#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i29 s LYS 2 N 0.00 4.19 0.11 3.17 1.02 -1.26 -3.56 119.74 123.41 2i29 s LYS 2 Ca 0.00 2.46 -0.14 0.00 0.02 0.00 0.00 55.97 58.31 2i29 s LYS 2 Cb 0.00 -3.01 0.02 0.00 -0.52 0.00 0.00 37.83 34.32 2i29 s LYS 2 CO 0.00 -0.44 0.34 1.52 -0.92 0.00 0.00 175.35 175.85 2i29 s TYR 3 N -0.93 -0.11 0.11 3.18 1.13 -0.79 -1.97 117.35 117.98 2i29 s TYR 3 Ca 0.53 -0.23 -0.01 0.00 -1.41 0.00 0.00 57.07 55.95 2i29 s TYR 3 Cb -0.44 0.17 -0.04 0.00 -1.10 0.00 0.00 41.96 40.54 2i29 s TYR 3 CO 0.57 -0.65 0.03 0.00 -2.51 0.00 0.00 175.55 173.00 2i29 s MET 4 N -3.74 0.84 -0.10 -3.49 0.23 -0.18 0.01 119.30 112.86 2i29 s MET 4 Ca 0.03 -1.38 -0.01 0.00 -1.03 0.00 0.00 55.69 53.30 2i29 s MET 4 Cb 0.03 0.23 0.03 0.00 -1.53 0.00 0.00 34.83 33.58 2i29 s MET 4 CO -0.11 -0.22 -0.06 0.42 -2.03 0.00 0.00 175.02 173.02 2i29 s ILE 5 N -4.01 0.88 0.28 3.16 1.01 -1.26 -1.12 121.20 120.14 2i29 s ILE 5 Ca 0.19 -0.20 -0.07 0.00 0.00 0.00 0.00 60.65 60.57 2i29 s ILE 5 Cb 0.08 -0.93 -0.06 0.00 0.01 0.00 0.00 42.46 41.56 2i29 s ILE 5 CO -0.01 0.34 0.58 0.42 0.00 0.00 0.00 174.94 176.27 2i29 s THR 6 N 1.72 4.96 0.05 2.92 -4.23 0.41 -4.97 115.64 116.49 2i29 s THR 6 Ca 0.04 0.29 0.04 0.00 -1.18 0.00 0.00 61.69 60.88 2i29 s THR 6 Cb -0.13 -3.69 -0.02 0.00 1.34 0.00 0.00 72.50 70.00 2i29 s THR 6 CO -0.07 -0.24 -0.11 -0.55 -0.54 0.00 0.00 174.62 173.10 2i29 s SER 7 N -2.84 1.34 0.57 3.99 0.15 -1.26 -1.44 113.70 114.21 2i29 s SER 7 Ca 0.46 -0.52 0.26 0.00 0.70 0.00 0.00 55.95 56.85 2i29 s SER 7 Cb -0.11 -0.04 1.64 0.00 -1.71 0.00 0.00 66.02 65.80 2i29 s SER 7 CO 0.27 -0.08 2.18 0.50 1.20 0.00 0.00 173.24 177.30 2i29 h LYS 8 N 4.63 0.00 0.00 5.44 3.64 -1.02 -3.47 116.57 125.79 2i29 h LYS 8 Ca -0.38 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 2i29 h LYS 8 Cb 1.19 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 2i29 h LYS 8 CO 0.42 0.00 0.00 0.41 -2.27 0.00 0.00 179.45 178.01 2i29 n GLY 9 N -1.41 0.47 3.82 5.01 0.00 -1.26 -5.08 105.19 106.73 2i29 n GLY 9 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 2i29 n GLY 9 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2i29 s ASP 10 N -2.62 3.84 0.21 1.61 3.84 -1.26 -4.88 116.67 117.40 2i29 s ASP 10 Ca 0.00 0.95 -0.09 0.00 -0.00 0.00 0.00 52.55 53.40 2i29 s ASP 10 Cb 0.00 -1.52 0.15 0.00 -1.38 0.00 0.00 42.92 40.17 2i29 s ASP 10 CO 0.00 -2.34 1.82 1.05 -0.00 0.00 0.00 175.17 175.70 2i29 h GLU 11 N -1.36 1.07 -0.14 2.11 4.11 -2.00 -2.63 114.58 115.74 2i29 h GLU 11 Ca -0.49 -0.13 0.00 0.00 0.07 0.00 0.00 59.36 58.81 2i29 h GLU 11 Cb 1.33 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 2i29 h GLU 11 CO 0.63 0.79 0.09 1.57 0.07 0.00 0.00 179.01 182.16 2i29 h LYS 12 N 1.06 0.18 -0.28 1.06 2.10 -1.99 -2.68 116.57 116.01 2i29 h LYS 12 Ca 0.27 -0.01 -0.06 0.00 -2.00 0.00 0.00 60.65 58.84 2i29 h LYS 12 Cb 0.04 -0.04 -0.01 0.00 -0.90 0.00 0.00 32.23 31.32 2i29 h LYS 12 CO -0.04 0.12 -0.07 0.77 -2.00 0.00 0.00 179.45 178.24 2i29 h SER 13 N 0.19 0.55 -0.19 7.07 0.02 -1.90 -1.82 113.55 117.47 2i29 h SER 13 Ca 0.05 -0.36 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 2i29 h SER 13 Cb -0.02 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 2i29 h SER 13 CO -0.01 0.79 0.13 0.44 -1.14 0.00 0.00 176.83 177.03 2i29 h ASP 14 N 0.31 0.22 -0.89 3.07 3.32 -1.54 -0.30 116.42 120.61 2i29 h ASP 14 Ca 0.07 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.09 2i29 h ASP 14 Cb 0.54 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 40.00 2i29 h ASP 14 CO 0.03 0.16 0.48 -0.07 -1.72 0.00 0.00 179.24 178.12 2i29 h LEU 15 N 0.26 1.12 -0.77 1.55 4.07 -1.48 0.18 115.31 120.24 2i29 h LEU 15 Ca 0.07 -0.11 -0.10 0.00 0.08 0.00 0.00 57.88 57.82 2i29 h LEU 15 Cb -0.03 -0.29 -0.02 0.00 1.08 0.00 0.00 40.66 41.41 2i29 h LEU 15 CO -0.01 0.91 -0.13 0.25 -1.08 0.00 0.00 178.44 178.37 2i29 h LEU 16 N 1.25 0.80 -0.29 1.67 5.85 -1.14 -2.10 115.31 121.35 2i29 h LEU 16 Ca 0.31 -0.25 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 2i29 h LEU 16 Cb 0.04 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 2i29 h LEU 16 CO -0.05 0.94 0.08 -0.09 -0.34 0.00 0.00 178.44 178.98 2i29 h ARG 17 N 0.72 0.46 -0.39 1.25 2.43 -0.51 -1.95 114.38 116.38 2i29 h ARG 17 Ca 0.12 -0.11 0.03 0.00 -0.81 0.00 0.00 59.98 59.21 2i29 h ARG 17 Cb 0.62 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 2i29 h ARG 17 CO 0.04 0.53 0.20 -0.07 -1.51 0.00 0.00 179.97 179.16 2i29 h LEU 18 N 0.31 0.30 -1.08 3.80 3.38 -0.84 0.31 115.31 121.49 2i29 h LEU 18 Ca 0.09 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 2i29 h LEU 18 Cb 0.27 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 2i29 h LEU 18 CO -0.00 0.22 0.54 0.78 0.09 0.00 0.00 178.44 180.07 2i29 h ASN 19 N 0.41 1.03 -0.32 -0.43 2.35 -1.36 -0.75 115.58 116.50 2i29 h ASN 19 Ca 0.17 -0.05 -0.05 0.00 -0.55 0.00 0.00 56.30 55.82 2i29 h ASN 19 Cb 0.06 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.16 2i29 h ASN 19 CO -0.11 0.77 0.02 0.24 -1.65 0.00 0.00 177.43 176.71 2i29 h MET 20 N 1.19 0.55 -0.59 0.81 2.86 -0.98 -0.81 114.93 117.96 2i29 h MET 20 Ca 0.31 -0.16 0.09 0.00 -2.06 0.00 0.00 59.70 57.88 2i29 h MET 20 Cb -0.08 -0.06 -0.07 0.00 0.06 0.00 0.00 31.60 31.46 2i29 h MET 20 CO -0.06 0.67 0.23 0.82 1.06 0.00 0.00 176.91 179.62 2i29 h ILE 21 N 0.36 0.80 -0.64 -1.22 2.04 -0.58 0.18 117.51 118.46 2i29 h ILE 21 Ca 0.09 -0.14 -0.03 0.00 1.00 0.00 0.00 64.86 65.78 2i29 h ILE 21 Cb 0.40 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 36.80 2i29 h ILE 21 CO 0.01 0.08 0.27 0.00 0.00 0.00 0.00 178.15 178.51 2i29 h ALA 22 N 1.39 0.82 -0.81 1.87 0.00 -1.04 -0.21 119.26 121.29 2i29 h ALA 22 Ca 0.29 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 55.06 2i29 h ALA 22 Cb 0.34 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 2i29 h ALA 22 CO -0.28 0.43 0.52 0.78 0.00 0.00 0.00 179.25 180.70 2i29 h GLY 23 N 0.89 1.16 1.75 0.00 0.00 -0.35 -2.43 103.07 104.08 2i29 h GLY 23 Ca 0.21 -0.40 -0.11 0.00 0.00 0.00 0.00 47.33 47.04 2i29 h GLY 23 CO -0.02 0.36 -0.39 0.74 0.00 0.00 0.00 176.54 177.23 2i29 h PHE 24 N 1.03 0.33 -0.62 5.60 0.05 -0.40 -2.85 116.94 120.07 2i29 h PHE 24 Ca 0.31 -0.09 0.12 0.00 3.82 0.00 0.00 57.97 62.14 2i29 h PHE 24 Cb -0.04 -0.07 -0.04 0.00 2.00 0.00 0.00 35.95 37.80 2i29 h PHE 24 CO -0.02 0.64 0.42 0.78 -0.18 0.00 0.00 178.31 179.95 2i29 h GLY 25 N 1.18 0.49 2.00 -1.45 0.00 -0.55 -0.95 103.07 103.79 2i29 h GLY 25 Ca 0.02 -0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.20 2i29 h GLY 25 CO 0.06 0.06 -0.11 0.83 0.00 0.00 0.00 176.54 177.39 2i29 h GLU 26 N 0.32 0.00 0.00 4.80 4.39 -1.30 -3.42 114.58 119.36 2i29 h GLU 26 Ca 0.30 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.00 2i29 h GLU 26 Cb 0.73 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.38 2i29 h GLU 26 CO -0.07 0.11 0.00 0.66 -1.16 0.00 0.00 179.01 178.54 2i29 n TYR 27 N -3.30 0.00 0.00 4.33 4.01 -0.36 -5.15 117.16 116.69 2i29 n TYR 27 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2i29 n TYR 27 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.36 2i29 n TYR 27 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 2i29 n ASP 28 N 0.00 0.00 -0.49 7.72 3.85 -1.24 -4.96 116.55 121.43 2i29 n ASP 28 Ca 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.08 2i29 n ASP 28 Cb 0.00 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.77 2i29 n ASP 28 CO 0.00 0.00 0.00 0.80 -1.01 0.00 0.00 177.20 176.99 2i29 n MET 29 N 0.00 0.00 -2.93 0.11 0.00 -1.26 -4.45 117.12 108.59 2i29 n MET 29 Ca 0.00 0.00 -0.40 0.00 -0.00 0.00 0.00 57.70 57.30 2i29 n MET 29 Cb 0.00 -0.56 -0.05 0.00 0.00 0.00 0.00 33.22 32.61 2i29 n MET 29 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 175.97 173.97 2i29 s GLU 30 N -2.13 4.55 -0.12 2.12 2.12 -1.23 -4.67 118.70 119.34 2i29 s GLU 30 Ca 0.00 1.16 -0.29 0.00 0.36 0.00 0.00 54.97 56.19 2i29 s GLU 30 Cb 0.00 -3.35 -0.01 0.00 0.26 0.00 0.00 34.13 31.03 2i29 s GLU 30 CO 0.00 0.32 1.00 -0.47 -0.54 0.00 0.00 175.26 175.57 2i29 s TYR 31 N -0.22 3.50 -0.25 5.30 6.14 -1.26 -1.88 117.35 128.68 2i29 s TYR 31 Ca 0.40 1.57 -0.02 0.00 0.64 0.00 0.00 57.07 59.66 2i29 s TYR 31 Cb -0.21 -3.19 0.13 0.00 0.42 0.00 0.00 41.96 39.11 2i29 s TYR 31 CO 0.25 -0.24 0.35 0.34 0.64 0.00 0.00 175.55 176.89 2i29 s ASP 32 N 1.11 0.56 0.00 4.32 -1.08 0.10 -4.89 116.67 116.78 2i29 s ASP 32 Ca 0.48 -0.02 0.20 0.00 -0.52 0.00 0.00 52.55 52.68 2i29 s ASP 32 Cb -0.18 0.96 0.79 0.00 -1.46 0.00 0.00 42.92 43.03 2i29 s ASP 32 CO 0.17 -0.32 1.56 -0.90 0.52 0.00 0.00 175.17 176.20 2i29 n ASP 33 N 5.35 1.34 -0.08 -0.34 5.68 -1.26 -3.05 116.55 124.19 2i29 n ASP 33 Ca -0.03 -1.67 -0.10 0.00 -0.50 0.00 0.00 54.79 52.49 2i29 n ASP 33 Cb 0.50 -0.09 -0.05 0.00 -1.14 0.00 0.00 41.12 40.33 2i29 n ASP 33 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 2i29 h VAL 34 N 1.76 0.41 -2.04 2.12 2.07 -1.95 -3.44 116.25 115.18 2i29 h VAL 34 Ca 0.00 -1.47 -0.53 0.00 0.82 0.00 0.00 66.70 65.52 2i29 h VAL 34 Cb 0.39 0.94 -0.41 0.00 -1.52 0.00 0.00 31.29 30.69 2i29 h VAL 34 CO 0.00 0.14 -0.90 -0.62 0.02 0.00 0.00 177.57 176.21 2i29 n GLU 35 N -4.57 2.23 -2.14 1.57 4.71 -1.26 -5.11 120.64 116.07 2i29 n GLU 35 Ca -0.15 -4.15 -0.33 0.00 -0.01 0.00 0.00 57.16 52.52 2i29 n GLU 35 Cb 0.39 -1.97 -0.00 0.00 -1.01 0.00 0.00 31.44 28.85 2i29 n GLU 35 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 2i29 s PRO 36 N -3.05 3.47 -0.01 3.49 0.04 -1.17 -4.90 135.00 132.86 2i29 s PRO 36 Ca 0.44 1.16 0.22 0.00 0.04 0.00 0.00 61.00 62.86 2i29 s PRO 36 Cb 0.33 -2.06 -0.26 0.00 0.04 0.00 0.00 34.50 32.55 2i29 s PRO 36 CO -0.11 -0.69 0.69 0.39 0.04 0.00 0.00 177.00 177.32 2i29 n GLU 37 N -1.89 0.39 -3.87 4.56 1.02 -0.83 -4.61 120.64 115.41 2i29 n GLU 37 Ca 0.08 -0.11 -0.18 0.00 -0.02 0.00 0.00 57.16 56.94 2i29 n GLU 37 Cb 0.53 -1.53 -0.17 0.00 -0.02 0.00 0.00 31.44 30.26 2i29 n GLU 37 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2i29 s ILE 38 N -3.30 0.15 -0.20 -3.67 1.01 -1.11 -1.35 121.20 112.73 2i29 s ILE 38 Ca -0.01 0.14 0.01 0.00 0.00 0.00 0.00 60.65 60.79 2i29 s ILE 38 Cb 0.15 -0.27 0.03 0.00 0.01 0.00 0.00 42.46 42.37 2i29 s ILE 38 CO 0.88 0.16 -0.18 -0.69 0.00 0.00 0.00 174.94 175.11 2i29 s VAL 39 N 1.26 2.12 -0.20 2.92 1.01 -0.90 -1.01 120.40 125.60 2i29 s VAL 39 Ca -0.06 -1.06 -0.06 0.00 0.00 0.00 0.00 61.98 60.79 2i29 s VAL 39 Cb -0.13 -1.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 2i29 s VAL 39 CO -0.02 0.42 0.04 -0.63 0.00 0.00 0.00 175.10 174.91 2i29 s ILE 40 N 1.26 4.37 -0.18 2.22 1.01 -0.28 -1.22 121.20 128.38 2i29 s ILE 40 Ca 0.02 -0.17 -0.03 0.00 0.00 0.00 0.00 60.65 60.46 2i29 s ILE 40 Cb -0.14 -2.98 -0.02 0.00 0.01 0.00 0.00 42.46 39.33 2i29 s ILE 40 CO -0.11 0.43 -0.05 -0.55 0.00 0.00 0.00 174.94 174.66 2i29 s SER 41 N 0.80 4.55 -0.27 3.58 0.15 -0.32 -0.45 113.70 121.75 2i29 s SER 41 Ca 0.02 -0.24 -0.00 0.00 0.70 0.00 0.00 55.95 56.43 2i29 s SER 41 Cb -0.14 -1.75 0.05 0.00 -1.71 0.00 0.00 66.02 62.47 2i29 s SER 41 CO 0.02 0.10 -0.06 -0.63 1.20 0.00 0.00 173.24 173.87 2i29 s ILE 42 N 0.76 2.65 0.00 6.45 1.01 -0.52 -0.04 121.20 131.52 2i29 s ILE 42 Ca -0.02 -1.36 0.00 0.00 0.00 0.00 0.00 60.65 59.27 2i29 s ILE 42 Cb -0.15 -2.47 0.00 0.00 0.01 0.00 0.00 42.46 39.85 2i29 s ILE 42 CO 0.02 0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.59 2i29 n GLY 43 N 4.57 -0.45 0.00 6.18 0.00 -0.66 -0.32 105.19 114.52 2i29 n GLY 43 Ca -0.15 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.62 2i29 n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i29 n GLY 44 N 0.00 5.50 0.20 -0.02 0.00 -1.26 -2.31 105.19 107.30 2i29 n GLY 44 Ca 0.00 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 43.94 2i29 n GLY 44 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2i29 h ASP 45 N 0.00 0.16 -0.65 1.61 3.32 -1.96 -2.08 116.42 116.81 2i29 h ASP 45 Ca 0.00 -0.05 0.07 0.00 0.02 0.00 0.00 57.03 57.06 2i29 h ASP 45 Cb 0.00 -0.04 -0.06 0.00 0.22 0.00 0.00 39.33 39.45 2i29 h ASP 45 CO 0.00 0.50 0.34 1.23 -1.72 0.00 0.00 179.24 179.59 2i29 h GLY 46 N 1.10 0.96 0.87 2.75 0.00 -1.99 0.22 103.07 106.97 2i29 h GLY 46 Ca 0.02 -0.23 -0.03 0.00 0.00 0.00 0.00 47.33 47.09 2i29 h GLY 46 CO 0.05 0.11 0.04 -0.84 0.00 0.00 0.00 176.54 175.90 2i29 h THR 47 N 0.62 1.23 -0.67 4.70 2.02 -1.86 -0.92 112.91 118.01 2i29 h THR 47 Ca 0.30 -0.78 0.01 0.00 0.77 0.00 0.00 66.41 66.71 2i29 h THR 47 Cb 0.24 1.24 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 2i29 h THR 47 CO -0.21 0.25 0.45 0.15 0.37 0.00 0.00 175.52 176.52 2i29 h PHE 48 N 0.24 0.84 -0.40 3.16 3.57 -1.02 -0.40 116.94 122.94 2i29 h PHE 48 Ca 0.08 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.61 2i29 h PHE 48 Cb 0.33 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.77 2i29 h PHE 48 CO 0.02 0.53 0.26 -0.07 -2.23 0.00 0.00 178.31 176.82 2i29 h LEU 49 N 0.91 0.44 -0.59 0.59 -0.00 -0.35 -0.78 115.31 115.53 2i29 h LEU 49 Ca 0.25 -0.01 0.05 0.00 -0.00 0.00 0.00 57.88 58.18 2i29 h LEU 49 Cb -0.10 -0.10 -0.05 0.00 -0.00 0.00 0.00 40.66 40.41 2i29 h LEU 49 CO -0.06 0.32 0.31 0.28 -0.00 0.00 0.00 178.44 179.29 2i29 h SER 50 N 0.53 0.45 -0.10 -0.43 0.02 -0.89 -0.83 113.55 112.31 2i29 h SER 50 Ca 0.15 0.03 0.03 0.00 -0.84 0.00 0.00 61.79 61.16 2i29 h SER 50 Cb -0.04 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 62.41 2i29 h SER 50 CO -0.04 0.30 -0.08 0.00 -1.14 0.00 0.00 176.83 175.86 2i29 h ALA 51 N 1.32 -0.00 -0.62 3.77 0.00 -0.72 0.01 119.26 123.02 2i29 h ALA 51 Ca 0.26 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.27 2i29 h ALA 51 Cb 0.17 0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.09 2i29 h ALA 51 CO -0.18 -0.54 0.34 0.35 0.00 0.00 0.00 179.25 179.21 2i29 h PHE 52 N -0.10 0.61 0.00 0.00 3.57 -0.93 -2.58 116.94 117.51 2i29 h PHE 52 Ca 0.07 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.55 2i29 h PHE 52 Cb 0.20 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 2i29 h PHE 52 CO -0.20 0.29 -0.20 0.45 -2.23 0.00 0.00 178.31 176.43 2i29 h HIS 53 N 0.63 0.00 -0.14 0.41 3.86 -0.90 -2.12 115.15 116.90 2i29 h HIS 53 Ca 0.28 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.39 2i29 h HIS 53 Cb 0.17 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.63 2i29 h HIS 53 CO -0.09 0.20 -0.33 0.37 0.86 0.00 0.00 177.93 178.94 2i29 h GLN 54 N 0.00 0.28 0.00 2.45 5.75 -0.60 -3.28 115.11 119.71 2i29 h GLN 54 Ca -0.00 -0.11 -0.01 0.00 -0.15 0.00 0.00 58.65 58.38 2i29 h GLN 54 Cb 0.90 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.42 2i29 h GLN 54 CO 0.03 0.58 -0.44 0.66 -2.65 0.00 0.00 178.83 177.01 2i29 n TYR 55 N -4.09 0.00 0.40 3.99 4.01 -1.10 -4.79 117.16 115.59 2i29 n TYR 55 Ca -0.01 -1.34 0.05 0.00 -0.16 0.00 0.00 57.90 56.45 2i29 n TYR 55 Cb 0.43 -0.22 0.24 0.00 -0.31 0.00 0.00 39.34 39.48 2i29 n TYR 55 CO 0.00 0.00 0.00 -0.85 -0.46 0.00 0.00 176.86 175.55 2i29 n GLU 56 N -1.07 0.02 0.02 -0.72 0.28 -0.81 -1.48 120.64 116.88 2i29 n GLU 56 Ca 0.17 0.29 0.12 0.00 -0.16 0.00 0.00 57.16 57.59 2i29 n GLU 56 Cb 0.71 -1.50 0.22 0.00 1.43 0.00 0.00 31.44 32.29 2i29 n GLU 56 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2i29 n GLU 57 N -1.47 0.11 -1.09 3.44 4.71 -1.26 -4.16 120.64 120.92 2i29 n GLU 57 Ca 0.03 0.02 0.00 0.00 -0.01 0.00 0.00 57.16 57.21 2i29 n GLU 57 Cb 0.12 -1.56 0.14 0.00 -1.01 0.00 0.00 31.44 29.13 2i29 n GLU 57 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 2i29 n ARG 58 N -1.72 1.66 0.08 3.49 3.00 -0.55 -4.84 116.66 117.78 2i29 n ARG 58 Ca 0.05 -3.24 0.10 0.00 -0.01 0.00 0.00 57.85 54.75 2i29 n ARG 58 Cb 0.37 -1.45 0.57 0.00 0.00 0.00 0.00 32.46 31.96 2i29 n ARG 58 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 2i29 h LEU 59 N 1.27 0.18 -0.07 0.55 3.38 -1.71 -1.48 115.31 117.43 2i29 h LEU 59 Ca 0.02 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2i29 h LEU 59 Cb 1.25 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2i29 h LEU 59 CO 0.15 0.12 -0.11 -0.67 0.09 0.00 0.00 178.44 178.03 2i29 n ASP 60 N -4.48 0.21 -0.00 -0.43 -0.08 -1.26 -3.44 116.55 107.07 2i29 n ASP 60 Ca 0.04 -0.08 0.07 0.00 -1.51 0.00 0.00 54.79 53.30 2i29 n ASP 60 Cb 0.25 -0.21 -0.10 0.00 2.34 0.00 0.00 41.12 43.40 2i29 n ASP 60 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2i29 n GLU 61 N -1.29 1.05 -4.49 -0.67 4.71 -0.60 -5.03 120.64 114.32 2i29 n GLU 61 Ca 0.11 -0.09 -0.33 0.00 -0.01 0.00 0.00 57.16 56.84 2i29 n GLU 61 Cb 0.30 -1.26 -0.10 0.00 -1.01 0.00 0.00 31.44 29.36 2i29 n GLU 61 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2i29 s ILE 62 N -2.73 3.72 -0.11 -3.67 1.01 -0.94 -4.58 121.20 113.90 2i29 s ILE 62 Ca -0.02 -0.66 0.00 0.00 0.00 0.00 0.00 60.65 59.97 2i29 s ILE 62 Cb 0.09 -2.59 -0.02 0.00 0.01 0.00 0.00 42.46 39.95 2i29 s ILE 62 CO 0.55 0.46 -0.12 0.00 0.00 0.00 0.00 174.94 175.83 2i29 s ALA 63 N -0.95 2.72 -0.07 9.38 0.00 -0.46 -4.26 121.76 128.12 2i29 s ALA 63 Ca 0.16 -0.90 -0.05 0.00 0.00 0.00 0.00 51.96 51.17 2i29 s ALA 63 Cb -0.11 -1.19 -0.04 0.00 0.00 0.00 0.00 23.12 21.78 2i29 s ALA 63 CO 0.06 0.36 0.15 -0.06 0.00 0.00 0.00 175.76 176.27 2i29 s PHE 64 N -0.05 3.55 0.00 0.00 0.08 0.56 -2.12 117.98 120.01 2i29 s PHE 64 Ca -0.02 0.44 0.04 0.00 0.12 0.00 0.00 56.93 57.50 2i29 s PHE 64 Cb -0.14 -1.88 -0.01 0.00 -0.57 0.00 0.00 43.02 40.42 2i29 s PHE 64 CO 0.04 0.69 -0.12 0.42 -0.10 0.00 0.00 175.22 176.15 2i29 s ILE 65 N -1.15 0.92 -0.07 0.64 1.09 -0.36 -1.75 121.20 120.52 2i29 s ILE 65 Ca 0.20 -0.61 0.05 0.00 -1.10 0.00 0.00 60.65 59.19 2i29 s ILE 65 Cb -0.12 -0.79 -0.01 0.00 -1.06 0.00 0.00 42.46 40.48 2i29 s ILE 65 CO 0.10 0.17 -0.24 -0.83 -0.10 0.00 0.00 174.94 174.05 2i29 s GLY 66 N -0.50 1.33 -0.16 6.18 0.00 -1.26 -1.18 107.32 111.73 2i29 s GLY 66 Ca 0.03 -1.02 -0.03 0.00 0.00 0.00 0.00 44.72 43.70 2i29 s GLY 66 CO -0.00 -0.57 -0.05 -0.42 0.00 0.00 0.00 173.10 172.06 2i29 s ILE 67 N -0.07 3.71 -0.33 0.90 1.01 0.95 -1.90 121.20 125.46 2i29 s ILE 67 Ca -0.06 -0.42 -0.12 0.00 0.00 0.00 0.00 60.65 60.05 2i29 s ILE 67 Cb -0.14 -2.63 -0.02 0.00 0.01 0.00 0.00 42.46 39.68 2i29 s ILE 67 CO 0.05 0.49 0.22 -2.28 0.00 0.00 0.00 174.94 173.42 2i29 s HIS 68 N 0.51 3.22 -0.97 3.97 5.65 0.10 -1.65 115.29 126.13 2i29 s HIS 68 Ca -0.04 -0.19 0.25 0.00 0.25 0.00 0.00 55.06 55.33 2i29 s HIS 68 Cb -0.15 -2.45 1.06 0.00 -1.18 0.00 0.00 32.58 29.86 2i29 s HIS 68 CO 0.03 -0.34 1.80 0.25 -0.65 0.00 0.00 174.74 175.83 2i29 n THR 69 N 5.09 0.30 0.00 0.89 -2.24 -0.98 -4.12 114.28 113.22 2i29 n THR 69 Ca -0.13 0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2i29 n THR 69 Cb 0.50 -0.64 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 2i29 n THR 69 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2i29 n GLY 73 N 1.09 -0.19 0.11 3.38 0.00 -1.26 -4.96 105.19 103.36 2i29 n GLY 73 Ca 0.06 0.12 -0.11 0.00 0.00 0.00 0.00 46.02 46.09 2i29 n GLY 73 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2i29 h PHE 74 N 0.00 0.27 0.00 1.61 3.57 -1.97 -2.97 116.94 117.45 2i29 h PHE 74 Ca 0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 2i29 h PHE 74 Cb 0.00 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 38.66 2i29 h PHE 74 CO 0.00 0.34 0.00 0.66 -2.23 0.00 0.00 178.31 177.08 2i29 n TYR 75 N -4.84 0.00 -3.68 0.41 4.01 -1.26 -4.58 117.16 107.21 2i29 n TYR 75 Ca -0.04 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.34 2i29 n TYR 75 Cb 0.13 -0.31 -0.07 0.00 -0.31 0.00 0.00 39.34 38.77 2i29 n TYR 75 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2i29 s ALA 76 N -2.63 3.69 0.00 -0.72 0.00 -1.12 -4.34 121.76 116.64 2i29 s ALA 76 Ca 0.19 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.58 2i29 s ALA 76 Cb 0.14 -2.22 0.00 0.00 0.00 0.00 0.00 23.12 21.04 2i29 s ALA 76 CO 0.33 0.25 0.00 -0.25 0.00 0.00 0.00 175.76 176.09 2i29 n ASP 77 N 3.13 0.00 -3.98 0.00 10.43 -1.26 -4.91 116.55 119.95 2i29 n ASP 77 Ca -0.15 0.00 -0.15 0.00 2.57 0.00 0.00 54.79 57.06 2i29 n ASP 77 Cb 0.53 0.00 -0.14 0.00 1.84 0.00 0.00 41.12 43.35 2i29 n ASP 77 CO 0.00 0.00 0.00 0.26 -1.07 0.00 0.00 177.20 176.39 2i29 s TRP 78 N 0.00 0.50 0.22 1.24 0.52 -0.80 -5.03 118.94 115.59 2i29 s TRP 78 Ca 0.00 -0.19 -0.07 0.00 0.02 0.00 0.00 56.10 55.86 2i29 s TRP 78 Cb 0.00 -0.32 -0.06 0.00 -1.15 0.00 0.00 33.47 31.94 2i29 s TRP 78 CO 0.00 -0.03 0.50 1.03 0.02 0.00 0.00 176.95 178.47 2i29 s ARG 79 N -0.50 3.69 0.29 4.98 0.52 -1.26 0.03 118.95 126.71 2i29 s ARG 79 Ca -0.01 0.08 0.03 0.00 -0.52 0.00 0.00 55.73 55.31 2i29 s ARG 79 Cb -0.04 -2.71 0.74 0.00 0.52 0.00 0.00 34.95 33.46 2i29 s ARG 79 CO -0.00 0.33 1.66 -1.35 0.02 0.00 0.00 175.30 175.96 2i29 h PRO 80 N 2.37 0.24 0.00 3.54 0.11 -1.94 -1.06 132.00 135.27 2i29 h PRO 80 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2i29 h PRO 80 Cb 1.17 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2i29 h PRO 80 CO 0.69 0.16 0.00 0.00 -0.21 0.00 0.00 178.00 178.64 2i29 n ALA 81 N -2.63 1.56 1.16 -0.75 0.00 -1.26 -1.59 120.51 116.99 2i29 n ALA 81 Ca 0.22 0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.86 2i29 n ALA 81 Cb 0.70 -1.33 0.22 0.00 0.00 0.00 0.00 19.45 19.05 2i29 n ALA 81 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2i29 n GLU 82 N -2.06 1.82 -0.27 0.00 1.02 -0.40 -4.57 120.64 116.18 2i29 n GLU 82 Ca 0.02 -1.38 0.08 0.00 -0.02 0.00 0.00 57.16 55.86 2i29 n GLU 82 Cb 0.18 -1.47 0.32 0.00 -0.02 0.00 0.00 31.44 30.45 2i29 n GLU 82 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2i29 h ALA 83 N 4.38 1.69 -0.24 0.62 0.00 -1.32 -1.11 119.26 123.28 2i29 h ALA 83 Ca 0.00 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2i29 h ALA 83 Cb 0.78 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2i29 h ALA 83 CO 0.00 0.12 -0.29 -0.44 0.00 0.00 0.00 179.25 178.64 2i29 h ASP 84 N 0.82 0.48 -0.17 0.00 3.32 -1.82 -1.05 116.42 118.00 2i29 h ASP 84 Ca 0.41 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 57.27 2i29 h ASP 84 Cb 0.46 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 2i29 h ASP 84 CO -0.17 0.76 0.07 0.11 -1.72 0.00 0.00 179.24 178.29 2i29 h LYS 85 N 0.41 0.26 -0.25 3.56 6.56 -1.55 -2.59 116.57 122.97 2i29 h LYS 85 Ca 0.05 -0.04 0.06 0.00 -1.06 0.00 0.00 60.65 59.66 2i29 h LYS 85 Cb 0.72 -0.04 -0.06 0.00 -0.57 0.00 0.00 32.23 32.28 2i29 h LYS 85 CO 0.06 0.33 -0.13 1.25 -2.06 0.00 0.00 179.45 178.90 2i29 h LEU 86 N 0.13 -0.42 -0.48 2.94 5.85 -1.16 0.27 115.31 122.43 2i29 h LEU 86 Ca 0.06 0.10 0.10 0.00 0.84 0.00 0.00 57.88 58.98 2i29 h LEU 86 Cb 0.16 0.23 -0.09 0.00 0.37 0.00 0.00 40.66 41.34 2i29 h LEU 86 CO -0.01 -0.16 -0.07 0.58 -0.34 0.00 0.00 178.44 178.44 2i29 h VAL 87 N -0.09 0.56 -0.28 1.05 2.07 -1.12 0.98 116.25 119.42 2i29 h VAL 87 Ca 0.14 -0.01 -0.02 0.00 0.82 0.00 0.00 66.70 67.63 2i29 h VAL 87 Cb 0.30 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 2i29 h VAL 87 CO -0.32 0.01 0.12 0.11 0.02 0.00 0.00 177.57 177.51 2i29 h LYS 88 N 0.04 0.42 -0.41 1.57 6.56 -1.03 -0.18 116.57 123.54 2i29 h LYS 88 Ca 0.24 -0.07 -0.11 0.00 -1.06 0.00 0.00 60.65 59.64 2i29 h LYS 88 Cb 0.36 -0.07 -0.01 0.00 -0.57 0.00 0.00 32.23 31.94 2i29 h LYS 88 CO -0.46 0.44 -0.18 -0.07 -2.06 0.00 0.00 179.45 177.12 2i29 h LEU 89 N 0.31 0.88 -0.70 2.94 3.38 -0.55 -1.76 115.31 119.81 2i29 h LEU 89 Ca 0.09 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 2i29 h LEU 89 Cb 0.17 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 2i29 h LEU 89 CO -0.01 1.08 0.41 0.25 0.09 0.00 0.00 178.44 180.26 2i29 h LEU 90 N 0.67 0.85 -0.55 1.67 6.46 -0.79 -0.92 115.31 122.69 2i29 h LEU 90 Ca 0.10 -0.07 0.03 0.00 -0.12 0.00 0.00 57.88 57.82 2i29 h LEU 90 Cb 0.74 -0.21 -0.04 0.00 -0.73 0.00 0.00 40.66 40.41 2i29 h LEU 90 CO 0.06 0.67 0.32 0.00 -0.62 0.00 0.00 178.44 178.87 2i29 h ALA 91 N 1.21 0.71 0.00 1.25 0.00 -0.80 -2.45 119.26 119.18 2i29 h ALA 91 Ca 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2i29 h ALA 91 Cb -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2i29 h ALA 91 CO -0.04 0.02 0.00 1.57 0.00 0.00 0.00 179.25 180.80 2i29 h LYS 92 N 0.63 0.00 -1.35 0.00 2.10 -0.97 -3.47 116.57 113.51 2i29 h LYS 92 Ca 0.23 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.72 2i29 h LYS 92 Cb 0.06 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.39 2i29 h LYS 92 CO -0.12 0.00 -0.21 0.41 -2.00 0.00 0.00 179.45 177.54 2i29 n GLY 93 N 0.79 0.10 2.82 0.07 0.00 -0.43 -4.95 105.19 103.58 2i29 n GLY 93 Ca 0.04 -0.53 -0.42 0.00 0.00 0.00 0.00 46.02 45.11 2i29 n GLY 93 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2i29 n GLU 94 N -1.81 3.56 -3.59 1.61 1.02 -0.72 -4.89 120.64 115.82 2i29 n GLU 94 Ca -0.08 -3.37 -0.14 0.00 -0.02 0.00 0.00 57.16 53.55 2i29 n GLU 94 Cb 0.56 -2.96 -0.06 0.00 -0.02 0.00 0.00 31.44 28.96 2i29 n GLU 94 CO 0.00 0.00 0.00 1.52 1.18 0.00 0.00 177.13 179.83 2i29 s TYR 95 N 0.73 -0.41 0.30 -0.32 -0.85 -1.26 -4.45 117.35 111.10 2i29 s TYR 95 Ca 0.42 0.49 0.10 0.00 -0.52 0.00 0.00 57.07 57.55 2i29 s TYR 95 Cb 0.11 0.32 -0.05 0.00 0.38 0.00 0.00 41.96 42.72 2i29 s TYR 95 CO -0.01 -0.61 -0.02 -0.65 -1.52 0.00 0.00 175.55 172.73 2i29 s GLN 96 N -2.24 2.10 -0.15 -3.49 1.11 1.09 -4.91 119.66 113.17 2i29 s GLN 96 Ca -0.06 -1.62 -0.05 0.00 0.01 0.00 0.00 55.36 53.64 2i29 s GLN 96 Cb -0.01 -2.00 -0.03 0.00 -1.01 0.00 0.00 33.01 29.96 2i29 s GLN 96 CO -0.00 0.25 0.00 0.15 0.01 0.00 0.00 175.29 175.70 2i29 s LYS 97 N -3.67 3.68 -0.09 2.91 1.02 -1.26 -0.55 119.74 121.77 2i29 s LYS 97 Ca 0.33 -0.44 0.02 0.00 0.02 0.00 0.00 55.97 55.90 2i29 s LYS 97 Cb -0.03 -3.00 -0.02 0.00 -0.52 0.00 0.00 37.83 34.26 2i29 s LYS 97 CO 0.19 0.32 -0.15 0.08 -0.92 0.00 0.00 175.35 174.87 2i29 s VAL 98 N 0.17 2.89 -0.16 3.17 1.01 -0.68 -4.96 120.40 121.84 2i29 s VAL 98 Ca 0.01 -0.75 -0.02 0.00 0.00 0.00 0.00 61.98 61.22 2i29 s VAL 98 Cb -0.13 -2.16 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 2i29 s VAL 98 CO 0.02 0.56 -0.08 -0.44 0.00 0.00 0.00 175.10 175.16 2i29 s SER 99 N -0.10 4.37 -0.05 3.32 0.01 -1.26 -0.41 113.70 119.58 2i29 s SER 99 Ca -0.02 -0.26 -0.01 0.00 1.31 0.00 0.00 55.95 56.96 2i29 s SER 99 Cb -0.14 -1.70 -0.04 0.00 0.21 0.00 0.00 66.02 64.35 2i29 s SER 99 CO 0.04 0.13 0.04 -0.31 0.41 0.00 0.00 173.24 173.54 2i29 s TYR 100 N 0.58 3.22 0.65 2.43 2.02 -0.61 -4.86 117.35 120.77 2i29 s TYR 100 Ca -0.05 0.21 -0.15 0.00 -0.37 0.00 0.00 57.07 56.70 2i29 s TYR 100 Cb -0.15 -1.76 -0.00 0.00 -0.40 0.00 0.00 41.96 39.64 2i29 s TYR 100 CO 0.03 0.52 1.10 -2.14 -1.57 0.00 0.00 175.55 173.49 2i29 s PRO 101 N -1.26 2.86 0.32 -1.71 0.02 -1.26 -2.04 135.00 131.92 2i29 s PRO 101 Ca 0.17 1.37 0.07 0.00 0.02 0.00 0.00 61.00 62.64 2i29 s PRO 101 Cb -0.12 -1.96 -0.06 0.00 0.02 0.00 0.00 34.50 32.38 2i29 s PRO 101 CO 0.07 -1.20 -0.05 -0.51 -0.33 0.00 0.00 177.00 174.97 2i29 s LEU 102 N -4.83 2.60 -0.14 -5.54 1.43 -1.25 -4.68 118.68 106.28 2i29 s LEU 102 Ca 0.67 -1.23 -0.04 0.00 -1.03 0.00 0.00 54.13 52.49 2i29 s LEU 102 Cb -0.20 -0.78 -0.03 0.00 0.03 0.00 0.00 46.19 45.20 2i29 s LEU 102 CO 0.41 -0.33 0.01 -0.22 0.23 0.00 0.00 176.35 176.45 2i29 s LEU 103 N -3.54 3.56 -0.20 1.79 2.96 -0.94 -0.34 118.68 121.97 2i29 s LEU 103 Ca 0.32 0.04 -0.12 0.00 -0.22 0.00 0.00 54.13 54.15 2i29 s LEU 103 Cb 0.04 -1.86 -0.05 0.00 0.50 0.00 0.00 46.19 44.83 2i29 s LEU 103 CO 0.15 0.24 0.23 -0.75 -1.32 0.00 0.00 176.35 174.90 2i29 s LYS 104 N -0.06 4.16 -0.16 1.98 2.20 0.12 -1.50 119.74 126.49 2i29 s LYS 104 Ca 0.04 -0.08 -0.02 0.00 -0.36 0.00 0.00 55.97 55.55 2i29 s LYS 104 Cb -0.13 -3.49 -0.02 0.00 -1.51 0.00 0.00 37.83 32.69 2i29 s LYS 104 CO 0.02 0.14 -0.08 0.99 -0.36 0.00 0.00 175.35 176.06 2i29 s THR 105 N 0.81 3.45 -0.13 3.43 2.01 -0.39 -1.97 115.64 122.86 2i29 s THR 105 Ca 0.12 -0.51 0.02 0.00 0.31 0.00 0.00 61.69 61.63 2i29 s THR 105 Cb -0.13 -2.50 -0.00 0.00 0.01 0.00 0.00 72.50 69.88 2i29 s THR 105 CO 0.03 0.49 -0.19 -0.89 -0.69 0.00 0.00 174.62 173.38 2i29 s THR 106 N 0.55 2.46 -0.19 -0.82 2.01 0.07 -0.68 115.64 119.04 2i29 s THR 106 Ca -0.05 -0.86 -0.02 0.00 0.31 0.00 0.00 61.69 61.06 2i29 s THR 106 Cb -0.15 -2.00 -0.01 0.00 0.01 0.00 0.00 72.50 70.36 2i29 s THR 106 CO 0.03 0.54 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.72 2i29 s VAL 107 N 0.54 3.13 -0.04 3.82 1.01 0.10 -0.78 120.40 128.19 2i29 s VAL 107 Ca -0.12 -0.59 0.01 0.00 0.00 0.00 0.00 61.98 61.28 2i29 s VAL 107 Cb -0.16 -2.39 -0.03 0.00 0.00 0.00 0.00 36.38 33.80 2i29 s VAL 107 CO 0.04 0.47 -0.03 -0.54 0.00 0.00 0.00 175.10 175.03 2i29 s LYS 108 N 1.15 2.76 -0.08 2.72 1.02 -0.24 -0.33 119.74 126.75 2i29 s LYS 108 Ca 0.01 -0.57 0.00 0.00 0.02 0.00 0.00 55.97 55.43 2i29 s LYS 108 Cb -0.14 -2.64 -0.05 0.00 -0.52 0.00 0.00 37.83 34.48 2i29 s LYS 108 CO -0.02 0.65 -0.07 0.66 -0.92 0.00 0.00 175.35 175.65 2i29 n TYR 109 N 1.83 0.00 -4.94 3.18 4.01 -1.26 -0.21 117.16 119.77 2i29 n TYR 109 Ca -0.17 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.25 2i29 n TYR 109 Cb 0.53 -0.29 -0.16 0.00 -0.31 0.00 0.00 39.34 39.11 2i29 n TYR 109 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 2i29 s GLU 115 N -2.15 3.18 -0.08 -0.72 2.02 -1.25 -4.67 118.70 115.02 2i29 s GLU 115 Ca -0.10 -0.80 0.04 0.00 0.02 0.00 0.00 54.97 54.13 2i29 s GLU 115 Cb 0.03 -2.46 -0.01 0.00 0.10 0.00 0.00 34.13 31.79 2i29 s GLU 115 CO 0.17 0.15 -0.23 0.00 0.02 0.00 0.00 175.26 175.38 2i29 s ALA 116 N 0.44 2.25 -0.06 5.21 0.00 0.56 -4.96 121.76 125.20 2i29 s ALA 116 Ca -0.14 -1.00 0.04 0.00 0.00 0.00 0.00 51.96 50.87 2i29 s ALA 116 Cb -0.17 -0.81 -0.02 0.00 0.00 0.00 0.00 23.12 22.12 2i29 s ALA 116 CO 0.06 0.35 -0.16 0.99 0.00 0.00 0.00 175.76 177.00 2i29 s THR 117 N 0.07 2.90 0.06 0.00 2.01 -1.26 0.02 115.64 119.44 2i29 s THR 117 Ca -0.10 -0.77 0.05 0.00 0.31 0.00 0.00 61.69 61.18 2i29 s THR 117 Cb -0.16 -2.13 -0.03 0.00 0.01 0.00 0.00 72.50 70.20 2i29 s THR 117 CO 0.06 0.58 -0.15 -0.31 -0.69 0.00 0.00 174.62 174.11 2i29 s TYR 118 N -0.57 1.30 -0.14 4.92 2.02 0.15 -5.00 117.35 120.03 2i29 s TYR 118 Ca 0.08 -0.42 -0.04 0.00 -0.37 0.00 0.00 57.07 56.32 2i29 s TYR 118 Cb -0.11 -0.74 -0.03 0.00 -0.40 0.00 0.00 41.96 40.67 2i29 s TYR 118 CO 0.01 0.07 -0.01 -0.51 -1.57 0.00 0.00 175.55 173.54 2i29 s LEU 119 N -1.53 3.43 -0.06 -1.29 1.43 -1.26 -1.26 118.68 118.14 2i29 s LEU 119 Ca 0.00 -0.03 0.04 0.00 -1.03 0.00 0.00 54.13 53.12 2i29 s LEU 119 Cb -0.09 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.28 2i29 s LEU 119 CO 0.02 0.22 -0.18 0.00 0.23 0.00 0.00 176.35 176.64 2i29 s ALA 120 N 0.08 2.49 -0.10 4.21 0.00 -0.56 -4.90 121.76 122.98 2i29 s ALA 120 Ca 0.01 -1.00 0.12 0.00 0.00 0.00 0.00 51.96 51.09 2i29 s ALA 120 Cb -0.13 -0.89 -0.24 0.00 0.00 0.00 0.00 23.12 21.86 2i29 s ALA 120 CO 0.02 0.47 0.43 -0.11 0.00 0.00 0.00 175.76 176.57 2i29 n LEU 121 N 2.66 0.92 0.00 0.00 7.94 -1.26 -2.22 117.00 125.05 2i29 n LEU 121 Ca -0.17 0.25 0.00 0.00 -1.11 0.00 0.00 56.01 54.98 2i29 n LEU 121 Cb 0.52 0.07 0.00 0.00 0.53 0.00 0.00 43.42 44.54 2i29 n LEU 121 CO 0.26 0.49 0.00 0.59 -1.11 0.00 0.00 177.39 177.62 2i29 n ASN 122 N -3.02 0.00 -3.77 1.96 3.02 -1.26 -4.00 115.26 108.20 2i29 n ASN 122 Ca -0.24 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.22 2i29 n ASN 122 Cb 1.08 -0.36 -0.02 0.00 -0.61 0.00 0.00 39.78 39.87 2i29 n ASN 122 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 2i29 s GLU 123 N -0.74 1.62 -0.07 3.52 1.03 -1.26 -1.32 118.70 121.48 2i29 s GLU 123 Ca 0.00 -0.89 0.01 0.00 0.03 0.00 0.00 54.97 54.13 2i29 s GLU 123 Cb 0.00 0.59 0.02 0.00 -0.80 0.00 0.00 34.13 33.93 2i29 s GLU 123 CO 0.00 -0.73 -0.09 0.45 -1.33 0.00 0.00 175.26 173.56 2i29 s SER 124 N -2.89 1.68 0.29 0.83 0.15 0.43 -1.46 113.70 112.73 2i29 s SER 124 Ca 0.10 -0.26 0.11 0.00 0.70 0.00 0.00 55.95 56.60 2i29 s SER 124 Cb -0.04 -0.74 -0.05 0.00 -1.71 0.00 0.00 66.02 63.48 2i29 s SER 124 CO 0.02 -0.02 -0.17 0.42 1.20 0.00 0.00 173.24 174.68 2i29 s THR 125 N 0.97 2.36 -0.03 6.45 -4.23 -0.72 -0.64 115.64 119.80 2i29 s THR 125 Ca -0.09 -2.35 0.01 0.00 -1.18 0.00 0.00 61.69 58.08 2i29 s THR 125 Cb -0.15 -2.36 0.02 0.00 1.34 0.00 0.00 72.50 71.35 2i29 s THR 125 CO 0.00 -0.37 -0.03 0.68 -0.54 0.00 0.00 174.62 174.36 2i29 s VAL 126 N -2.57 0.39 0.22 2.29 -7.23 -0.26 -1.00 120.40 112.24 2i29 s VAL 126 Ca 0.30 -0.10 -0.00 0.00 -1.81 0.00 0.00 61.98 60.37 2i29 s VAL 126 Cb -0.03 -0.41 -0.04 0.00 0.56 0.00 0.00 36.38 36.46 2i29 s VAL 126 CO 0.15 0.17 0.11 -0.54 -0.31 0.00 0.00 175.10 174.67 2i29 s LYS 127 N 0.60 1.26 1.00 4.82 1.02 -0.71 -1.13 119.74 126.61 2i29 s LYS 127 Ca -0.07 -1.67 -0.16 0.00 0.02 0.00 0.00 55.97 54.09 2i29 s LYS 127 Cb -0.10 0.06 0.20 0.00 -0.52 0.00 0.00 37.83 37.46 2i29 s LYS 127 CO -0.00 -0.34 1.22 -1.54 -0.92 0.00 0.00 175.35 173.76 2i29 s SER 128 N -3.21 2.75 0.00 2.83 1.04 -1.26 -0.80 113.70 115.05 2i29 s SER 128 Ca 0.38 0.55 0.19 0.00 0.48 0.00 0.00 55.95 57.55 2i29 s SER 128 Cb 0.07 -0.79 0.73 0.00 0.10 0.00 0.00 66.02 66.13 2i29 s SER 128 CO 0.12 -2.98 1.52 -1.54 0.98 0.00 0.00 173.24 171.34 2i29 n SER 129 N -3.98 1.53 -0.49 7.02 3.41 -1.17 -3.66 113.62 116.27 2i29 n SER 129 Ca 0.12 -1.72 0.00 0.00 -0.26 0.00 0.00 58.87 57.02 2i29 n SER 129 Cb 0.60 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 2i29 n SER 129 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2i29 n GLY 130 N 1.09 0.42 0.00 5.00 0.00 -1.26 -5.03 105.19 105.40 2i29 n GLY 130 Ca 0.15 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.62 2i29 n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i29 n GLY 131 N -0.31 0.99 3.71 -0.02 0.00 -1.26 -5.17 105.19 103.14 2i29 n GLY 131 Ca 0.00 -0.76 -0.42 0.00 0.00 0.00 0.00 46.02 44.84 2i29 n GLY 131 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2i29 s PRO 132 N -0.30 4.32 -0.26 1.61 0.02 -1.26 -4.73 135.00 134.41 2i29 s PRO 132 Ca 0.00 2.06 -0.17 0.00 0.02 0.00 0.00 61.00 62.91 2i29 s PRO 132 Cb 0.00 -3.29 -0.03 0.00 0.02 0.00 0.00 34.50 31.20 2i29 s PRO 132 CO 0.00 -0.45 0.47 0.12 -0.33 0.00 0.00 177.00 176.82 2i29 s PHE 133 N 1.24 3.26 -0.08 6.54 5.36 -1.24 -4.92 117.98 128.14 2i29 s PHE 133 Ca 0.64 0.57 -0.03 0.00 -0.96 0.00 0.00 56.93 57.16 2i29 s PHE 133 Cb -0.36 -2.68 0.04 0.00 -0.34 0.00 0.00 43.02 39.69 2i29 s PHE 133 CO 0.30 -0.26 0.15 0.08 -1.46 0.00 0.00 175.22 174.03 2i29 s VAL 134 N 2.22 -0.22 0.03 3.12 1.01 -1.26 -2.63 120.40 122.67 2i29 s VAL 134 Ca 0.19 0.34 -0.00 0.00 0.00 0.00 0.00 61.98 62.51 2i29 s VAL 134 Cb -0.16 -0.27 -0.03 0.00 0.00 0.00 0.00 36.38 35.92 2i29 s VAL 134 CO 0.09 0.14 -0.03 0.68 0.00 0.00 0.00 175.10 175.98 2i29 s VAL 135 N 2.14 0.20 -0.13 2.92 -7.23 -0.24 -3.47 120.40 114.59 2i29 s VAL 135 Ca 0.02 -1.26 -0.17 0.00 -1.81 0.00 0.00 61.98 58.75 2i29 s VAL 135 Cb -0.12 -0.76 -0.04 0.00 0.56 0.00 0.00 36.38 36.02 2i29 s VAL 135 CO -0.05 -0.68 0.44 -1.81 -0.31 0.00 0.00 175.10 172.69 2i29 s ASP 136 N -2.02 6.63 -0.30 4.85 -0.00 0.63 0.36 116.67 126.81 2i29 s ASP 136 Ca -0.07 0.75 -0.12 0.00 -0.00 0.00 0.00 52.55 53.11 2i29 s ASP 136 Cb -0.03 -2.27 -0.04 0.00 -0.00 0.00 0.00 42.92 40.58 2i29 s ASP 136 CO -0.04 0.01 0.21 -0.69 -0.00 0.00 0.00 175.17 174.66 2i29 s VAL 137 N 0.64 5.27 -0.15 -1.27 1.01 0.37 -0.91 120.40 125.35 2i29 s VAL 137 Ca 0.24 0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.24 2i29 s VAL 137 Cb -0.15 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.65 2i29 s VAL 137 CO 0.09 0.16 -0.18 -0.69 0.00 0.00 0.00 175.10 174.48 2i29 s VAL 138 N 1.74 2.42 -0.26 2.92 1.01 -0.16 -0.39 120.40 127.69 2i29 s VAL 138 Ca 0.07 -0.85 -0.01 0.00 0.00 0.00 0.00 61.98 61.18 2i29 s VAL 138 Cb -0.17 -2.00 0.03 0.00 0.00 0.00 0.00 36.38 34.24 2i29 s VAL 138 CO 0.11 0.53 -0.06 -0.63 0.00 0.00 0.00 175.10 175.05 2i29 s ILE 139 N 0.86 2.82 -1.37 2.22 1.01 0.14 -0.20 121.20 126.68 2i29 s ILE 139 Ca -0.05 -1.13 -0.03 0.00 0.00 0.00 0.00 60.65 59.43 2i29 s ILE 139 Cb -0.15 -2.47 -0.00 0.00 0.01 0.00 0.00 42.46 39.84 2i29 s ILE 139 CO -0.02 0.14 0.47 0.59 0.00 0.00 0.00 174.94 176.12 2i29 n ASN 140 N 4.64 -0.96 0.00 3.58 3.02 0.22 -1.44 115.26 124.31 2i29 n ASN 140 Ca -0.16 -1.01 0.00 0.00 -0.03 0.00 0.00 54.58 53.39 2i29 n ASN 140 Cb 0.46 -3.11 0.00 0.00 -0.61 0.00 0.00 39.78 36.52 2i29 n ASN 140 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2i29 n ASP 141 N -2.94 0.00 -4.72 6.41 8.00 -1.26 -4.99 116.55 117.04 2i29 n ASP 141 Ca -0.28 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 54.85 2i29 n ASP 141 Cb 0.67 -0.78 -0.07 0.00 -0.02 0.00 0.00 41.12 40.93 2i29 n ASP 141 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2i29 s ILE 142 N -2.55 5.32 -0.34 0.53 -4.36 -0.52 -5.03 121.20 114.24 2i29 s ILE 142 Ca 0.00 0.49 -0.29 0.00 -0.26 0.00 0.00 60.65 60.60 2i29 s ILE 142 Cb 0.00 -3.61 -0.01 0.00 1.25 0.00 0.00 42.46 40.09 2i29 s ILE 142 CO 0.00 0.39 1.56 -2.28 0.24 0.00 0.00 174.94 174.84 2i29 s HIS 143 N 0.52 2.19 -0.20 1.37 5.65 -1.26 -0.68 115.29 122.88 2i29 s HIS 143 Ca 0.15 0.65 -0.11 0.00 0.25 0.00 0.00 55.06 56.00 2i29 s HIS 143 Cb -0.13 -4.16 -0.20 0.00 -1.18 0.00 0.00 32.58 26.91 2i29 s HIS 143 CO 0.03 -2.43 0.10 0.34 -0.65 0.00 0.00 174.74 172.13 2i29 n PHE 144 N 9.10 0.77 -3.47 3.88 7.35 0.48 -4.98 117.46 130.59 2i29 n PHE 144 Ca 0.19 0.23 -0.12 0.00 -0.76 0.00 0.00 57.45 56.99 2i29 n PHE 144 Cb 0.47 -1.09 -0.03 0.00 0.35 0.00 0.00 39.48 39.18 2i29 n PHE 144 CO 0.00 0.00 0.00 -1.83 -0.76 0.00 0.00 176.76 174.17 2i29 s GLU 145 N -2.48 1.06 -0.37 -4.13 -1.05 -1.13 -5.02 118.70 105.59 2i29 s GLU 145 Ca -0.29 -0.28 -0.12 0.00 -0.15 0.00 0.00 54.97 54.13 2i29 s GLU 145 Cb 0.08 0.49 0.02 0.00 -0.44 0.00 0.00 34.13 34.28 2i29 s GLU 145 CO 0.64 -0.44 0.22 0.50 0.95 0.00 0.00 175.26 177.12 2i29 s ARG 146 N -3.03 3.00 -0.14 -4.83 3.52 -1.26 -0.48 118.95 115.73 2i29 s ARG 146 Ca 0.00 -0.97 -0.22 0.00 -0.13 0.00 0.00 55.73 54.42 2i29 s ARG 146 Cb -0.01 -3.75 -0.03 0.00 -1.56 0.00 0.00 34.95 29.60 2i29 s ARG 146 CO -0.08 -0.64 0.65 0.12 -0.81 0.00 0.00 175.30 174.55 2i29 s PHE 147 N 1.60 3.46 -0.05 5.12 2.19 0.16 -4.64 117.98 125.82 2i29 s PHE 147 Ca 0.03 1.06 0.05 0.00 0.33 0.00 0.00 56.93 58.40 2i29 s PHE 147 Cb -0.19 -2.79 -0.01 0.00 -1.31 0.00 0.00 43.02 38.73 2i29 s PHE 147 CO 0.08 -0.05 -0.21 1.03 1.83 0.00 0.00 175.22 177.89 2i29 s ARG 148 N 1.41 2.09 0.00 10.12 0.52 -1.26 -1.08 118.95 130.75 2i29 s ARG 148 Ca 0.32 -0.75 0.00 0.00 -0.52 0.00 0.00 55.73 54.78 2i29 s ARG 148 Cb -0.16 -1.81 0.00 0.00 0.52 0.00 0.00 34.95 33.49 2i29 s ARG 148 CO 0.13 0.33 0.00 0.41 0.02 0.00 0.00 175.30 176.18 2i29 n GLY 149 N 2.99 -0.50 0.10 -3.53 0.00 -1.08 -0.66 105.19 102.51 2i29 n GLY 149 Ca -0.17 -0.98 -0.12 0.00 0.00 0.00 0.00 46.02 44.74 2i29 n GLY 149 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2i29 h ASP 150 N 0.00 0.15 0.00 1.61 3.32 -0.97 -3.30 116.42 117.23 2i29 h ASP 150 Ca 0.00 -0.29 0.00 0.00 0.02 0.00 0.00 57.03 56.76 2i29 h ASP 150 Cb 0.00 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.50 2i29 h ASP 150 CO 0.00 1.25 0.00 0.61 -1.72 0.00 0.00 179.24 179.38 2i29 n GLY 151 N 1.64 -1.59 3.12 2.75 0.00 -1.18 -4.32 105.19 105.60 2i29 n GLY 151 Ca -0.18 -1.10 -0.14 0.00 0.00 0.00 0.00 46.02 44.60 2i29 n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i29 s LEU 152 N 0.00 2.32 -0.07 0.99 1.43 -0.28 -1.33 118.68 121.75 2i29 s LEU 152 Ca 0.00 -0.67 0.02 0.00 -1.03 0.00 0.00 54.13 52.45 2i29 s LEU 152 Cb 0.00 -0.24 0.01 0.00 0.03 0.00 0.00 46.19 45.99 2i29 s LEU 152 CO 0.00 -0.23 -0.13 0.00 0.23 0.00 0.00 176.35 176.23 2i29 s MET 154 N 0.63 3.18 0.07 0.00 1.75 0.18 -0.52 119.30 124.59 2i29 s MET 154 Ca -0.14 -0.73 0.08 0.00 -1.25 0.00 0.00 55.69 53.64 2i29 s MET 154 Cb -0.16 -2.82 -0.04 0.00 2.84 0.00 0.00 34.83 34.66 2i29 s MET 154 CO 0.04 -0.21 -0.18 0.45 -0.65 0.00 0.00 175.02 174.47 2i29 s SER 155 N 1.39 3.85 0.88 1.11 0.15 -0.25 -0.43 113.70 120.40 2i29 s SER 155 Ca 0.05 -0.47 -0.14 0.00 0.70 0.00 0.00 55.95 56.09 2i29 s SER 155 Cb -0.14 -0.60 0.13 0.00 -1.71 0.00 0.00 66.02 63.71 2i29 s SER 155 CO -0.08 0.22 1.22 0.42 1.20 0.00 0.00 173.24 176.23 2i29 s THR 156 N -1.01 1.99 0.22 6.45 -4.23 -0.44 -1.23 115.64 117.39 2i29 s THR 156 Ca 0.16 0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 60.59 2i29 s THR 156 Cb -0.11 -2.96 0.18 0.00 1.34 0.00 0.00 72.50 70.96 2i29 s THR 156 CO 0.07 0.00 1.84 -0.65 -0.54 0.00 0.00 174.62 175.34 2i29 h PRO 157 N -1.35 1.17 0.00 3.99 0.11 -1.83 -2.26 132.00 131.83 2i29 h PRO 157 Ca -0.46 -0.14 -0.01 0.00 0.11 0.00 0.00 66.00 65.50 2i29 h PRO 157 Cb 1.30 -0.23 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 2i29 h PRO 157 CO 0.55 0.86 -0.04 0.66 -0.21 0.00 0.00 178.00 179.82 2i29 h SER 158 N 1.16 0.00 0.90 -2.05 4.64 -1.82 -2.81 113.55 113.57 2i29 h SER 158 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 2i29 h SER 158 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 2i29 h SER 158 CO -0.05 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2i29 n GLY 159 N 0.50 -1.37 0.27 -0.77 0.00 -0.88 -3.91 105.19 99.03 2i29 n GLY 159 Ca 0.02 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.11 2i29 n GLY 159 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2i29 h THR 160 N 0.00 0.63 -0.00 2.61 1.35 -1.19 0.42 112.91 116.73 2i29 h THR 160 Ca 0.00 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 2i29 h THR 160 Cb 0.45 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.09 2i29 h THR 160 CO 0.00 0.08 -0.02 0.35 -0.25 0.00 0.00 175.52 175.69 2i29 n THR 161 N -3.81 0.00 0.00 6.82 -2.24 -1.25 -2.18 114.28 111.62 2i29 n THR 161 Ca -0.02 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2i29 n THR 161 Cb 0.18 -0.47 0.00 0.00 -2.10 0.00 0.00 70.33 67.94 2i29 n THR 161 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2i29 n ALA 162 N -1.43 0.00 -0.23 6.98 0.00 0.14 -4.64 120.51 121.33 2i29 n ALA 162 Ca 0.09 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.55 2i29 n ALA 162 Cb 0.31 0.00 0.13 0.00 0.00 0.00 0.00 19.45 19.89 2i29 n ALA 162 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2i29 h TYR 163 N 0.00 0.48 -0.87 0.00 5.03 -1.87 -1.02 116.97 118.72 2i29 h TYR 163 Ca 0.00 0.03 0.18 0.00 2.58 0.00 0.00 58.73 61.52 2i29 h TYR 163 Cb 0.00 -0.12 -0.17 0.00 1.55 0.00 0.00 36.73 38.00 2i29 h TYR 163 CO 0.00 0.13 -0.19 -0.97 -1.32 0.00 0.00 178.16 175.81 2i29 h ASN 164 N 0.47 -0.76 -0.39 -2.11 -1.24 -1.79 -2.13 115.58 107.63 2i29 h ASN 164 Ca 0.34 0.26 -0.01 0.00 0.71 0.00 0.00 56.30 57.60 2i29 h ASN 164 Cb 0.42 0.53 -0.02 0.00 0.73 0.00 0.00 38.32 39.98 2i29 h ASN 164 CO -0.32 -0.29 0.21 0.50 -1.29 0.00 0.00 177.43 176.25 2i29 h LYS 165 N 0.01 0.54 -0.08 6.67 3.64 -0.68 -0.46 116.57 126.20 2i29 h LYS 165 Ca 0.43 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.77 2i29 h LYS 165 Cb 0.69 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.40 2i29 h LYS 165 CO -0.89 0.44 0.08 0.77 -2.27 0.00 0.00 179.45 177.58 2i29 h SER 166 N 0.50 0.00 -0.38 4.20 0.02 -1.34 -1.72 113.55 114.83 2i29 h SER 166 Ca 0.14 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 2i29 h SER 166 Cb 0.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.60 2i29 h SER 166 CO -0.02 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 175.85 2i29 n LEU 167 N -4.08 2.62 0.00 5.07 4.77 -0.57 -4.92 117.00 119.90 2i29 n LEU 167 Ca -0.01 -1.21 0.00 0.00 -0.03 0.00 0.00 56.01 54.76 2i29 n LEU 167 Cb 0.18 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 2i29 n LEU 167 CO 0.30 0.61 0.00 0.61 -1.33 0.00 0.00 177.39 177.58 2i29 n GLY 168 N 1.31 0.80 3.78 -0.72 0.00 -0.64 -4.73 105.19 104.99 2i29 n GLY 168 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 2i29 n GLY 168 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2i29 s GLY 169 N -1.97 1.92 0.45 -0.02 0.00 -0.29 -4.86 107.32 102.55 2i29 s GLY 169 Ca 0.00 0.38 -0.22 0.00 0.00 0.00 0.00 44.72 44.88 2i29 s GLY 169 CO 0.00 0.72 1.03 0.00 0.00 0.00 0.00 173.10 174.85 2i29 s ALA 170 N -2.63 2.96 -0.13 3.20 0.00 -1.26 -4.56 121.76 119.34 2i29 s ALA 170 Ca 0.63 0.62 -0.22 0.00 0.00 0.00 0.00 51.96 52.99 2i29 s ALA 170 Cb -0.18 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 2i29 s ALA 170 CO 0.48 -0.24 0.66 -0.51 0.00 0.00 0.00 175.76 176.15 2i29 s LEU 171 N -3.18 4.24 -0.08 0.00 1.43 -1.26 -4.84 118.68 115.00 2i29 s LEU 171 Ca 0.64 1.03 0.02 0.00 -1.03 0.00 0.00 54.13 54.79 2i29 s LEU 171 Cb -0.18 -2.99 -0.02 0.00 0.03 0.00 0.00 46.19 43.03 2i29 s LEU 171 CO 0.22 -0.18 -0.12 -0.04 0.23 0.00 0.00 176.35 176.45 2i29 s MET 172 N 1.28 2.79 0.15 1.70 -1.94 -1.26 -5.10 119.30 116.92 2i29 s MET 172 Ca 0.33 -0.66 -0.31 0.00 -1.71 0.00 0.00 55.69 53.34 2i29 s MET 172 Cb -0.17 -2.49 -0.09 0.00 2.01 0.00 0.00 34.83 34.09 2i29 s MET 172 CO 0.14 0.52 1.47 -1.58 -0.01 0.00 0.00 175.02 175.56 2i29 s HIS 173 N -0.45 3.14 -2.00 -0.03 2.46 -1.26 -4.63 115.29 112.52 2i29 s HIS 173 Ca 0.06 0.82 0.09 0.00 0.47 0.00 0.00 55.06 56.50 2i29 s HIS 173 Cb -0.12 -3.80 0.56 0.00 -0.13 0.00 0.00 32.58 29.09 2i29 s HIS 173 CO 0.02 -2.86 0.99 -0.35 -2.47 0.00 0.00 174.74 170.07 2i29 n PRO 174 N 3.76 0.44 0.04 2.88 -0.05 -1.26 -1.19 135.00 139.62 2i29 n PRO 174 Ca 0.12 0.00 0.14 0.00 -0.05 0.00 0.00 63.50 63.71 2i29 n PRO 174 Cb 0.40 -1.33 0.54 0.00 -0.05 0.00 0.00 33.50 33.06 2i29 n PRO 174 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 175.50 174.32 2i29 n SER 175 N -0.83 0.30 -4.62 3.54 3.41 -1.26 -4.30 113.62 109.86 2i29 n SER 175 Ca 0.07 0.52 -0.41 0.00 -0.26 0.00 0.00 58.87 58.78 2i29 n SER 175 Cb 0.03 -0.59 -0.06 0.00 -0.26 0.00 0.00 64.21 63.33 2i29 n SER 175 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2i29 s ILE 176 N -3.04 4.91 -0.98 -1.33 1.01 -0.33 -5.00 121.20 116.44 2i29 s ILE 176 Ca 0.13 1.09 -0.23 0.00 0.00 0.00 0.00 60.65 61.63 2i29 s ILE 176 Cb 0.17 -4.02 0.05 0.00 0.01 0.00 0.00 42.46 38.67 2i29 s ILE 176 CO 0.56 -0.10 1.41 -1.61 0.00 0.00 0.00 174.94 175.19 2i29 s GLU 177 N 2.68 3.55 0.30 2.79 2.02 -1.26 -4.79 118.70 123.97 2i29 s GLU 177 Ca 0.28 -1.07 -0.10 0.00 0.02 0.00 0.00 54.97 54.10 2i29 s GLU 177 Cb -0.15 -5.20 0.01 0.00 0.10 0.00 0.00 34.13 28.88 2i29 s GLU 177 CO 0.10 -2.17 0.52 0.00 0.02 0.00 0.00 175.26 173.74 2i29 s ALA 178 N 4.90 -0.03 0.04 5.21 0.00 -1.26 -2.91 121.76 127.71 2i29 s ALA 178 Ca 0.44 -1.04 0.01 0.00 0.00 0.00 0.00 51.96 51.36 2i29 s ALA 178 Cb -0.01 1.04 -0.03 0.00 0.00 0.00 0.00 23.12 24.12 2i29 s ALA 178 CO -0.07 -0.86 -0.05 0.00 0.00 0.00 0.00 175.76 174.78 2i29 s MET 179 N -3.50 0.45 -0.06 0.00 0.23 -0.82 -4.17 119.30 111.43 2i29 s MET 179 Ca 0.24 -0.79 0.01 0.00 -1.03 0.00 0.00 55.69 54.12 2i29 s MET 179 Cb -0.01 -0.01 0.02 0.00 -1.53 0.00 0.00 34.83 33.29 2i29 s MET 179 CO 0.13 -0.03 -0.09 -1.14 -2.03 0.00 0.00 175.02 171.86 2i29 s GLN 180 N -2.02 1.34 -0.23 3.16 0.74 -0.37 -0.80 119.66 121.49 2i29 s GLN 180 Ca -0.09 -0.27 -0.10 0.00 0.05 0.00 0.00 55.36 54.95 2i29 s GLN 180 Cb -0.06 -1.21 -0.05 0.00 1.10 0.00 0.00 33.01 32.79 2i29 s GLN 180 CO -0.02 -0.05 0.14 -1.17 -0.55 0.00 0.00 175.29 173.63 2i29 s LEU 181 N 0.91 4.02 0.17 3.68 2.96 0.54 -1.10 118.68 129.87 2i29 s LEU 181 Ca -0.11 0.08 0.11 0.00 -0.22 0.00 0.00 54.13 54.00 2i29 s LEU 181 Cb -0.15 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.43 2i29 s LEU 181 CO 0.01 0.08 -0.24 0.42 -1.32 0.00 0.00 176.35 175.29 2i29 s THR 182 N 0.99 2.25 0.14 3.68 -4.23 0.32 -1.76 115.64 117.02 2i29 s THR 182 Ca 0.07 -1.92 -0.11 0.00 -1.18 0.00 0.00 61.69 58.55 2i29 s THR 182 Cb -0.13 -2.03 -0.06 0.00 1.34 0.00 0.00 72.50 71.61 2i29 s THR 182 CO 0.04 -0.07 0.48 -1.61 -0.54 0.00 0.00 174.62 172.91 2i29 s GLU 183 N -2.47 3.84 -0.32 3.99 2.02 -1.26 -1.45 118.70 123.05 2i29 s GLU 183 Ca 0.18 0.29 -0.04 0.00 0.02 0.00 0.00 54.97 55.41 2i29 s GLU 183 Cb -0.08 -2.90 0.05 0.00 0.10 0.00 0.00 34.13 31.30 2i29 s GLU 183 CO 0.08 0.48 0.05 -1.64 0.02 0.00 0.00 175.26 174.25 2i29 s MET 184 N -2.16 2.50 -1.21 1.61 -1.94 -0.44 -4.81 119.30 112.86 2i29 s MET 184 Ca 0.38 -1.24 -0.14 0.00 -1.71 0.00 0.00 55.69 52.98 2i29 s MET 184 Cb -0.14 -3.31 -0.01 0.00 2.01 0.00 0.00 34.83 33.38 2i29 s MET 184 CO 0.20 -0.65 0.71 0.00 -0.01 0.00 0.00 175.02 175.26 2i29 n ALA 185 N 4.70 -2.38 -1.77 3.03 0.00 -1.26 -0.82 120.51 122.02 2i29 n ALA 185 Ca -0.13 -0.23 -0.39 0.00 0.00 0.00 0.00 53.44 52.69 2i29 n ALA 185 Cb 0.44 -3.38 -0.02 0.00 0.00 0.00 0.00 19.45 16.49 2i29 n ALA 185 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2i29 s SER 186 N -3.75 6.63 -0.17 0.00 1.04 -1.26 -3.31 113.70 112.88 2i29 s SER 186 Ca 0.33 2.45 -0.19 0.00 0.48 0.00 0.00 55.95 59.02 2i29 s SER 186 Cb -0.11 -2.63 -0.03 0.00 0.10 0.00 0.00 66.02 63.35 2i29 s SER 186 CO 0.86 -0.61 0.52 -0.63 0.98 0.00 0.00 173.24 174.37 2i29 s ILE 187 N -1.31 5.12 -0.10 -1.02 1.01 0.16 -4.93 121.20 120.13 2i29 s ILE 187 Ca 0.54 0.99 -0.01 0.00 0.00 0.00 0.00 60.65 62.17 2i29 s ILE 187 Cb -0.34 -3.85 0.03 0.00 0.01 0.00 0.00 42.46 38.31 2i29 s ILE 187 CO 0.43 0.22 -0.05 0.20 0.00 0.00 0.00 174.94 175.74 2i29 s ASN 188 N 0.98 2.05 0.00 3.58 0.01 -1.26 -4.31 114.94 115.99 2i29 s ASN 188 Ca 0.25 -0.27 0.00 0.00 -0.71 0.00 0.00 52.86 52.14 2i29 s ASN 188 Cb -0.15 -0.71 0.00 0.00 0.41 0.00 0.00 41.25 40.80 2i29 s ASN 188 CO 0.10 -0.15 0.00 -0.46 -1.51 0.00 0.00 177.10 175.08 2i29 n ASN 189 N 5.01 0.00 -0.00 -1.22 0.23 -0.05 -4.97 115.26 114.26 2i29 n ASN 189 Ca -0.11 -0.29 0.08 0.00 -0.53 0.00 0.00 54.58 53.73 2i29 n ASN 189 Cb 0.50 0.00 0.49 0.00 -2.08 0.00 0.00 39.78 38.69 2i29 n ASN 189 CO 0.00 0.00 0.00 0.08 -0.93 0.00 0.00 177.26 176.41 2i29 h ARG 190 N 0.00 0.40 0.02 -3.83 -0.00 -2.05 -3.25 114.38 105.67 2i29 h ARG 190 Ca 0.00 -0.02 -0.39 0.00 -0.00 0.00 0.00 59.98 59.57 2i29 h ARG 190 Cb 0.00 -0.09 -0.06 0.00 -0.00 0.00 0.00 29.97 29.82 2i29 h ARG 190 CO 0.00 0.26 -2.25 1.55 -0.00 0.00 0.00 179.97 179.54 2i29 n VAL 191 N -4.48 1.56 -3.70 0.08 3.14 -1.26 -4.96 118.33 108.71 2i29 n VAL 191 Ca 0.05 -0.44 -0.36 0.00 -2.96 0.00 0.00 64.34 60.63 2i29 n VAL 191 Cb 0.20 -1.72 -0.07 0.00 -1.06 0.00 0.00 33.84 31.19 2i29 n VAL 191 CO 0.00 0.00 0.00 -0.31 -6.46 0.00 0.00 176.83 170.06 2i29 s TYR 192 N -2.50 3.46 -0.04 1.45 2.02 -1.23 -5.08 117.35 115.43 2i29 s TYR 192 Ca -0.33 0.43 0.00 0.00 -0.37 0.00 0.00 57.07 56.80 2i29 s TYR 192 Cb 0.10 -2.17 0.03 0.00 -0.40 0.00 0.00 41.96 39.52 2i29 s TYR 192 CO 0.59 0.35 -0.00 1.03 -1.57 0.00 0.00 175.55 175.95 2i29 s ARG 193 N 0.15 0.39 0.41 -0.62 0.52 -1.26 -0.88 118.95 117.66 2i29 s ARG 193 Ca 0.11 0.08 0.05 0.00 -0.52 0.00 0.00 55.73 55.46 2i29 s ARG 193 Cb -0.12 -0.61 -0.06 0.00 0.52 0.00 0.00 34.95 34.68 2i29 s ARG 193 CO 0.01 -0.17 0.03 0.95 0.02 0.00 0.00 175.30 176.13 2i29 s THR 194 N 1.26 1.61 0.29 0.02 -4.23 -1.26 -4.46 115.64 108.88 2i29 s THR 194 Ca -0.06 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.49 2i29 s THR 194 Cb -0.13 -2.78 0.06 0.00 1.34 0.00 0.00 72.50 70.99 2i29 s THR 194 CO -0.02 0.00 1.73 -0.29 -0.54 0.00 0.00 174.62 175.50 2i29 h ILE 195 N 1.77 1.27 -0.66 2.99 6.09 -1.97 -3.47 117.51 123.53 2i29 h ILE 195 Ca -0.43 -1.32 -0.13 0.00 -1.37 0.00 0.00 64.86 61.61 2i29 h ILE 195 Cb 1.26 1.46 -0.03 0.00 0.47 0.00 0.00 36.82 39.98 2i29 h ILE 195 CO 0.76 0.41 -0.15 0.61 -3.07 0.00 0.00 178.15 176.71 2i29 n GLY 196 N -0.35 0.45 3.27 8.18 0.00 -1.26 -4.98 105.19 110.51 2i29 n GLY 196 Ca -0.01 -0.67 -0.14 0.00 0.00 0.00 0.00 46.02 45.20 2i29 n GLY 196 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2i29 s SER 197 N -2.80 -0.29 0.68 1.61 0.01 -1.26 -5.11 113.70 106.54 2i29 s SER 197 Ca 0.00 0.35 -0.16 0.00 1.31 0.00 0.00 55.95 57.46 2i29 s SER 197 Cb 0.00 0.48 0.01 0.00 0.21 0.00 0.00 66.02 66.72 2i29 s SER 197 CO 0.00 -0.36 1.17 -2.84 0.41 0.00 0.00 173.24 171.62 2i29 s PRO 198 N -0.83 2.50 -0.05 12.44 0.02 -1.26 -4.84 135.00 142.98 2i29 s PRO 198 Ca -0.09 1.65 0.04 0.00 0.02 0.00 0.00 61.00 62.61 2i29 s PRO 198 Cb -0.04 -1.89 0.00 0.00 0.02 0.00 0.00 34.50 32.59 2i29 s PRO 198 CO 0.04 -1.53 -0.16 -0.51 -0.33 0.00 0.00 177.00 174.51 2i29 s LEU 199 N -4.86 1.86 -0.21 -5.54 1.43 -0.72 -4.95 118.68 105.68 2i29 s LEU 199 Ca 0.72 -0.34 -0.03 0.00 -1.03 0.00 0.00 54.13 53.45 2i29 s LEU 199 Cb -0.26 -0.94 -0.01 0.00 0.03 0.00 0.00 46.19 45.01 2i29 s LEU 199 CO 0.42 0.12 -0.07 -0.69 0.23 0.00 0.00 176.35 176.36 2i29 s VAL 200 N 0.22 3.20 -0.07 -1.59 1.01 -1.26 -0.34 120.40 121.58 2i29 s VAL 200 Ca -0.07 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 61.36 2i29 s VAL 200 Cb -0.13 -2.44 -0.03 0.00 0.00 0.00 0.00 36.38 33.78 2i29 s VAL 200 CO 0.03 0.44 -0.07 -0.36 0.00 0.00 0.00 175.10 175.14 2i29 s PHE 201 N 1.36 2.93 0.90 5.22 0.40 0.02 -4.97 117.98 123.85 2i29 s PHE 201 Ca 0.04 0.01 -0.13 0.00 -0.60 0.00 0.00 56.93 56.25 2i29 s PHE 201 Cb -0.14 -1.72 0.17 0.00 0.51 0.00 0.00 43.02 41.84 2i29 s PHE 201 CO -0.04 0.32 1.25 -1.25 0.70 0.00 0.00 175.22 176.20 2i29 s PRO 202 N -0.77 1.01 0.57 0.24 0.04 -1.26 -1.94 135.00 132.88 2i29 s PRO 202 Ca 0.12 -0.42 -0.20 0.00 0.04 0.00 0.00 61.00 60.54 2i29 s PRO 202 Cb -0.11 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 2i29 s PRO 202 CO 0.01 -2.14 1.22 0.21 0.04 0.00 0.00 177.00 176.35 2i29 s LYS 203 N -5.73 3.10 0.00 4.56 2.20 -1.15 -2.86 119.74 119.87 2i29 s LYS 203 Ca 0.71 1.87 0.00 0.00 -0.36 0.00 0.00 55.97 58.19 2i29 s LYS 203 Cb -0.05 -2.03 0.00 0.00 -1.51 0.00 0.00 37.83 34.24 2i29 s LYS 203 CO 0.51 -1.11 0.00 0.72 -0.36 0.00 0.00 175.35 175.11 2i29 n HIS 204 N -1.37 0.00 -3.52 4.03 8.25 -1.26 -5.01 115.22 116.34 2i29 n HIS 204 Ca 0.12 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.21 2i29 n HIS 204 Cb 0.49 -0.62 -0.06 0.00 1.12 0.00 0.00 29.99 30.92 2i29 n HIS 204 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2i29 s HIS 205 N -2.29 3.64 -0.15 4.41 3.76 -1.13 -5.07 115.29 118.46 2i29 s HIS 205 Ca 0.00 0.86 -0.01 0.00 -0.15 0.00 0.00 55.06 55.76 2i29 s HIS 205 Cb 0.00 -2.30 -0.01 0.00 1.11 0.00 0.00 32.58 31.38 2i29 s HIS 205 CO 0.00 0.52 -0.10 0.08 -0.85 0.00 0.00 174.74 174.39 2i29 s VAL 206 N -0.57 3.17 -0.18 -0.90 1.01 -1.26 -4.60 120.40 117.06 2i29 s VAL 206 Ca 0.22 -0.60 -0.03 0.00 0.00 0.00 0.00 61.98 61.57 2i29 s VAL 206 Cb -0.15 -2.36 -0.01 0.00 0.00 0.00 0.00 36.38 33.85 2i29 s VAL 206 CO 0.10 0.50 -0.06 -0.69 0.00 0.00 0.00 175.10 174.95 2i29 s VAL 207 N 0.62 3.39 -0.07 2.92 1.01 -0.73 -0.61 120.40 126.92 2i29 s VAL 207 Ca -0.06 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.45 2i29 s VAL 207 Cb -0.15 -2.50 -0.01 0.00 0.00 0.00 0.00 36.38 33.71 2i29 s VAL 207 CO 0.03 0.46 -0.20 -0.55 0.00 0.00 0.00 175.10 174.84 2i29 s SER 208 N 0.97 3.52 -0.18 3.32 0.15 0.73 0.25 113.70 122.46 2i29 s SER 208 Ca -0.00 -0.40 -0.05 0.00 0.70 0.00 0.00 55.95 56.20 2i29 s SER 208 Cb -0.15 -1.05 -0.03 0.00 -1.71 0.00 0.00 66.02 63.09 2i29 s SER 208 CO 0.00 0.25 -0.00 -0.76 1.20 0.00 0.00 173.24 173.92 2i29 s LEU 209 N -0.16 3.33 -0.10 3.45 1.43 0.20 -0.99 118.68 125.85 2i29 s LEU 209 Ca -0.02 -0.14 0.03 0.00 -1.03 0.00 0.00 54.13 52.97 2i29 s LEU 209 Cb -0.14 -1.83 0.00 0.00 0.03 0.00 0.00 46.19 44.26 2i29 s LEU 209 CO 0.04 0.12 -0.21 -1.10 0.23 0.00 0.00 176.35 175.42 2i29 s GLN 210 N 0.69 2.74 0.58 1.70 -0.21 -0.09 -1.44 119.66 123.63 2i29 s GLN 210 Ca -0.00 -0.77 -0.20 0.00 0.02 0.00 0.00 55.36 54.41 2i29 s GLN 210 Cb -0.14 -2.11 -0.04 0.00 1.00 0.00 0.00 33.01 31.72 2i29 s GLN 210 CO 0.02 0.12 1.27 -2.14 -2.12 0.00 0.00 175.29 172.45 2i29 s PRO 211 N 0.47 3.00 -0.17 2.91 0.02 -1.26 -0.27 135.00 139.70 2i29 s PRO 211 Ca -0.17 2.01 -0.10 0.00 0.02 0.00 0.00 61.00 62.76 2i29 s PRO 211 Cb -0.17 -2.06 -0.07 0.00 0.02 0.00 0.00 34.50 32.21 2i29 s PRO 211 CO 0.07 -1.24 -0.25 0.28 -0.33 0.00 0.00 177.00 175.53 2i29 n VAL 212 N -1.38 1.16 0.00 3.83 0.31 -1.23 -4.77 118.33 116.25 2i29 n VAL 212 Ca 0.13 -0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 2i29 n VAL 212 Cb 0.48 -1.85 0.00 0.00 -0.91 0.00 0.00 33.84 31.55 2i29 n VAL 212 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 2i29 n ASN 213 N -3.95 0.00 -2.58 4.52 0.23 -1.26 -5.02 115.26 107.20 2i29 n ASN 213 Ca -0.32 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.73 2i29 n ASN 213 Cb 0.67 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.37 2i29 n ASN 213 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 2i29 n ASP 214 N 0.00 -5.25 -0.49 0.53 4.64 -1.26 -5.01 116.55 109.71 2i29 n ASP 214 Ca 0.00 0.37 0.05 0.00 -1.38 0.00 0.00 54.79 53.83 2i29 n ASP 214 Cb 0.00 -1.23 0.10 0.00 -1.04 0.00 0.00 41.12 38.95 2i29 n ASP 214 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 2i29 n LYS 215 N 1.26 1.87 -3.76 -0.67 5.02 -1.26 -4.78 118.16 115.84 2i29 n LYS 215 Ca 0.00 -1.62 -0.36 0.00 -2.02 0.00 0.00 58.31 54.31 2i29 n LYS 215 Cb 0.34 -1.21 -0.10 0.00 -0.02 0.00 0.00 35.03 34.04 2i29 n LYS 215 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2i29 s ASP 216 N -0.92 5.86 0.00 4.39 1.01 -1.26 -1.01 116.67 124.74 2i29 s ASP 216 Ca 0.17 0.06 0.03 0.00 0.71 0.00 0.00 52.55 53.52 2i29 s ASP 216 Cb 0.09 -2.05 -0.01 0.00 1.01 0.00 0.00 42.92 41.97 2i29 s ASP 216 CO 0.13 0.08 -0.11 -0.36 0.21 0.00 0.00 175.17 175.12 2i29 s PHE 217 N 0.97 0.94 -0.47 4.23 0.08 -0.24 -3.05 117.98 120.45 2i29 s PHE 217 Ca 0.06 -0.22 -0.25 0.00 0.12 0.00 0.00 56.93 56.64 2i29 s PHE 217 Cb -0.13 -0.60 0.03 0.00 -0.57 0.00 0.00 43.02 41.75 2i29 s PHE 217 CO 0.03 -0.01 0.92 -1.14 -0.10 0.00 0.00 175.22 174.92 2i29 s GLN 218 N -0.46 3.49 -0.19 0.44 2.00 0.02 0.24 119.66 125.20 2i29 s GLN 218 Ca 0.03 0.08 -0.05 0.00 -2.00 0.00 0.00 55.36 53.42 2i29 s GLN 218 Cb -0.05 -3.95 -0.02 0.00 0.80 0.00 0.00 33.01 29.79 2i29 s GLN 218 CO -0.00 -1.26 -0.00 0.42 -0.50 0.00 0.00 175.29 173.95 2i29 s ILE 219 N 3.76 3.96 0.02 -2.34 1.01 -0.19 -1.73 121.20 125.69 2i29 s ILE 219 Ca 0.36 -0.31 -0.00 0.00 0.00 0.00 0.00 60.65 60.69 2i29 s ILE 219 Cb -0.11 -2.78 -0.04 0.00 0.01 0.00 0.00 42.46 39.54 2i29 s ILE 219 CO 0.25 0.44 0.12 -0.94 0.00 0.00 0.00 174.94 174.81 2i29 s SER 220 N 0.91 5.90 -0.23 3.58 1.04 -0.17 -1.41 113.70 123.31 2i29 s SER 220 Ca 0.01 0.18 -0.03 0.00 0.48 0.00 0.00 55.95 56.58 2i29 s SER 220 Cb -0.14 -1.73 0.08 0.00 0.10 0.00 0.00 66.02 64.32 2i29 s SER 220 CO 0.02 0.23 0.08 -0.69 0.98 0.00 0.00 173.24 173.87 2i29 s VAL 221 N -1.31 0.27 0.00 5.02 1.01 0.98 -1.75 120.40 124.63 2i29 s VAL 221 Ca 0.27 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 61.60 2i29 s VAL 221 Cb -0.12 -1.01 0.00 0.00 0.00 0.00 0.00 36.38 35.25 2i29 s VAL 221 CO 0.19 -0.44 0.00 0.47 0.00 0.00 0.00 175.10 175.31 2i29 n ASP 222 N 5.13 0.00 0.12 3.32 8.00 -0.54 -1.59 116.55 130.99 2i29 n ASP 222 Ca -0.07 0.00 0.05 0.00 0.71 0.00 0.00 54.79 55.48 2i29 n ASP 222 Cb 0.45 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.57 2i29 n ASP 222 CO 0.00 0.00 0.00 -0.74 -0.39 0.00 0.00 177.20 176.07 2i29 h HIS 223 N 0.00 0.00 -3.10 1.24 2.76 -1.96 -3.46 115.15 110.62 2i29 h HIS 223 Ca 0.00 0.00 -0.53 0.00 -2.20 0.00 0.00 60.37 57.64 2i29 h HIS 223 Cb 0.00 0.00 0.01 0.00 1.55 0.00 0.00 27.41 28.97 2i29 h HIS 223 CO 0.00 0.37 0.64 -1.17 -1.30 0.00 0.00 177.93 176.46 2i29 s LEU 224 N -6.10 4.36 -0.13 0.26 2.96 -0.62 -5.02 118.68 114.39 2i29 s LEU 224 Ca 0.02 2.12 -0.02 0.00 -0.22 0.00 0.00 54.13 56.04 2i29 s LEU 224 Cb 0.08 -3.58 0.04 0.00 0.50 0.00 0.00 46.19 43.23 2i29 s LEU 224 CO 0.75 -0.55 -0.00 -0.55 -1.32 0.00 0.00 176.35 174.68 2i29 s SER 225 N 1.14 2.24 0.01 3.68 0.15 -1.26 -0.01 113.70 119.65 2i29 s SER 225 Ca 0.61 -0.42 0.02 0.00 0.70 0.00 0.00 55.95 56.86 2i29 s SER 225 Cb -0.32 -0.60 -0.01 0.00 -1.71 0.00 0.00 66.02 63.38 2i29 s SER 225 CO 0.29 -0.22 -0.07 0.27 1.20 0.00 0.00 173.24 174.71 2i29 s ILE 226 N 1.86 0.55 -0.04 6.45 -4.36 -0.50 -4.98 121.20 120.19 2i29 s ILE 226 Ca 0.03 -0.56 -0.30 0.00 -0.26 0.00 0.00 60.65 59.55 2i29 s ILE 226 Cb -0.14 -0.52 -0.03 0.00 1.25 0.00 0.00 42.46 43.03 2i29 s ILE 226 CO -0.07 -0.03 1.03 -0.22 0.24 0.00 0.00 174.94 175.90 2i29 s LEU 227 N -0.65 4.31 -0.13 0.37 2.96 -1.26 -1.02 118.68 123.27 2i29 s LEU 227 Ca -0.01 1.65 -0.02 0.00 -0.22 0.00 0.00 54.13 55.53 2i29 s LEU 227 Cb -0.05 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 43.05 2i29 s LEU 227 CO 0.00 -0.38 -0.06 -1.00 -1.32 0.00 0.00 176.35 173.59 2i29 s HIS 228 N 1.52 2.97 0.08 5.38 3.76 0.14 -4.96 115.29 124.18 2i29 s HIS 228 Ca 0.51 -0.26 0.05 0.00 -0.15 0.00 0.00 55.06 55.21 2i29 s HIS 228 Cb -0.21 -1.87 -0.04 0.00 1.11 0.00 0.00 32.58 31.57 2i29 s HIS 228 CO 0.24 0.04 -0.01 1.03 -0.85 0.00 0.00 174.74 175.18 2i29 s ARG 229 N 0.02 2.51 -1.23 1.40 0.52 -1.26 -1.08 118.95 119.83 2i29 s ARG 229 Ca -0.01 -0.84 -0.02 0.00 -0.52 0.00 0.00 55.73 54.34 2i29 s ARG 229 Cb -0.14 -2.52 -0.01 0.00 0.52 0.00 0.00 34.95 32.81 2i29 s ARG 229 CO 0.03 0.54 0.84 -3.47 0.02 0.00 0.00 175.30 173.27 2i29 n ASP 230 N 0.65 -2.28 -4.76 0.23 2.03 -1.14 -4.95 116.55 106.33 2i29 n ASP 230 Ca -0.11 -0.74 -0.40 0.00 0.52 0.00 0.00 54.79 54.06 2i29 n ASP 230 Cb 0.52 -4.56 -0.05 0.00 -0.72 0.00 0.00 41.12 36.30 2i29 n ASP 230 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2i29 s VAL 231 N -3.51 4.71 -0.16 5.18 1.01 -0.18 -4.38 120.40 123.07 2i29 s VAL 231 Ca 0.07 1.55 0.18 0.00 0.00 0.00 0.00 61.98 63.78 2i29 s VAL 231 Cb -0.02 -4.07 -0.25 0.00 0.00 0.00 0.00 36.38 32.04 2i29 s VAL 231 CO 0.77 0.41 0.23 0.00 0.00 0.00 0.00 175.10 176.51 2i29 n GLN 232 N 2.56 0.68 -3.63 2.72 0.00 0.71 -4.78 117.38 115.64 2i29 n GLN 232 Ca -0.04 0.03 -0.11 0.00 0.00 0.00 0.00 57.00 56.88 2i29 n GLN 232 Cb 0.50 -1.57 -0.07 0.00 0.00 0.00 0.00 30.24 29.10 2i29 n GLN 232 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.06 175.06 2i29 s GLU 233 N -2.62 0.64 -0.14 2.61 2.12 -1.15 -4.46 118.70 115.69 2i29 s GLU 233 Ca -0.09 0.70 0.02 0.00 0.36 0.00 0.00 54.97 55.97 2i29 s GLU 233 Cb 0.07 0.31 0.01 0.00 0.26 0.00 0.00 34.13 34.78 2i29 s GLU 233 CO 0.84 -0.09 -0.21 0.42 -0.54 0.00 0.00 175.26 175.68 2i29 s ILE 234 N 0.18 2.14 -0.13 -3.70 1.01 -0.52 -1.08 121.20 119.10 2i29 s ILE 234 Ca 0.02 -0.95 0.03 0.00 0.00 0.00 0.00 60.65 59.74 2i29 s ILE 234 Cb -0.05 -1.86 0.01 0.00 0.01 0.00 0.00 42.46 40.57 2i29 s ILE 234 CO -0.03 0.54 -0.21 -0.60 0.00 0.00 0.00 174.94 174.65 2i29 s ARG 235 N 0.83 2.85 -0.12 2.79 3.52 0.04 0.58 118.95 129.45 2i29 s ARG 235 Ca -0.06 -0.80 -0.01 0.00 -0.13 0.00 0.00 55.73 54.73 2i29 s ARG 235 Cb -0.15 -2.29 -0.02 0.00 -1.56 0.00 0.00 34.95 30.92 2i29 s ARG 235 CO -0.02 0.01 -0.09 0.71 -0.81 0.00 0.00 175.30 175.10 2i29 s TYR 236 N 0.76 2.89 -0.03 5.12 2.02 0.14 -0.75 117.35 127.50 2i29 s TYR 236 Ca -0.09 -0.38 -0.14 0.00 -0.37 0.00 0.00 57.07 56.09 2i29 s TYR 236 Cb -0.16 -1.84 0.02 0.00 -0.40 0.00 0.00 41.96 39.59 2i29 s TYR 236 CO 0.00 -0.03 0.31 -1.83 -1.57 0.00 0.00 175.55 172.44 2i29 s GLU 237 N 0.05 0.62 0.14 -0.62 -1.05 -0.83 -1.78 118.70 115.23 2i29 s GLU 237 Ca -0.03 -0.08 -0.32 0.00 -0.15 0.00 0.00 54.97 54.40 2i29 s GLU 237 Cb -0.14 0.28 -0.11 0.00 -0.44 0.00 0.00 34.13 33.71 2i29 s GLU 237 CO 0.04 -0.16 1.79 0.28 0.95 0.00 0.00 175.26 178.15 2i29 n VAL 238 N 1.56 0.25 -1.73 1.83 0.31 -1.26 0.13 118.33 119.43 2i29 n VAL 238 Ca -0.20 -0.04 -0.33 0.00 -0.01 0.00 0.00 64.34 63.75 2i29 n VAL 238 Cb 0.56 -2.02 0.05 0.00 -0.91 0.00 0.00 33.84 31.53 2i29 n VAL 238 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2i29 s SER 239 N 2.23 5.01 0.32 4.52 0.15 0.54 -4.70 113.70 121.77 2i29 s SER 239 Ca 0.80 2.04 0.17 0.00 0.70 0.00 0.00 55.95 59.67 2i29 s SER 239 Cb -0.52 -2.56 0.36 0.00 -1.71 0.00 0.00 66.02 61.60 2i29 s SER 239 CO 0.37 -1.70 1.58 0.00 1.20 0.00 0.00 173.24 174.69 2i29 h ALA 240 N 0.01 0.81 -2.25 5.45 0.00 -1.92 -3.43 119.26 117.92 2i29 h ALA 240 Ca -0.47 -0.41 -0.46 0.00 0.00 0.00 0.00 54.91 53.57 2i29 h ALA 240 Cb 1.25 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2i29 h ALA 240 CO 0.54 0.57 0.35 0.15 0.00 0.00 0.00 179.25 180.86 2i29 s LYS 241 N -3.26 4.31 0.16 0.00 1.02 -1.26 -5.06 119.74 115.66 2i29 s LYS 241 Ca 0.02 1.25 0.08 0.00 0.02 0.00 0.00 55.97 57.34 2i29 s LYS 241 Cb 0.09 -2.41 -0.04 0.00 -0.52 0.00 0.00 37.83 34.95 2i29 s LYS 241 CO 0.72 0.03 -0.18 0.15 -0.92 0.00 0.00 175.35 175.15 2i29 s LYS 242 N -2.75 1.27 -0.05 1.68 1.02 -1.26 -3.74 119.74 115.91 2i29 s LYS 242 Ca 0.58 -1.40 -0.17 0.00 0.02 0.00 0.00 55.97 55.00 2i29 s LYS 242 Cb -0.14 -1.31 -0.05 0.00 -0.52 0.00 0.00 37.83 35.81 2i29 s LYS 242 CO 0.19 0.26 0.45 -1.50 -0.92 0.00 0.00 175.35 173.83 2i29 s ILE 243 N -2.07 5.07 -0.17 2.17 2.07 -0.87 -4.67 121.20 122.75 2i29 s ILE 243 Ca 0.16 0.92 -0.06 0.00 -1.41 0.00 0.00 60.65 60.26 2i29 s ILE 243 Cb -0.06 -3.78 -0.04 0.00 0.13 0.00 0.00 42.46 38.72 2i29 s ILE 243 CO 0.06 0.46 0.03 -1.00 -1.91 0.00 0.00 174.94 172.59 2i29 s HIS 244 N -0.29 3.20 -0.02 3.50 3.76 -1.26 -1.58 115.29 122.61 2i29 s HIS 244 Ca 0.25 0.01 -0.00 0.00 -0.15 0.00 0.00 55.06 55.16 2i29 s HIS 244 Cb -0.16 -2.02 -0.04 0.00 1.11 0.00 0.00 32.58 31.47 2i29 s HIS 244 CO 0.12 0.15 0.05 -0.06 -0.85 0.00 0.00 174.74 174.16 2i29 s PHE 245 N 0.22 3.22 -0.04 1.40 0.08 0.45 -0.32 117.98 122.99 2i29 s PHE 245 Ca 0.02 0.18 -0.23 0.00 0.12 0.00 0.00 56.93 57.02 2i29 s PHE 245 Cb -0.13 -1.73 -0.04 0.00 -0.57 0.00 0.00 43.02 40.55 2i29 s PHE 245 CO 0.01 0.52 0.70 0.00 -0.10 0.00 0.00 175.22 176.36 2i29 s ALA 246 N -1.12 3.36 0.08 5.36 0.00 -0.72 -1.69 121.76 127.02 2i29 s ALA 246 Ca 0.21 0.15 -0.12 0.00 0.00 0.00 0.00 51.96 52.20 2i29 s ALA 246 Cb -0.12 -2.94 0.01 0.00 0.00 0.00 0.00 23.12 20.07 2i29 s ALA 246 CO 0.11 -0.05 0.27 1.03 0.00 0.00 0.00 175.76 177.13 2i29 s ARG 247 N 0.55 0.87 0.00 0.00 0.52 0.29 -4.84 118.95 116.33 2i29 s ARG 247 Ca 0.37 -0.74 0.00 0.00 -0.52 0.00 0.00 55.73 54.84 2i29 s ARG 247 Cb -0.18 0.37 0.00 0.00 0.52 0.00 0.00 34.95 35.65 2i29 s ARG 247 CO 0.19 -0.29 0.00 1.19 0.02 0.00 0.00 175.30 176.41 2i29 n PHE 248 N 0.17 0.00 -3.58 -0.53 0.99 -1.26 0.35 117.46 113.60 2i29 n PHE 248 Ca -0.17 0.00 -0.06 0.00 -0.00 0.00 0.00 57.45 57.22 2i29 n PHE 248 Cb 0.61 0.00 -0.02 0.00 -1.00 0.00 0.00 39.48 39.08 2i29 n PHE 248 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 2i29 s ARG 249 N 0.00 0.83 -0.07 -1.08 3.00 -1.26 -4.98 118.95 115.39 2i29 s ARG 249 Ca 0.00 -0.36 -0.30 0.00 0.00 0.00 0.00 55.73 55.07 2i29 s ARG 249 Cb 0.00 0.34 -0.04 0.00 0.00 0.00 0.00 34.95 35.25 2i29 s ARG 249 CO 0.00 -0.37 1.46 0.45 0.00 0.00 0.00 175.30 176.84 2i29 s SER 250 N -2.59 6.80 -0.43 0.23 0.15 -1.26 -4.94 113.70 111.67 2i29 s SER 250 Ca 0.08 2.05 0.04 0.00 0.70 0.00 0.00 55.95 58.82 2i29 s SER 250 Cb -0.01 -2.54 0.17 0.00 -1.71 0.00 0.00 66.02 61.93 2i29 s SER 250 CO -0.05 -0.81 0.40 0.12 1.20 0.00 0.00 173.24 174.10 2i29 s PHE 251 N 3.34 0.56 0.44 3.44 5.36 -1.26 -5.14 117.98 124.72 2i29 s PHE 251 Ca 0.65 -1.95 -0.25 0.00 -0.96 0.00 0.00 56.93 54.41 2i29 s PHE 251 Cb -0.29 -0.68 -0.08 0.00 -0.34 0.00 0.00 43.02 41.62 2i29 s PHE 251 CO 0.24 -0.91 1.40 -2.14 -1.46 0.00 0.00 175.22 172.35 2i29 s PRO 252 N 0.28 3.75 0.24 10.12 0.02 -1.26 -4.76 135.00 143.40 2i29 s PRO 252 Ca 0.31 2.36 -0.06 0.00 0.02 0.00 0.00 61.00 63.64 2i29 s PRO 252 Cb 0.02 -2.68 0.45 0.00 0.02 0.00 0.00 34.50 32.30 2i29 s PRO 252 CO -0.16 -0.74 1.66 0.35 -0.33 0.00 0.00 177.00 177.78 2i29 h PHE 253 N 2.41 0.12 -0.20 6.54 3.57 -2.00 0.17 116.94 127.55 2i29 h PHE 253 Ca -0.51 0.05 -0.06 0.00 3.53 0.00 0.00 57.97 60.98 2i29 h PHE 253 Cb 1.26 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 40.05 2i29 h PHE 253 CO 0.51 -0.17 -0.14 -1.49 -2.23 0.00 0.00 178.31 174.79 2i29 h TRP 254 N 0.18 0.34 -0.33 0.41 -0.00 -1.99 0.12 115.95 114.68 2i29 h TRP 254 Ca 0.41 -0.05 -0.05 0.00 -0.00 0.00 0.00 58.89 59.21 2i29 h TRP 254 Cb 0.73 -0.09 -0.01 0.00 -0.00 0.00 0.00 29.16 29.78 2i29 h TRP 254 CO -0.33 0.46 0.01 -0.09 -0.00 0.00 0.00 178.44 178.49 2i29 h ARG 255 N 0.30 0.58 -0.91 0.49 2.43 -1.28 0.16 114.38 116.16 2i29 h ARG 255 Ca 0.06 -0.18 0.07 0.00 -0.81 0.00 0.00 59.98 59.12 2i29 h ARG 255 Cb 0.44 -0.06 -0.07 0.00 -0.42 0.00 0.00 29.97 29.87 2i29 h ARG 255 CO 0.03 0.70 0.57 -0.09 -1.51 0.00 0.00 179.97 179.67 2i29 h ARG 256 N 0.39 1.00 -0.15 0.20 2.43 -0.10 0.26 114.38 118.41 2i29 h ARG 256 Ca 0.10 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.18 2i29 h ARG 256 Cb 0.43 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 2i29 h ARG 256 CO 0.02 0.66 -0.00 0.28 -1.51 0.00 0.00 179.97 179.41 2i29 h VAL 257 N 1.03 1.26 -0.32 0.20 2.07 -0.64 -2.27 116.25 117.58 2i29 h VAL 257 Ca 0.40 -0.86 0.07 0.00 0.82 0.00 0.00 66.70 67.13 2i29 h VAL 257 Cb 0.20 1.52 -0.07 0.00 -1.52 0.00 0.00 31.29 31.42 2i29 h VAL 257 CO -0.18 0.25 -0.15 -0.74 0.02 0.00 0.00 177.57 176.78 2i29 h HIS 258 N 0.01 -0.36 -0.50 1.57 -0.00 -0.38 -1.40 115.15 114.10 2i29 h HIS 258 Ca 0.04 0.03 -0.00 0.00 -0.00 0.00 0.00 60.37 60.44 2i29 h HIS 258 Cb 0.39 0.21 -0.02 0.00 -0.00 0.00 0.00 27.41 27.98 2i29 h HIS 258 CO 0.04 -0.22 0.29 -0.44 -0.00 0.00 0.00 177.93 177.60 2i29 h ASP 259 N -0.09 0.60 1.02 3.26 3.32 -0.88 0.30 116.42 123.94 2i29 h ASP 259 Ca 0.16 -0.03 -0.19 0.00 0.02 0.00 0.00 57.03 56.99 2i29 h ASP 259 Cb 0.34 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.71 2i29 h ASP 259 CO -0.38 0.47 -1.03 0.28 -1.72 0.00 0.00 179.24 176.86 2i29 h SER 260 N 0.69 0.00 0.00 6.45 0.02 -1.05 -3.39 113.55 116.27 2i29 h SER 260 Ca 0.18 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.12 2i29 h SER 260 Cb -0.01 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.53 2i29 h SER 260 CO -0.03 0.83 -1.03 0.49 -1.14 0.00 0.00 176.83 175.95 2i29 n PHE 261 N -3.22 0.00 -0.09 3.45 3.01 -0.56 -4.91 117.46 115.13 2i29 n PHE 261 Ca -0.03 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.31 2i29 n PHE 261 Cb 0.90 -0.02 -0.05 0.00 -0.01 0.00 0.00 39.48 40.30 2i29 n PHE 261 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 2i29 n ILE 262 N -2.09 1.48 -0.37 4.37 2.08 0.10 -5.06 119.36 119.87 2i29 n ILE 262 Ca -0.01 0.07 0.00 0.00 0.56 0.00 0.00 62.75 63.37 2i29 n ILE 262 Cb 0.51 -2.26 0.00 0.00 -0.75 0.00 0.00 39.64 37.14 2i29 n ILE 262 CO 0.00 0.00 0.00 -1.84 0.56 0.00 0.00 176.55 175.27