#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nx3 s PHE 4 N 0.00 2.86 -0.16 2.13 5.36 -1.25 -4.75 117.98 122.17 2nx3 s PHE 4 Ca 0.00 1.52 -0.06 0.00 -0.96 0.00 0.00 56.93 57.43 2nx3 s PHE 4 Cb 0.00 -3.42 -0.04 0.00 -0.34 0.00 0.00 43.02 39.22 2nx3 s PHE 4 CO 0.00 -1.60 0.05 -1.17 -1.46 0.00 0.00 175.22 171.05 2nx3 s LEU 5 N -2.95 3.78 -0.32 6.12 2.96 -0.91 -1.08 118.68 126.27 2nx3 s LEU 5 Ca 0.63 0.10 0.01 0.00 -0.22 0.00 0.00 54.13 54.65 2nx3 s LEU 5 Cb -0.30 -1.94 0.10 0.00 0.50 0.00 0.00 46.19 44.55 2nx3 s LEU 5 CO 0.37 0.21 0.08 -0.69 -1.32 0.00 0.00 176.35 175.00 2nx3 s VAL 6 N 0.12 1.43 -0.41 1.68 1.01 -0.84 -1.28 120.40 122.10 2nx3 s VAL 6 Ca 0.04 -1.76 -0.19 0.00 0.00 0.00 0.00 61.98 60.07 2nx3 s VAL 6 Cb -0.12 -2.06 0.02 0.00 0.00 0.00 0.00 36.38 34.21 2nx3 s VAL 6 CO 0.01 -0.64 0.54 -0.63 0.00 0.00 0.00 175.10 174.38 2nx3 s ILE 7 N 1.34 4.96 0.24 2.22 1.01 -1.00 -1.91 121.20 128.06 2nx3 s ILE 7 Ca 0.10 -0.00 0.02 0.00 0.00 0.00 0.00 60.65 60.76 2nx3 s ILE 7 Cb -0.18 -4.09 -0.01 0.00 0.01 0.00 0.00 42.46 38.19 2nx3 s ILE 7 CO -0.18 -0.45 0.06 0.00 0.00 0.00 0.00 174.94 174.37 2nx3 n ALA 8 N 5.91 0.30 0.00 9.38 0.00 -0.97 -1.37 120.51 133.76 2nx3 n ALA 8 Ca -0.04 -1.16 0.00 0.00 0.00 0.00 0.00 53.44 52.24 2nx3 n ALA 8 Cb 0.48 0.75 0.00 0.00 0.00 0.00 0.00 19.45 20.68 2nx3 n ALA 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nx3 n GLY 9 N 0.87 1.95 3.80 0.00 0.00 -1.25 -0.24 105.19 110.31 2nx3 n GLY 9 Ca -0.05 -2.08 -0.33 0.00 0.00 0.00 0.00 46.02 43.56 2nx3 n GLY 9 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2nx3 s PRO 10 N -1.54 3.31 0.07 1.61 0.04 -1.17 -0.73 135.00 136.59 2nx3 s PRO 10 Ca 0.00 1.27 -0.24 0.00 0.04 0.00 0.00 61.00 62.07 2nx3 s PRO 10 Cb 0.00 -2.03 -0.16 0.00 0.04 0.00 0.00 34.50 32.35 2nx3 s PRO 10 CO 0.00 -0.82 1.66 -0.97 0.04 0.00 0.00 177.00 176.91 2nx3 h ASN 11 N 0.57 -0.04 -3.41 6.66 -1.24 -1.86 -3.36 115.58 112.90 2nx3 h ASN 11 Ca -0.47 -0.07 -0.44 0.00 0.71 0.00 0.00 56.30 56.02 2nx3 h ASN 11 Cb 1.23 0.01 -0.15 0.00 0.73 0.00 0.00 38.32 40.13 2nx3 h ASN 11 CO 0.57 0.05 -0.74 0.00 -1.29 0.00 0.00 177.43 176.02 2nx3 s ALA 12 N -5.89 1.91 -0.83 1.57 0.00 -1.26 -1.46 121.76 115.79 2nx3 s ALA 12 Ca -0.14 -1.59 -0.24 0.00 0.00 0.00 0.00 51.96 50.00 2nx3 s ALA 12 Cb 0.05 -0.08 0.05 0.00 0.00 0.00 0.00 23.12 23.14 2nx3 s ALA 12 CO 0.66 0.08 1.27 0.42 0.00 0.00 0.00 175.76 178.19 2nx3 s ILE 13 N -2.81 3.96 0.03 0.00 1.01 -0.33 -4.80 121.20 118.26 2nx3 s ILE 13 Ca 0.20 -0.25 0.10 0.00 0.00 0.00 0.00 60.65 60.69 2nx3 s ILE 13 Cb -0.01 -4.92 -0.22 0.00 0.01 0.00 0.00 42.46 37.32 2nx3 s ILE 13 CO 0.06 -1.80 0.94 -0.33 0.00 0.00 0.00 174.94 173.81 2nx3 h GLU 14 N 9.78 0.01 -1.93 2.79 5.08 -1.98 -3.40 114.58 124.93 2nx3 h GLU 14 Ca -0.09 -0.01 0.18 0.00 -1.00 0.00 0.00 59.36 58.44 2nx3 h GLU 14 Cb 1.04 0.01 -0.16 0.00 0.50 0.00 0.00 28.75 30.14 2nx3 h GLU 14 CO 1.30 0.73 0.63 -1.54 -1.00 0.00 0.00 179.01 179.14 2nx3 s SER 15 N -6.39 -0.24 0.32 1.42 1.04 -1.26 -5.02 113.70 103.57 2nx3 s SER 15 Ca -0.02 -0.05 0.15 0.00 0.48 0.00 0.00 55.95 56.52 2nx3 s SER 15 Cb 0.09 0.29 0.48 0.00 0.10 0.00 0.00 66.02 66.98 2nx3 s SER 15 CO 0.82 -0.48 1.65 -0.33 0.98 0.00 0.00 173.24 175.88 2nx3 h GLU 16 N 2.00 0.00 0.00 4.02 5.08 -1.98 -2.63 114.58 121.07 2nx3 h GLU 16 Ca -0.18 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.14 2nx3 h GLU 16 Cb 1.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 2nx3 h GLU 16 CO 0.27 0.49 -0.20 1.05 -1.00 0.00 0.00 179.01 179.62 2nx3 h GLU 17 N 0.00 0.00 0.53 2.33 4.11 -1.99 -2.25 114.58 117.31 2nx3 h GLU 17 Ca -0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 2nx3 h GLU 17 Cb 1.05 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.30 2nx3 h GLU 17 CO 0.06 0.20 -0.26 1.25 0.07 0.00 0.00 179.01 180.34 2nx3 h LEU 18 N 0.00 -0.61 -2.26 3.06 5.85 -1.87 0.44 115.31 119.93 2nx3 h LEU 18 Ca -0.00 -0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.71 2nx3 h LEU 18 Cb 0.52 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 2nx3 h LEU 18 CO 0.03 -0.22 0.16 -0.07 -0.34 0.00 0.00 178.44 177.99 2nx3 h LEU 19 N -1.07 0.00 0.02 2.25 4.07 -1.51 0.10 115.31 119.17 2nx3 h LEU 19 Ca -0.07 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.89 2nx3 h LEU 19 Cb 0.62 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.36 2nx3 h LEU 19 CO 0.12 0.00 -0.01 -0.07 -1.08 0.00 0.00 178.44 177.40 2nx3 h LEU 20 N 0.00 -0.02 -2.22 1.67 4.07 -1.27 0.58 115.31 118.12 2nx3 h LEU 20 Ca 0.07 -0.74 -0.01 0.00 0.08 0.00 0.00 57.88 57.28 2nx3 h LEU 20 Cb 0.39 0.01 -0.00 0.00 1.08 0.00 0.00 40.66 42.14 2nx3 h LEU 20 CO -0.00 0.81 -0.05 0.50 -1.08 0.00 0.00 178.44 178.62 2nx3 h LYS 21 N -0.92 0.00 0.00 1.13 3.64 -0.32 0.11 116.57 120.20 2nx3 h LYS 21 Ca -0.00 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 2nx3 h LYS 21 Cb 0.76 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.58 2nx3 h LYS 21 CO 0.00 0.05 -0.40 0.28 -2.27 0.00 0.00 179.45 177.11 2nx3 h VAL 22 N 0.00 0.11 -0.35 2.00 2.07 -0.85 -3.36 116.25 115.88 2nx3 h VAL 22 Ca -0.00 -1.12 0.10 0.00 0.82 0.00 0.00 66.70 66.50 2nx3 h VAL 22 Cb 0.12 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 2nx3 h VAL 22 CO 0.01 0.04 0.46 1.23 0.02 0.00 0.00 177.57 179.33 2nx3 h GLY 23 N -1.00 0.00 0.93 2.17 0.00 0.26 -0.81 103.07 104.62 2nx3 h GLY 23 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.28 2nx3 h GLY 23 CO -0.01 0.00 -0.21 -2.09 0.00 0.00 0.00 176.54 174.23 2nx3 h GLU 24 N 0.00 -0.56 -0.77 4.80 4.81 -1.11 -0.81 114.58 120.94 2nx3 h GLU 24 Ca 0.17 0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.39 2nx3 h GLU 24 Cb 1.09 0.13 -0.03 0.00 0.63 0.00 0.00 28.75 30.56 2nx3 h GLU 24 CO -0.00 -0.33 0.33 1.49 -0.73 0.00 0.00 179.01 179.76 2nx3 h GLU 25 N -0.66 1.13 0.25 1.92 4.57 -1.30 -1.54 114.58 118.95 2nx3 h GLU 25 Ca -0.06 -0.19 0.00 0.00 -1.18 0.00 0.00 59.36 57.93 2nx3 h GLU 25 Cb 0.49 -0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 28.87 2nx3 h GLU 25 CO 0.10 0.90 -0.23 0.82 -1.18 0.00 0.00 179.01 179.41 2nx3 h ILE 26 N 1.11 0.50 -0.32 2.32 1.08 -1.26 0.34 117.51 121.27 2nx3 h ILE 26 Ca 0.26 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.79 2nx3 h ILE 26 Cb 0.18 0.50 -0.06 0.00 -3.07 0.00 0.00 36.82 34.37 2nx3 h ILE 26 CO -0.03 0.00 -0.04 0.50 -0.69 0.00 0.00 178.15 177.89 2nx3 h LYS 27 N -0.51 0.04 -0.43 2.37 1.63 -0.98 0.51 116.57 119.19 2nx3 h LYS 27 Ca -0.01 -0.00 0.08 0.00 -0.85 0.00 0.00 60.65 59.87 2nx3 h LYS 27 Cb 0.47 -0.01 -0.07 0.00 -0.60 0.00 0.00 32.23 32.03 2nx3 h LYS 27 CO -0.04 0.03 0.04 -0.09 -3.45 0.00 0.00 179.45 175.93 2nx3 h ARG 28 N 0.04 0.15 0.00 1.90 2.43 -0.84 0.18 114.38 118.23 2nx3 h ARG 28 Ca 0.15 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 2nx3 h ARG 28 Cb 0.22 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 2nx3 h ARG 28 CO -0.30 0.10 0.00 -0.07 -1.51 0.00 0.00 179.97 178.19 2nx3 h LEU 29 N 0.15 0.00 -0.84 3.80 3.38 0.54 -2.16 115.31 120.18 2nx3 h LEU 29 Ca 0.21 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.12 2nx3 h LEU 29 Cb 0.29 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2nx3 h LEU 29 CO -0.32 0.00 -0.32 -1.28 0.09 0.00 0.00 178.44 176.60 2nx3 h SER 30 N 0.00 0.00 0.00 -0.43 0.87 0.30 -2.33 113.55 111.96 2nx3 h SER 30 Ca 0.00 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.50 2nx3 h SER 30 Cb 0.53 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.48 2nx3 h SER 30 CO 0.00 0.32 -0.38 -0.33 -0.53 0.00 0.00 176.83 175.91 2nx3 h GLU 31 N 0.00 0.00 -0.76 2.24 4.39 -0.68 -3.33 114.58 116.44 2nx3 h GLU 31 Ca -0.00 0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.73 2nx3 h GLU 31 Cb 0.91 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.52 2nx3 h GLU 31 CO 0.04 0.78 0.50 -0.22 -1.16 0.00 0.00 179.01 178.95 2nx3 h LYS 32 N -1.00 0.89 -2.70 2.33 3.64 -1.56 -3.17 116.57 115.01 2nx3 h LYS 32 Ca -0.10 -0.05 -0.72 0.00 -1.27 0.00 0.00 60.65 58.51 2nx3 h LYS 32 Cb 0.90 -0.20 -0.34 0.00 -0.41 0.00 0.00 32.23 32.18 2nx3 h LYS 32 CO -0.06 0.59 0.20 1.19 -2.27 0.00 0.00 179.45 179.10 2nx3 n PHE 33 N -4.45 3.00 -0.12 1.91 3.72 -0.88 -4.91 117.46 115.73 2nx3 n PHE 33 Ca 0.10 -3.32 0.09 0.00 -0.05 0.00 0.00 57.45 54.27 2nx3 n PHE 33 Cb 0.12 -1.00 0.43 0.00 -0.94 0.00 0.00 39.48 38.10 2nx3 n PHE 33 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2nx3 h LYS 34 N 5.04 0.55 0.00 -1.08 1.79 -1.65 -2.48 116.57 118.75 2nx3 h LYS 34 Ca 0.20 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.63 2nx3 h LYS 34 Cb 0.65 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.18 2nx3 h LYS 34 CO 1.11 0.36 0.00 -0.85 -1.08 0.00 0.00 179.45 178.99 2nx3 n GLU 35 N -4.48 0.41 -3.94 3.15 0.00 -1.26 -4.73 120.64 109.79 2nx3 n GLU 35 Ca 0.10 0.03 -0.35 0.00 0.00 0.00 0.00 57.16 56.94 2nx3 n GLU 35 Cb 0.29 -1.50 -0.10 0.00 0.00 0.00 0.00 31.44 30.13 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 -2.53 4.83 -0.58 3.84 1.01 -0.93 -3.85 120.40 122.18 2nx3 s VAL 36 Ca 0.26 -0.02 -0.21 0.00 0.00 0.00 0.00 61.98 62.01 2nx3 s VAL 36 Cb 0.18 -3.19 0.07 0.00 0.00 0.00 0.00 36.38 33.44 2nx3 s VAL 36 CO 0.40 0.44 0.80 -0.70 0.00 0.00 0.00 175.10 176.03 2nx3 s GLU 37 N 0.54 3.14 0.59 2.72 2.12 -0.24 -4.95 118.70 122.63 2nx3 s GLU 37 Ca 0.04 -0.85 -0.13 0.00 0.36 0.00 0.00 54.97 54.39 2nx3 s GLU 37 Cb -0.13 -4.16 -0.05 0.00 0.26 0.00 0.00 34.13 30.06 2nx3 s GLU 37 CO 0.01 -1.51 1.02 -0.06 -0.54 0.00 0.00 175.26 174.18 2nx3 s PHE 38 N 3.29 3.42 -0.21 5.30 0.08 -1.26 -1.99 117.98 126.62 2nx3 s PHE 38 Ca 0.19 1.39 -0.04 0.00 0.12 0.00 0.00 56.93 58.60 2nx3 s PHE 38 Cb -0.18 -2.80 0.11 0.00 -0.57 0.00 0.00 43.02 39.57 2nx3 s PHE 38 CO 0.12 -0.71 0.34 0.08 -0.10 0.00 0.00 175.22 174.94 2nx3 s VAL 39 N -2.89 -0.53 0.22 -0.44 1.01 -0.80 -4.28 120.40 112.69 2nx3 s VAL 39 Ca 0.58 0.03 -0.30 0.00 0.00 0.00 0.00 61.98 62.29 2nx3 s VAL 39 Cb -0.12 -0.70 -0.09 0.00 0.00 0.00 0.00 36.38 35.47 2nx3 s VAL 39 CO 0.45 -0.06 1.27 0.12 0.00 0.00 0.00 175.10 176.87 2nx3 s PHE 40 N 2.50 3.29 0.03 5.22 5.36 -0.10 -2.28 117.98 131.99 2nx3 s PHE 40 Ca 0.07 1.34 0.02 0.00 -0.96 0.00 0.00 56.93 57.39 2nx3 s PHE 40 Cb -0.14 -3.55 -0.02 0.00 -0.34 0.00 0.00 43.02 38.97 2nx3 s PHE 40 CO -0.13 -1.61 -0.06 0.21 -1.46 0.00 0.00 175.22 172.16 2nx3 s LYS 41 N -0.53 0.45 -0.30 10.12 2.36 0.67 -0.29 119.74 132.23 2nx3 s LYS 41 Ca 0.53 -0.59 -0.17 0.00 -2.55 0.00 0.00 55.97 53.19 2nx3 s LYS 41 Cb -0.36 -0.25 0.20 0.00 -1.05 0.00 0.00 37.83 36.37 2nx3 s LYS 41 CO 0.40 0.05 1.24 0.45 1.55 0.00 0.00 175.35 179.04 2nx3 s SER 42 N -1.20 -0.13 -0.01 1.43 0.15 -1.09 -3.62 113.70 109.23 2nx3 s SER 42 Ca -0.08 0.21 -0.25 0.00 0.70 0.00 0.00 55.95 56.53 2nx3 s SER 42 Cb -0.08 0.93 -0.04 0.00 -1.71 0.00 0.00 66.02 65.11 2nx3 s SER 42 CO 0.00 -0.03 0.76 -0.44 1.20 0.00 0.00 173.24 174.73 2nx3 s SER 43 N 0.93 7.13 0.19 5.45 0.01 -0.53 -4.53 113.70 122.35 2nx3 s SER 43 Ca -0.06 1.36 0.26 0.00 1.31 0.00 0.00 55.95 58.82 2nx3 s SER 43 Cb -0.03 -2.45 0.78 0.00 0.21 0.00 0.00 66.02 64.53 2nx3 s SER 43 CO -0.11 -0.07 1.74 2.22 0.41 0.00 0.00 173.24 177.43 2nx3 n PHE 44 N 3.35 0.86 -3.66 2.43 1.16 -1.26 -1.18 117.46 119.15 2nx3 n PHE 44 Ca -0.01 0.25 -0.06 0.00 -1.87 0.00 0.00 57.45 55.76 2nx3 n PHE 44 Cb 0.51 -0.90 -0.07 0.00 -1.61 0.00 0.00 39.48 37.41 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 -4.43 -0.76 -0.83 5.98 2.15 -1.24 -3.82 116.67 113.72 2nx3 s ASP 45 Ca 0.10 1.29 -0.18 0.00 0.43 0.00 0.00 52.55 54.19 2nx3 s ASP 45 Cb 0.13 1.56 0.13 0.00 -0.30 0.00 0.00 42.92 44.44 2nx3 s ASP 45 CO 0.61 -0.22 0.99 -0.54 -0.17 0.00 0.00 175.17 175.83 2nx3 s LYS 46 N 2.25 3.46 0.00 4.34 -0.14 0.19 -4.87 119.74 124.98 2nx3 s LYS 46 Ca -0.07 -1.70 0.27 0.00 -1.36 0.00 0.00 55.97 53.12 2nx3 s LYS 46 Cb -0.10 -4.66 0.88 0.00 -1.68 0.00 0.00 37.83 32.27 2nx3 s LYS 46 CO -0.17 -1.67 1.67 0.00 -0.76 0.00 0.00 175.35 174.43 2nx3 n ALA 47 N 6.25 2.94 -1.30 5.17 0.00 -1.26 -4.14 120.51 128.17 2nx3 n ALA 47 Ca 0.14 -0.23 0.04 0.00 0.00 0.00 0.00 53.44 53.39 2nx3 n ALA 47 Cb 0.47 -1.29 0.20 0.00 0.00 0.00 0.00 19.45 18.83 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 -1.48 2.56 -4.73 0.00 6.94 -1.26 -5.05 115.26 112.25 2nx3 n ASN 48 Ca 0.07 -3.49 -0.36 0.00 -0.02 0.00 0.00 54.58 50.77 2nx3 n ASN 48 Cb 0.34 -0.55 0.08 0.00 -2.36 0.00 0.00 39.78 37.29 2nx3 n ASN 48 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2nx3 s ARG 49 N -3.07 2.42 0.04 -3.83 1.81 -1.26 -4.93 118.95 110.13 2nx3 s ARG 49 Ca 0.40 2.02 -0.20 0.00 -1.72 0.00 0.00 55.73 56.22 2nx3 s ARG 49 Cb 0.36 -1.83 -0.14 0.00 -0.45 0.00 0.00 34.95 32.88 2nx3 s ARG 49 CO 0.01 -1.69 1.35 0.77 -0.68 0.00 0.00 175.30 175.06 2nx3 h SER 50 N 0.34 0.38 -2.92 0.23 0.02 -1.96 -3.44 113.55 106.19 2nx3 h SER 50 Ca -0.50 -0.48 -0.62 0.00 -0.84 0.00 0.00 61.79 59.35 2nx3 h SER 50 Cb 1.33 -0.11 -0.05 0.00 0.14 0.00 0.00 62.40 63.71 2nx3 h SER 50 CO 0.52 0.78 -0.34 -0.55 -1.14 0.00 0.00 176.83 176.10 2nx3 s SER 51 N -6.13 6.56 0.49 3.07 0.15 -1.24 -4.98 113.70 111.62 2nx3 s SER 51 Ca -0.14 0.65 0.31 0.00 0.70 0.00 0.00 55.95 57.48 2nx3 s SER 51 Cb 0.05 -2.13 1.26 0.00 -1.71 0.00 0.00 66.02 63.49 2nx3 s SER 51 CO 0.75 0.27 1.92 -0.29 1.20 0.00 0.00 173.24 177.10 2nx3 h ILE 52 N 3.25 0.00 -0.38 6.45 6.09 -1.96 -2.73 117.51 128.22 2nx3 h ILE 52 Ca -0.51 -0.48 0.00 0.00 -1.37 0.00 0.00 64.86 62.51 2nx3 h ILE 52 Cb 1.20 1.43 0.00 0.00 0.47 0.00 0.00 36.82 39.92 2nx3 h ILE 52 CO 0.64 0.00 0.00 1.41 -3.07 0.00 0.00 178.15 177.13 2nx3 n HIS 53 N -2.92 1.09 -3.46 2.19 8.25 -1.26 -4.93 115.22 114.18 2nx3 n HIS 53 Ca 0.01 -0.40 -0.25 0.00 -0.26 0.00 0.00 57.72 56.81 2nx3 n HIS 53 Cb 0.30 -0.25 -0.02 0.00 1.12 0.00 0.00 29.99 31.14 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 -0.63 6.35 0.28 0.41 0.01 -1.03 -5.06 113.70 114.03 2nx3 s SER 54 Ca 0.33 0.48 -0.29 0.00 1.31 0.00 0.00 55.95 57.78 2nx3 s SER 54 Cb 0.23 -2.05 -0.10 0.00 0.21 0.00 0.00 66.02 64.31 2nx3 s SER 54 CO 0.13 -0.21 1.31 0.12 0.41 0.00 0.00 173.24 175.00 2nx3 s PHE 55 N -2.16 3.14 0.00 2.43 5.36 -1.26 -4.93 117.98 120.55 2nx3 s PHE 55 Ca 0.40 1.34 0.00 0.00 -0.96 0.00 0.00 56.93 57.71 2nx3 s PHE 55 Cb -0.10 -3.65 0.00 0.00 -0.34 0.00 0.00 43.02 38.93 2nx3 s PHE 55 CO 0.33 -1.87 0.00 0.54 -1.46 0.00 0.00 175.22 172.76 2nx3 n ARG 56 N 1.49 1.36 -1.29 10.12 1.74 -1.26 -4.70 116.66 124.11 2nx3 n ARG 56 Ca 0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.10 2nx3 n ARG 56 Cb 0.42 -0.98 0.00 0.00 -1.02 0.00 0.00 32.46 30.88 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 3.24 0.45 0.19 -0.13 0.00 -1.26 0.57 105.19 108.25 2nx3 n GLY 57 Ca 0.00 -1.59 0.07 0.00 0.00 0.00 0.00 46.02 44.50 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 -5.06 115.22 127.77 2nx3 n HIS 58 Ca 0.00 -0.71 0.00 0.00 -0.26 0.00 0.00 57.72 56.75 2nx3 n HIS 58 Cb 0.00 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 30.99 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 -1.01 2.56 0.14 -1.41 0.00 -1.26 -4.50 105.19 99.70 2nx3 n GLY 59 Ca 0.11 -1.88 -0.13 0.00 0.00 0.00 0.00 46.02 44.12 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 0.40 -0.92 0.99 6.46 -2.00 -2.71 115.31 117.53 2nx3 h LEU 60 Ca 0.00 -0.49 -0.06 0.00 -0.12 0.00 0.00 57.88 57.21 2nx3 h LEU 60 Cb 0.00 -0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 39.79 2nx3 h LEU 60 CO 0.00 0.81 0.13 -0.33 -0.62 0.00 0.00 178.44 178.43 2nx3 h GLU 61 N -0.00 0.92 -0.64 1.25 5.08 -1.98 -1.03 114.58 118.18 2nx3 h GLU 61 Ca 0.02 -0.21 -0.07 0.00 -1.00 0.00 0.00 59.36 58.11 2nx3 h GLU 61 Cb 0.70 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 2nx3 h GLU 61 CO 0.04 0.83 0.12 -0.92 -1.00 0.00 0.00 179.01 178.08 2nx3 h TYR 62 N 0.88 1.09 -0.23 4.33 3.20 -1.78 -2.97 116.97 121.48 2nx3 h TYR 62 Ca 0.19 -0.14 -0.17 0.00 3.14 0.00 0.00 58.73 61.76 2nx3 h TYR 62 Cb 0.34 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.30 2nx3 h TYR 62 CO 0.02 0.91 -0.50 0.78 -1.64 0.00 0.00 178.16 177.74 2nx3 h GLY 63 N 1.05 0.82 0.97 1.82 0.00 -1.13 -3.04 103.07 103.56 2nx3 h GLY 63 Ca 0.20 -0.99 0.05 0.00 0.00 0.00 0.00 47.33 46.59 2nx3 h GLY 63 CO 0.01 0.89 0.57 -2.08 0.00 0.00 0.00 176.54 175.93 2nx3 h VAL 64 N 0.48 1.11 0.59 4.60 2.07 -1.15 -1.03 116.25 122.92 2nx3 h VAL 64 Ca 0.00 -0.36 -0.03 0.00 0.82 0.00 0.00 66.70 67.14 2nx3 h VAL 64 Cb 1.11 -0.03 0.01 0.00 -1.52 0.00 0.00 31.29 30.86 2nx3 h VAL 64 CO 0.11 0.19 -0.28 0.50 0.02 0.00 0.00 177.57 178.11 2nx3 h LYS 65 N 1.05 -0.76 -0.59 1.57 3.64 -1.52 -0.15 116.57 119.82 2nx3 h LYS 65 Ca 0.36 0.05 0.12 0.00 -1.27 0.00 0.00 60.65 59.91 2nx3 h LYS 65 Cb 0.10 0.17 -0.10 0.00 -0.41 0.00 0.00 32.23 31.98 2nx3 h LYS 65 CO -0.12 -0.49 -0.07 0.00 -2.27 0.00 0.00 179.45 176.51 2nx3 h ALA 66 N -0.43 0.49 -0.74 5.00 0.00 -1.32 0.51 119.26 122.77 2nx3 h ALA 66 Ca -0.08 0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2nx3 h ALA 66 Cb 0.62 0.37 -0.04 0.00 0.00 0.00 0.00 17.79 18.75 2nx3 h ALA 66 CO 0.13 -0.41 0.41 -0.07 0.00 0.00 0.00 179.25 179.31 2nx3 h LEU 67 N 0.06 0.91 -0.40 0.00 4.07 -1.01 -1.07 115.31 117.87 2nx3 h LEU 67 Ca 0.30 -0.07 -0.18 0.00 0.08 0.00 0.00 57.88 58.00 2nx3 h LEU 67 Cb 0.47 -0.23 -0.00 0.00 1.08 0.00 0.00 40.66 41.97 2nx3 h LEU 67 CO -0.55 0.73 -0.67 -0.09 -1.08 0.00 0.00 178.44 176.77 2nx3 h ARG 68 N 1.03 0.53 0.65 1.13 2.43 0.94 -2.64 114.38 118.45 2nx3 h ARG 68 Ca 0.26 -0.39 -0.03 0.00 -0.81 0.00 0.00 59.98 59.01 2nx3 h ARG 68 Cb 0.02 0.07 0.01 0.00 -0.42 0.00 0.00 29.97 29.64 2nx3 h ARG 68 CO -0.04 1.02 -0.31 -0.22 -1.51 0.00 0.00 179.97 178.90 2nx3 h LYS 69 N 0.38 -0.83 -0.85 0.20 3.64 0.58 0.36 116.57 120.04 2nx3 h LYS 69 Ca -0.02 0.06 0.09 0.00 -1.27 0.00 0.00 60.65 59.50 2nx3 h LYS 69 Cb 1.25 0.19 -0.06 0.00 -0.41 0.00 0.00 32.23 33.20 2nx3 h LYS 69 CO 0.12 -0.54 0.55 -0.24 -2.27 0.00 0.00 179.45 177.08 2nx3 h VAL 70 N -0.92 0.99 -0.09 2.00 3.04 -1.29 -0.08 116.25 119.90 2nx3 h VAL 70 Ca -0.09 -0.30 -0.02 0.00 -1.01 0.00 0.00 66.70 65.28 2nx3 h VAL 70 Cb 0.68 0.05 -0.00 0.00 -2.01 0.00 0.00 31.29 30.01 2nx3 h VAL 70 CO 0.15 0.16 -0.03 0.50 -1.01 0.00 0.00 177.57 177.33 2nx3 h LYS 71 N 0.86 0.17 0.00 4.17 3.64 -1.18 0.11 116.57 124.34 2nx3 h LYS 71 Ca 0.38 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.69 2nx3 h LYS 71 Cb 0.36 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2nx3 h LYS 71 CO -0.15 0.52 0.00 -0.85 -2.27 0.00 0.00 179.45 176.70 2nx3 n GLU 72 N -4.76 0.23 -0.04 1.90 0.28 0.12 0.36 120.64 118.73 2nx3 n GLU 72 Ca -0.07 0.12 -0.03 0.00 -0.16 0.00 0.00 57.16 57.03 2nx3 n GLU 72 Cb 0.25 -1.50 -0.08 0.00 1.43 0.00 0.00 31.44 31.55 2nx3 n GLU 72 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 2nx3 n GLU 73 N -1.31 2.01 0.00 3.44 2.13 -0.10 -4.71 120.64 122.10 2nx3 n GLU 73 Ca 0.08 -0.02 0.01 0.00 0.66 0.00 0.00 57.16 57.89 2nx3 n GLU 73 Cb 0.15 -1.25 -0.01 0.00 0.27 0.00 0.00 31.44 30.60 2nx3 n GLU 73 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2nx3 n PHE 74 N -2.26 0.00 -2.56 4.31 3.72 0.36 -5.00 117.46 116.02 2nx3 n PHE 74 Ca -0.13 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.07 2nx3 n PHE 74 Cb 0.71 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.25 2nx3 n PHE 74 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2nx3 n GLY 75 N 0.82 -0.46 3.89 1.37 0.00 0.16 -4.97 105.19 106.01 2nx3 n GLY 75 Ca 0.01 -0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2nx3 n GLY 75 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2nx3 s LEU 76 N -5.94 4.35 0.85 0.99 1.43 -1.25 -5.07 118.68 114.05 2nx3 s LEU 76 Ca 0.09 0.52 -0.11 0.00 -1.03 0.00 0.00 54.13 53.59 2nx3 s LEU 76 Cb -0.04 -2.83 0.11 0.00 0.03 0.00 0.00 46.19 43.47 2nx3 s LEU 76 CO 0.11 0.21 1.16 -0.54 0.23 0.00 0.00 176.35 177.52 2nx3 s LYS 77 N -2.03 1.41 0.09 1.70 -0.14 -1.26 -4.55 119.74 114.96 2nx3 s LYS 77 Ca 0.31 1.59 0.06 0.00 -1.36 0.00 0.00 55.97 56.57 2nx3 s LYS 77 Cb -0.13 -1.77 -0.03 0.00 -1.68 0.00 0.00 37.83 34.22 2nx3 s LYS 77 CO 0.19 -2.35 -0.15 0.42 -0.76 0.00 0.00 175.35 172.71 2nx3 s ILE 78 N -2.47 1.22 -0.22 2.17 -1.09 -1.26 -0.93 121.20 118.62 2nx3 s ILE 78 Ca 0.69 -1.46 -0.26 0.00 -2.23 0.00 0.00 60.65 57.39 2nx3 s ILE 78 Cb -0.24 -1.25 0.07 0.00 -1.58 0.00 0.00 42.46 39.45 2nx3 s ILE 78 CO 0.54 -0.28 0.71 0.28 -1.23 0.00 0.00 174.94 174.97 2nx3 s THR 79 N -1.56 0.00 0.18 2.92 -1.32 0.60 -0.37 115.64 116.10 2nx3 s THR 79 Ca 0.02 0.00 -0.18 0.00 -1.21 0.00 0.00 61.69 60.32 2nx3 s THR 79 Cb -0.08 -1.00 0.03 0.00 -1.51 0.00 0.00 72.50 69.94 2nx3 s THR 79 CO 0.03 0.00 0.52 0.28 -2.21 0.00 0.00 174.62 173.24 2nx3 s THR 80 N -0.01 0.03 -0.07 5.08 -1.32 -1.23 -2.68 115.64 115.44 2nx3 s THR 80 Ca -0.03 -0.66 -0.04 0.00 -1.21 0.00 0.00 61.69 59.75 2nx3 s THR 80 Cb -0.04 -1.46 -0.04 0.00 -1.51 0.00 0.00 72.50 69.45 2nx3 s THR 80 CO 0.03 -0.13 0.12 1.51 -2.21 0.00 0.00 174.62 173.94 2nx3 s ASP 81 N -2.85 6.09 -0.14 8.08 -4.77 -1.26 -1.96 116.67 119.86 2nx3 s ASP 81 Ca 0.07 0.34 -0.07 0.00 -3.30 0.00 0.00 52.55 49.59 2nx3 s ASP 81 Cb -0.01 -1.89 -0.04 0.00 -1.09 0.00 0.00 42.92 39.89 2nx3 s ASP 81 CO -0.05 0.34 0.13 0.27 0.70 0.00 0.00 175.17 176.56 2nx3 s ILE 82 N -1.11 5.40 -0.55 2.11 -4.36 -0.89 -4.80 121.20 116.99 2nx3 s ILE 82 Ca 0.19 0.17 0.14 0.00 -0.26 0.00 0.00 60.65 60.89 2nx3 s ILE 82 Cb -0.12 -3.37 -0.16 0.00 1.25 0.00 0.00 42.46 40.06 2nx3 s ILE 82 CO 0.09 0.58 0.54 1.41 0.24 0.00 0.00 174.94 177.80 2nx3 n HIS 83 N 2.37 0.00 -3.88 1.37 8.25 -1.26 -4.46 115.22 117.60 2nx3 n HIS 83 Ca -0.19 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.16 2nx3 n HIS 83 Cb 0.54 -0.05 -0.11 0.00 1.12 0.00 0.00 29.99 31.50 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 -2.39 0.37 0.23 -0.41 0.41 -1.26 -5.06 118.70 110.58 2nx3 s GLU 84 Ca 0.04 -0.31 -0.08 0.00 -0.41 0.00 0.00 54.97 54.20 2nx3 s GLU 84 Cb 0.10 0.15 0.36 0.00 -1.78 0.00 0.00 34.13 32.97 2nx3 s GLU 84 CO 0.56 -0.08 1.67 0.77 -0.49 0.00 0.00 175.26 177.70 2nx3 h SER 85 N 4.75 -0.15 0.00 -0.19 0.02 -1.90 -0.67 113.55 115.41 2nx3 h SER 85 Ca -0.30 0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 2nx3 h SER 85 Cb 1.20 0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.98 2nx3 h SER 85 CO 0.41 -0.08 0.08 -2.67 -1.14 0.00 0.00 176.83 173.43 2nx3 n TRP 86 N -5.23 0.20 1.08 3.45 4.27 -1.26 -0.86 117.44 119.10 2nx3 n TRP 86 Ca 0.11 0.10 0.12 0.00 -3.89 0.00 0.00 57.50 53.94 2nx3 n TRP 86 Cb 0.40 -0.59 0.16 0.00 -1.36 0.00 0.00 31.31 29.92 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 -1.67 0.54 0.15 -2.67 6.02 -0.26 -4.51 117.38 114.99 2nx3 n GLN 87 Ca -0.00 -0.38 -0.07 0.00 -0.01 0.00 0.00 57.00 56.53 2nx3 n GLN 87 Cb 0.09 -1.49 -0.04 0.00 1.02 0.00 0.00 30.24 29.82 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 3.42 -1.00 -0.00 -1.58 0.00 -1.10 -2.60 119.26 116.39 2nx3 h ALA 88 Ca 0.00 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.85 2nx3 h ALA 88 Cb 0.56 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.65 2nx3 h ALA 88 CO 0.00 -0.99 -0.23 0.93 0.00 0.00 0.00 179.25 178.96 2nx3 h GLU 89 N -0.44 -0.34 -0.31 0.00 4.39 -1.79 -0.24 114.58 115.85 2nx3 h GLU 89 Ca -0.04 0.02 0.09 0.00 0.34 0.00 0.00 59.36 59.77 2nx3 h GLU 89 Cb 0.36 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 2nx3 h GLU 89 CO 0.02 -0.23 0.22 -1.00 -1.16 0.00 0.00 179.01 176.86 2nx3 h PRO 90 N -0.35 0.01 0.23 2.33 0.13 -1.80 -2.45 132.00 130.09 2nx3 h PRO 90 Ca 0.06 -0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.85 2nx3 h PRO 90 Cb 0.44 -0.00 0.03 0.00 0.13 0.00 0.00 31.00 31.59 2nx3 h PRO 90 CO -0.21 0.01 -1.58 0.28 -0.23 0.00 0.00 178.00 176.27 2nx3 h VAL 91 N 0.01 1.16 -0.48 1.56 2.07 -1.03 -3.32 116.25 116.22 2nx3 h VAL 91 Ca 0.15 -2.65 0.14 0.00 0.82 0.00 0.00 66.70 65.16 2nx3 h VAL 91 Cb 0.57 2.93 -0.02 0.00 -1.52 0.00 0.00 31.29 33.26 2nx3 h VAL 91 CO -0.00 0.83 0.40 0.00 0.02 0.00 0.00 177.57 178.82 2nx3 h ALA 92 N 0.16 2.34 -0.16 1.67 0.00 -0.56 -0.95 119.26 121.76 2nx3 h ALA 92 Ca -0.29 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.51 2nx3 h ALA 92 Cb 2.14 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 19.92 2nx3 h ALA 92 CO 0.24 -0.65 0.12 0.39 0.00 0.00 0.00 179.25 179.35 2nx3 n GLU 93 N -4.11 1.24 0.00 0.00 1.02 -1.17 -3.50 120.64 114.12 2nx3 n GLU 93 Ca 0.09 -0.50 0.00 0.00 -0.02 0.00 0.00 57.16 56.73 2nx3 n GLU 93 Cb 0.61 -1.20 0.00 0.00 -0.02 0.00 0.00 31.44 30.83 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 0.78 0.00 -4.77 2.62 3.14 -0.71 -5.04 118.33 114.35 2nx3 n VAL 94 Ca 0.10 0.00 -0.33 0.00 -2.96 0.00 0.00 64.34 61.15 2nx3 n VAL 94 Cb 0.59 0.00 -0.14 0.00 -1.06 0.00 0.00 33.84 33.23 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 -0.01 2.65 0.11 1.55 0.00 -0.45 -4.61 121.76 121.01 2nx3 s ALA 95 Ca 0.00 -0.90 -0.01 0.00 0.00 0.00 0.00 51.96 51.05 2nx3 s ALA 95 Cb 0.00 -1.20 -0.19 0.00 0.00 0.00 0.00 23.12 21.74 2nx3 s ALA 95 CO 0.00 0.30 1.23 -0.44 0.00 0.00 0.00 175.76 176.85 2nx3 h ASP 96 N 6.47 0.35 -3.34 0.00 3.32 -1.00 -3.43 116.42 118.79 2nx3 h ASP 96 Ca -0.29 -0.34 -0.62 0.00 0.02 0.00 0.00 57.03 55.80 2nx3 h ASP 96 Cb 1.20 -0.11 -0.33 0.00 0.22 0.00 0.00 39.33 40.31 2nx3 h ASP 96 CO 0.55 1.21 -0.86 -0.63 -1.72 0.00 0.00 179.24 177.80 2nx3 s ILE 97 N -2.87 1.75 -0.35 0.35 1.01 -1.10 -1.04 121.20 118.95 2nx3 s ILE 97 Ca -0.03 -0.83 -0.14 0.00 0.00 0.00 0.00 60.65 59.64 2nx3 s ILE 97 Cb 0.08 -1.54 -0.01 0.00 0.01 0.00 0.00 42.46 41.01 2nx3 s ILE 97 CO 0.86 0.49 0.32 -0.63 0.00 0.00 0.00 174.94 175.98 2nx3 s ILE 98 N 0.53 5.21 -0.17 2.92 -1.09 0.51 -3.50 121.20 125.62 2nx3 s ILE 98 Ca -0.16 -0.10 -0.19 0.00 -2.23 0.00 0.00 60.65 57.98 2nx3 s ILE 98 Cb -0.17 -3.79 -0.03 0.00 -1.58 0.00 0.00 42.46 36.88 2nx3 s ILE 98 CO 0.06 -0.08 0.52 -1.58 -1.23 0.00 0.00 174.94 172.63 2nx3 s GLN 99 N 1.90 4.25 -0.23 2.79 0.74 -0.83 -0.68 119.66 127.60 2nx3 s GLN 99 Ca 0.09 0.47 -0.11 0.00 0.05 0.00 0.00 55.36 55.86 2nx3 s GLN 99 Cb -0.17 -3.52 -0.05 0.00 1.10 0.00 0.00 33.01 30.37 2nx3 s GLN 99 CO 0.11 -0.05 0.18 0.42 -0.55 0.00 0.00 175.29 175.41 2nx3 s ILE 100 N 1.29 5.35 0.54 -2.34 -1.09 -0.30 -2.09 121.20 122.56 2nx3 s ILE 100 Ca 0.26 0.24 -0.22 0.00 -2.23 0.00 0.00 60.65 58.70 2nx3 s ILE 100 Cb -0.15 -3.52 -0.05 0.00 -1.58 0.00 0.00 42.46 37.15 2nx3 s ILE 100 CO 0.10 0.35 1.37 -2.84 -1.23 0.00 0.00 174.94 172.69 2nx3 s PRO 101 N 0.99 3.15 0.17 2.79 0.02 -1.26 -2.00 135.00 138.85 2nx3 s PRO 101 Ca 0.09 2.26 -0.18 0.00 0.02 0.00 0.00 61.00 63.19 2nx3 s PRO 101 Cb -0.13 -2.27 0.10 0.00 0.02 0.00 0.00 34.50 32.21 2nx3 s PRO 101 CO 0.04 -1.19 1.65 0.00 -0.33 0.00 0.00 177.00 177.16 2nx3 h ALA 102 N 1.48 0.18 0.00 -1.55 0.00 -1.89 -0.34 119.26 117.14 2nx3 h ALA 102 Ca -0.51 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 2nx3 h ALA 102 Cb 1.30 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 19.49 2nx3 h ALA 102 CO 0.57 -0.51 -0.04 0.74 0.00 0.00 0.00 179.25 180.01 2nx3 h PHE 103 N -0.07 0.00 -0.04 0.00 0.04 -1.92 -2.52 116.94 112.43 2nx3 h PHE 103 Ca 0.20 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.97 2nx3 h PHE 103 Cb 0.37 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.52 2nx3 h PHE 103 CO -0.40 0.04 0.00 1.28 -0.60 0.00 0.00 178.31 178.63 2nx3 n LEU 104 N -3.99 2.69 0.15 1.54 4.77 -0.27 -4.52 117.00 117.37 2nx3 n LEU 104 Ca -0.03 -0.91 0.06 0.00 -0.03 0.00 0.00 56.01 55.10 2nx3 n LEU 104 Cb 0.13 -0.01 0.33 0.00 -2.33 0.00 0.00 43.42 41.54 2nx3 n LEU 104 CO 0.30 0.46 0.77 0.00 -1.33 0.00 0.00 177.39 177.58 2nx3 n ARG 106 N -1.98 1.18 -2.68 0.00 5.12 -1.26 -4.89 116.66 112.14 2nx3 n ARG 106 Ca -0.01 -1.44 -0.42 0.00 -1.93 0.00 0.00 57.85 54.05 2nx3 n ARG 106 Cb 0.29 -1.28 -0.03 0.00 -1.16 0.00 0.00 32.46 30.28 2nx3 n ARG 106 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 2nx3 s GLN 107 N -1.18 3.48 0.12 5.56 -1.52 0.12 -4.92 119.66 121.32 2nx3 s GLN 107 Ca 0.18 -1.12 -0.24 0.00 -1.95 0.00 0.00 55.36 52.23 2nx3 s GLN 107 Cb 0.12 -4.94 -0.05 0.00 -0.22 0.00 0.00 33.01 27.92 2nx3 s GLN 107 CO 0.18 -2.05 1.34 2.41 -0.25 0.00 0.00 175.29 176.93 2nx3 n THR 108 N 6.35 -0.53 -0.28 -0.19 -1.04 -1.26 -1.32 114.28 116.00 2nx3 n THR 108 Ca 0.22 2.10 0.08 0.00 -2.04 0.00 0.00 64.05 64.41 2nx3 n THR 108 Cb 0.50 -2.62 0.23 0.00 -1.82 0.00 0.00 70.33 66.62 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 0.39 -0.24 8.00 3.32 -1.99 0.26 116.42 126.16 2nx3 h ASP 109 Ca 0.12 0.11 -0.04 0.00 0.02 0.00 0.00 57.03 57.25 2nx3 h ASP 109 Cb 0.32 0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 2nx3 h ASP 109 CO -0.73 0.13 0.04 0.25 -1.72 0.00 0.00 179.24 177.21 2nx3 h LEU 110 N 0.51 0.46 0.50 1.55 5.85 -1.58 -0.81 115.31 121.78 2nx3 h LEU 110 Ca 0.47 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 59.09 2nx3 h LEU 110 Cb 0.74 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.66 2nx3 h LEU 110 CO -0.42 0.50 -0.24 -0.07 -0.34 0.00 0.00 178.44 177.87 2nx3 h LEU 111 N 0.49 -0.57 -0.49 2.25 3.38 0.02 -2.70 115.31 117.68 2nx3 h LEU 111 Ca 0.11 -0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.13 2nx3 h LEU 111 Cb 0.25 0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.09 2nx3 h LEU 111 CO 0.00 -0.16 0.14 -0.07 0.09 0.00 0.00 178.44 178.45 2nx3 h LEU 112 N -1.14 0.09 -1.98 1.67 3.38 -1.02 -0.26 115.31 116.06 2nx3 h LEU 112 Ca -0.07 0.07 0.12 0.00 0.09 0.00 0.00 57.88 58.09 2nx3 h LEU 112 Cb 0.56 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 2nx3 h LEU 112 CO 0.11 0.08 0.30 0.00 0.09 0.00 0.00 178.44 179.03 2nx3 h ALA 113 N 1.35 2.37 0.00 1.53 0.00 -1.22 0.32 119.26 123.61 2nx3 h ALA 113 Ca 0.24 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.99 2nx3 h ALA 113 Cb 0.29 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2nx3 h ALA 113 CO -0.28 -0.49 -0.74 0.00 0.00 0.00 0.00 179.25 177.74 2nx3 h ALA 114 N 1.79 0.57 0.00 0.00 0.00 -0.74 -3.28 119.26 117.60 2nx3 h ALA 114 Ca 0.20 -0.65 -0.16 0.00 0.00 0.00 0.00 54.91 54.30 2nx3 h ALA 114 Cb 0.77 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2nx3 h ALA 114 CO -0.01 0.87 -0.79 0.00 0.00 0.00 0.00 179.25 179.32 2nx3 h ALA 115 N 1.32 0.54 -0.03 0.00 0.00 0.57 -3.27 119.26 118.38 2nx3 h ALA 115 Ca -0.02 -0.69 -0.13 0.00 0.00 0.00 0.00 54.91 54.06 2nx3 h ALA 115 Cb 1.54 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.24 2nx3 h ALA 115 CO 0.09 0.93 -0.59 1.57 0.00 0.00 0.00 179.25 181.24 2nx3 h LYS 116 N 0.00 0.11 0.00 0.00 2.10 -0.77 -2.78 116.57 115.23 2nx3 h LYS 116 Ca -0.02 -0.08 0.00 0.00 -2.00 0.00 0.00 60.65 58.55 2nx3 h LYS 116 Cb 1.57 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.91 2nx3 h LYS 116 CO 0.09 0.67 0.00 0.25 -2.00 0.00 0.00 179.45 178.46 2nx3 n THR 117 N -3.86 1.69 0.00 0.07 -2.24 -1.23 -4.82 114.28 103.88 2nx3 n THR 117 Ca -0.02 0.42 0.00 0.00 -2.27 0.00 0.00 64.05 62.18 2nx3 n THR 117 Cb 0.60 -1.36 0.00 0.00 -2.10 0.00 0.00 70.33 67.47 2nx3 n THR 117 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2nx3 n GLY 118 N -1.12 2.58 3.33 3.38 0.00 -1.05 -4.99 105.19 107.32 2nx3 n GLY 118 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 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 0.00 -2.56 0.31 1.61 1.81 -1.26 -4.83 118.95 114.02 2nx3 s ARG 119 Ca 0.00 0.35 -0.21 0.00 -1.72 0.00 0.00 55.73 54.16 2nx3 s ARG 119 Cb 0.00 -1.40 -0.09 0.00 -0.45 0.00 0.00 34.95 33.01 2nx3 s ARG 119 CO 0.00 -4.69 0.83 0.00 -0.68 0.00 0.00 175.30 170.76 2nx3 s ALA 120 N -2.26 3.28 -0.12 2.13 0.00 -0.21 -4.77 121.76 119.81 2nx3 s ALA 120 Ca 0.68 0.28 0.03 0.00 0.00 0.00 0.00 51.96 52.95 2nx3 s ALA 120 Cb -0.17 -2.97 0.01 0.00 0.00 0.00 0.00 23.12 19.99 2nx3 s ALA 120 CO 0.60 0.25 -0.21 0.08 0.00 0.00 0.00 175.76 176.48 2nx3 s VAL 121 N -1.75 1.95 -0.37 0.00 1.01 -0.95 0.19 120.40 120.48 2nx3 s VAL 121 Ca 0.50 -0.93 -0.03 0.00 0.00 0.00 0.00 61.98 61.53 2nx3 s VAL 121 Cb -0.15 -1.72 0.09 0.00 0.00 0.00 0.00 36.38 34.60 2nx3 s VAL 121 CO 0.20 0.53 0.14 0.21 0.00 0.00 0.00 175.10 176.17 2nx3 s ASN 122 N 0.69 5.16 -0.28 3.32 2.47 0.14 -0.86 114.94 125.58 2nx3 s ASN 122 Ca -0.11 -1.72 -0.18 0.00 0.42 0.00 0.00 52.86 51.27 2nx3 s ASN 122 Cb -0.16 -1.80 -0.02 0.00 -1.45 0.00 0.00 41.25 37.82 2nx3 s ASN 122 CO 0.02 -0.44 0.52 -0.69 -3.72 0.00 0.00 177.10 172.79 2nx3 s VAL 123 N 1.20 5.05 0.09 -5.21 1.01 0.22 -1.15 120.40 121.61 2nx3 s VAL 123 Ca 0.03 0.77 -0.30 0.00 0.00 0.00 0.00 61.98 62.49 2nx3 s VAL 123 Cb -0.22 -3.86 -0.06 0.00 0.00 0.00 0.00 36.38 32.24 2nx3 s VAL 123 CO -0.03 0.01 1.08 -0.54 0.00 0.00 0.00 175.10 175.63 2nx3 s LYS 124 N 2.35 4.55 0.01 2.72 1.02 -0.85 -1.34 119.74 128.20 2nx3 s LYS 124 Ca 0.21 1.62 -0.30 0.00 0.02 0.00 0.00 55.97 57.52 2nx3 s LYS 124 Cb -0.15 -3.36 -0.06 0.00 -0.52 0.00 0.00 37.83 33.74 2nx3 s LYS 124 CO 0.10 -0.03 1.40 0.21 -0.92 0.00 0.00 175.35 176.11 2nx3 s LYS 125 N 0.45 4.28 0.35 1.68 2.20 0.67 -4.07 119.74 125.31 2nx3 s LYS 125 Ca 0.52 1.98 -0.28 0.00 -0.36 0.00 0.00 55.97 57.83 2nx3 s LYS 125 Cb -0.26 -3.55 -0.11 0.00 -1.51 0.00 0.00 37.83 32.40 2nx3 s LYS 125 CO 0.31 -0.57 1.44 0.20 -0.36 0.00 0.00 175.35 176.37 2nx3 s GLY 126 N 1.84 2.89 0.15 5.54 0.00 -1.25 -4.47 107.32 112.02 2nx3 s GLY 126 Ca 0.64 1.47 0.08 0.00 0.00 0.00 0.00 44.72 46.91 2nx3 s GLY 126 CO 0.27 2.17 1.14 -1.06 0.00 0.00 0.00 173.10 175.62 2nx3 n GLN 127 N 0.73 0.05 0.00 2.90 3.00 -1.26 -0.32 117.38 122.48 2nx3 n GLN 127 Ca 0.01 0.48 0.08 0.00 -0.01 0.00 0.00 57.00 57.56 2nx3 n GLN 127 Cb 0.40 -1.81 0.05 0.00 0.00 0.00 0.00 30.24 28.88 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 -1.73 0.00 -3.72 1.08 1.16 -1.26 -1.54 117.46 111.46 2nx3 n PHE 128 Ca -0.01 0.00 -0.37 0.00 -1.87 0.00 0.00 57.45 55.21 2nx3 n PHE 128 Cb 0.16 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 37.96 2nx3 n PHE 128 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 2nx3 s LEU 129 N -1.48 4.35 0.48 5.98 1.43 0.56 -5.08 118.68 124.92 2nx3 s LEU 129 Ca 0.18 0.53 -0.19 0.00 -1.03 0.00 0.00 54.13 53.62 2nx3 s LEU 129 Cb 0.13 -2.23 -0.09 0.00 0.03 0.00 0.00 46.19 44.03 2nx3 s LEU 129 CO 0.24 0.30 0.98 0.00 0.23 0.00 0.00 176.35 178.10 2nx3 s ALA 130 N -0.52 3.00 0.20 4.21 0.00 -1.26 -4.86 121.76 122.53 2nx3 s ALA 130 Ca 0.16 0.34 -0.12 0.00 0.00 0.00 0.00 51.96 52.33 2nx3 s ALA 130 Cb -0.13 -3.16 0.24 0.00 0.00 0.00 0.00 23.12 20.07 2nx3 s ALA 130 CO 0.05 -0.15 1.68 -1.35 0.00 0.00 0.00 175.76 175.99 2nx3 h PRO 131 N 1.34 0.14 0.00 0.00 0.11 -1.98 -0.37 132.00 131.24 2nx3 h PRO 131 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2nx3 h PRO 131 Cb 1.19 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2nx3 h PRO 131 CO 0.61 0.09 0.00 -2.67 -0.21 0.00 0.00 178.00 175.82 2nx3 n TRP 132 N -5.22 0.50 0.78 0.65 2.14 -1.26 -1.78 117.44 113.25 2nx3 n TRP 132 Ca 0.07 0.22 0.13 0.00 2.07 0.00 0.00 57.50 59.99 2nx3 n TRP 132 Cb 0.30 -0.85 0.50 0.00 -0.81 0.00 0.00 31.31 30.45 2nx3 n TRP 132 CO 0.00 0.00 0.00 -0.25 2.07 0.00 0.00 177.69 179.51 2nx3 n ASP 133 N -1.98 0.37 0.00 -0.67 8.00 -0.15 -3.06 116.55 119.06 2nx3 n ASP 133 Ca 0.01 0.54 0.13 0.00 0.71 0.00 0.00 54.79 56.18 2nx3 n ASP 133 Cb 0.14 -0.64 0.58 0.00 -0.02 0.00 0.00 41.12 41.18 2nx3 n ASP 133 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2nx3 n THR 134 N -1.86 0.22 -0.19 -3.53 -2.24 -0.73 -3.39 114.28 102.56 2nx3 n THR 134 Ca 0.06 0.05 -0.07 0.00 -2.27 0.00 0.00 64.05 61.82 2nx3 n THR 134 Cb 0.36 -0.61 0.03 0.00 -2.10 0.00 0.00 70.33 68.00 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 0.73 -0.11 -0.78 3.64 -1.74 -2.21 116.57 116.11 2nx3 h LYS 135 Ca 0.00 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.22 2nx3 h LYS 135 Cb 0.39 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 2nx3 h LYS 135 CO 0.00 0.52 -0.40 -0.91 -2.27 0.00 0.00 179.45 176.39 2nx3 h ASN 136 N 0.73 0.25 -0.66 4.20 2.35 -1.81 -1.63 115.58 119.01 2nx3 h ASN 136 Ca 0.20 -0.10 0.05 0.00 -0.55 0.00 0.00 56.30 55.89 2nx3 h ASN 136 Cb -0.03 -0.07 -0.05 0.00 0.05 0.00 0.00 38.32 38.22 2nx3 h ASN 136 CO -0.04 0.63 0.39 0.58 -1.65 0.00 0.00 177.43 177.33 2nx3 h VAL 137 N 0.20 1.02 -0.48 2.81 2.07 -1.54 -0.45 116.25 119.88 2nx3 h VAL 137 Ca 0.02 -0.25 -0.08 0.00 0.82 0.00 0.00 66.70 67.21 2nx3 h VAL 137 Cb 0.80 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 2nx3 h VAL 137 CO 0.06 0.13 -0.02 0.58 0.02 0.00 0.00 177.57 178.35 2nx3 h VAL 138 N 0.73 1.26 -0.87 2.57 2.07 -1.14 -2.64 116.25 118.23 2nx3 h VAL 138 Ca 0.28 -1.10 0.09 0.00 0.82 0.00 0.00 66.70 66.80 2nx3 h VAL 138 Cb 0.12 1.02 -0.06 0.00 -1.52 0.00 0.00 31.29 30.85 2nx3 h VAL 138 CO -0.15 0.38 0.56 -0.08 0.02 0.00 0.00 177.57 178.30 2nx3 h GLU 139 N 0.71 0.83 -0.25 1.57 4.81 -0.28 -0.69 114.58 121.28 2nx3 h GLU 139 Ca 0.13 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.26 2nx3 h GLU 139 Cb 0.54 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 2nx3 h GLU 139 CO 0.03 0.55 -0.06 0.87 -0.73 0.00 0.00 179.01 179.67 2nx3 h LYS 140 N 0.86 0.49 -0.23 1.92 1.57 -0.87 -2.76 116.57 117.53 2nx3 h LYS 140 Ca 0.40 -0.19 -0.06 0.00 -1.87 0.00 0.00 60.65 58.93 2nx3 h LYS 140 Cb 0.40 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 2nx3 h LYS 140 CO -0.17 0.71 -0.13 -0.07 -0.57 0.00 0.00 179.45 179.22 2nx3 h LEU 141 N 0.23 0.37 0.21 2.94 3.38 -1.01 -0.45 115.31 120.97 2nx3 h LEU 141 Ca 0.06 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2nx3 h LEU 141 Cb 0.53 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.18 2nx3 h LEU 141 CO 0.03 0.53 -0.10 0.11 0.09 0.00 0.00 178.44 179.09 2nx3 h LYS 142 N 0.36 -0.27 -0.88 1.13 1.79 -1.12 0.62 116.57 118.19 2nx3 h LYS 142 Ca 0.07 0.02 0.10 0.00 -2.18 0.00 0.00 60.65 58.65 2nx3 h LYS 142 Cb 0.44 0.06 -0.06 0.00 -1.58 0.00 0.00 32.23 31.09 2nx3 h LYS 142 CO 0.03 -0.02 0.57 0.35 -1.08 0.00 0.00 179.45 179.30 2nx3 h PHE 143 N -0.50 0.94 0.00 -1.35 3.57 -1.32 -0.44 116.94 117.85 2nx3 h PHE 143 Ca -0.03 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2nx3 h PHE 143 Cb 0.37 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.81 2nx3 h PHE 143 CO -0.00 0.43 0.00 0.41 -2.23 0.00 0.00 178.31 176.92 2nx3 n GLY 144 N -1.41 -0.97 0.00 2.40 0.00 -0.19 -4.88 105.19 100.14 2nx3 n GLY 144 Ca 0.15 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2nx3 n GLY 144 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nx3 n GLY 145 N 0.45 1.56 3.71 -0.02 0.00 -0.17 -3.43 105.19 107.29 2nx3 n GLY 145 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 2nx3 n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nx3 n ALA 146 N -1.51 1.84 -0.08 4.61 0.00 0.16 -4.91 120.51 120.61 2nx3 n ALA 146 Ca 0.00 0.39 -0.17 0.00 0.00 0.00 0.00 53.44 53.66 2nx3 n ALA 146 Cb 0.00 -2.37 -0.06 0.00 0.00 0.00 0.00 19.45 17.02 2nx3 n ALA 146 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2nx3 n LYS 147 N 2.03 0.37 -3.30 0.00 5.02 -1.26 -4.39 118.16 116.63 2nx3 n LYS 147 Ca 0.10 0.14 -0.45 0.00 -2.02 0.00 0.00 58.31 56.08 2nx3 n LYS 147 Cb 0.34 -1.16 -0.06 0.00 -0.02 0.00 0.00 35.03 34.13 2nx3 n LYS 147 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2nx3 s GLU 148 N -2.32 3.00 -0.07 1.97 2.12 -1.26 -5.06 118.70 117.09 2nx3 s GLU 148 Ca -0.23 -1.47 0.01 0.00 0.36 0.00 0.00 54.97 53.63 2nx3 s GLU 148 Cb 0.08 -4.22 -0.03 0.00 0.26 0.00 0.00 34.13 30.23 2nx3 s GLU 148 CO 0.32 -1.23 -0.07 0.42 -0.54 0.00 0.00 175.26 174.16 2nx3 s ILE 149 N 1.82 3.74 -0.02 -3.70 1.01 -1.26 -2.25 121.20 120.53 2nx3 s ILE 149 Ca 0.05 -0.47 0.04 0.00 0.00 0.00 0.00 60.65 60.28 2nx3 s ILE 149 Cb -0.26 -2.53 -0.01 0.00 0.01 0.00 0.00 42.46 39.67 2nx3 s ILE 149 CO 0.05 0.60 -0.14 -0.31 0.00 0.00 0.00 174.94 175.14 2nx3 s TYR 150 N -0.81 1.38 -0.19 3.97 2.02 -0.04 -2.86 117.35 120.81 2nx3 s TYR 150 Ca 0.12 -0.33 -0.00 0.00 -0.37 0.00 0.00 57.07 56.50 2nx3 s TYR 150 Cb -0.11 -0.92 0.01 0.00 -0.40 0.00 0.00 41.96 40.55 2nx3 s TYR 150 CO 0.01 -0.09 -0.16 -0.51 -1.57 0.00 0.00 175.55 173.24 2nx3 s LEU 151 N -0.11 2.34 -0.15 -1.29 1.43 0.24 -0.61 118.68 120.52 2nx3 s LEU 151 Ca 0.01 -0.59 -0.05 0.00 -1.03 0.00 0.00 54.13 52.47 2nx3 s LEU 151 Cb -0.08 -1.55 -0.03 0.00 0.03 0.00 0.00 46.19 44.56 2nx3 s LEU 151 CO 0.01 -0.01 0.01 -0.89 0.23 0.00 0.00 176.35 175.70 2nx3 s THR 152 N 1.34 4.34 -0.19 5.49 2.01 -0.45 -1.30 115.64 126.88 2nx3 s THR 152 Ca 0.05 -0.20 -0.26 0.00 0.31 0.00 0.00 61.69 61.59 2nx3 s THR 152 Cb -0.13 -2.91 -0.01 0.00 0.01 0.00 0.00 72.50 69.46 2nx3 s THR 152 CO -0.10 0.50 0.89 -0.70 -0.69 0.00 0.00 174.62 174.51 2nx3 s GLU 153 N 0.13 4.27 -0.02 4.92 2.56 0.13 -0.24 118.70 130.45 2nx3 s GLU 153 Ca 0.02 1.09 0.03 0.00 0.00 0.00 0.00 54.97 56.11 2nx3 s GLU 153 Cb -0.13 -3.60 0.04 0.00 2.00 0.00 0.00 34.13 32.44 2nx3 s GLU 153 CO 0.02 -0.43 0.85 2.89 -0.56 0.00 0.00 175.26 178.03 2nx3 n ARG 154 N 5.62 1.35 0.00 4.30 1.85 -1.26 -0.84 116.66 127.68 2nx3 n ARG 154 Ca 0.07 -1.25 0.00 0.00 -1.00 0.00 0.00 57.85 55.66 2nx3 n ARG 154 Cb 0.48 -0.84 0.00 0.00 -1.05 0.00 0.00 32.46 31.05 2nx3 n ARG 154 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2nx3 n GLY 155 N -0.40 2.19 3.13 2.89 0.00 -1.26 -3.66 105.19 108.07 2nx3 n GLY 155 Ca 0.02 -1.97 -0.18 0.00 0.00 0.00 0.00 46.02 43.90 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 -2.62 0.95 0.06 2.61 2.01 0.60 -4.28 115.64 114.97 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 -0.91 -0.09 0.00 0.01 0.00 0.00 72.50 71.51 2nx3 s THR 156 CO 0.00 -0.16 1.93 -0.89 -0.69 0.00 0.00 174.62 174.81 2nx3 s THR 157 N -1.08 2.86 -0.52 -0.82 2.01 -0.59 -1.06 115.64 116.44 2nx3 s THR 157 Ca -0.02 0.03 0.04 0.00 0.31 0.00 0.00 61.69 62.05 2nx3 s THR 157 Cb -0.09 -3.02 0.16 0.00 0.01 0.00 0.00 72.50 69.57 2nx3 s THR 157 CO 0.01 -0.00 0.38 0.12 -0.69 0.00 0.00 174.62 174.44 2nx3 s PHE 158 N 3.92 2.06 0.01 4.92 5.36 -0.16 -4.87 117.98 129.22 2nx3 s PHE 158 Ca 0.86 -2.68 0.00 0.00 -0.96 0.00 0.00 56.93 54.15 2nx3 s PHE 158 Cb -0.44 -1.66 0.00 0.00 -0.34 0.00 0.00 43.02 40.58 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 2.65 -2.01 3.76 13.12 0.00 -1.26 -4.43 105.19 117.02 2nx3 n GLY 159 Ca 0.23 -1.40 -0.39 0.00 0.00 0.00 0.00 46.02 44.47 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 -0.25 3.87 -1.58 1.61 2.02 -1.26 -4.04 117.35 117.72 2nx3 s TYR 160 Ca 0.00 1.84 -0.14 0.00 -0.37 0.00 0.00 57.07 58.41 2nx3 s TYR 160 Cb 0.00 -2.94 0.10 0.00 -0.40 0.00 0.00 41.96 38.72 2nx3 s TYR 160 CO 0.00 0.37 0.85 0.09 -1.57 0.00 0.00 175.55 175.29 2nx3 n ASN 161 N 1.14 -3.68 -3.67 2.29 3.02 -1.26 -4.96 115.26 108.13 2nx3 n ASN 161 Ca -0.01 -0.89 -0.13 0.00 -0.03 0.00 0.00 54.58 53.53 2nx3 n ASN 161 Cb 0.48 -3.38 -0.08 0.00 -0.61 0.00 0.00 39.78 36.19 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 -3.44 -0.63 0.08 6.41 3.84 -1.26 -4.27 114.94 115.67 2nx3 s ASN 162 Ca 0.61 1.18 0.09 0.00 0.21 0.00 0.00 52.86 54.95 2nx3 s ASN 162 Cb -0.32 1.17 -0.03 0.00 -0.55 0.00 0.00 41.25 41.52 2nx3 s ASN 162 CO 0.87 -0.20 -0.24 -0.76 -2.79 0.00 0.00 177.10 173.98 2nx3 s LEU 163 N 0.56 2.23 0.06 3.21 1.43 -1.26 -0.99 118.68 123.92 2nx3 s LEU 163 Ca -0.02 -0.63 0.07 0.00 -1.03 0.00 0.00 54.13 52.52 2nx3 s LEU 163 Cb -0.05 -1.11 -0.03 0.00 0.03 0.00 0.00 46.19 45.04 2nx3 s LEU 163 CO -0.03 0.18 -0.19 0.54 0.23 0.00 0.00 176.35 177.08 2nx3 s VAL 164 N -0.93 1.52 -0.36 -1.59 0.11 -0.23 -4.82 120.40 114.10 2nx3 s VAL 164 Ca 0.10 -1.23 -0.12 0.00 -2.93 0.00 0.00 61.98 57.79 2nx3 s VAL 164 Cb -0.10 -1.35 0.00 0.00 -1.53 0.00 0.00 36.38 33.40 2nx3 s VAL 164 CO 0.03 0.08 0.23 -0.69 -3.33 0.00 0.00 175.10 171.43 2nx3 s VAL 165 N -0.91 5.02 -0.77 2.04 1.01 -1.26 -0.29 120.40 125.23 2nx3 s VAL 165 Ca 0.05 -0.49 -0.20 0.00 0.00 0.00 0.00 61.98 61.34 2nx3 s VAL 165 Cb -0.09 -3.67 0.11 0.00 0.00 0.00 0.00 36.38 32.72 2nx3 s VAL 165 CO 0.02 -0.12 0.99 -0.62 0.00 0.00 0.00 175.10 175.37 2nx3 s ASP 166 N 1.66 6.39 0.00 3.32 -1.08 -1.26 -4.89 116.67 120.81 2nx3 s ASP 166 Ca 0.05 -1.57 0.04 0.00 -0.52 0.00 0.00 52.55 50.55 2nx3 s ASP 166 Cb -0.18 -2.39 0.26 0.00 -1.46 0.00 0.00 42.92 39.15 2nx3 s ASP 166 CO 0.09 -1.20 0.70 0.49 0.52 0.00 0.00 175.17 175.76 2nx3 n PHE 167 N 6.88 0.00 0.29 -5.34 3.72 -1.26 -1.41 117.46 120.34 2nx3 n PHE 167 Ca 0.08 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.61 2nx3 n PHE 167 Cb 0.47 0.00 0.33 0.00 -0.94 0.00 0.00 39.48 39.34 2nx3 n PHE 167 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2nx3 h ARG 168 N 0.00 0.00 0.00 -1.08 3.08 -2.03 -3.15 114.38 111.20 2nx3 h ARG 168 Ca 0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.98 2nx3 h ARG 168 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 2nx3 h ARG 168 CO 0.00 0.00 -0.33 0.66 -1.07 0.00 0.00 179.97 179.23 2nx3 h SER 169 N 0.00 0.00 0.63 7.04 4.64 -1.66 -3.11 113.55 121.09 2nx3 h SER 169 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 2nx3 h SER 169 Cb 0.83 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.91 2nx3 h SER 169 CO 0.00 0.33 -0.42 -0.07 -0.87 0.00 0.00 176.83 175.80 2nx3 h LEU 170 N 0.00 -1.07 -0.49 5.97 4.07 -1.76 0.07 115.31 122.09 2nx3 h LEU 170 Ca -0.00 0.07 0.00 0.00 0.08 0.00 0.00 57.88 58.02 2nx3 h LEU 170 Cb 0.75 0.32 0.00 0.00 1.08 0.00 0.00 40.66 42.82 2nx3 h LEU 170 CO 0.04 -0.64 0.00 -0.81 -1.08 0.00 0.00 178.44 175.96 2nx3 n PRO 171 N -5.55 0.14 -0.01 1.13 -0.04 -1.23 -2.23 135.00 127.20 2nx3 n PRO 171 Ca -0.13 0.37 -0.18 0.00 -0.04 0.00 0.00 63.50 63.51 2nx3 n PRO 171 Cb 0.43 -1.77 -0.14 0.00 -0.04 0.00 0.00 33.50 31.99 2nx3 n PRO 171 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2nx3 h ILE 172 N 0.00 1.48 0.00 0.52 2.04 -1.37 -3.35 117.51 116.83 2nx3 h ILE 172 Ca 0.00 -2.42 -0.10 0.00 1.00 0.00 0.00 64.86 63.34 2nx3 h ILE 172 Cb 0.34 3.10 -0.01 0.00 -0.74 0.00 0.00 36.82 39.51 2nx3 h ILE 172 CO 0.00 0.64 -0.46 0.24 0.00 0.00 0.00 178.15 178.58 2nx3 h MET 173 N -0.63 0.00 -0.04 2.37 2.86 -0.92 -2.93 114.93 115.64 2nx3 h MET 173 Ca -0.14 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.51 2nx3 h MET 173 Cb 1.42 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 33.07 2nx3 h MET 173 CO 0.05 0.46 0.05 -0.22 1.06 0.00 0.00 176.91 178.31 2nx3 h LYS 174 N 0.00 0.00 -0.16 1.72 3.64 -1.58 -2.14 116.57 118.04 2nx3 h LYS 174 Ca -0.00 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.42 2nx3 h LYS 174 Cb 0.92 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.74 2nx3 h LYS 174 CO 0.06 0.00 0.13 1.96 -2.27 0.00 0.00 179.45 179.33 2nx3 h GLN 175 N 0.00 0.00 0.00 1.90 4.20 -1.67 -3.22 115.11 116.32 2nx3 h GLN 175 Ca 0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.73 2nx3 h GLN 175 Cb 0.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.91 2nx3 h GLN 175 CO -0.00 0.00 -0.31 -2.67 -0.67 0.00 0.00 178.83 175.18 2nx3 n TRP 176 N -4.31 0.00 0.00 2.96 2.14 -0.84 -5.11 117.44 112.28 2nx3 n TRP 176 Ca 0.01 -0.19 0.00 0.00 2.07 0.00 0.00 57.50 59.39 2nx3 n TRP 176 Cb 0.25 -0.06 0.00 0.00 -0.81 0.00 0.00 31.31 30.70 2nx3 n TRP 176 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 2nx3 n ALA 177 N -0.26 0.00 -1.84 -1.67 0.00 -1.01 -4.97 120.51 110.76 2nx3 n ALA 177 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.06 2nx3 n ALA 177 Cb 0.63 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.06 2nx3 n ALA 177 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2nx3 s LYS 178 N -2.00 4.38 -0.12 0.00 -0.14 -1.13 -4.02 119.74 116.70 2nx3 s LYS 178 Ca 0.00 2.15 0.00 0.00 -1.36 0.00 0.00 55.97 56.76 2nx3 s LYS 178 Cb 0.00 -3.12 -0.02 0.00 -1.68 0.00 0.00 37.83 33.02 2nx3 s LYS 178 CO 0.00 -0.20 -0.13 0.08 -0.76 0.00 0.00 175.35 174.34 2nx3 s VAL 179 N -0.68 3.08 0.14 3.17 1.01 -1.26 -0.60 120.40 125.26 2nx3 s VAL 179 Ca 0.52 -0.66 0.10 0.00 0.00 0.00 0.00 61.98 61.94 2nx3 s VAL 179 Cb -0.39 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 2nx3 s VAL 179 CO 0.47 0.53 -0.22 -0.63 0.00 0.00 0.00 175.10 175.25 2nx3 s ILE 180 N 0.27 2.54 -0.18 2.22 1.09 -0.42 0.12 121.20 126.84 2nx3 s ILE 180 Ca -0.09 -1.70 -0.01 0.00 -1.10 0.00 0.00 60.65 57.74 2nx3 s ILE 180 Cb -0.15 -2.17 -0.00 0.00 -1.06 0.00 0.00 42.46 39.08 2nx3 s ILE 180 CO 0.05 0.05 -0.12 -0.47 -0.10 0.00 0.00 174.94 174.35 2nx3 s TYR 181 N -1.23 2.85 -0.71 3.97 5.04 0.10 -0.69 117.35 126.69 2nx3 s TYR 181 Ca 0.17 -1.11 -0.23 0.00 -2.44 0.00 0.00 57.07 53.46 2nx3 s TYR 181 Cb -0.10 -1.97 0.06 0.00 0.35 0.00 0.00 41.96 40.31 2nx3 s TYR 181 CO 0.09 -0.55 1.07 0.34 -1.34 0.00 0.00 175.55 175.15 2nx3 s ASP 182 N 1.12 6.21 0.36 4.32 -1.08 -0.02 0.19 116.67 127.77 2nx3 s ASP 182 Ca 0.01 -0.94 0.15 0.00 -0.52 0.00 0.00 52.55 51.25 2nx3 s ASP 182 Cb -0.14 -2.46 0.68 0.00 -1.46 0.00 0.00 42.92 39.54 2nx3 s ASP 182 CO -0.04 -1.52 1.76 0.00 0.52 0.00 0.00 175.17 175.90 2nx3 h ALA 183 N 9.64 1.15 0.02 3.66 0.00 -0.86 -2.92 119.26 129.94 2nx3 h ALA 183 Ca -0.24 -0.38 -0.30 0.00 0.00 0.00 0.00 54.91 53.99 2nx3 h ALA 183 Cb 1.06 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 2nx3 h ALA 183 CO 1.21 0.52 -1.72 1.79 0.00 0.00 0.00 179.25 181.05 2nx3 h THR 184 N 0.00 0.84 0.00 0.00 1.35 -1.86 -3.39 112.91 109.85 2nx3 h THR 184 Ca -0.00 -2.68 -0.15 0.00 -0.55 0.00 0.00 66.41 63.02 2nx3 h THR 184 Cb 0.82 2.45 -0.03 0.00 -1.73 0.00 0.00 68.15 69.66 2nx3 h THR 184 CO 0.05 0.55 -1.42 1.41 -0.25 0.00 0.00 175.52 175.86 2nx3 n HIS 185 N -3.11 0.93 0.19 4.73 8.25 -1.25 -3.85 115.22 121.11 2nx3 n HIS 185 Ca -0.18 0.31 0.03 0.00 -0.26 0.00 0.00 57.72 57.61 2nx3 n HIS 185 Cb 1.05 -1.06 0.13 0.00 1.12 0.00 0.00 29.99 31.23 2nx3 n HIS 185 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2nx3 n SER 186 N -2.85 0.02 -0.27 0.41 7.64 -1.10 -1.48 113.62 115.99 2nx3 n SER 186 Ca -0.09 0.51 0.08 0.00 1.01 0.00 0.00 58.87 60.37 2nx3 n SER 186 Cb 0.82 -0.51 0.14 0.00 -1.01 0.00 0.00 64.21 63.65 2nx3 n SER 186 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2nx3 n VAL 187 N -1.53 1.78 -3.43 0.44 0.24 -1.25 -4.74 118.33 109.84 2nx3 n VAL 187 Ca 0.01 -1.90 -0.29 0.00 -2.04 0.00 0.00 64.34 60.12 2nx3 n VAL 187 Cb 0.06 -0.08 -0.04 0.00 -1.47 0.00 0.00 33.84 32.32 2nx3 n VAL 187 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2nx3 s GLN 188 N -2.45 3.64 -0.55 7.34 -2.07 -0.55 -0.07 119.66 124.96 2nx3 s GLN 188 Ca 0.29 -0.00 -0.06 0.00 -1.82 0.00 0.00 55.36 53.76 2nx3 s GLN 188 Cb 0.24 -2.69 0.14 0.00 -1.09 0.00 0.00 33.01 29.61 2nx3 s GLN 188 CO 0.05 0.28 0.40 -0.51 -1.32 0.00 0.00 175.29 174.18 2nx3 s LEU 189 N -3.30 5.58 -0.19 2.60 1.43 -1.01 -4.30 118.68 119.50 2nx3 s LEU 189 Ca 0.44 -2.34 -0.39 0.00 -1.03 0.00 0.00 54.13 50.80 2nx3 s LEU 189 Cb -0.11 -1.95 -0.16 0.00 0.03 0.00 0.00 46.19 44.01 2nx3 s LEU 189 CO 0.28 -0.54 1.65 -2.65 0.23 0.00 0.00 176.35 175.31 2nx3 n PRO 190 N 4.27 1.14 -1.40 1.29 -0.02 -1.26 -0.38 135.00 138.64 2nx3 n PRO 190 Ca 0.01 0.42 -0.14 0.00 -2.02 0.00 0.00 63.50 61.76 2nx3 n PRO 190 Cb 0.41 -2.09 -0.06 0.00 -0.02 0.00 0.00 33.50 31.73 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 3.78 1.36 0.35 -1.23 0.00 -1.25 -4.23 105.19 103.97 2nx3 n GLY 191 Ca 0.25 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.29 2nx3 n GLY 191 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2nx3 h GLY 192 N 0.00 1.03 -4.00 -0.02 0.00 -0.74 -2.94 103.07 96.41 2nx3 h GLY 192 Ca -0.29 -0.37 -0.63 0.00 0.00 0.00 0.00 47.33 46.04 2nx3 h GLY 192 CO 0.43 0.34 0.81 1.04 0.00 0.00 0.00 176.54 179.16 2nx3 n LEU 193 N -4.44 7.50 0.00 3.11 4.77 -1.01 -4.79 117.00 122.14 2nx3 n LEU 193 Ca 0.09 -4.17 0.00 0.00 -0.03 0.00 0.00 56.01 51.90 2nx3 n LEU 193 Cb 0.08 -1.00 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 2nx3 n LEU 193 CO 0.35 1.46 0.00 0.61 -1.33 0.00 0.00 177.39 178.48 2nx3 n GLY 194 N -0.67 1.35 0.12 -0.72 0.00 -1.11 -2.74 105.19 101.42 2nx3 n GLY 194 Ca 0.57 0.30 -0.19 0.00 0.00 0.00 0.00 46.02 46.71 2nx3 n GLY 194 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2nx3 h ASP 195 N 0.00 0.50 -3.04 1.61 2.03 -1.94 -3.46 116.42 112.12 2nx3 h ASP 195 Ca 0.00 -0.64 0.00 0.00 -0.73 0.00 0.00 57.03 55.66 2nx3 h ASP 195 Cb 0.00 -0.16 0.00 0.00 -0.83 0.00 0.00 39.33 38.34 2nx3 h ASP 195 CO 0.00 1.53 0.00 0.29 -1.03 0.00 0.00 179.24 180.03 2nx3 n LYS 196 N -3.53 1.85 -4.48 4.15 5.02 -1.11 -3.62 118.16 116.45 2nx3 n LYS 196 Ca -0.17 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 55.89 2nx3 n LYS 196 Cb 1.06 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.96 2nx3 n LYS 196 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2nx3 s SER 197 N -1.00 3.45 0.00 4.39 0.01 -1.26 -2.40 113.70 116.89 2nx3 s SER 197 Ca 0.00 -1.09 0.00 0.00 1.31 0.00 0.00 55.95 56.17 2nx3 s SER 197 Cb 0.00 -0.29 0.00 0.00 0.21 0.00 0.00 66.02 65.94 2nx3 s SER 197 CO 0.00 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.17 2nx3 n GLY 198 N -0.64 2.14 0.00 3.44 0.00 -0.28 -4.42 105.19 105.43 2nx3 n GLY 198 Ca -0.05 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.88 2nx3 n GLY 198 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nx3 n GLY 199 N 5.00 1.62 3.32 -0.02 0.00 -1.26 -2.39 105.19 111.46 2nx3 n GLY 199 Ca 0.00 0.16 -0.44 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.49 4.11 0.27 1.61 -1.94 0.90 -4.77 119.30 118.99 2nx3 s MET 200 Ca 0.00 -3.20 -0.01 0.00 -1.71 0.00 0.00 55.69 50.77 2nx3 s MET 200 Cb 0.00 -4.50 0.58 0.00 2.01 0.00 0.00 34.83 32.92 2nx3 s MET 200 CO 0.00 -1.24 1.68 -0.09 -0.01 0.00 0.00 175.02 175.35 2nx3 h ARG 201 N 6.65 0.27 0.00 2.03 2.43 -1.84 -1.43 114.38 122.50 2nx3 h ARG 201 Ca 0.17 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 2nx3 h ARG 201 Cb 0.87 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 2nx3 h ARG 201 CO 0.99 0.18 0.00 -0.85 -1.51 0.00 0.00 179.97 178.78 2nx3 n GLU 202 N -5.16 0.11 0.00 0.20 0.00 -1.26 -2.05 120.64 112.48 2nx3 n GLU 202 Ca 0.18 0.58 0.11 0.00 0.00 0.00 0.00 57.16 58.03 2nx3 n GLU 202 Cb 0.56 -1.84 -0.03 0.00 0.00 0.00 0.00 31.44 30.13 2nx3 n GLU 202 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 2nx3 n PHE 203 N -2.07 0.00 0.22 -1.84 3.72 -0.54 -4.56 117.46 112.39 2nx3 n PHE 203 Ca -0.01 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.24 2nx3 n PHE 203 Cb 0.04 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.50 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 1.92 0.64 0.46 4.37 2.04 -1.51 -2.58 117.51 122.86 2nx3 h ILE 204 Ca 0.00 -0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 2nx3 h ILE 204 Cb 0.69 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 2nx3 h ILE 204 CO 0.00 0.00 -0.22 0.15 0.00 0.00 0.00 178.15 178.08 2nx3 h PHE 205 N -0.49 -0.58 -0.81 1.37 3.57 -1.80 -2.00 116.94 116.19 2nx3 h PHE 205 Ca -0.05 -0.01 0.18 0.00 3.53 0.00 0.00 57.97 61.62 2nx3 h PHE 205 Cb 0.38 0.19 -0.11 0.00 2.79 0.00 0.00 35.95 39.20 2nx3 h PHE 205 CO -0.05 -0.32 0.30 -1.35 -2.23 0.00 0.00 178.31 174.66 2nx3 h PRO 206 N -0.69 0.37 0.00 6.41 0.11 -1.81 0.00 132.00 136.39 2nx3 h PRO 206 Ca -0.06 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.93 2nx3 h PRO 206 Cb 0.51 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.52 2nx3 h PRO 206 CO 0.10 0.24 -0.45 -0.07 -0.21 0.00 0.00 178.00 177.62 2nx3 h LEU 207 N 0.38 0.00 -0.39 2.35 3.38 -1.39 -2.83 115.31 116.80 2nx3 h LEU 207 Ca 0.48 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.37 2nx3 h LEU 207 Cb 0.83 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 2nx3 h LEU 207 CO -0.49 0.45 -0.05 0.40 0.09 0.00 0.00 178.44 178.84 2nx3 h ILE 208 N 0.00 1.27 -0.55 1.22 2.04 -0.24 -1.77 117.51 119.48 2nx3 h ILE 208 Ca -0.00 -1.10 0.07 0.00 1.00 0.00 0.00 64.86 64.83 2nx3 h ILE 208 Cb 0.98 1.19 -0.06 0.00 -0.74 0.00 0.00 36.82 38.19 2nx3 h ILE 208 CO 0.06 0.37 0.23 0.03 0.00 0.00 0.00 178.15 178.84 2nx3 h ARG 209 N 0.54 0.43 -0.22 2.37 3.08 -1.23 -2.14 114.38 117.20 2nx3 h ARG 209 Ca 0.11 -0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.18 2nx3 h ARG 209 Cb 0.54 -0.10 -0.05 0.00 0.08 0.00 0.00 29.97 30.45 2nx3 h ARG 209 CO 0.03 0.28 -0.10 0.00 -1.07 0.00 0.00 179.97 179.11 2nx3 h ALA 210 N 1.35 0.09 -0.50 0.04 0.00 -1.22 -1.09 119.26 117.92 2nx3 h ALA 210 Ca 0.26 0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.33 2nx3 h ALA 210 Cb 0.26 0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.24 2nx3 h ALA 210 CO -0.23 -0.52 0.18 0.00 0.00 0.00 0.00 179.25 178.68 2nx3 h ALA 211 N 1.12 0.62 -0.15 0.00 0.00 -0.70 0.09 119.26 120.23 2nx3 h ALA 211 Ca 0.12 0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 2nx3 h ALA 211 Cb 0.25 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2nx3 h ALA 211 CO -0.27 -0.21 -0.54 -0.39 0.00 0.00 0.00 179.25 177.84 2nx3 h VAL 212 N 0.36 1.34 -0.62 0.00 -1.51 -1.16 0.10 116.25 114.76 2nx3 h VAL 212 Ca 0.24 -1.81 -0.07 0.00 -1.23 0.00 0.00 66.70 63.83 2nx3 h VAL 212 Cb 0.26 1.81 -0.02 0.00 -2.13 0.00 0.00 31.29 31.20 2nx3 h VAL 212 CO -0.24 0.55 0.11 0.00 -1.23 0.00 0.00 177.57 176.76 2nx3 h ALA 213 N 1.06 0.82 0.04 5.19 0.00 -0.67 -3.03 119.26 122.68 2nx3 h ALA 213 Ca 0.01 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 2nx3 h ALA 213 Cb 1.06 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2nx3 h ALA 213 CO 0.10 0.57 -0.02 0.28 0.00 0.00 0.00 179.25 180.18 2nx3 h VAL 214 N 0.93 1.23 0.00 0.00 2.07 -0.88 -3.47 116.25 116.13 2nx3 h VAL 214 Ca 0.19 -0.86 0.00 0.00 0.82 0.00 0.00 66.70 66.85 2nx3 h VAL 214 Cb 0.41 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.98 2nx3 h VAL 214 CO 0.01 0.22 0.00 0.61 0.02 0.00 0.00 177.57 178.43 2nx3 n GLY 215 N -0.09 2.31 3.35 2.17 0.00 0.01 -4.79 105.19 108.16 2nx3 n GLY 215 Ca -0.08 -0.49 -0.18 0.00 0.00 0.00 0.00 46.02 45.26 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 -0.58 1.64 -3.63 0.00 8.00 0.12 -4.99 116.55 117.10 2nx3 n ASP 217 Ca -0.01 -1.30 -0.02 0.00 0.71 0.00 0.00 54.79 54.17 2nx3 n ASP 217 Cb 0.66 0.58 -0.02 0.00 -0.02 0.00 0.00 41.12 42.32 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 -2.63 -0.23 -0.13 0.44 0.00 -1.14 -2.15 107.32 101.48 2nx3 s GLY 218 Ca 0.16 1.80 0.02 0.00 0.00 0.00 0.00 44.72 46.70 2nx3 s GLY 218 CO 0.65 0.59 -0.20 -1.34 0.00 0.00 0.00 173.10 172.80 2nx3 s VAL 219 N -2.13 1.90 -0.26 1.40 -7.23 -0.41 -0.72 120.40 112.96 2nx3 s VAL 219 Ca 0.11 -0.89 -0.10 0.00 -1.81 0.00 0.00 61.98 59.29 2nx3 s VAL 219 Cb -0.01 -1.69 -0.05 0.00 0.56 0.00 0.00 36.38 35.20 2nx3 s VAL 219 CO -0.03 0.52 0.16 0.12 -0.31 0.00 0.00 175.10 175.56 2nx3 s PHE 220 N 0.82 3.24 -0.13 2.82 5.36 0.13 -2.38 117.98 127.85 2nx3 s PHE 220 Ca -0.08 0.10 -0.06 0.00 -0.96 0.00 0.00 56.93 55.93 2nx3 s PHE 220 Cb -0.16 -2.31 0.05 0.00 -0.34 0.00 0.00 43.02 40.27 2nx3 s PHE 220 CO -0.01 -0.08 0.29 0.00 -1.46 0.00 0.00 175.22 173.96 2nx3 s MET 221 N 1.42 0.24 -0.12 10.12 0.23 -0.47 -0.17 119.30 130.56 2nx3 s MET 221 Ca 0.07 0.63 -0.19 0.00 -1.03 0.00 0.00 55.69 55.17 2nx3 s MET 221 Cb -0.15 -0.08 -0.04 0.00 -1.53 0.00 0.00 34.83 33.03 2nx3 s MET 221 CO 0.07 -0.18 0.51 -1.21 -2.03 0.00 0.00 175.02 172.18 2nx3 s GLU 222 N 1.46 4.34 0.27 3.16 2.02 -1.26 -3.79 118.70 124.89 2nx3 s GLU 222 Ca -0.08 0.50 0.11 0.00 0.02 0.00 0.00 54.97 55.53 2nx3 s GLU 222 Cb -0.10 -3.45 -0.05 0.00 0.10 0.00 0.00 34.13 30.63 2nx3 s GLU 222 CO -0.10 0.11 -0.19 -0.08 0.02 0.00 0.00 175.26 175.02 2nx3 s THR 223 N 0.76 2.39 -0.16 3.63 -1.32 0.09 -2.19 115.64 118.84 2nx3 s THR 223 Ca 0.27 -2.38 -0.25 0.00 -1.21 0.00 0.00 61.69 58.12 2nx3 s THR 223 Cb -0.15 -2.27 0.06 0.00 -1.51 0.00 0.00 72.50 68.63 2nx3 s THR 223 CO 0.11 -0.42 0.64 -2.28 -2.21 0.00 0.00 174.62 170.46 2nx3 s HIS 224 N -2.55 -0.66 0.32 9.09 5.04 -0.60 -3.04 115.29 122.89 2nx3 s HIS 224 Ca 0.29 1.41 0.05 0.00 -1.54 0.00 0.00 55.06 55.27 2nx3 s HIS 224 Cb -0.05 0.30 0.68 0.00 0.04 0.00 0.00 32.58 33.55 2nx3 s HIS 224 CO 0.14 -0.45 1.86 -1.35 -2.34 0.00 0.00 174.74 172.60 2nx3 h PRO 225 N 4.23 0.83 -2.15 2.88 0.11 -1.94 -1.68 132.00 134.27 2nx3 h PRO 225 Ca -0.28 -0.05 -0.55 0.00 0.11 0.00 0.00 66.00 65.23 2nx3 h PRO 225 Cb 1.16 -0.19 -0.36 0.00 0.11 0.00 0.00 31.00 31.72 2nx3 h PRO 225 CO 0.23 0.55 -0.97 0.39 -0.21 0.00 0.00 178.00 177.98 2nx3 n GLU 226 N -4.57 0.33 -0.32 1.05 1.02 -1.26 -4.63 120.64 112.25 2nx3 n GLU 226 Ca 0.17 -3.08 0.35 0.00 -0.02 0.00 0.00 57.16 54.58 2nx3 n GLU 226 Cb 0.39 -1.56 0.66 0.00 -0.02 0.00 0.00 31.44 30.91 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 5.21 0.00 -0.58 3.49 0.11 -1.88 0.32 132.00 138.68 2nx3 h PRO 227 Ca 0.21 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.22 2nx3 h PRO 227 Cb 0.92 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.01 2nx3 h PRO 227 CO 0.37 0.00 0.00 1.49 -0.21 0.00 0.00 178.00 179.65 2nx3 h GLU 228 N 0.00 1.02 -0.18 1.05 4.81 -1.94 -2.94 114.58 116.39 2nx3 h GLU 228 Ca 0.58 -0.32 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 2nx3 h GLU 228 Cb 2.72 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 32.01 2nx3 h GLU 228 CO -0.01 1.01 0.00 1.63 -0.73 0.00 0.00 179.01 180.91 2nx3 n LYS 229 N -4.23 1.77 -1.55 1.92 5.02 0.11 -4.96 118.16 116.24 2nx3 n LYS 229 Ca 0.02 -1.15 -0.38 0.00 -2.02 0.00 0.00 58.31 54.78 2nx3 n LYS 229 Cb 0.34 -1.39 0.04 0.00 -0.02 0.00 0.00 35.03 34.00 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 0.38 -0.41 1.25 7.82 0.00 -1.11 -4.90 120.51 123.54 2nx3 n ALA 230 Ca 0.16 -0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.73 2nx3 n ALA 230 Cb 0.34 -1.98 0.31 0.00 0.00 0.00 0.00 19.45 18.12 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 -0.19 1.79 -3.60 0.00 4.77 -1.26 -4.68 117.00 113.83 2nx3 n LEU 231 Ca 0.13 -0.59 -0.12 0.00 -0.03 0.00 0.00 56.01 55.39 2nx3 n LEU 231 Cb 0.47 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.47 2nx3 n LEU 231 CO 0.50 0.31 0.60 -0.94 -1.33 0.00 0.00 177.39 176.53 2nx3 s SER 232 N -2.20 -0.56 -1.12 -1.43 1.04 -1.26 -4.50 113.70 103.67 2nx3 s SER 232 Ca 0.29 0.92 -0.08 0.00 0.48 0.00 0.00 55.95 57.56 2nx3 s SER 232 Cb 0.20 0.88 0.06 0.00 0.10 0.00 0.00 66.02 67.26 2nx3 s SER 232 CO 0.41 -0.30 0.35 0.47 0.98 0.00 0.00 173.24 175.15 2nx3 n ASP 233 N 1.83 -3.24 -0.29 7.02 8.00 -1.26 -4.82 116.55 123.79 2nx3 n ASP 233 Ca -0.14 -0.24 0.11 0.00 0.71 0.00 0.00 54.79 55.23 2nx3 n ASP 233 Cb 0.56 -2.73 0.27 0.00 -0.02 0.00 0.00 41.12 39.20 2nx3 n ASP 233 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2nx3 h ALA 234 N 0.97 1.31 0.63 2.24 0.00 -1.83 -2.20 119.26 120.38 2nx3 h ALA 234 Ca -0.36 0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 2nx3 h ALA 234 Cb 1.25 0.13 0.01 0.00 0.00 0.00 0.00 17.79 19.17 2nx3 h ALA 234 CO 0.46 -0.29 -0.30 -1.35 0.00 0.00 0.00 179.25 177.76 2nx3 h PRO 235 N 0.42 -0.82 0.00 0.00 0.11 -1.88 -2.70 132.00 127.13 2nx3 h PRO 235 Ca 0.51 0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.68 2nx3 h PRO 235 Cb 0.92 0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2nx3 h PRO 235 CO -0.49 -0.54 0.00 0.25 -0.21 0.00 0.00 178.00 177.01 2nx3 n THR 236 N -5.45 1.59 -0.70 -1.15 -2.24 -0.98 -4.60 114.28 100.75 2nx3 n THR 236 Ca -0.13 0.45 -0.32 0.00 -2.27 0.00 0.00 64.05 61.79 2nx3 n THR 236 Cb 0.35 -1.39 0.16 0.00 -2.10 0.00 0.00 70.33 67.35 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 -1.55 -2.30 -3.73 6.98 0.00 -0.87 -4.75 120.51 114.30 2nx3 n ALA 237 Ca 0.01 -0.76 -0.25 0.00 0.00 0.00 0.00 53.44 52.44 2nx3 n ALA 237 Cb 0.06 -1.91 -0.17 0.00 0.00 0.00 0.00 19.45 17.42 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 -3.68 0.71 -0.28 0.00 2.96 -0.93 -4.98 118.68 112.47 2nx3 s LEU 238 Ca 0.61 -0.38 -0.43 0.00 -0.22 0.00 0.00 54.13 53.71 2nx3 s LEU 238 Cb -0.21 -0.44 -0.19 0.00 0.50 0.00 0.00 46.19 45.85 2nx3 s LEU 238 CO 0.64 -0.26 1.43 -2.65 -1.32 0.00 0.00 176.35 174.20 2nx3 n PRO 239 N 5.15 0.20 0.23 0.98 -0.02 -1.26 -1.56 135.00 138.70 2nx3 n PRO 239 Ca -0.07 0.07 0.18 0.00 -2.02 0.00 0.00 63.50 61.66 2nx3 n PRO 239 Cb 0.49 -1.60 0.82 0.00 -0.02 0.00 0.00 33.50 33.19 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 4.58 0.00 -1.02 2.45 5.85 -1.56 -0.70 115.31 124.92 2nx3 h LEU 240 Ca -0.47 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.16 2nx3 h LEU 240 Cb 1.38 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.40 2nx3 h LEU 240 CO 0.86 0.00 -0.35 -1.28 -0.34 0.00 0.00 178.44 177.33 2nx3 h SER 241 N 0.00 0.27 0.58 1.25 0.87 -1.86 -3.06 113.55 111.60 2nx3 h SER 241 Ca 0.08 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 2nx3 h SER 241 Cb 0.73 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 2nx3 h SER 241 CO -0.00 0.61 -0.63 0.00 -0.53 0.00 0.00 176.83 176.27 2nx3 n GLN 242 N -4.08 0.13 -0.21 2.24 6.02 -0.28 -4.28 117.38 116.93 2nx3 n GLN 242 Ca -0.01 0.02 0.31 0.00 -0.01 0.00 0.00 57.00 57.31 2nx3 n GLN 242 Cb 0.44 -1.57 0.72 0.00 1.02 0.00 0.00 30.24 30.85 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 0.00 0.00 1.08 5.85 -1.46 -2.58 115.31 118.21 2nx3 h LEU 243 Ca 0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2nx3 h LEU 243 Cb 0.60 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.63 2nx3 h LEU 243 CO 0.00 0.00 -0.12 -0.08 -0.34 0.00 0.00 178.44 177.90 2nx3 h GLU 244 N 0.00 0.00 -0.47 1.25 4.81 -1.79 -3.30 114.58 115.07 2nx3 h GLU 244 Ca 0.46 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.79 2nx3 h GLU 244 Cb 2.02 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 31.32 2nx3 h GLU 244 CO -0.00 0.71 -0.08 0.78 -0.73 0.00 0.00 179.01 179.68 2nx3 h GLY 245 N -1.00 0.39 0.21 1.92 0.00 -1.75 -0.81 103.07 102.02 2nx3 h GLY 245 Ca -0.03 0.13 0.17 0.00 0.00 0.00 0.00 47.33 47.60 2nx3 h GLY 245 CO -0.02 -0.17 0.57 -2.22 0.00 0.00 0.00 176.54 174.70 2nx3 h ILE 246 N 0.03 0.75 -0.39 2.60 2.04 -1.68 0.09 117.51 120.95 2nx3 h ILE 246 Ca 0.23 -0.26 -0.09 0.00 1.00 0.00 0.00 64.86 65.74 2nx3 h ILE 246 Cb 0.35 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.33 2nx3 h ILE 246 CO -0.46 0.14 -0.11 0.40 0.00 0.00 0.00 178.15 178.12 2nx3 h ILE 247 N 0.77 1.28 -0.75 -0.67 2.04 -1.26 -0.00 117.51 118.91 2nx3 h ILE 247 Ca 0.54 -1.20 0.02 0.00 1.00 0.00 0.00 64.86 65.21 2nx3 h ILE 247 Cb 0.77 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 38.06 2nx3 h ILE 247 CO -0.36 0.40 0.49 -0.08 0.00 0.00 0.00 178.15 178.60 2nx3 h GLU 248 N 0.56 0.95 -0.38 2.37 4.57 -0.28 -2.22 114.58 120.15 2nx3 h GLU 248 Ca 0.10 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.20 2nx3 h GLU 248 Cb 0.63 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 28.99 2nx3 h GLU 248 CO 0.04 0.63 0.17 0.00 -1.18 0.00 0.00 179.01 178.67 2nx3 h ALA 249 N 1.29 0.49 -0.68 2.92 0.00 -0.75 -2.88 119.26 119.64 2nx3 h ALA 249 Ca 0.28 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 55.17 2nx3 h ALA 249 Cb -0.07 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.50 2nx3 h ALA 249 CO -0.08 0.07 0.32 0.82 0.00 0.00 0.00 179.25 180.38 2nx3 h ILE 250 N 0.47 0.82 -0.43 0.00 2.04 -0.42 -1.71 117.51 118.28 2nx3 h ILE 250 Ca 0.13 -0.19 -0.10 0.00 1.00 0.00 0.00 64.86 65.70 2nx3 h ILE 250 Cb 0.15 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.44 2nx3 h ILE 250 CO -0.01 0.10 -0.14 -0.07 0.00 0.00 0.00 178.15 178.03 2nx3 h LEU 251 N 0.54 0.86 -0.15 1.44 3.38 -1.36 -1.05 115.31 118.97 2nx3 h LEU 251 Ca 0.34 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2nx3 h LEU 251 Cb 0.38 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2nx3 h LEU 251 CO -0.28 1.04 0.08 -0.33 0.09 0.00 0.00 178.44 179.04 2nx3 h GLU 252 N 0.67 0.21 0.11 1.13 5.08 -1.25 0.43 114.58 120.96 2nx3 h GLU 252 Ca 0.10 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 2nx3 h GLU 252 Cb 0.69 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.90 2nx3 h GLU 252 CO 0.05 0.23 -0.05 0.82 -1.00 0.00 0.00 179.01 179.06 2nx3 h ILE 253 N 0.13 0.93 -0.93 3.13 1.08 -1.31 -2.60 117.51 117.94 2nx3 h ILE 253 Ca 0.05 -0.13 0.10 0.00 -0.39 0.00 0.00 64.86 64.49 2nx3 h ILE 253 Cb 0.09 1.01 -0.08 0.00 -3.07 0.00 0.00 36.82 34.77 2nx3 h ILE 253 CO -0.01 0.03 0.57 -0.09 -0.69 0.00 0.00 178.15 177.97 2nx3 h ARG 254 N -0.21 0.92 0.45 2.37 2.43 -1.05 0.29 114.38 119.57 2nx3 h ARG 254 Ca -0.02 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 2nx3 h ARG 254 Cb 0.17 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 2nx3 h ARG 254 CO 0.03 0.61 -0.38 1.49 -1.51 0.00 0.00 179.97 180.20 2nx3 h GLU 255 N 0.95 -0.80 -0.08 0.20 4.57 0.24 0.36 114.58 120.01 2nx3 h GLU 255 Ca 0.45 0.05 -0.16 0.00 -1.18 0.00 0.00 59.36 58.52 2nx3 h GLU 255 Cb 0.39 0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 29.15 2nx3 h GLU 255 CO -0.24 -0.53 -0.66 -0.24 -1.18 0.00 0.00 179.01 176.15 2nx3 h VAL 256 N -0.83 1.38 0.01 0.32 3.04 -1.20 -3.28 116.25 115.69 2nx3 h VAL 256 Ca -0.04 -2.06 -0.20 0.00 -1.01 0.00 0.00 66.70 63.39 2nx3 h VAL 256 Cb 0.72 2.04 -0.01 0.00 -2.01 0.00 0.00 31.29 32.03 2nx3 h VAL 256 CO -0.03 0.61 -0.91 0.00 -1.01 0.00 0.00 177.57 176.24 2nx3 h ALA 257 N 1.06 0.48 -0.87 3.17 0.00 -0.35 -3.35 119.26 119.40 2nx3 h ALA 257 Ca -0.02 -0.76 0.23 0.00 0.00 0.00 0.00 54.91 54.36 2nx3 h ALA 257 Cb 1.20 -0.08 -0.14 0.00 0.00 0.00 0.00 17.79 18.77 2nx3 h ALA 257 CO 0.11 0.96 0.19 0.66 0.00 0.00 0.00 179.25 181.17 2nx3 h SER 258 N 0.08 -0.08 0.04 0.00 4.64 -0.34 0.26 113.55 118.16 2nx3 h SER 258 Ca -0.04 0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 2nx3 h SER 258 Cb 1.56 0.29 0.00 0.00 -0.31 0.00 0.00 62.40 63.94 2nx3 h SER 258 CO 0.14 -0.17 0.00 2.29 -0.87 0.00 0.00 176.83 178.22 2nx3 n LYS 259 N -5.26 0.05 0.00 4.77 2.85 -1.26 -1.47 118.16 117.85 2nx3 n LYS 259 Ca 0.20 0.21 0.04 0.00 -1.05 0.00 0.00 58.31 57.71 2nx3 n LYS 259 Cb 0.66 -1.50 -0.02 0.00 -0.65 0.00 0.00 35.03 33.52 2nx3 n LYS 259 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2nx3 n TYR 260 N -1.23 0.00 -1.77 5.58 4.01 0.91 -4.99 117.16 119.66 2nx3 n TYR 260 Ca 0.02 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.34 2nx3 n TYR 260 Cb 0.02 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.02 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 -1.37 2.36 0.77 -0.72 2.02 -0.54 -4.94 117.35 114.93 2nx3 s TYR 261 Ca 0.05 0.13 -0.14 0.00 -0.37 0.00 0.00 57.07 56.75 2nx3 s TYR 261 Cb 0.06 -4.12 0.06 0.00 -0.40 0.00 0.00 41.96 37.57 2nx3 s TYR 261 CO 0.24 -4.51 1.18 -1.21 -1.57 0.00 0.00 175.55 169.69 2nx3 s GLU 262 N 2.41 1.90 -0.61 -0.62 8.01 -1.26 -4.98 118.70 123.56 2nx3 s GLU 262 Ca 0.78 1.67 -0.09 0.00 0.01 0.00 0.00 54.97 57.34 2nx3 s GLU 262 Cb -0.45 -1.82 0.16 0.00 -4.31 0.00 0.00 34.13 27.71 2nx3 s GLU 262 CO 0.35 -1.99 0.48 0.95 0.01 0.00 0.00 175.26 175.05 2nx3 s THR 263 N -2.20 4.44 -2.00 3.63 -4.23 -1.26 -5.16 115.64 108.85 2nx3 s THR 263 Ca 0.72 -2.29 0.18 0.00 -1.18 0.00 0.00 61.69 59.12 2nx3 s THR 263 Cb -0.27 -3.86 0.52 0.00 1.34 0.00 0.00 72.50 70.24 2nx3 s THR 263 CO 0.49 -0.87 1.50 2.30 -0.54 0.00 0.00 174.62 177.49