 0.33 0.00 0.11 -0.23 0.00 0.00 178.00 178.86 2nx3 h TRP 132 N 0.51 0.00 0.00 1.56 0.09 -1.93 -2.99 115.95 113.19 2nx3 h TRP 132 Ca 0.48 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.46 2nx3 h TRP 132 Cb 1.05 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.29 2nx3 h TRP 132 CO -0.00 0.00 -0.05 -0.25 0.09 0.00 0.00 178.44 178.23 2nx3 n ASP 133 N -2.46 0.68 0.00 0.11 8.00 -0.42 -3.09 116.55 119.37 2nx3 n ASP 133 Ca 0.04 0.52 0.05 0.00 0.71 0.00 0.00 54.79 56.11 2nx3 n ASP 133 Cb 0.38 -0.67 0.22 0.00 -0.02 0.00 0.00 41.12 41.03 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 -2.13 1.31 -0.25 -3.53 -2.24 -1.13 -2.25 114.28 104.06 2nx3 n THR 134 Ca 0.06 0.33 -0.07 0.00 -2.27 0.00 0.00 64.05 62.10 2nx3 n THR 134 Cb 0.42 -1.16 0.05 0.00 -2.10 0.00 0.00 70.33 67.53 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 1.06 0.00 -0.78 3.64 -1.76 -1.18 116.57 117.55 2nx3 h LYS 135 Ca 0.00 -0.20 -0.03 0.00 -1.27 0.00 0.00 60.65 59.14 2nx3 h LYS 135 Cb 0.17 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2nx3 h LYS 135 CO 0.00 0.89 -0.16 -0.91 -2.27 0.00 0.00 179.45 177.00 2nx3 h ASN 136 N 1.01 0.00 -0.33 4.20 2.35 -1.71 -1.94 115.58 119.15 2nx3 h ASN 136 Ca 0.23 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.81 2nx3 h ASN 136 Cb 0.23 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.60 2nx3 h ASN 136 CO -0.02 0.16 -0.48 0.58 -1.65 0.00 0.00 177.43 176.03 2nx3 h VAL 137 N 0.00 1.27 -0.21 2.81 2.07 -1.34 -2.60 116.25 118.26 2nx3 h VAL 137 Ca -0.00 -1.65 -0.05 0.00 0.82 0.00 0.00 66.70 65.82 2nx3 h VAL 137 Cb 0.51 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 2nx3 h VAL 137 CO 0.02 0.55 -0.06 0.58 0.02 0.00 0.00 177.57 178.68 2nx3 h VAL 138 N 0.71 1.29 -0.58 2.57 2.07 -0.80 -2.72 116.25 118.79 2nx3 h VAL 138 Ca 0.03 -1.06 0.07 0.00 0.82 0.00 0.00 66.70 66.57 2nx3 h VAL 138 Cb 1.08 1.55 -0.06 0.00 -1.52 0.00 0.00 31.29 32.34 2nx3 h VAL 138 CO 0.11 0.32 0.25 -0.08 0.02 0.00 0.00 177.57 178.20 2nx3 h GLU 139 N 0.13 0.46 -0.13 1.57 4.81 -1.37 0.88 114.58 120.93 2nx3 h GLU 139 Ca 0.05 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.28 2nx3 h GLU 139 Cb 0.51 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 2nx3 h GLU 139 CO 0.02 0.30 -0.03 0.87 -0.73 0.00 0.00 179.01 179.45 2nx3 h LYS 140 N 0.47 0.01 -0.68 1.92 1.57 -1.41 0.14 116.57 118.59 2nx3 h LYS 140 Ca 0.28 -0.00 0.03 0.00 -1.87 0.00 0.00 60.65 59.08 2nx3 h LYS 140 Cb 0.27 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.54 2nx3 h LYS 140 CO -0.24 0.00 0.43 -0.07 -0.57 0.00 0.00 179.45 179.00 2nx3 h LEU 141 N 0.01 0.71 -0.60 2.94 3.38 -1.03 -1.79 115.31 118.92 2nx3 h LEU 141 Ca 0.06 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 2nx3 h LEU 141 Cb 0.09 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 2nx3 h LEU 141 CO -0.13 0.49 0.18 0.11 0.09 0.00 0.00 178.44 179.18 2nx3 h LYS 142 N 0.84 0.94 -0.00 1.13 1.57 -0.45 -1.36 116.57 119.24 2nx3 h LYS 142 Ca 0.27 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2nx3 h LYS 142 Cb 0.01 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.18 2nx3 h LYS 142 CO -0.10 0.84 0.02 0.35 -0.57 0.00 0.00 179.45 179.99 2nx3 h PHE 143 N 0.86 0.00 -0.60 -1.35 3.57 -0.01 -1.07 116.94 118.33 2nx3 h PHE 143 Ca 0.19 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.69 2nx3 h PHE 143 Cb 0.30 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.04 2nx3 h PHE 143 CO 0.02 0.00 0.00 0.41 -2.23 0.00 0.00 178.31 176.51 2nx3 n GLY 144 N -1.15 2.49 2.12 2.40 0.00 -0.58 -4.93 105.19 105.54 2nx3 n GLY 144 Ca -0.03 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.21 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 1.10 0.94 3.76 -0.02 0.00 -0.40 -2.43 105.19 108.14 2nx3 n GLY 145 Ca 0.24 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.36 2.85 0.00 4.61 0.00 -0.81 -4.88 121.76 120.16 2nx3 s ALA 146 Ca 0.00 1.05 0.00 0.00 0.00 0.00 0.00 51.96 53.01 2nx3 s ALA 146 Cb 0.00 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.68 2nx3 s ALA 146 CO 0.00 -0.94 0.00 1.63 0.00 0.00 0.00 175.76 176.45 2nx3 n LYS 147 N -0.86 0.00 -3.17 0.00 5.02 -1.26 -4.49 118.16 113.41 2nx3 n LYS 147 Ca 0.09 0.00 -0.44 0.00 -2.02 0.00 0.00 58.31 55.94 2nx3 n LYS 147 Cb 0.48 -0.51 -0.05 0.00 -0.02 0.00 0.00 35.03 34.93 2nx3 n LYS 147 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2nx3 s GLU 148 N -1.97 3.06 -0.08 1.97 2.12 -1.26 -5.04 118.70 117.50 2nx3 s GLU 148 Ca 0.00 -1.23 0.02 0.00 0.36 0.00 0.00 54.97 54.11 2nx3 s GLU 148 Cb 0.00 -4.21 -0.02 0.00 0.26 0.00 0.00 34.13 30.16 2nx3 s GLU 148 CO 0.00 -1.39 -0.12 0.42 -0.54 0.00 0.00 175.26 173.63 2nx3 s ILE 149 N 2.48 3.20 0.01 -3.70 1.01 -1.26 -1.55 121.20 121.39 2nx3 s ILE 149 Ca 0.11 -0.65 0.06 0.00 0.00 0.00 0.00 60.65 60.17 2nx3 s ILE 149 Cb -0.23 -2.30 -0.02 0.00 0.01 0.00 0.00 42.46 39.92 2nx3 s ILE 149 CO 0.08 0.57 -0.18 -0.31 0.00 0.00 0.00 174.94 175.10 2nx3 s TYR 150 N -0.38 1.56 -0.11 3.97 2.02 -0.05 -2.61 117.35 121.75 2nx3 s TYR 150 Ca 0.04 -0.32 0.02 0.00 -0.37 0.00 0.00 57.07 56.45 2nx3 s TYR 150 Cb -0.12 -0.97 -0.01 0.00 -0.40 0.00 0.00 41.96 40.45 2nx3 s TYR 150 CO 0.02 0.01 -0.18 -0.51 -1.57 0.00 0.00 175.55 173.32 2nx3 s LEU 151 N -0.67 2.43 -0.22 -1.29 1.43 0.38 -1.50 118.68 119.23 2nx3 s LEU 151 Ca 0.06 -0.42 -0.04 0.00 -1.03 0.00 0.00 54.13 52.69 2nx3 s LEU 151 Cb -0.07 -1.51 -0.01 0.00 0.03 0.00 0.00 46.19 44.62 2nx3 s LEU 151 CO 0.00 0.18 -0.03 -0.89 0.23 0.00 0.00 176.35 175.84 2nx3 s THR 152 N 0.26 3.52 -0.14 5.49 2.01 -0.56 -0.13 115.64 126.10 2nx3 s THR 152 Ca -0.13 -0.44 -0.29 0.00 0.31 0.00 0.00 61.69 61.14 2nx3 s THR 152 Cb -0.16 -2.61 -0.01 0.00 0.01 0.00 0.00 72.50 69.73 2nx3 s THR 152 CO 0.07 0.42 1.03 -0.70 -0.69 0.00 0.00 174.62 174.74 2nx3 s GLU 153 N 1.42 4.37 -0.01 4.92 2.56 0.25 -1.11 118.70 131.11 2nx3 s GLU 153 Ca 0.05 1.40 0.02 0.00 0.00 0.00 0.00 54.97 56.43 2nx3 s GLU 153 Cb -0.14 -3.57 0.03 0.00 2.00 0.00 0.00 34.13 32.44 2nx3 s GLU 153 CO -0.02 -0.41 0.78 2.89 -0.56 0.00 0.00 175.26 177.95 2nx3 n ARG 154 N 5.40 0.51 0.00 4.30 1.85 -1.26 -0.08 116.66 127.38 2nx3 n ARG 154 Ca 0.10 -0.98 0.00 0.00 -1.00 0.00 0.00 57.85 55.97 2nx3 n ARG 154 Cb 0.48 -0.66 0.00 0.00 -1.05 0.00 0.00 32.46 31.23 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 2.28 3.33 2.89 0.00 -1.26 -3.58 105.19 108.65 2nx3 n GLY 155 Ca 0.01 -1.93 -0.23 0.00 0.00 0.00 0.00 46.02 43.88 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 -2.88 1.86 -0.04 2.61 2.01 -0.36 -4.19 115.64 114.65 2nx3 s THR 156 Ca 0.00 -1.85 -0.30 0.00 0.31 0.00 0.00 61.69 59.86 2nx3 s THR 156 Cb 0.00 -1.81 -0.07 0.00 0.01 0.00 0.00 72.50 70.63 2nx3 s THR 156 CO 0.00 -0.23 1.86 -0.89 -0.69 0.00 0.00 174.62 174.67 2nx3 s THR 157 N -1.80 3.26 -0.54 -0.82 2.01 0.03 -1.72 115.64 116.05 2nx3 s THR 157 Ca 0.14 0.31 0.04 0.00 0.31 0.00 0.00 61.69 62.49 2nx3 s THR 157 Cb -0.07 -3.22 0.14 0.00 0.01 0.00 0.00 72.50 69.36 2nx3 s THR 157 CO 0.06 -0.05 0.31 0.12 -0.69 0.00 0.00 174.62 174.38 2nx3 s PHE 158 N 4.80 2.97 0.00 4.92 5.36 -0.69 -4.89 117.98 130.45 2nx3 s PHE 158 Ca 0.83 -3.04 0.00 0.00 -0.96 0.00 0.00 56.93 53.76 2nx3 s PHE 158 Cb -0.37 -2.55 0.00 0.00 -0.34 0.00 0.00 43.02 39.76 2nx3 s PHE 158 CO 0.36 -0.71 0.00 0.41 -1.46 0.00 0.00 175.22 173.82 2nx3 n GLY 159 N 2.92 -0.43 3.78 13.12 0.00 -1.26 -4.26 105.19 119.06 2nx3 n GLY 159 Ca 0.10 -1.09 -0.39 0.00 0.00 0.00 0.00 46.02 44.64 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 3.81 -1.44 1.61 2.02 -1.26 -4.28 117.35 117.81 2nx3 s TYR 160 Ca 0.00 1.41 -0.10 0.00 -0.37 0.00 0.00 57.07 58.00 2nx3 s TYR 160 Cb 0.00 -2.64 0.07 0.00 -0.40 0.00 0.00 41.96 38.98 2nx3 s TYR 160 CO 0.00 0.49 0.71 0.09 -1.57 0.00 0.00 175.55 175.27 2nx3 n ASN 161 N 1.97 -4.59 -3.65 2.29 3.02 -1.26 -4.97 115.26 108.08 2nx3 n ASN 161 Ca -0.07 -0.53 -0.15 0.00 -0.03 0.00 0.00 54.58 53.80 2nx3 n ASN 161 Cb 0.50 -3.72 -0.07 0.00 -0.61 0.00 0.00 39.78 35.88 2nx3 n ASN 161 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2nx3 s ASN 162 N -2.95 -0.39 0.10 6.41 2.47 -1.26 -4.13 114.94 115.18 2nx3 s ASN 162 Ca 0.49 0.32 0.07 0.00 0.42 0.00 0.00 52.86 54.17 2nx3 s ASN 162 Cb -0.25 0.42 -0.03 0.00 -1.45 0.00 0.00 41.25 39.94 2nx3 s ASN 162 CO 0.61 -0.55 -0.18 -0.76 -3.72 0.00 0.00 177.10 172.50 2nx3 s LEU 163 N -1.39 2.32 0.03 3.21 1.43 -1.26 -1.71 118.68 121.31 2nx3 s LEU 163 Ca -0.11 -0.69 0.04 0.00 -1.03 0.00 0.00 54.13 52.34 2nx3 s LEU 163 Cb -0.02 -0.73 -0.02 0.00 0.03 0.00 0.00 46.19 45.45 2nx3 s LEU 163 CO 0.05 -0.01 -0.13 0.54 0.23 0.00 0.00 176.35 177.03 2nx3 s VAL 164 N -1.38 1.03 -0.42 -1.59 0.11 -0.70 -4.87 120.40 112.59 2nx3 s VAL 164 Ca 0.05 -0.93 -0.16 0.00 -2.93 0.00 0.00 61.98 58.01 2nx3 s VAL 164 Cb -0.09 -0.94 0.03 0.00 -1.53 0.00 0.00 36.38 33.85 2nx3 s VAL 164 CO 0.04 0.01 0.36 -0.69 -3.33 0.00 0.00 175.10 171.49 2nx3 s VAL 165 N -0.80 5.19 -0.67 2.04 1.01 -1.26 -1.23 120.40 124.68 2nx3 s VAL 165 Ca 0.01 -0.58 -0.22 0.00 0.00 0.00 0.00 61.98 61.19 2nx3 s VAL 165 Cb -0.07 -3.99 0.08 0.00 0.00 0.00 0.00 36.38 32.39 2nx3 s VAL 165 CO 0.01 -0.38 0.96 -0.62 0.00 0.00 0.00 175.10 175.07 2nx3 s ASP 166 N 1.82 6.20 0.00 3.32 -1.08 -1.26 -4.90 116.67 120.77 2nx3 s ASP 166 Ca 0.08 -1.08 0.07 0.00 -0.52 0.00 0.00 52.55 51.10 2nx3 s ASP 166 Cb -0.19 -2.41 0.34 0.00 -1.46 0.00 0.00 42.92 39.20 2nx3 s ASP 166 CO 0.11 -1.40 1.19 0.49 0.52 0.00 0.00 175.17 176.08 2nx3 n PHE 167 N 7.56 0.00 0.31 -5.34 3.72 -1.26 -1.95 117.46 120.50 2nx3 n PHE 167 Ca -0.02 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.53 2nx3 n PHE 167 Cb 0.45 -0.42 0.70 0.00 -0.94 0.00 0.00 39.48 39.27 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 -0.39 -1.08 3.08 -2.03 -2.83 114.38 111.13 2nx3 h ARG 168 Ca 0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 2nx3 h ARG 168 Cb 0.11 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 2nx3 h ARG 168 CO 0.00 0.00 -0.12 0.66 -1.07 0.00 0.00 179.97 179.44 2nx3 h SER 169 N 0.00 0.68 0.36 7.04 4.64 -1.82 -2.61 113.55 121.85 2nx3 h SER 169 Ca 0.00 -0.20 -0.00 0.00 -0.47 0.00 0.00 61.79 61.12 2nx3 h SER 169 Cb 0.29 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.16 2nx3 h SER 169 CO 0.00 0.83 -0.48 -0.07 -0.87 0.00 0.00 176.83 176.24 2nx3 h LEU 170 N 0.63 -1.35 -1.42 5.97 4.07 -1.73 0.39 115.31 121.86 2nx3 h LEU 170 Ca 0.11 0.12 -0.06 0.00 0.08 0.00 0.00 57.88 58.13 2nx3 h LEU 170 Cb 0.57 0.47 -0.01 0.00 1.08 0.00 0.00 40.66 42.77 2nx3 h LEU 170 CO 0.04 -0.61 -0.29 1.55 -1.08 0.00 0.00 178.44 178.05 2nx3 h PRO 171 N -0.88 0.00 -0.05 1.13 0.13 -1.74 -1.88 132.00 128.72 2nx3 h PRO 171 Ca -0.04 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.07 2nx3 h PRO 171 Cb 0.81 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.94 2nx3 h PRO 171 CO -0.13 0.29 -0.06 0.82 -0.23 0.00 0.00 178.00 178.69 2nx3 h ILE 172 N 0.00 1.39 0.00 -3.56 2.04 -1.06 -3.16 117.51 113.17 2nx3 h ILE 172 Ca -0.00 -1.27 0.00 0.00 1.00 0.00 0.00 64.86 64.59 2nx3 h ILE 172 Cb 0.55 2.14 0.00 0.00 -0.74 0.00 0.00 36.82 38.77 2nx3 h ILE 172 CO 0.04 0.34 0.00 0.23 0.00 0.00 0.00 178.15 178.76 2nx3 n MET 173 N -4.74 0.23 0.03 2.37 2.81 0.13 -2.61 117.12 115.34 2nx3 n MET 173 Ca -0.08 0.35 0.09 0.00 -1.81 0.00 0.00 57.70 56.26 2nx3 n MET 173 Cb 0.30 -1.86 0.40 0.00 -0.71 0.00 0.00 33.22 31.34 2nx3 n MET 173 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 2nx3 n LYS 174 N -2.29 0.05 0.25 0.03 3.00 -0.71 -2.95 118.16 115.54 2nx3 n LYS 174 Ca 0.03 0.25 0.12 0.00 -0.00 0.00 0.00 58.31 58.71 2nx3 n LYS 174 Cb 0.31 -1.59 0.61 0.00 0.00 0.00 0.00 35.03 34.36 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 0.00 0.00 1.64 4.20 -1.61 -3.35 115.11 115.99 2nx3 h GLN 175 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2nx3 h GLN 175 Cb 0.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.11 2nx3 h GLN 175 CO 0.00 0.15 -0.09 -2.67 -0.67 0.00 0.00 178.83 175.54 2nx3 n TRP 176 N -3.40 0.00 -3.61 2.96 2.14 -1.16 -5.12 117.44 109.25 2nx3 n TRP 176 Ca -0.01 0.00 -0.03 0.00 2.07 0.00 0.00 57.50 59.53 2nx3 n TRP 176 Cb 0.34 -0.01 -0.01 0.00 -0.81 0.00 0.00 31.31 30.82 2nx3 n TRP 176 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 2nx3 s ALA 177 N 0.00 -2.02 0.24 -1.67 0.00 -1.15 -4.96 121.76 112.20 2nx3 s ALA 177 Ca 0.00 1.06 -0.30 0.00 0.00 0.00 0.00 51.96 52.72 2nx3 s ALA 177 Cb 0.00 0.21 -0.09 0.00 0.00 0.00 0.00 23.12 23.24 2nx3 s ALA 177 CO 0.00 -0.80 1.08 0.15 0.00 0.00 0.00 175.76 176.19 2nx3 s LYS 178 N -2.66 4.65 -0.15 0.00 1.02 -1.07 -4.24 119.74 117.29 2nx3 s LYS 178 Ca 0.10 1.73 -0.03 0.00 0.02 0.00 0.00 55.97 57.79 2nx3 s LYS 178 Cb 0.01 -3.23 -0.03 0.00 -0.52 0.00 0.00 37.83 34.06 2nx3 s LYS 178 CO -0.04 0.20 -0.04 0.08 -0.92 0.00 0.00 175.35 174.63 2nx3 s VAL 179 N -0.85 3.88 0.14 3.17 1.01 -1.26 -0.47 120.40 126.01 2nx3 s VAL 179 Ca 0.46 -0.37 0.09 0.00 0.00 0.00 0.00 61.98 62.16 2nx3 s VAL 179 Cb -0.30 -2.69 -0.04 0.00 0.00 0.00 0.00 36.38 33.35 2nx3 s VAL 179 CO 0.38 0.50 -0.14 -0.63 0.00 0.00 0.00 175.10 175.20 2nx3 s ILE 180 N 0.28 3.01 -0.21 2.22 1.01 0.81 -0.33 121.20 127.99 2nx3 s ILE 180 Ca -0.03 -1.54 -0.01 0.00 0.00 0.00 0.00 60.65 59.06 2nx3 s ILE 180 Cb -0.14 -2.42 0.01 0.00 0.01 0.00 0.00 42.46 39.92 2nx3 s ILE 180 CO 0.03 0.03 -0.11 -0.47 0.00 0.00 0.00 174.94 174.42 2nx3 s TYR 181 N -1.35 2.93 -0.74 3.97 5.04 -0.60 -0.58 117.35 126.02 2nx3 s TYR 181 Ca 0.21 -1.43 -0.25 0.00 -2.44 0.00 0.00 57.07 53.15 2nx3 s TYR 181 Cb -0.10 -2.02 0.04 0.00 0.35 0.00 0.00 41.96 40.24 2nx3 s TYR 181 CO 0.12 -0.71 1.21 0.34 -1.34 0.00 0.00 175.55 175.17 2nx3 s ASP 182 N 1.35 6.20 0.00 4.32 -1.08 0.89 -0.31 116.67 128.04 2nx3 s ASP 182 Ca 0.03 -0.71 0.31 0.00 -0.52 0.00 0.00 52.55 51.66 2nx3 s ASP 182 Cb -0.15 -2.52 1.61 0.00 -1.46 0.00 0.00 42.92 40.41 2nx3 s ASP 182 CO -0.07 -1.69 2.10 0.00 0.52 0.00 0.00 175.17 176.02 2nx3 n ALA 183 N 8.84 2.53 -0.11 3.66 0.00 -0.28 -3.07 120.51 132.07 2nx3 n ALA 183 Ca 0.04 -0.16 -0.16 0.00 0.00 0.00 0.00 53.44 53.16 2nx3 n ALA 183 Cb 0.48 -1.50 -0.10 0.00 0.00 0.00 0.00 19.45 18.33 2nx3 n ALA 183 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2nx3 n THR 184 N -1.22 1.29 0.66 0.00 -2.24 -1.26 -4.54 114.28 106.98 2nx3 n THR 184 Ca 0.16 -0.48 0.12 0.00 -2.27 0.00 0.00 64.05 61.58 2nx3 n THR 184 Cb 0.21 -1.33 0.26 0.00 -2.10 0.00 0.00 70.33 67.37 2nx3 n THR 184 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2nx3 n HIS 185 N -3.22 0.54 0.23 4.78 8.25 -1.25 -3.50 115.22 121.04 2nx3 n HIS 185 Ca -0.40 0.16 0.11 0.00 -0.26 0.00 0.00 57.72 57.32 2nx3 n HIS 185 Cb 0.92 -0.66 0.48 0.00 1.12 0.00 0.00 29.99 31.85 2nx3 n HIS 185 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 2nx3 h SER 186 N 0.00 0.00 -0.62 0.41 0.02 -1.59 -2.26 113.55 109.50 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 0.70 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.24 2nx3 h SER 186 CO 0.00 0.20 0.00 1.33 -1.14 0.00 0.00 176.83 177.22 2nx3 n VAL 187 N -3.35 0.91 -2.79 2.27 0.24 -1.23 -4.70 118.33 109.68 2nx3 n VAL 187 Ca 0.00 -0.96 -0.36 0.00 -2.04 0.00 0.00 64.34 60.99 2nx3 n VAL 187 Cb 0.42 0.58 -0.07 0.00 -1.47 0.00 0.00 33.84 33.30 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 -1.07 4.46 -0.59 7.34 0.74 -0.85 -1.99 119.66 127.69 2nx3 s GLN 188 Ca 0.44 1.26 -0.06 0.00 0.05 0.00 0.00 55.36 57.05 2nx3 s GLN 188 Cb 0.23 -2.58 0.15 0.00 1.10 0.00 0.00 33.01 31.91 2nx3 s GLN 188 CO 0.30 0.17 0.44 -0.51 -0.55 0.00 0.00 175.29 175.14 2nx3 s LEU 189 N -2.45 5.58 -0.75 3.68 1.43 -0.85 -4.25 118.68 121.08 2nx3 s LEU 189 Ca 0.54 -2.52 -0.31 0.00 -1.03 0.00 0.00 54.13 50.81 2nx3 s LEU 189 Cb -0.15 -1.94 -0.19 0.00 0.03 0.00 0.00 46.19 43.94 2nx3 s LEU 189 CO 0.20 -0.49 2.24 -2.65 0.23 0.00 0.00 176.35 175.88 2nx3 n PRO 190 N 4.02 0.00 -3.83 1.29 -0.02 -1.26 -0.45 135.00 134.75 2nx3 n PRO 190 Ca 0.04 0.00 -0.26 0.00 -2.02 0.00 0.00 63.50 61.26 2nx3 n PRO 190 Cb 0.40 -1.34 0.02 0.00 -0.02 0.00 0.00 33.50 32.57 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 6.08 -0.37 0.10 -1.23 0.00 -1.26 -4.26 105.19 104.25 2nx3 n GLY 191 Ca 0.56 0.16 0.14 0.00 0.00 0.00 0.00 46.02 46.87 2nx3 n GLY 191 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nx3 n GLY 192 N -1.66 -1.00 0.38 -0.02 0.00 0.41 -3.41 105.19 99.88 2nx3 n GLY 192 Ca -0.15 -0.25 0.07 0.00 0.00 0.00 0.00 46.02 45.69 2nx3 n GLY 192 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2nx3 n LEU 193 N -1.01 2.82 0.00 0.99 4.77 0.21 -4.76 117.00 120.03 2nx3 n LEU 193 Ca 0.14 -2.72 0.00 0.00 -0.03 0.00 0.00 56.01 53.40 2nx3 n LEU 193 Cb 0.27 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 2nx3 n LEU 193 CO 0.24 0.66 0.00 0.61 -1.33 0.00 0.00 177.39 177.57 2nx3 n GLY 194 N -0.73 1.48 0.03 -0.72 0.00 -1.22 -4.08 105.19 99.95 2nx3 n GLY 194 Ca 0.14 -0.44 0.12 0.00 0.00 0.00 0.00 46.02 45.84 2nx3 n GLY 194 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2nx3 n ASP 195 N 4.16 0.69 -4.07 1.61 8.00 -1.26 -4.90 116.55 120.77 2nx3 n ASP 195 Ca 0.00 -0.49 -0.11 0.00 0.71 0.00 0.00 54.79 54.90 2nx3 n ASP 195 Cb 0.00 0.40 -0.11 0.00 -0.02 0.00 0.00 41.12 41.40 2nx3 n ASP 195 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2nx3 s LYS 196 N -2.95 0.55 0.23 -1.24 1.02 -1.26 -3.73 119.74 112.37 2nx3 s LYS 196 Ca 0.12 -0.89 -0.21 0.00 0.02 0.00 0.00 55.97 55.01 2nx3 s LYS 196 Cb 0.17 -0.13 -0.08 0.00 -0.52 0.00 0.00 37.83 37.27 2nx3 s LYS 196 CO 0.72 -0.00 0.76 -1.12 -0.92 0.00 0.00 175.35 174.78 2nx3 s SER 197 N -1.98 7.11 0.02 2.83 0.01 -1.26 -0.62 113.70 119.80 2nx3 s SER 197 Ca -0.05 1.48 0.00 0.00 1.31 0.00 0.00 55.95 58.69 2nx3 s SER 197 Cb -0.05 -2.44 0.00 0.00 0.21 0.00 0.00 66.02 63.73 2nx3 s SER 197 CO -0.02 0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.26 2nx3 n GLY 198 N 0.73 1.38 3.60 3.44 0.00 -0.99 -4.76 105.19 108.59 2nx3 n GLY 198 Ca -0.02 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 44.04 2nx3 n GLY 198 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2nx3 s GLY 199 N -1.10 -0.35 -0.46 -0.02 0.00 -1.26 -2.00 107.32 102.13 2nx3 s GLY 199 Ca 0.00 1.33 0.03 0.00 0.00 0.00 0.00 44.72 46.08 2nx3 s GLY 199 CO 0.00 0.38 0.29 1.06 0.00 0.00 0.00 173.10 174.82 2nx3 s MET 200 N -2.17 1.33 0.49 2.90 -1.94 -0.84 -4.89 119.30 114.17 2nx3 s MET 200 Ca 0.13 -2.15 0.17 0.00 -1.71 0.00 0.00 55.69 52.12 2nx3 s MET 200 Cb 0.03 -2.26 1.20 0.00 2.01 0.00 0.00 34.83 35.81 2nx3 s MET 200 CO -0.04 -1.22 2.07 -0.09 -0.01 0.00 0.00 175.02 175.73 2nx3 h ARG 201 N 6.40 0.14 0.00 2.03 2.43 -1.87 -1.90 114.38 121.61 2nx3 h ARG 201 Ca 0.06 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 2nx3 h ARG 201 Cb 0.90 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.42 2nx3 h ARG 201 CO 0.48 0.10 0.13 1.05 -1.51 0.00 0.00 179.97 180.21 2nx3 h GLU 202 N 0.15 0.00 -0.12 0.20 9.09 -1.95 -0.61 114.58 121.35 2nx3 h GLU 202 Ca 0.13 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.54 2nx3 h GLU 202 Cb 0.32 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.42 2nx3 h GLU 202 CO -0.02 0.00 0.00 1.19 0.05 0.00 0.00 179.01 180.23 2nx3 n PHE 203 N -2.40 0.14 0.02 2.06 3.72 -0.71 -4.60 117.46 115.69 2nx3 n PHE 203 Ca -0.02 -0.10 -0.13 0.00 -0.05 0.00 0.00 57.45 57.16 2nx3 n PHE 203 Cb 0.16 -0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.61 2nx3 n PHE 203 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 2nx3 h ILE 204 N 3.12 1.19 -0.32 4.37 2.04 -1.22 -2.80 117.51 123.90 2nx3 h ILE 204 Ca 0.00 -1.07 -0.03 0.00 1.00 0.00 0.00 64.86 64.76 2nx3 h ILE 204 Cb 0.71 1.86 -0.01 0.00 -0.74 0.00 0.00 36.82 38.63 2nx3 h ILE 204 CO 0.00 0.26 0.07 0.15 0.00 0.00 0.00 178.15 178.63 2nx3 h PHE 205 N -0.60 0.53 -0.71 1.37 3.57 -1.82 -2.39 116.94 116.89 2nx3 h PHE 205 Ca -0.01 -0.07 0.06 0.00 3.53 0.00 0.00 57.97 61.49 2nx3 h PHE 205 Cb 0.50 -0.15 -0.06 0.00 2.79 0.00 0.00 35.95 39.03 2nx3 h PHE 205 CO 0.08 0.56 0.41 -1.35 -2.23 0.00 0.00 178.31 175.78 2nx3 h PRO 206 N 0.35 0.72 0.00 6.41 0.11 -1.81 -1.82 132.00 135.96 2nx3 h PRO 206 Ca 0.10 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.15 2nx3 h PRO 206 Cb 0.30 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.25 2nx3 h PRO 206 CO 0.00 0.47 -0.09 -0.07 -0.21 0.00 0.00 178.00 178.10 2nx3 h LEU 207 N 0.74 0.00 -0.20 2.35 3.38 -1.42 -2.82 115.31 117.33 2nx3 h LEU 207 Ca 0.32 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.14 2nx3 h LEU 207 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2nx3 h LEU 207 CO -0.19 0.09 -0.46 0.40 0.09 0.00 0.00 178.44 178.37 2nx3 h ILE 208 N 0.00 1.32 -0.78 1.22 2.04 -0.82 -1.58 117.51 118.91 2nx3 h ILE 208 Ca -0.00 -1.69 0.00 0.00 1.00 0.00 0.00 64.86 64.17 2nx3 h ILE 208 Cb 0.73 1.86 -0.04 0.00 -0.74 0.00 0.00 36.82 38.63 2nx3 h ILE 208 CO 0.01 0.53 0.49 0.03 0.00 0.00 0.00 178.15 179.21 2nx3 h ARG 209 N 0.37 1.04 -0.39 2.37 3.08 -1.22 -1.47 114.38 118.16 2nx3 h ARG 209 Ca -0.00 -0.08 -0.09 0.00 0.07 0.00 0.00 59.98 59.88 2nx3 h ARG 209 Cb 1.07 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 2nx3 h ARG 209 CO 0.10 0.71 -0.12 0.00 -1.07 0.00 0.00 179.97 179.60 2nx3 h ALA 210 N 1.47 0.54 -0.09 0.04 0.00 -1.37 -1.58 119.26 118.27 2nx3 h ALA 210 Ca 0.28 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2nx3 h ALA 210 Cb -0.08 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 2nx3 h ALA 210 CO -0.06 0.43 0.06 0.00 0.00 0.00 0.00 179.25 179.69 2nx3 h ALA 211 N 0.83 0.12 0.00 0.00 0.00 -0.67 0.87 119.26 120.41 2nx3 h ALA 211 Ca 0.10 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2nx3 h ALA 211 Cb 0.65 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2nx3 h ALA 211 CO 0.04 -0.39 -0.24 -0.39 0.00 0.00 0.00 179.25 178.27 2nx3 h VAL 212 N 0.12 0.80 0.13 0.00 -1.51 -1.27 -0.12 116.25 114.39 2nx3 h VAL 212 Ca 0.03 -0.96 -0.28 0.00 -1.23 0.00 0.00 66.70 64.26 2nx3 h VAL 212 Cb -0.01 1.58 0.01 0.00 -2.13 0.00 0.00 31.29 30.74 2nx3 h VAL 212 CO -0.01 0.23 -1.23 0.00 -1.23 0.00 0.00 177.57 175.33 2nx3 h ALA 213 N 1.76 0.09 -0.20 5.19 0.00 -0.81 -3.29 119.26 121.99 2nx3 h ALA 213 Ca -0.00 -0.84 -0.11 0.00 0.00 0.00 0.00 54.91 53.96 2nx3 h ALA 213 Cb 0.56 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 2nx3 h ALA 213 CO 0.03 0.86 -0.31 0.28 0.00 0.00 0.00 179.25 180.12 2nx3 h VAL 214 N 0.14 1.33 0.00 0.00 2.07 -0.50 -3.47 116.25 115.82 2nx3 h VAL 214 Ca -0.15 -1.52 0.00 0.00 0.82 0.00 0.00 66.70 65.85 2nx3 h VAL 214 Cb 1.93 1.82 0.00 0.00 -1.52 0.00 0.00 31.29 33.52 2nx3 h VAL 214 CO 0.21 0.47 0.00 0.61 0.02 0.00 0.00 177.57 178.88 2nx3 n GLY 215 N 0.31 2.64 3.36 2.17 0.00 -0.09 -4.87 105.19 108.72 2nx3 n GLY 215 Ca -0.05 -0.89 -0.10 0.00 0.00 0.00 0.00 46.02 44.98 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 -0.23 0.44 -3.56 0.00 8.00 0.55 -4.98 116.55 116.77 2nx3 n ASP 217 Ca -0.10 -0.21 0.03 0.00 0.71 0.00 0.00 54.79 55.22 2nx3 n ASP 217 Cb 0.63 0.02 -0.00 0.00 -0.02 0.00 0.00 41.12 41.74 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 -2.86 -0.47 -0.00 0.44 0.00 -1.18 -1.73 107.32 101.51 2nx3 s GLY 218 Ca 0.16 1.07 0.07 0.00 0.00 0.00 0.00 44.72 46.02 2nx3 s GLY 218 CO 0.61 0.23 -0.21 0.14 0.00 0.00 0.00 173.10 173.86 2nx3 s VAL 219 N -2.02 1.68 -0.19 1.40 1.01 -0.31 -1.56 120.40 120.42 2nx3 s VAL 219 Ca 0.15 -0.96 -0.02 0.00 0.00 0.00 0.00 61.98 61.14 2nx3 s VAL 219 Cb 0.07 -1.41 -0.00 0.00 0.00 0.00 0.00 36.38 35.04 2nx3 s VAL 219 CO -0.06 0.42 -0.10 0.12 0.00 0.00 0.00 175.10 175.48 2nx3 s PHE 220 N -0.55 2.88 0.06 5.22 5.36 0.57 -1.06 117.98 130.47 2nx3 s PHE 220 Ca 0.08 -1.00 0.01 0.00 -0.96 0.00 0.00 56.93 55.06 2nx3 s PHE 220 Cb -0.08 -2.00 -0.03 0.00 -0.34 0.00 0.00 43.02 40.57 2nx3 s PHE 220 CO -0.00 -0.51 -0.06 -1.64 -1.46 0.00 0.00 175.22 171.55 2nx3 s MET 221 N 1.14 0.61 -0.13 10.12 -1.94 0.19 -1.13 119.30 128.16 2nx3 s MET 221 Ca 0.01 -1.00 0.01 0.00 -1.71 0.00 0.00 55.69 53.00 2nx3 s MET 221 Cb -0.14 -0.12 -0.01 0.00 2.01 0.00 0.00 34.83 36.57 2nx3 s MET 221 CO -0.03 -0.01 -0.17 -1.21 -0.01 0.00 0.00 175.02 173.59 2nx3 s GLU 222 N -2.70 3.24 0.25 2.03 2.02 -1.26 -3.40 118.70 118.89 2nx3 s GLU 222 Ca -0.01 -0.76 0.09 0.00 0.02 0.00 0.00 54.97 54.31 2nx3 s GLU 222 Cb -0.02 -2.53 -0.05 0.00 0.10 0.00 0.00 34.13 31.63 2nx3 s GLU 222 CO -0.03 0.15 -0.14 -0.08 0.02 0.00 0.00 175.26 175.18 2nx3 s THR 223 N 0.46 2.01 -0.28 3.63 -1.32 -0.58 -0.79 115.64 118.78 2nx3 s THR 223 Ca -0.12 -2.26 -0.19 0.00 -1.21 0.00 0.00 61.69 57.91 2nx3 s THR 223 Cb -0.16 -2.25 0.09 0.00 -1.51 0.00 0.00 72.50 68.66 2nx3 s THR 223 CO 0.05 -0.45 0.76 -2.28 -2.21 0.00 0.00 174.62 170.50 2nx3 s HIS 224 N -2.80 -0.89 0.53 9.09 5.04 -0.44 -3.82 115.29 122.00 2nx3 s HIS 224 Ca 0.27 1.89 0.26 0.00 -1.54 0.00 0.00 55.06 55.94 2nx3 s HIS 224 Cb -0.01 0.49 1.40 0.00 0.04 0.00 0.00 32.58 34.50 2nx3 s HIS 224 CO 0.11 -0.44 1.98 -1.00 -2.34 0.00 0.00 174.74 173.05 2nx3 h PRO 225 N 6.19 0.01 -2.04 2.88 0.13 -1.94 -2.48 132.00 134.75 2nx3 h PRO 225 Ca -0.29 -0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.32 2nx3 h PRO 225 Cb 1.20 -0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.99 2nx3 h PRO 225 CO 0.13 0.01 -0.92 0.39 -0.23 0.00 0.00 178.00 177.38 2nx3 n GLU 226 N -4.36 0.34 -0.15 0.86 1.02 -1.26 -4.62 120.64 112.47 2nx3 n GLU 226 Ca 0.11 -2.98 0.28 0.00 -0.02 0.00 0.00 57.16 54.54 2nx3 n GLU 226 Cb 0.66 -1.55 0.72 0.00 -0.02 0.00 0.00 31.44 31.25 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 5.20 0.00 0.00 3.49 0.11 -1.86 0.18 132.00 139.11 2nx3 h PRO 227 Ca 0.19 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.29 2nx3 h PRO 227 Cb 0.93 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.04 2nx3 h PRO 227 CO 0.34 0.00 -0.06 1.05 -0.21 0.00 0.00 178.00 179.12 2nx3 h GLU 228 N 0.00 0.00 -0.62 1.05 4.11 -1.93 -2.42 114.58 114.77 2nx3 h GLU 228 Ca 0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.83 2nx3 h GLU 228 Cb 1.68 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.93 2nx3 h GLU 228 CO -0.00 0.06 0.00 1.63 0.07 0.00 0.00 179.01 180.77 2nx3 n LYS 229 N -4.23 2.71 -1.92 1.06 5.02 0.62 -5.01 118.16 116.42 2nx3 n LYS 229 Ca -0.03 -2.50 -0.38 0.00 -2.02 0.00 0.00 58.31 53.39 2nx3 n LYS 229 Cb 0.15 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 33.68 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 -1.04 2.77 -2.57 7.82 0.00 -0.91 -4.92 121.76 122.91 2nx3 s ALA 230 Ca 0.43 1.19 0.26 0.00 0.00 0.00 0.00 51.96 53.84 2nx3 s ALA 230 Cb 0.23 -3.51 0.83 0.00 0.00 0.00 0.00 23.12 20.67 2nx3 s ALA 230 CO 0.30 -1.20 1.62 1.28 0.00 0.00 0.00 175.76 177.75 2nx3 n LEU 231 N -1.07 1.87 -3.60 0.00 4.77 -1.26 -4.58 117.00 113.12 2nx3 n LEU 231 Ca 0.11 -0.65 -0.03 0.00 -0.03 0.00 0.00 56.01 55.41 2nx3 n LEU 231 Cb 0.47 -0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.48 2nx3 n LEU 231 CO 0.50 0.32 0.48 -0.55 -1.33 0.00 0.00 177.39 176.81 2nx3 s SER 232 N -1.94 -0.79 -1.29 -1.43 0.15 -1.26 -4.47 113.70 102.68 2nx3 s SER 232 Ca 0.35 1.19 -0.01 0.00 0.70 0.00 0.00 55.95 58.18 2nx3 s SER 232 Cb 0.20 1.55 0.00 0.00 -1.71 0.00 0.00 66.02 66.07 2nx3 s SER 232 CO 0.32 -0.18 0.16 0.47 1.20 0.00 0.00 173.24 175.21 2nx3 n ASP 233 N 4.45 -4.82 -0.33 5.45 9.92 -1.26 -4.81 116.55 125.16 2nx3 n ASP 233 Ca -0.16 -0.09 0.13 0.00 -0.53 0.00 0.00 54.79 54.15 2nx3 n ASP 233 Cb 0.56 -3.85 0.35 0.00 -0.64 0.00 0.00 41.12 37.54 2nx3 n ASP 233 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2nx3 h ALA 234 N 0.75 1.78 0.00 2.24 0.00 -1.81 -0.23 119.26 121.99 2nx3 h ALA 234 Ca -0.38 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 2nx3 h ALA 234 Cb 1.28 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2nx3 h ALA 234 CO 0.44 -0.11 -0.23 -1.35 0.00 0.00 0.00 179.25 178.00 2nx3 h PRO 235 N 0.72 0.00 0.00 0.00 0.11 -1.86 -3.16 132.00 127.81 2nx3 h PRO 235 Ca 0.54 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.55 2nx3 h PRO 235 Cb 0.90 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.99 2nx3 h PRO 235 CO -0.31 0.23 -1.64 0.25 -0.21 0.00 0.00 178.00 176.31 2nx3 n THR 236 N -3.60 0.68 -1.61 -1.15 -2.24 -0.26 -4.26 114.28 101.84 2nx3 n THR 236 Ca -0.01 -0.62 -0.49 0.00 -2.27 0.00 0.00 64.05 60.67 2nx3 n THR 236 Cb 0.36 -0.35 -0.05 0.00 -2.10 0.00 0.00 70.33 68.19 2nx3 n THR 236 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nx3 n ALA 237 N -2.35 -0.17 -2.73 6.98 0.00 -0.29 -4.88 120.51 117.07 2nx3 n ALA 237 Ca -0.09 0.47 -0.36 0.00 0.00 0.00 0.00 53.44 53.47 2nx3 n ALA 237 Cb 0.72 -2.14 -0.07 0.00 0.00 0.00 0.00 19.45 17.96 2nx3 n ALA 237 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2nx3 s LEU 238 N 0.56 4.25 0.04 0.00 2.96 0.03 -4.80 118.68 121.73 2nx3 s LEU 238 Ca 0.78 0.42 -0.36 0.00 -0.22 0.00 0.00 54.13 54.74 2nx3 s LEU 238 Cb -0.83 -2.25 -0.16 0.00 0.50 0.00 0.00 46.19 43.46 2nx3 s LEU 238 CO 0.47 0.17 1.47 -2.65 -1.32 0.00 0.00 176.35 174.49 2nx3 n PRO 239 N 3.33 1.42 -0.12 0.98 -0.02 -1.26 -1.32 135.00 138.01 2nx3 n PRO 239 Ca -0.14 0.51 0.13 0.00 -2.02 0.00 0.00 63.50 61.98 2nx3 n PRO 239 Cb 0.52 -2.20 0.50 0.00 -0.02 0.00 0.00 33.50 32.30 2nx3 n PRO 239 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2nx3 h LEU 240 N 5.46 0.39 -1.07 2.45 5.85 -1.70 -0.83 115.31 125.85 2nx3 h LEU 240 Ca -0.47 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.20 2nx3 h LEU 240 Cb 1.31 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.27 2nx3 h LEU 240 CO 0.83 0.22 -0.28 0.77 -0.34 0.00 0.00 178.44 179.65 2nx3 h SER 241 N 0.43 0.00 1.13 1.25 4.64 -1.88 -2.82 113.55 116.29 2nx3 h SER 241 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 2nx3 h SER 241 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 2nx3 h SER 241 CO -0.09 0.28 0.00 0.00 -0.87 0.00 0.00 176.83 176.15 2nx3 n GLN 242 N -3.46 0.09 -0.18 4.77 6.02 -0.32 -4.04 117.38 120.26 2nx3 n GLN 242 Ca -0.00 0.09 -0.02 0.00 -0.01 0.00 0.00 57.00 57.06 2nx3 n GLN 242 Cb 0.45 -1.61 0.08 0.00 1.02 0.00 0.00 30.24 30.18 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 0.00 0.22 0.12 1.08 5.85 -1.46 -2.73 115.31 118.39 2nx3 h LEU 243 Ca 0.00 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 2nx3 h LEU 243 Cb 0.57 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.64 2nx3 h LEU 243 CO 0.00 0.15 -0.06 -0.08 -0.34 0.00 0.00 178.44 178.11 2nx3 h GLU 244 N 0.39 -0.15 -0.65 1.25 4.81 -1.80 -2.52 114.58 115.91 2nx3 h GLU 244 Ca 0.26 0.01 0.13 0.00 -0.13 0.00 0.00 59.36 59.63 2nx3 h GLU 244 Cb 0.28 0.03 -0.10 0.00 0.63 0.00 0.00 28.75 29.59 2nx3 h GLU 244 CO -0.25 0.05 0.12 0.78 -0.73 0.00 0.00 179.01 178.98 2nx3 h GLY 245 N -0.34 0.84 0.92 1.92 0.00 -1.76 -0.58 103.07 104.07 2nx3 h GLY 245 Ca -0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 2nx3 h GLY 245 CO 0.03 -0.16 0.12 -2.22 0.00 0.00 0.00 176.54 174.30 2nx3 h ILE 246 N 0.23 1.16 -0.61 2.60 5.03 -1.45 -1.93 117.51 122.54 2nx3 h ILE 246 Ca 0.35 -0.47 0.04 0.00 -0.12 0.00 0.00 64.86 64.66 2nx3 h ILE 246 Cb 0.56 0.99 -0.04 0.00 -3.03 0.00 0.00 36.82 35.30 2nx3 h ILE 246 CO -0.47 0.16 0.36 0.40 -0.68 0.00 0.00 178.15 177.92 2nx3 h ILE 247 N 0.28 1.03 -0.87 -0.67 2.04 -0.89 -0.49 117.51 117.95 2nx3 h ILE 247 Ca 0.09 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.71 2nx3 h ILE 247 Cb 0.15 0.28 -0.04 0.00 -0.74 0.00 0.00 36.82 36.47 2nx3 h ILE 247 CO -0.01 0.13 0.54 -0.08 0.00 0.00 0.00 178.15 178.73 2nx3 h GLU 248 N 0.69 1.16 -0.12 2.37 4.57 -0.95 -1.93 114.58 120.37 2nx3 h GLU 248 Ca 0.25 -0.09 -0.02 0.00 -1.18 0.00 0.00 59.36 58.32 2nx3 h GLU 248 Cb 0.07 -0.25 -0.00 0.00 -0.16 0.00 0.00 28.75 28.41 2nx3 h GLU 248 CO -0.13 0.80 0.00 0.00 -1.18 0.00 0.00 179.01 178.50 2nx3 h ALA 249 N 1.41 0.16 -0.89 2.92 0.00 -0.49 -2.59 119.26 119.78 2nx3 h ALA 249 Ca 0.31 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2nx3 h ALA 249 Cb -0.08 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 2nx3 h ALA 249 CO -0.06 -0.15 0.49 -0.84 0.00 0.00 0.00 179.25 178.68 2nx3 h ILE 250 N -0.05 1.26 -0.15 0.00 -0.00 -0.89 -1.30 117.51 116.38 2nx3 h ILE 250 Ca 0.03 -0.64 -0.00 0.00 -0.00 0.00 0.00 64.86 64.25 2nx3 h ILE 250 Cb 0.35 0.05 -0.01 0.00 -0.00 0.00 0.00 36.82 37.22 2nx3 h ILE 250 CO 0.01 0.29 0.09 -0.07 -0.00 0.00 0.00 178.15 178.47 2nx3 h LEU 251 N 1.25 0.17 0.11 0.16 3.38 -1.32 0.32 115.31 119.39 2nx3 h LEU 251 Ca 0.31 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 2nx3 h LEU 251 Cb 0.03 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2nx3 h LEU 251 CO -0.05 0.15 -0.05 -0.33 0.09 0.00 0.00 178.44 178.25 2nx3 h GLU 252 N 0.17 -0.15 -0.84 1.13 5.08 -1.20 0.12 114.58 118.90 2nx3 h GLU 252 Ca 0.05 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.45 2nx3 h GLU 252 Cb 0.01 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.25 2nx3 h GLU 252 CO -0.01 -0.09 0.54 0.82 -1.00 0.00 0.00 179.01 179.28 2nx3 h ILE 253 N -0.16 1.15 -0.65 3.13 2.04 -1.11 -2.33 117.51 119.57 2nx3 h ILE 253 Ca -0.02 -0.37 -0.05 0.00 1.00 0.00 0.00 64.86 65.43 2nx3 h ILE 253 Cb 0.13 -0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.17 2nx3 h ILE 253 CO 0.03 0.20 0.22 -0.09 0.00 0.00 0.00 178.15 178.50 2nx3 h ARG 254 N 1.07 1.01 -0.87 2.37 2.43 -0.02 0.40 114.38 120.76 2nx3 h ARG 254 Ca 0.33 -0.21 0.13 0.00 -0.81 0.00 0.00 59.98 59.43 2nx3 h ARG 254 Cb -0.02 -0.15 -0.09 0.00 -0.42 0.00 0.00 29.97 29.29 2nx3 h ARG 254 CO -0.11 0.87 0.48 1.49 -1.51 0.00 0.00 179.97 181.19 2nx3 h GLU 255 N 0.94 0.70 0.14 0.20 4.81 -0.20 -0.37 114.58 120.79 2nx3 h GLU 255 Ca 0.21 -0.04 -0.33 0.00 -0.13 0.00 0.00 59.36 59.07 2nx3 h GLU 255 Cb 0.27 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.49 2nx3 h GLU 255 CO -0.01 0.46 -1.71 -0.24 -0.73 0.00 0.00 179.01 176.78 2nx3 h VAL 256 N 0.72 0.86 0.00 0.32 3.04 -1.32 -3.39 116.25 116.48 2nx3 h VAL 256 Ca 0.46 -2.41 -0.10 0.00 -1.01 0.00 0.00 66.70 63.64 2nx3 h VAL 256 Cb 0.58 2.65 -0.01 0.00 -2.01 0.00 0.00 31.29 32.49 2nx3 h VAL 256 CO -0.32 0.81 -0.46 0.00 -1.01 0.00 0.00 177.57 176.58 2nx3 h ALA 257 N 0.03 1.21 0.00 3.17 0.00 -0.79 -3.18 119.26 119.70 2nx3 h ALA 257 Ca -0.36 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.13 2nx3 h ALA 257 Cb 1.95 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.67 2nx3 h ALA 257 CO 0.10 0.58 -0.00 0.66 0.00 0.00 0.00 179.25 180.59 2nx3 h SER 258 N 0.00 0.00 -0.01 0.00 4.64 -1.25 -0.77 113.55 116.16 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 0.00 0.00 2.29 -0.87 0.00 0.00 176.83 178.31 2nx3 n LYS 259 N -3.38 1.03 0.00 4.77 2.85 -1.20 -2.77 118.16 119.46 2nx3 n LYS 259 Ca -0.03 -0.05 0.00 0.00 -1.05 0.00 0.00 58.31 57.19 2nx3 n LYS 259 Cb 0.09 -1.25 0.00 0.00 -0.65 0.00 0.00 35.03 33.22 2nx3 n LYS 259 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2nx3 n TYR 260 N -0.70 0.00 -1.88 5.58 4.01 -0.30 -5.05 117.16 118.82 2nx3 n TYR 260 Ca 0.12 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.46 2nx3 n TYR 260 Cb 0.06 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.10 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 -0.21 2.59 0.56 -0.72 2.02 -1.11 -4.98 117.35 115.49 2nx3 s TYR 261 Ca 0.00 1.30 -0.15 0.00 -0.37 0.00 0.00 57.07 57.85 2nx3 s TYR 261 Cb 0.00 -3.85 -0.06 0.00 -0.40 0.00 0.00 41.96 37.65 2nx3 s TYR 261 CO 0.00 -2.66 1.01 -1.21 -1.57 0.00 0.00 175.55 171.12 2nx3 s GLU 262 N -2.35 3.72 -0.16 -0.62 8.01 -1.26 -5.04 118.70 120.99 2nx3 s GLU 262 Ca 0.59 0.98 -0.15 0.00 0.01 0.00 0.00 54.97 56.39 2nx3 s GLU 262 Cb -0.42 -2.10 -0.04 0.00 -4.31 0.00 0.00 34.13 27.26 2nx3 s GLU 262 CO 0.54 -0.47 0.35 0.99 0.01 0.00 0.00 175.26 176.69 2nx3 s THR 263 N -2.70 5.26 -2.00 3.63 2.01 -1.26 -5.18 115.64 115.40 2nx3 s THR 263 Ca 0.59 0.66 0.23 0.00 0.31 0.00 0.00 61.69 63.49 2nx3 s THR 263 Cb -0.12 -3.69 0.66 0.00 0.01 0.00 0.00 72.50 69.36 2nx3 s THR 263 CO 0.37 0.34 1.75 2.30 -0.69 0.00 0.00 174.62 178.70