#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pb4 s VAL 2 N 0.00 0.72 -0.19 2.03 1.01 -1.01 -2.71 120.40 120.25 2pb4 s VAL 2 Ca 0.00 -0.27 -0.05 0.00 0.00 0.00 0.00 61.98 61.67 2pb4 s VAL 2 Cb 0.00 -0.69 -0.02 0.00 0.00 0.00 0.00 36.38 35.67 2pb4 s VAL 2 CO 0.00 0.25 -0.01 -0.22 0.00 0.00 0.00 175.10 175.12 2pb4 s LEU 3 N 0.60 3.23 -0.24 3.92 2.96 0.92 -0.18 118.68 129.89 2pb4 s LEU 3 Ca -0.09 -0.19 -0.06 0.00 -0.22 0.00 0.00 54.13 53.57 2pb4 s LEU 3 Cb -0.13 -1.81 -0.01 0.00 0.50 0.00 0.00 46.19 44.74 2pb4 s LEU 3 CO 0.01 0.09 0.02 -0.31 -1.32 0.00 0.00 176.35 174.84 2pb4 s TYR 4 N 0.83 3.04 -0.40 5.38 2.02 0.22 -1.20 117.35 127.24 2pb4 s TYR 4 Ca 0.00 -0.74 -0.22 0.00 -0.37 0.00 0.00 57.07 55.74 2pb4 s TYR 4 Cb -0.14 -2.18 0.01 0.00 -0.40 0.00 0.00 41.96 39.25 2pb4 s TYR 4 CO 0.02 -0.48 0.71 -0.06 -1.57 0.00 0.00 175.55 174.18 2pb4 s PHE 5 N 1.54 3.08 -0.15 2.71 0.40 0.26 -0.34 117.98 125.48 2pb4 s PHE 5 Ca 0.06 0.28 0.02 0.00 -0.60 0.00 0.00 56.93 56.69 2pb4 s PHE 5 Cb -0.15 -3.38 0.01 0.00 0.51 0.00 0.00 43.02 40.01 2pb4 s PHE 5 CO 0.00 -0.79 -0.21 0.42 0.70 0.00 0.00 175.22 175.34 2pb4 s ILE 6 N 2.98 2.15 0.26 0.64 1.01 -0.40 -0.00 121.20 127.84 2pb4 s ILE 6 Ca 0.27 -0.95 -0.23 0.00 0.00 0.00 0.00 60.65 59.74 2pb4 s ILE 6 Cb -0.13 -1.87 -0.09 0.00 0.01 0.00 0.00 42.46 40.38 2pb4 s ILE 6 CO 0.18 0.54 0.83 -0.83 0.00 0.00 0.00 174.94 175.66 2pb4 s GLY 7 N 0.86 2.75 0.00 6.18 0.00 -0.72 -2.17 107.32 114.21 2pb4 s GLY 7 Ca -0.06 0.35 0.23 0.00 0.00 0.00 0.00 44.72 45.25 2pb4 s GLY 7 CO -0.03 0.77 1.20 1.04 0.00 0.00 0.00 173.10 176.08 2pb4 n LEU 8 N 0.79 1.82 0.00 0.66 4.77 0.77 -4.51 117.00 121.31 2pb4 n LEU 8 Ca -0.01 -0.65 0.00 0.00 -0.03 0.00 0.00 56.01 55.32 2pb4 n LEU 8 Cb 0.50 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2pb4 n LEU 8 CO 0.44 0.34 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 2pb4 n GLY 9 N 1.40 -1.68 0.07 -0.72 0.00 -0.85 -2.66 105.19 100.75 2pb4 n GLY 9 Ca 0.10 -1.60 -0.07 0.00 0.00 0.00 0.00 46.02 44.44 2pb4 n GLY 9 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2pb4 h LEU 10 N 0.00 0.00 0.00 0.99 3.38 -1.80 0.98 115.31 118.86 2pb4 h LEU 10 Ca 0.00 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 2pb4 h LEU 10 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 2pb4 h LEU 10 CO 0.00 0.85 -0.40 0.00 0.09 0.00 0.00 178.44 178.98 2pb4 n TYR 11 N -4.62 0.00 -4.24 1.13 9.36 -1.26 -4.72 117.16 112.80 2pb4 n TYR 11 Ca -0.10 0.00 -0.11 0.00 3.32 0.00 0.00 57.90 61.00 2pb4 n TYR 11 Cb 0.29 -0.01 -0.03 0.00 -0.63 0.00 0.00 39.34 38.97 2pb4 n TYR 11 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 2pb4 n ASP 12 N -3.31 1.61 0.19 2.98 5.68 -1.26 -1.32 116.55 121.12 2pb4 n ASP 12 Ca -0.00 -1.90 0.14 0.00 -0.50 0.00 0.00 54.79 52.53 2pb4 n ASP 12 Cb 0.20 0.32 0.66 0.00 -1.14 0.00 0.00 41.12 41.16 2pb4 n ASP 12 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 2pb4 h GLU 13 N 0.00 0.00 -0.09 0.11 9.09 -1.90 -2.14 114.58 119.65 2pb4 h GLU 13 Ca -0.15 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.26 2pb4 h GLU 13 Cb 0.51 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.61 2pb4 h GLU 13 CO 0.23 0.00 0.00 0.54 0.05 0.00 0.00 179.01 179.83 2pb4 n ARG 14 N -2.46 1.77 0.00 1.06 1.74 -1.26 -4.02 116.66 113.49 2pb4 n ARG 14 Ca -0.00 -1.14 0.15 0.00 -0.77 0.00 0.00 57.85 56.09 2pb4 n ARG 14 Cb 0.13 -1.45 0.72 0.00 -1.02 0.00 0.00 32.46 30.84 2pb4 n ARG 14 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2pb4 n ASP 15 N 0.37 0.58 -4.84 0.55 8.00 -0.81 -4.81 116.55 115.60 2pb4 n ASP 15 Ca 0.18 -1.02 -0.32 0.00 0.71 0.00 0.00 54.79 54.34 2pb4 n ASP 15 Cb 0.37 -0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.42 2pb4 n ASP 15 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2pb4 s ILE 16 N -2.14 4.49 0.58 0.53 2.07 -1.09 -3.84 121.20 121.81 2pb4 s ILE 16 Ca 0.39 1.16 -0.07 0.00 -1.41 0.00 0.00 60.65 60.72 2pb4 s ILE 16 Cb 0.21 -3.71 -0.01 0.00 0.13 0.00 0.00 42.46 39.08 2pb4 s ILE 16 CO 0.39 -0.72 0.91 0.42 -1.91 0.00 0.00 174.94 174.03 2pb4 s THR 17 N -2.66 4.16 0.23 4.00 -4.23 -1.26 -4.89 115.64 110.98 2pb4 s THR 17 Ca 0.59 0.25 -0.07 0.00 -1.18 0.00 0.00 61.69 61.28 2pb4 s THR 17 Cb -0.10 -3.64 0.20 0.00 1.34 0.00 0.00 72.50 70.29 2pb4 s THR 17 CO 0.34 -0.70 1.87 0.58 -0.54 0.00 0.00 174.62 176.17 2pb4 h VAL 18 N -0.14 1.13 -0.37 2.29 2.07 -1.96 -0.33 116.25 118.94 2pb4 h VAL 18 Ca -0.46 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 66.71 2pb4 h VAL 18 Cb 1.23 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 2pb4 h VAL 18 CO 0.62 0.19 0.23 0.50 0.02 0.00 0.00 177.57 179.13 2pb4 h LYS 19 N 1.03 0.50 -0.66 1.57 3.64 -1.97 -1.76 116.57 118.93 2pb4 h LYS 19 Ca 0.33 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.65 2pb4 h LYS 19 Cb 0.02 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.70 2pb4 h LYS 19 CO -0.12 0.35 0.29 0.78 -2.27 0.00 0.00 179.45 178.49 2pb4 h GLY 20 N 0.49 1.03 0.78 5.01 0.00 -1.69 -1.79 103.07 106.91 2pb4 h GLY 20 Ca 0.13 -0.53 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 2pb4 h GLY 20 CO -0.03 0.50 0.01 -2.00 0.00 0.00 0.00 176.54 175.03 2pb4 h LEU 21 N 0.91 0.13 -0.74 3.11 5.85 -0.95 -0.88 115.31 122.74 2pb4 h LEU 21 Ca 0.22 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 2pb4 h LEU 21 Cb 0.15 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 2pb4 h LEU 21 CO -0.02 0.35 0.42 -0.33 -0.34 0.00 0.00 178.44 178.52 2pb4 h GLU 22 N -0.10 1.02 -0.26 1.25 5.08 -1.25 -0.96 114.58 119.37 2pb4 h GLU 22 Ca 0.02 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 2pb4 h GLU 22 Cb 0.27 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2pb4 h GLU 22 CO 0.00 0.75 0.05 0.82 -1.00 0.00 0.00 179.01 179.62 2pb4 h ILE 23 N 1.02 1.23 -0.70 3.13 2.04 -1.29 -2.76 117.51 120.19 2pb4 h ILE 23 Ca 0.26 -0.76 0.07 0.00 1.00 0.00 0.00 64.86 65.43 2pb4 h ILE 23 Cb 0.01 1.23 -0.04 0.00 -0.74 0.00 0.00 36.82 37.28 2pb4 h ILE 23 CO -0.05 0.24 0.46 0.00 0.00 0.00 0.00 178.15 178.81 2pb4 h ALA 24 N 0.86 1.76 0.00 1.87 0.00 -0.82 -0.94 119.26 121.99 2pb4 h ALA 24 Ca 0.08 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2pb4 h ALA 24 Cb 0.32 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 2pb4 h ALA 24 CO 0.00 0.12 -0.03 0.87 0.00 0.00 0.00 179.25 180.21 2pb4 h LYS 25 N 0.69 0.00 -0.02 0.00 1.57 -0.89 -2.70 116.57 115.22 2pb4 h LYS 25 Ca 0.30 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 2pb4 h LYS 25 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 2pb4 h LYS 25 CO -0.10 0.03 -0.19 1.63 -0.57 0.00 0.00 179.45 180.25 2pb4 n LYS 26 N -3.16 1.61 -2.89 3.15 5.02 -0.38 -4.94 118.16 116.56 2pb4 n LYS 26 Ca -0.00 -1.22 -0.38 0.00 -2.02 0.00 0.00 58.31 54.69 2pb4 n LYS 26 Cb 0.28 -1.47 -0.06 0.00 -0.02 0.00 0.00 35.03 33.75 2pb4 n LYS 26 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2pb4 h ASP 28 N 3.62 0.40 -4.20 0.00 3.32 -1.30 -3.45 116.42 114.82 2pb4 h ASP 28 Ca -0.47 -0.29 -0.36 0.00 0.02 0.00 0.00 57.03 55.93 2pb4 h ASP 28 Cb 1.20 -0.12 -0.26 0.00 0.22 0.00 0.00 39.33 40.36 2pb4 h ASP 28 CO 0.66 1.04 -0.77 -0.31 -1.72 0.00 0.00 179.24 178.14 2pb4 s TYR 29 N -3.46 0.78 -0.10 4.55 2.02 -1.18 -5.05 117.35 114.90 2pb4 s TYR 29 Ca -0.05 -0.24 -0.01 0.00 -0.37 0.00 0.00 57.07 56.40 2pb4 s TYR 29 Cb 0.10 -0.48 0.03 0.00 -0.40 0.00 0.00 41.96 41.20 2pb4 s TYR 29 CO 0.84 -0.02 -0.06 0.08 -1.57 0.00 0.00 175.55 174.82 2pb4 s VAL 30 N -0.54 0.86 0.30 0.71 1.01 -1.26 -1.51 120.40 119.97 2pb4 s VAL 30 Ca 0.00 -0.19 0.08 0.00 0.00 0.00 0.00 61.98 61.88 2pb4 s VAL 30 Cb -0.05 -0.91 -0.04 0.00 0.00 0.00 0.00 36.38 35.37 2pb4 s VAL 30 CO 0.00 0.34 0.11 -0.36 0.00 0.00 0.00 175.10 175.19 2pb4 s PHE 31 N 1.75 2.78 0.11 5.22 0.40 0.53 -1.54 117.98 127.22 2pb4 s PHE 31 Ca 0.05 -0.27 -0.20 0.00 -0.60 0.00 0.00 56.93 55.90 2pb4 s PHE 31 Cb -0.13 -1.45 0.05 0.00 0.51 0.00 0.00 43.02 42.01 2pb4 s PHE 31 CO -0.07 0.46 0.49 0.00 0.70 0.00 0.00 175.22 176.80 2pb4 s ALA 32 N -2.33 -1.22 -0.00 5.36 0.00 -0.77 -0.03 121.76 122.76 2pb4 s ALA 32 Ca 0.35 0.30 0.02 0.00 0.00 0.00 0.00 51.96 52.63 2pb4 s ALA 32 Cb -0.05 0.63 -0.01 0.00 0.00 0.00 0.00 23.12 23.69 2pb4 s ALA 32 CO 0.22 -0.62 -0.07 -1.83 0.00 0.00 0.00 175.76 173.46 2pb4 s GLU 33 N -3.30 0.54 -0.22 0.00 4.04 -0.74 -0.59 118.70 118.44 2pb4 s GLU 33 Ca -0.00 -0.29 0.19 0.00 0.04 0.00 0.00 54.97 54.91 2pb4 s GLU 33 Cb 0.00 -0.51 0.48 0.00 0.02 0.00 0.00 34.13 34.12 2pb4 s GLU 33 CO -0.09 0.14 1.15 1.19 -1.84 0.00 0.00 175.26 175.81 2pb4 n PHE 34 N 2.79 1.29 -0.03 4.83 3.72 -1.26 -4.32 117.46 124.47 2pb4 n PHE 34 Ca -0.14 -1.82 0.03 0.00 -0.05 0.00 0.00 57.45 55.46 2pb4 n PHE 34 Cb 0.57 -0.24 -0.13 0.00 -0.94 0.00 0.00 39.48 38.74 2pb4 n PHE 34 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 2pb4 n TYR 35 N -0.47 0.00 0.08 1.38 0.18 -1.26 -4.30 117.16 112.76 2pb4 n TYR 35 Ca 0.16 0.00 -0.06 0.00 1.88 0.00 0.00 57.90 59.88 2pb4 n TYR 35 Cb 0.89 -0.54 -0.06 0.00 -0.38 0.00 0.00 39.34 39.25 2pb4 n TYR 35 CO 0.00 0.00 0.00 1.79 -2.08 0.00 0.00 176.86 176.57 2pb4 h THR 36 N 0.00 1.66 -2.05 -3.48 1.35 -1.99 -3.41 112.91 104.98 2pb4 h THR 36 Ca -0.16 -3.15 0.21 0.00 -0.55 0.00 0.00 66.41 62.76 2pb4 h THR 36 Cb 1.23 2.70 -0.11 0.00 -1.73 0.00 0.00 68.15 70.24 2pb4 h THR 36 CO 0.01 0.90 0.59 -0.55 -0.25 0.00 0.00 175.52 176.22 2pb4 s SER 37 N -6.74 -0.17 0.12 5.36 0.15 -1.26 -5.06 113.70 106.10 2pb4 s SER 37 Ca 0.00 -0.25 0.08 0.00 0.70 0.00 0.00 55.95 56.48 2pb4 s SER 37 Cb 0.11 0.37 -0.04 0.00 -1.71 0.00 0.00 66.02 64.75 2pb4 s SER 37 CO 0.81 -0.67 -0.18 -0.76 1.20 0.00 0.00 173.24 173.64 2pb4 s LEU 38 N -2.83 2.36 -0.86 3.45 1.43 -1.26 -4.45 118.68 116.52 2pb4 s LEU 38 Ca 0.11 -0.76 -0.18 0.00 -1.03 0.00 0.00 54.13 52.28 2pb4 s LEU 38 Cb 0.00 -0.76 0.15 0.00 0.03 0.00 0.00 46.19 45.61 2pb4 s LEU 38 CO -0.01 -0.02 0.99 -0.04 0.23 0.00 0.00 176.35 177.49 2pb4 s MET 39 N -2.32 3.52 0.62 1.70 -1.94 -1.26 -4.90 119.30 114.72 2pb4 s MET 39 Ca 0.09 -1.84 0.40 0.00 -1.71 0.00 0.00 55.69 52.63 2pb4 s MET 39 Cb -0.08 -4.70 2.01 0.00 2.01 0.00 0.00 34.83 34.08 2pb4 s MET 39 CO 0.05 -1.63 2.22 0.00 -0.01 0.00 0.00 175.02 175.64 2pb4 h ALA 40 N 8.65 1.00 -0.60 3.03 0.00 -1.85 -2.86 119.26 126.64 2pb4 h ALA 40 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2pb4 h ALA 40 Cb 1.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2pb4 h ALA 40 CO 1.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.68 2pb4 n GLY 41 N -0.63 2.89 1.54 0.00 0.00 -0.43 -4.98 105.19 103.58 2pb4 n GLY 41 Ca -0.02 -0.90 -0.04 0.00 0.00 0.00 0.00 46.02 45.07 2pb4 n GLY 41 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2pb4 n THR 42 N 0.79 0.00 -4.28 2.61 5.66 -1.08 -4.56 114.28 113.41 2pb4 n THR 42 Ca 0.27 -0.41 -0.15 0.00 -3.05 0.00 0.00 64.05 60.71 2pb4 n THR 42 Cb 1.10 0.41 -0.10 0.00 -1.55 0.00 0.00 70.33 70.19 2pb4 n THR 42 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2pb4 s THR 43 N -2.63 0.47 0.25 1.09 -4.23 -1.26 -4.86 115.64 104.46 2pb4 s THR 43 Ca 0.07 -1.99 -0.05 0.00 -1.18 0.00 0.00 61.69 58.53 2pb4 s THR 43 Cb -0.02 -2.51 0.17 0.00 1.34 0.00 0.00 72.50 71.48 2pb4 s THR 43 CO 0.05 -0.09 1.82 0.25 -0.54 0.00 0.00 174.62 176.11 2pb4 h LEU 44 N 2.49 0.99 -0.73 4.79 5.85 -1.99 -1.91 115.31 124.80 2pb4 h LEU 44 Ca -0.38 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.22 2pb4 h LEU 44 Cb 1.24 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.97 2pb4 h LEU 44 CO 0.60 0.88 0.47 1.23 -0.34 0.00 0.00 178.44 181.28 2pb4 h GLY 45 N 1.11 1.03 1.41 3.75 0.00 -1.98 0.25 103.07 108.63 2pb4 h GLY 45 Ca 0.25 -0.37 -0.13 0.00 0.00 0.00 0.00 47.33 47.08 2pb4 h GLY 45 CO -0.02 0.34 -0.33 3.21 0.00 0.00 0.00 176.54 179.74 2pb4 h ARG 46 N 0.95 0.66 -0.31 4.80 3.08 -1.89 -0.32 114.38 121.36 2pb4 h ARG 46 Ca 0.28 -0.31 -0.07 0.00 0.07 0.00 0.00 59.98 59.95 2pb4 h ARG 46 Cb -0.06 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 2pb4 h ARG 46 CO -0.08 0.90 -0.09 0.82 -1.07 0.00 0.00 179.97 180.46 2pb4 h ILE 47 N 0.56 1.28 -0.69 2.04 2.04 -0.80 -1.63 117.51 120.31 2pb4 h ILE 47 Ca 0.06 -1.14 0.01 0.00 1.00 0.00 0.00 64.86 64.79 2pb4 h ILE 47 Cb 0.84 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 38.26 2pb4 h ILE 47 CO 0.07 0.37 0.45 1.56 0.00 0.00 0.00 178.15 180.60 2pb4 h GLN 48 N 0.38 0.91 -0.63 2.37 4.20 -0.35 -1.20 115.11 120.79 2pb4 h GLN 48 Ca 0.08 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 2pb4 h GLN 48 Cb 0.58 -0.20 -0.03 0.00 0.30 0.00 0.00 27.48 28.13 2pb4 h GLN 48 CO 0.03 0.61 0.33 -0.22 -0.67 0.00 0.00 178.83 178.91 2pb4 h LYS 49 N 0.93 0.89 -0.42 1.46 1.63 -0.93 0.22 116.57 120.35 2pb4 h LYS 49 Ca 0.25 -0.11 -0.05 0.00 -0.85 0.00 0.00 60.65 59.89 2pb4 h LYS 49 Cb -0.10 -0.17 -0.02 0.00 -0.60 0.00 0.00 32.23 31.35 2pb4 h LYS 49 CO -0.05 0.68 0.07 1.25 -3.45 0.00 0.00 179.45 177.95 2pb4 h LEU 50 N 0.86 0.66 -0.22 5.20 5.85 -0.90 -3.02 115.31 123.74 2pb4 h LEU 50 Ca 0.22 -0.26 -0.08 0.00 0.84 0.00 0.00 57.88 58.60 2pb4 h LEU 50 Cb 0.07 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 2pb4 h LEU 50 CO -0.03 0.76 -0.37 0.40 -0.34 0.00 0.00 178.44 178.85 2pb4 h ILE 51 N 0.55 0.67 -2.20 4.05 2.04 -1.10 -3.48 117.51 118.04 2pb4 h ILE 51 Ca 0.13 -1.81 -0.22 0.00 1.00 0.00 0.00 64.86 63.96 2pb4 h ILE 51 Cb 0.37 2.23 0.02 0.00 -0.74 0.00 0.00 36.82 38.70 2pb4 h ILE 51 CO 0.01 0.36 -0.30 0.61 0.00 0.00 0.00 178.15 178.82 2pb4 n GLY 52 N 0.99 0.00 3.05 5.37 0.00 0.77 -4.58 105.19 110.80 2pb4 n GLY 52 Ca 0.02 -0.35 -0.11 0.00 0.00 0.00 0.00 46.02 45.58 2pb4 n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pb4 s LYS 53 N -4.92 0.40 0.38 1.61 -0.14 -1.17 -5.06 119.74 110.83 2pb4 s LYS 53 Ca 0.10 -0.43 -0.24 0.00 -1.36 0.00 0.00 55.97 54.04 2pb4 s LYS 53 Cb -0.04 0.16 -0.09 0.00 -1.68 0.00 0.00 37.83 36.17 2pb4 s LYS 53 CO 0.12 -0.08 1.02 -1.83 -0.76 0.00 0.00 175.35 173.82 2pb4 s GLU 54 N -1.29 4.27 -0.17 1.68 -1.05 -1.26 -4.67 118.70 116.21 2pb4 s GLU 54 Ca -0.14 1.45 -0.00 0.00 -0.15 0.00 0.00 54.97 56.13 2pb4 s GLU 54 Cb -0.08 -2.59 -0.00 0.00 -0.44 0.00 0.00 34.13 31.02 2pb4 s GLU 54 CO 0.01 -0.03 -0.14 0.42 0.95 0.00 0.00 175.26 176.47 2pb4 s ILE 55 N -1.67 2.73 -0.32 1.83 1.01 -1.26 -4.42 121.20 119.09 2pb4 s ILE 55 Ca 0.56 -0.74 -0.19 0.00 0.00 0.00 0.00 60.65 60.29 2pb4 s ILE 55 Cb -0.21 -2.17 -0.01 0.00 0.01 0.00 0.00 42.46 40.08 2pb4 s ILE 55 CO 0.26 0.50 0.55 -0.60 0.00 0.00 0.00 174.94 175.66 2pb4 s ARG 56 N 0.97 3.78 0.08 2.79 3.52 -0.59 -4.95 118.95 124.55 2pb4 s ARG 56 Ca -0.02 0.06 -0.28 0.00 -0.13 0.00 0.00 55.73 55.36 2pb4 s ARG 56 Cb -0.15 -3.76 -0.06 0.00 -1.56 0.00 0.00 34.95 29.42 2pb4 s ARG 56 CO -0.02 -0.59 0.87 0.08 -0.81 0.00 0.00 175.30 174.83 2pb4 s VAL 57 N 2.47 4.60 -0.02 7.11 1.01 -1.26 -1.86 120.40 132.46 2pb4 s VAL 57 Ca 0.21 1.86 0.05 0.00 0.00 0.00 0.00 61.98 64.10 2pb4 s VAL 57 Cb -0.15 -4.23 -0.03 0.00 0.00 0.00 0.00 36.38 31.97 2pb4 s VAL 57 CO 0.12 0.34 -0.15 -0.76 0.00 0.00 0.00 175.10 174.66 2pb4 s LEU 58 N -0.06 2.72 0.84 3.92 1.43 0.24 -4.93 118.68 122.84 2pb4 s LEU 58 Ca 0.43 -0.26 -0.09 0.00 -1.03 0.00 0.00 54.13 53.17 2pb4 s LEU 58 Cb -0.22 -1.56 0.16 0.00 0.03 0.00 0.00 46.19 44.59 2pb4 s LEU 58 CO 0.27 0.31 1.16 -0.94 0.23 0.00 0.00 176.35 177.38 2pb4 s SER 59 N -0.99 3.79 0.18 2.29 1.04 -1.26 -4.38 113.70 114.36 2pb4 s SER 59 Ca 0.13 0.05 -0.12 0.00 0.48 0.00 0.00 55.95 56.48 2pb4 s SER 59 Cb -0.11 -0.29 0.08 0.00 0.10 0.00 0.00 66.02 65.81 2pb4 s SER 59 CO 0.02 -2.27 1.77 -0.09 0.98 0.00 0.00 173.24 173.66 2pb4 h ARG 60 N -1.10 0.86 -0.50 4.02 2.43 -1.99 -1.94 114.38 116.16 2pb4 h ARG 60 Ca -0.41 -0.12 -0.06 0.00 -0.81 0.00 0.00 59.98 58.58 2pb4 h ARG 60 Cb 1.26 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 30.63 2pb4 h ARG 60 CO 0.42 0.68 0.09 1.49 -1.51 0.00 0.00 179.97 181.13 2pb4 h GLU 61 N 0.82 0.82 -0.60 0.20 4.81 -1.97 0.25 114.58 118.90 2pb4 h GLU 61 Ca 0.21 -0.22 0.11 0.00 -0.13 0.00 0.00 59.36 59.34 2pb4 h GLU 61 Cb 0.09 -0.10 -0.09 0.00 0.63 0.00 0.00 28.75 29.29 2pb4 h GLU 61 CO -0.03 0.81 0.13 -0.44 -0.73 0.00 0.00 179.01 178.75 2pb4 h ASP 62 N 0.69 -0.00 0.27 1.04 3.32 -1.83 0.18 116.42 120.09 2pb4 h ASP 62 Ca 0.15 0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.30 2pb4 h ASP 62 Cb 0.39 0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.10 2pb4 h ASP 62 CO 0.01 0.01 -0.13 0.58 -1.72 0.00 0.00 179.24 177.99 2pb4 h VAL 63 N 0.26 0.00 -0.98 -1.35 2.07 -1.07 -1.70 116.25 113.48 2pb4 h VAL 63 Ca 0.32 -0.53 0.04 0.00 0.82 0.00 0.00 66.70 67.34 2pb4 h VAL 63 Cb 0.47 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.18 2pb4 h VAL 63 CO -0.41 0.00 0.64 -0.33 0.02 0.00 0.00 177.57 177.49 2pb4 h GLU 64 N -0.89 1.18 0.05 1.57 5.08 -0.47 -2.43 114.58 118.67 2pb4 h GLU 64 Ca -0.04 -0.07 -0.38 0.00 -1.00 0.00 0.00 59.36 57.88 2pb4 h GLU 64 Cb 0.28 -0.27 -0.05 0.00 0.50 0.00 0.00 28.75 29.21 2pb4 h GLU 64 CO 0.06 0.78 -2.25 -0.11 -1.00 0.00 0.00 179.01 176.49 2pb4 n LEU 65 N -4.45 2.62 -0.28 1.33 7.94 0.63 -4.73 117.00 120.06 2pb4 n LEU 65 Ca 0.13 0.03 0.08 0.00 -1.11 0.00 0.00 56.01 55.15 2pb4 n LEU 65 Cb 0.11 -0.89 0.16 0.00 0.53 0.00 0.00 43.42 43.34 2pb4 n LEU 65 CO 0.34 0.86 0.48 0.59 -1.11 0.00 0.00 177.39 178.56 2pb4 n ASN 66 N -3.32 2.06 -0.27 1.96 3.02 -0.72 -4.79 115.26 113.21 2pb4 n ASN 66 Ca -0.39 -3.34 0.08 0.00 -0.03 0.00 0.00 54.58 50.90 2pb4 n ASN 66 Cb 1.02 -0.46 0.22 0.00 -0.61 0.00 0.00 39.78 39.96 2pb4 n ASN 66 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 2pb4 h PHE 67 N 0.36 0.43 0.00 3.10 3.57 -0.83 0.11 116.94 123.68 2pb4 h PHE 67 Ca -0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2pb4 h PHE 67 Cb 1.02 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.69 2pb4 h PHE 67 CO 0.27 -0.05 0.00 -0.85 -2.23 0.00 0.00 178.31 175.45 2pb4 n GLU 68 N -5.10 0.17 -0.01 1.11 0.00 -1.26 -1.06 120.64 114.49 2pb4 n GLU 68 Ca 0.17 0.39 0.08 0.00 0.00 0.00 0.00 57.16 57.80 2pb4 n GLU 68 Cb 0.52 -1.82 -0.14 0.00 0.00 0.00 0.00 31.44 30.01 2pb4 n GLU 68 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2pb4 n ASN 69 N -2.13 0.96 -0.12 -1.84 3.02 0.24 -3.99 115.26 111.41 2pb4 n ASN 69 Ca 0.02 0.00 -0.23 0.00 -0.03 0.00 0.00 54.58 54.35 2pb4 n ASN 69 Cb 0.23 1.74 -0.08 0.00 -0.61 0.00 0.00 39.78 41.06 2pb4 n ASN 69 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2pb4 n ILE 70 N -2.15 1.46 -0.10 2.41 5.41 -0.40 -4.71 119.36 121.29 2pb4 n ILE 70 Ca -0.05 -0.22 -0.20 0.00 1.00 0.00 0.00 62.75 63.28 2pb4 n ILE 70 Cb 0.50 -1.99 -0.11 0.00 -0.71 0.00 0.00 39.64 37.33 2pb4 n ILE 70 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 2pb4 h VAL 71 N -0.95 1.00 -0.64 1.39 2.07 -1.31 -3.42 116.25 114.40 2pb4 h VAL 71 Ca -0.48 -2.16 0.01 0.00 0.82 0.00 0.00 66.70 64.89 2pb4 h VAL 71 Cb 1.41 2.30 -0.03 0.00 -1.52 0.00 0.00 31.29 33.44 2pb4 h VAL 71 CO -0.29 0.34 0.42 -0.07 0.02 0.00 0.00 177.57 177.99 2pb4 h LEU 72 N -1.00 0.71 -0.41 2.57 3.38 -1.67 -2.83 115.31 116.06 2pb4 h LEU 72 Ca -0.29 -0.02 0.04 0.00 0.09 0.00 0.00 57.88 57.71 2pb4 h LEU 72 Cb 1.24 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 2pb4 h LEU 72 CO -0.18 0.51 0.17 -0.65 0.09 0.00 0.00 178.44 178.38 2pb4 h PRO 73 N 0.83 0.35 -0.19 1.13 0.11 -1.80 -1.79 132.00 130.64 2pb4 h PRO 73 Ca 0.24 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 66.26 2pb4 h PRO 73 Cb -0.05 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 30.97 2pb4 h PRO 73 CO -0.06 0.23 -0.19 -0.07 -0.21 0.00 0.00 178.00 177.70 2pb4 h LEU 74 N 0.36 0.32 -1.14 2.35 3.38 -1.77 -2.28 115.31 116.53 2pb4 h LEU 74 Ca 0.19 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2pb4 h LEU 74 Cb 0.14 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2pb4 h LEU 74 CO -0.16 0.52 0.00 0.00 0.09 0.00 0.00 178.44 178.89 2pb4 h ALA 75 N 1.51 1.00 -0.18 1.53 0.00 -1.09 -1.80 119.26 120.23 2pb4 h ALA 75 Ca 0.05 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 2pb4 h ALA 75 Cb 0.51 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2pb4 h ALA 75 CO 0.03 0.00 -0.55 0.87 0.00 0.00 0.00 179.25 179.60 2pb4 h LYS 76 N 0.00 0.55 0.00 0.00 1.79 -1.16 0.49 116.57 118.24 2pb4 h LYS 76 Ca 0.00 -0.35 0.00 0.00 -2.18 0.00 0.00 60.65 58.12 2pb4 h LYS 76 Cb 0.19 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.88 2pb4 h LYS 76 CO 0.00 0.95 -0.03 0.39 -1.08 0.00 0.00 179.45 179.68 2pb4 n GLU 77 N -3.96 1.93 -3.96 3.15 -0.58 -1.08 -2.83 120.64 113.32 2pb4 n GLU 77 Ca -0.03 -1.73 -0.10 0.00 -0.42 0.00 0.00 57.16 54.89 2pb4 n GLU 77 Cb 0.61 -1.08 -0.06 0.00 -0.57 0.00 0.00 31.44 30.33 2pb4 n GLU 77 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 2pb4 s ASN 78 N -1.52 -0.04 -0.20 1.62 0.01 -0.70 -4.55 114.94 109.55 2pb4 s ASN 78 Ca 0.11 -0.87 -0.20 0.00 -0.71 0.00 0.00 52.86 51.19 2pb4 s ASN 78 Cb 0.09 0.51 -0.03 0.00 0.41 0.00 0.00 41.25 42.23 2pb4 s ASN 78 CO 0.01 -1.00 0.58 -1.81 -1.51 0.00 0.00 177.10 173.36 2pb4 s ASP 79 N -2.99 6.61 0.03 -1.22 1.01 -1.26 -1.10 116.67 117.76 2pb4 s ASP 79 Ca 0.20 0.74 0.09 0.00 0.71 0.00 0.00 52.55 54.28 2pb4 s ASP 79 Cb 0.02 -2.32 -0.03 0.00 1.01 0.00 0.00 42.92 41.60 2pb4 s ASP 79 CO 0.04 -0.24 -0.25 -0.69 0.21 0.00 0.00 175.17 174.24 2pb4 s VAL 80 N 1.84 2.02 0.03 -1.27 1.01 0.75 -0.80 120.40 123.99 2pb4 s VAL 80 Ca 0.26 -1.28 0.07 0.00 0.00 0.00 0.00 61.98 61.03 2pb4 s VAL 80 Cb -0.16 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.48 2pb4 s VAL 80 CO 0.10 0.38 -0.20 0.00 0.00 0.00 0.00 175.10 175.37 2pb4 s ALA 81 N -0.75 2.49 -0.24 5.51 0.00 -0.57 0.73 121.76 128.93 2pb4 s ALA 81 Ca 0.11 -1.20 0.00 0.00 0.00 0.00 0.00 51.96 50.87 2pb4 s ALA 81 Cb -0.10 -0.67 0.06 0.00 0.00 0.00 0.00 23.12 22.42 2pb4 s ALA 81 CO 0.01 0.56 -0.02 0.12 0.00 0.00 0.00 175.76 176.43 2pb4 s PHE 82 N -0.87 2.20 -0.01 0.00 5.36 0.53 -0.35 117.98 124.85 2pb4 s PHE 82 Ca 0.13 -1.68 -0.12 0.00 -0.96 0.00 0.00 56.93 54.30 2pb4 s PHE 82 Cb -0.10 -1.57 -0.05 0.00 -0.34 0.00 0.00 43.02 40.95 2pb4 s PHE 82 CO 0.04 -0.77 0.35 -0.51 -1.46 0.00 0.00 175.22 172.88 2pb4 s LEU 83 N 1.46 4.44 0.02 6.12 1.43 0.95 -1.27 118.68 131.82 2pb4 s LEU 83 Ca -0.03 0.84 -0.03 0.00 -1.03 0.00 0.00 54.13 53.87 2pb4 s LEU 83 Cb -0.18 -2.55 -0.01 0.00 0.03 0.00 0.00 46.19 43.47 2pb4 s LEU 83 CO -0.08 0.32 0.05 0.42 0.23 0.00 0.00 176.35 177.28 2pb4 s THR 84 N -1.12 0.11 0.67 5.49 -4.23 -0.92 -1.79 115.64 113.83 2pb4 s THR 84 Ca 0.24 -0.91 -0.16 0.00 -1.18 0.00 0.00 61.69 59.68 2pb4 s THR 84 Cb -0.15 -0.48 0.00 0.00 1.34 0.00 0.00 72.50 73.21 2pb4 s THR 84 CO 0.12 -0.50 1.16 -2.84 -0.54 0.00 0.00 174.62 172.02 2pb4 s PRO 85 N -1.74 2.63 4.77 3.99 0.02 -1.26 -0.16 135.00 143.24 2pb4 s PRO 85 Ca -0.13 1.60 0.00 0.00 0.02 0.00 0.00 61.00 62.49 2pb4 s PRO 85 Cb -0.07 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.54 2pb4 s PRO 85 CO -0.01 -1.42 0.00 0.41 -0.33 0.00 0.00 177.00 175.65 2pb4 n GLY 86 N 0.00 1.42 3.68 0.52 0.00 0.34 -4.63 105.19 106.52 2pb4 n GLY 86 Ca 0.12 -0.70 -0.35 0.00 0.00 0.00 0.00 46.02 45.09 2pb4 n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2pb4 s ASP 87 N -4.00 5.68 0.72 1.61 -1.08 -1.24 -2.00 116.67 116.37 2pb4 s ASP 87 Ca 0.00 0.15 -0.16 0.00 -0.52 0.00 0.00 52.55 52.03 2pb4 s ASP 87 Cb 0.00 -1.90 0.03 0.00 -1.46 0.00 0.00 42.92 39.60 2pb4 s ASP 87 CO 0.00 0.25 1.24 -2.84 0.52 0.00 0.00 175.17 174.33 2pb4 s PRO 88 N -0.06 2.14 0.00 4.34 0.02 -1.26 -2.76 135.00 137.42 2pb4 s PRO 88 Ca 0.07 1.87 0.00 0.00 0.02 0.00 0.00 61.00 62.95 2pb4 s PRO 88 Cb -0.12 -1.82 0.00 0.00 0.02 0.00 0.00 34.50 32.58 2pb4 s PRO 88 CO 0.01 -1.86 0.00 1.28 -0.33 0.00 0.00 177.00 176.10 2pb4 n LEU 89 N -2.60 0.49 -0.02 -5.54 4.32 -1.26 -4.83 117.00 107.56 2pb4 n LEU 89 Ca 0.14 0.00 -0.16 0.00 -0.02 0.00 0.00 56.01 55.98 2pb4 n LEU 89 Cb 0.50 -1.01 -0.12 0.00 -1.62 0.00 0.00 43.42 41.16 2pb4 n LEU 89 CO 0.47 -0.34 0.34 0.58 -1.22 0.00 0.00 177.39 177.23 2pb4 h VAL 90 N 0.00 1.58 -2.18 4.08 2.07 -1.92 -3.41 116.25 116.47 2pb4 h VAL 90 Ca 0.00 -2.10 -0.60 0.00 0.82 0.00 0.00 66.70 64.83 2pb4 h VAL 90 Cb 0.18 2.93 0.04 0.00 -1.52 0.00 0.00 31.29 32.93 2pb4 h VAL 90 CO 0.00 0.57 0.89 0.00 0.02 0.00 0.00 177.57 179.06 2pb4 n ALA 91 N -2.57 1.15 -0.34 1.67 0.00 -1.26 -4.84 120.51 114.32 2pb4 n ALA 91 Ca -0.10 0.39 0.07 0.00 0.00 0.00 0.00 53.44 53.80 2pb4 n ALA 91 Cb 0.55 -2.40 0.16 0.00 0.00 0.00 0.00 19.45 17.76 2pb4 n ALA 91 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2pb4 n THR 92 N 3.99 -0.40 1.31 0.00 -1.04 -1.26 -1.50 114.28 115.38 2pb4 n THR 92 Ca 0.19 2.15 0.14 0.00 -2.04 0.00 0.00 64.05 64.49 2pb4 n THR 92 Cb 0.29 -3.01 0.58 0.00 -1.82 0.00 0.00 70.33 66.37 2pb4 n THR 92 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2pb4 n THR 93 N -5.52 0.00 0.00 12.58 -2.24 -1.26 -4.22 114.28 113.62 2pb4 n THR 93 Ca 0.16 -0.04 -0.06 0.00 -2.27 0.00 0.00 64.05 61.84 2pb4 n THR 93 Cb 0.51 -0.13 0.12 0.00 -2.10 0.00 0.00 70.33 68.73 2pb4 n THR 93 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 2pb4 h HIS 94 N 0.40 0.63 -0.86 4.78 -0.00 -1.59 -3.16 115.15 115.36 2pb4 h HIS 94 Ca 0.00 -0.17 0.14 0.00 -0.00 0.00 0.00 60.37 60.34 2pb4 h HIS 94 Cb 0.39 -0.14 -0.09 0.00 -0.00 0.00 0.00 27.41 27.57 2pb4 h HIS 94 CO 0.00 0.84 0.46 0.00 -0.00 0.00 0.00 177.93 179.22 2pb4 h ALA 95 N 1.14 1.29 -0.08 2.45 0.00 -1.74 0.36 119.26 122.68 2pb4 h ALA 95 Ca 0.04 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.05 2pb4 h ALA 95 Cb 0.87 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 2pb4 h ALA 95 CO 0.07 -0.05 0.11 1.49 0.00 0.00 0.00 179.25 180.87 2pb4 h GLU 96 N 0.66 0.00 0.00 0.00 4.22 -1.83 -1.07 114.58 116.56 2pb4 h GLU 96 Ca 0.46 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.87 2pb4 h GLU 96 Cb 0.62 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 2pb4 h GLU 96 CO -0.35 0.00 -0.12 -0.07 -2.18 0.00 0.00 179.01 176.29 2pb4 h LEU 97 N 0.00 0.00 -0.80 1.64 3.38 -1.04 -1.14 115.31 117.34 2pb4 h LEU 97 Ca 0.04 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 2pb4 h LEU 97 Cb 0.25 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2pb4 h LEU 97 CO -0.00 0.12 -0.53 0.03 0.09 0.00 0.00 178.44 178.15 2pb4 h ARG 98 N 0.00 0.00 -0.31 1.13 3.08 -1.31 -2.15 114.38 114.82 2pb4 h ARG 98 Ca -0.00 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 2pb4 h ARG 98 Cb 0.30 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 2pb4 h ARG 98 CO 0.02 0.53 -0.29 0.82 -1.07 0.00 0.00 179.97 179.97 2pb4 h ILE 99 N 0.00 1.29 -0.85 2.04 2.04 -1.33 -1.78 117.51 118.92 2pb4 h ILE 99 Ca -0.01 -1.46 0.02 0.00 1.00 0.00 0.00 64.86 64.42 2pb4 h ILE 99 Cb 1.04 1.52 -0.05 0.00 -0.74 0.00 0.00 36.82 38.59 2pb4 h ILE 99 CO 0.07 0.47 0.56 0.03 0.00 0.00 0.00 178.15 179.28 2pb4 h ARG 100 N 0.52 1.09 -0.01 2.37 3.08 -1.23 -0.79 114.38 119.40 2pb4 h ARG 100 Ca 0.05 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2pb4 h ARG 100 Cb 0.86 -0.24 -0.00 0.00 0.08 0.00 0.00 29.97 30.67 2pb4 h ARG 100 CO 0.07 0.72 0.01 0.00 -1.07 0.00 0.00 179.97 179.70 2pb4 h ALA 101 N 1.33 0.01 -0.11 0.04 0.00 -1.19 -1.60 119.26 117.74 2pb4 h ALA 101 Ca 0.32 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.27 2pb4 h ALA 101 Cb -0.08 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 2pb4 h ALA 101 CO -0.09 -0.49 -0.18 -0.22 0.00 0.00 0.00 179.25 178.28 2pb4 h LYS 102 N 0.01 -0.23 -0.80 0.00 3.64 -0.85 0.45 116.57 118.79 2pb4 h LYS 102 Ca 0.00 0.02 0.20 0.00 -1.27 0.00 0.00 60.65 59.60 2pb4 h LYS 102 Cb -0.00 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.83 2pb4 h LYS 102 CO -0.00 -0.15 0.56 0.00 -2.27 0.00 0.00 179.45 177.58 2pb4 h ARG 103 N -0.24 0.19 -0.19 1.90 2.47 -0.90 0.33 114.38 117.94 2pb4 h ARG 103 Ca 0.09 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 2pb4 h ARG 103 Cb 0.37 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 28.65 2pb4 h ARG 103 CO -0.25 0.13 0.00 0.00 0.56 0.00 0.00 179.97 180.41 2pb4 n ALA 104 N -2.60 2.51 -1.66 0.04 0.00 -0.38 -4.90 120.51 113.52 2pb4 n ALA 104 Ca 0.16 -0.52 -0.08 0.00 0.00 0.00 0.00 53.44 53.00 2pb4 n ALA 104 Cb 0.74 -1.08 -0.02 0.00 0.00 0.00 0.00 19.45 19.09 2pb4 n ALA 104 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pb4 n GLY 105 N 1.11 0.57 3.56 0.00 0.00 0.12 -5.01 105.19 105.53 2pb4 n GLY 105 Ca 0.15 -0.61 -0.34 0.00 0.00 0.00 0.00 46.02 45.23 2pb4 n GLY 105 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2pb4 s VAL 106 N -2.36 4.21 0.29 1.61 1.01 0.01 -5.01 120.40 120.16 2pb4 s VAL 106 Ca 0.00 -0.25 -0.28 0.00 0.00 0.00 0.00 61.98 61.46 2pb4 s VAL 106 Cb 0.00 -2.85 -0.10 0.00 0.00 0.00 0.00 36.38 33.43 2pb4 s VAL 106 CO 0.00 0.50 0.95 -1.61 0.00 0.00 0.00 175.10 174.93 2pb4 s GLU 107 N 0.22 4.69 0.03 2.72 2.02 -1.10 -3.58 118.70 123.70 2pb4 s GLU 107 Ca -0.00 1.40 0.03 0.00 0.02 0.00 0.00 54.97 56.42 2pb4 s GLU 107 Cb -0.13 -3.00 -0.02 0.00 0.10 0.00 0.00 34.13 31.08 2pb4 s GLU 107 CO 0.02 0.37 -0.09 -1.54 0.02 0.00 0.00 175.26 174.04 2pb4 s SER 108 N -1.43 1.05 0.05 -0.19 1.04 -1.26 -0.06 113.70 112.91 2pb4 s SER 108 Ca 0.46 -0.37 0.04 0.00 0.48 0.00 0.00 55.95 56.57 2pb4 s SER 108 Cb -0.22 -0.05 -0.02 0.00 0.10 0.00 0.00 66.02 65.83 2pb4 s SER 108 CO 0.27 -0.04 -0.13 -0.31 0.98 0.00 0.00 173.24 174.02 2pb4 s TYR 109 N -0.79 1.08 -0.18 5.02 2.02 -0.34 -4.96 117.35 119.20 2pb4 s TYR 109 Ca -0.02 -0.42 -0.03 0.00 -0.37 0.00 0.00 57.07 56.23 2pb4 s TYR 109 Cb -0.07 -0.63 -0.02 0.00 -0.40 0.00 0.00 41.96 40.85 2pb4 s TYR 109 CO 0.00 0.02 -0.07 0.08 -1.57 0.00 0.00 175.55 174.02 2pb4 s VAL 110 N -1.12 3.41 -0.33 0.71 1.01 -1.26 -0.57 120.40 122.25 2pb4 s VAL 110 Ca -0.02 -0.51 -0.06 0.00 0.00 0.00 0.00 61.98 61.39 2pb4 s VAL 110 Cb -0.09 -2.51 0.04 0.00 0.00 0.00 0.00 36.38 33.83 2pb4 s VAL 110 CO 0.02 0.47 0.09 -0.63 0.00 0.00 0.00 175.10 175.04 2pb4 s ILE 111 N 0.87 3.64 0.74 2.22 -1.09 1.00 -4.97 121.20 123.60 2pb4 s ILE 111 Ca -0.02 -1.18 -0.11 0.00 -2.23 0.00 0.00 60.65 57.11 2pb4 s ILE 111 Cb -0.15 -3.07 0.03 0.00 -1.58 0.00 0.00 42.46 37.70 2pb4 s ILE 111 CO 0.01 -0.17 1.08 -1.00 -1.23 0.00 0.00 174.94 173.63 2pb4 s HIS 112 N 1.37 2.99 0.21 3.97 3.76 -1.26 -1.76 115.29 124.57 2pb4 s HIS 112 Ca -0.02 1.31 -0.18 0.00 -0.15 0.00 0.00 55.06 56.02 2pb4 s HIS 112 Cb -0.20 -2.98 0.02 0.00 1.11 0.00 0.00 32.58 30.54 2pb4 s HIS 112 CO 0.02 -1.47 0.55 0.00 -0.85 0.00 0.00 174.74 172.99 2pb4 s ALA 113 N -3.09 -0.91 0.28 -1.40 0.00 -1.26 -4.64 121.76 110.74 2pb4 s ALA 113 Ca 0.59 -0.30 -0.30 0.00 0.00 0.00 0.00 51.96 51.96 2pb4 s ALA 113 Cb -0.14 0.88 -0.13 0.00 0.00 0.00 0.00 23.12 23.73 2pb4 s ALA 113 CO 0.55 -0.84 1.31 -2.30 0.00 0.00 0.00 175.76 174.47 2pb4 n PRO 114 N -0.36 1.94 -4.34 0.00 -0.02 -1.26 -3.93 135.00 127.02 2pb4 n PRO 114 Ca -0.08 0.69 -0.25 0.00 -2.02 0.00 0.00 63.50 61.83 2pb4 n PRO 114 Cb 0.62 -2.28 -0.12 0.00 -0.02 0.00 0.00 33.50 31.70 2pb4 n PRO 114 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2pb4 s SER 115 N -0.03 2.90 0.52 2.55 0.15 -1.26 -3.60 113.70 114.93 2pb4 s SER 115 Ca 0.63 -0.76 0.24 0.00 0.70 0.00 0.00 55.95 56.76 2pb4 s SER 115 Cb -0.64 -0.18 1.41 0.00 -1.71 0.00 0.00 66.02 64.90 2pb4 s SER 115 CO 0.55 0.08 2.10 -0.29 1.20 0.00 0.00 173.24 176.88 2pb4 h ILE 116 N 3.75 0.72 -0.44 6.45 6.09 -1.96 0.15 117.51 132.28 2pb4 h ILE 116 Ca -0.47 -0.42 0.06 0.00 -1.37 0.00 0.00 64.86 62.67 2pb4 h ILE 116 Cb 1.19 1.25 -0.02 0.00 0.47 0.00 0.00 36.82 39.70 2pb4 h ILE 116 CO 0.43 0.10 0.30 1.88 -3.07 0.00 0.00 178.15 177.78 2pb4 h TYR 117 N 0.00 0.32 0.00 2.19 0.05 -2.01 -1.88 116.97 115.64 2pb4 h TYR 117 Ca -0.00 0.01 -0.32 0.00 0.05 0.00 0.00 58.73 58.47 2pb4 h TYR 117 Cb 0.24 -0.11 -0.06 0.00 1.01 0.00 0.00 36.73 37.82 2pb4 h TYR 117 CO 0.00 0.17 -2.21 -1.13 -1.05 0.00 0.00 178.16 173.94 2pb4 n SER 118 N -4.47 1.09 0.30 3.88 3.41 -0.74 -4.43 113.62 112.65 2pb4 n SER 118 Ca 0.06 -0.03 0.16 0.00 -0.26 0.00 0.00 58.87 58.80 2pb4 n SER 118 Cb 0.27 0.62 0.94 0.00 -0.26 0.00 0.00 64.21 65.78 2pb4 n SER 118 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2pb4 h ALA 119 N 0.65 1.36 0.00 7.33 0.00 -0.51 -1.16 119.26 126.93 2pb4 h ALA 119 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2pb4 h ALA 119 Cb 2.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.79 2pb4 h ALA 119 CO 0.00 0.03 0.00 1.33 0.00 0.00 0.00 179.25 180.61 2pb4 n VAL 120 N -3.63 1.35 0.28 0.00 0.24 -0.73 -1.64 118.33 114.19 2pb4 n VAL 120 Ca -0.03 0.34 0.17 0.00 -2.04 0.00 0.00 64.34 62.78 2pb4 n VAL 120 Cb 0.12 -1.23 0.86 0.00 -1.47 0.00 0.00 33.84 32.12 2pb4 n VAL 120 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2pb4 h GLY 121 N 1.11 0.00 2.00 7.63 0.00 -1.48 -1.00 103.07 111.33 2pb4 h GLY 121 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2pb4 h GLY 121 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 176.54 181.05 2pb4 n ILE 122 N -2.71 0.84 1.16 2.60 3.06 -0.65 -1.79 119.36 121.88 2pb4 n ILE 122 Ca -0.01 0.20 0.14 0.00 -2.50 0.00 0.00 62.75 60.57 2pb4 n ILE 122 Cb 0.10 -0.98 0.66 0.00 0.54 0.00 0.00 39.64 39.96 2pb4 n ILE 122 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 2pb4 n THR 123 N -1.76 0.09 -0.43 9.51 -2.24 -0.38 -4.89 114.28 114.19 2pb4 n THR 123 Ca 0.03 0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 2pb4 n THR 123 Cb 0.22 -0.55 0.00 0.00 -2.10 0.00 0.00 70.33 67.89 2pb4 n THR 123 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2pb4 n GLY 124 N 1.22 1.33 3.71 3.38 0.00 -0.74 -4.59 105.19 109.51 2pb4 n GLY 124 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 2pb4 n GLY 124 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2pb4 s LEU 125 N 0.00 4.35 0.16 0.99 1.43 -1.26 -4.56 118.68 119.78 2pb4 s LEU 125 Ca 0.00 1.43 -0.32 0.00 -1.03 0.00 0.00 54.13 54.21 2pb4 s LEU 125 Cb 0.00 -3.33 -0.12 0.00 0.03 0.00 0.00 46.19 42.78 2pb4 s LEU 125 CO 0.00 -0.18 1.77 1.41 0.23 0.00 0.00 176.35 179.58 2pb4 n HIS 126 N 3.82 2.65 -0.31 0.29 8.25 -1.26 -4.68 115.22 123.98 2pb4 n HIS 126 Ca 0.02 -0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2pb4 n HIS 126 Cb 0.51 -2.69 0.18 0.00 1.12 0.00 0.00 29.99 29.11 2pb4 n HIS 126 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 2pb4 h ILE 127 N 4.24 1.20 0.00 1.59 1.08 -1.95 -2.23 117.51 121.45 2pb4 h ILE 127 Ca -0.45 -0.41 -0.01 0.00 -0.39 0.00 0.00 64.86 63.61 2pb4 h ILE 127 Cb 1.22 -0.09 -0.00 0.00 -3.07 0.00 0.00 36.82 34.88 2pb4 h ILE 127 CO 0.95 0.22 -0.02 0.10 -0.69 0.00 0.00 178.15 178.70 2pb4 h TYR 128 N 1.19 0.00 -0.00 1.37 -0.00 -2.01 -2.51 116.97 115.01 2pb4 h TYR 128 Ca 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 59.07 2pb4 h TYR 128 Cb -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.65 2pb4 h TYR 128 CO -0.00 0.02 -0.06 1.63 -0.00 0.00 0.00 178.16 179.75 2pb4 n LYS 129 N -3.21 0.46 -2.45 0.10 5.02 -0.84 -4.85 118.16 112.39 2pb4 n LYS 129 Ca -0.01 -0.08 -0.41 0.00 -2.02 0.00 0.00 58.31 55.79 2pb4 n LYS 129 Cb 0.19 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.66 2pb4 n LYS 129 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2pb4 s PHE 130 N -2.60 3.53 0.00 2.13 0.40 -0.95 -0.76 117.98 119.74 2pb4 s PHE 130 Ca 0.27 1.59 0.00 0.00 -0.60 0.00 0.00 56.93 58.19 2pb4 s PHE 130 Cb 0.20 -3.33 0.00 0.00 0.51 0.00 0.00 43.02 40.40 2pb4 s PHE 130 CO 0.48 -0.77 0.00 0.41 0.70 0.00 0.00 175.22 176.05 2pb4 n GLY 131 N 1.70 1.90 3.74 4.36 0.00 0.41 -4.81 105.19 112.49 2pb4 n GLY 131 Ca 0.01 -1.90 -0.38 0.00 0.00 0.00 0.00 46.02 43.76 2pb4 n GLY 131 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2pb4 n MET 132 N 0.00 1.38 -3.89 1.61 0.00 -1.26 -4.82 117.12 110.13 2pb4 n MET 132 Ca 0.00 0.52 -0.22 0.00 -0.00 0.00 0.00 57.70 58.01 2pb4 n MET 132 Cb 0.00 -2.56 -0.04 0.00 0.00 0.00 0.00 33.22 30.62 2pb4 n MET 132 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 2pb4 s SER 133 N -1.17 5.22 0.27 6.12 0.01 -1.26 -4.42 113.70 118.46 2pb4 s SER 133 Ca 0.78 -0.51 -0.14 0.00 1.31 0.00 0.00 55.95 57.39 2pb4 s SER 133 Cb -0.40 -0.98 0.00 0.00 0.21 0.00 0.00 66.02 64.86 2pb4 s SER 133 CO 0.44 -0.31 0.53 0.00 0.41 0.00 0.00 173.24 174.32 2pb4 s ALA 134 N -2.31 -0.36 -0.08 1.44 0.00 -1.01 -5.02 121.76 114.42 2pb4 s ALA 134 Ca 0.39 -0.82 0.04 0.00 0.00 0.00 0.00 51.96 51.57 2pb4 s ALA 134 Cb -0.06 1.02 0.00 0.00 0.00 0.00 0.00 23.12 24.09 2pb4 s ALA 134 CO 0.26 -0.89 -0.19 0.99 0.00 0.00 0.00 175.76 175.92 2pb4 s THR 135 N -3.85 1.69 -0.40 0.00 2.01 -1.26 -0.97 115.64 112.86 2pb4 s THR 135 Ca 0.21 -0.81 -0.25 0.00 0.31 0.00 0.00 61.69 61.15 2pb4 s THR 135 Cb -0.02 -1.47 0.02 0.00 0.01 0.00 0.00 72.50 71.04 2pb4 s THR 135 CO 0.10 0.48 0.88 -0.69 -0.69 0.00 0.00 174.62 174.69 2pb4 s VAL 136 N 0.37 4.60 -0.01 3.82 1.01 0.13 -4.71 120.40 125.60 2pb4 s VAL 136 Ca -0.15 0.95 -0.01 0.00 0.00 0.00 0.00 61.98 62.78 2pb4 s VAL 136 Cb -0.16 -4.33 -0.04 0.00 0.00 0.00 0.00 36.38 31.85 2pb4 s VAL 136 CO 0.06 -0.60 0.09 0.00 0.00 0.00 0.00 175.10 174.64 2pb4 s ALA 137 N 3.44 3.60 0.28 5.51 0.00 -1.26 -1.54 121.76 131.80 2pb4 s ALA 137 Ca 0.36 -0.86 -0.29 0.00 0.00 0.00 0.00 51.96 51.16 2pb4 s ALA 137 Cb -0.12 -1.60 -0.10 0.00 0.00 0.00 0.00 23.12 21.30 2pb4 s ALA 137 CO 0.21 0.69 1.31 0.71 0.00 0.00 0.00 175.76 178.68 2pb4 s TYR 138 N -1.19 3.14 0.62 0.00 2.02 -1.26 -4.84 117.35 115.84 2pb4 s TYR 138 Ca 0.23 1.32 -0.15 0.00 -0.37 0.00 0.00 57.07 58.10 2pb4 s TYR 138 Cb -0.12 -3.65 -0.02 0.00 -0.40 0.00 0.00 41.96 37.77 2pb4 s TYR 138 CO 0.14 -1.90 1.07 -2.14 -1.57 0.00 0.00 175.55 171.15 2pb4 s PRO 139 N -1.09 3.13 -0.10 -1.71 0.02 -1.26 -4.86 135.00 129.13 2pb4 s PRO 139 Ca 0.52 1.21 -0.06 0.00 0.02 0.00 0.00 61.00 62.69 2pb4 s PRO 139 Cb -0.39 -2.01 0.04 0.00 0.02 0.00 0.00 34.50 32.17 2pb4 s PRO 139 CO 0.46 -0.96 0.25 -1.21 -0.33 0.00 0.00 177.00 175.21 2pb4 s GLU 140 N -4.22 0.23 4.40 5.54 0.41 0.08 -5.02 118.70 120.11 2pb4 s GLU 140 Ca 0.63 0.50 0.00 0.00 -0.41 0.00 0.00 54.97 55.69 2pb4 s GLU 140 Cb -0.17 -0.06 0.00 0.00 -1.78 0.00 0.00 34.13 32.12 2pb4 s GLU 140 CO 0.41 -0.14 0.00 0.41 -0.49 0.00 0.00 175.26 175.45 2pb4 n GLY 141 N 3.96 3.28 0.47 -1.39 0.00 -1.26 0.23 105.19 110.48 2pb4 n GLY 141 Ca -0.23 0.13 0.11 0.00 0.00 0.00 0.00 46.02 46.03 2pb4 n GLY 141 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2pb4 n ASN 142 N 4.85 1.41 -4.54 1.61 3.02 -1.26 -4.83 115.26 115.52 2pb4 n ASN 142 Ca 0.00 -1.63 -0.38 0.00 -0.03 0.00 0.00 54.58 52.53 2pb4 n ASN 142 Cb 0.00 -0.08 -0.11 0.00 -0.61 0.00 0.00 39.78 38.98 2pb4 n ASN 142 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 2pb4 s TRP 143 N -1.85 3.20 -0.55 3.10 -0.11 0.14 -5.02 118.94 117.84 2pb4 s TRP 143 Ca 0.33 -0.12 0.04 0.00 1.22 0.00 0.00 56.10 57.56 2pb4 s TRP 143 Cb 0.17 -2.38 0.15 0.00 -1.50 0.00 0.00 33.47 29.91 2pb4 s TRP 143 CO 0.27 -0.27 0.33 0.12 -4.62 0.00 0.00 176.95 172.78 2pb4 s PHE 144 N 1.71 2.86 0.28 5.86 2.19 -1.26 -0.74 117.98 128.87 2pb4 s PHE 144 Ca 0.06 -2.98 -0.29 0.00 0.33 0.00 0.00 56.93 54.05 2pb4 s PHE 144 Cb -0.16 -2.42 -0.09 0.00 -1.31 0.00 0.00 43.02 39.03 2pb4 s PHE 144 CO 0.09 -0.70 1.14 -1.25 1.83 0.00 0.00 175.22 176.33 2pb4 s PRO 145 N -0.48 4.59 -0.00 10.12 0.04 -1.26 -4.95 135.00 143.06 2pb4 s PRO 145 Ca 0.21 1.87 0.00 0.00 0.04 0.00 0.00 61.00 63.12 2pb4 s PRO 145 Cb -0.17 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 31.20 2pb4 s PRO 145 CO -0.07 0.13 0.58 0.25 0.04 0.00 0.00 177.00 177.93 2pb4 n THR 146 N 1.27 0.00 -0.13 1.26 -2.24 -1.26 -4.89 114.28 108.29 2pb4 n THR 146 Ca -0.00 -0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.92 2pb4 n THR 146 Cb 0.44 0.92 0.51 0.00 -2.10 0.00 0.00 70.33 70.11 2pb4 n THR 146 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2pb4 h SER 147 N 0.00 0.37 0.05 3.42 4.64 -1.95 0.21 113.55 120.28 2pb4 h SER 147 Ca 0.00 0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2pb4 h SER 147 Cb 1.06 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 63.09 2pb4 h SER 147 CO 0.00 0.20 -0.02 0.10 -0.87 0.00 0.00 176.83 176.24 2pb4 h TYR 148 N 0.40 0.00 -0.29 4.77 -0.00 -1.90 -0.01 116.97 119.94 2pb4 h TYR 148 Ca 0.33 0.00 -0.19 0.00 0.00 0.00 0.00 58.73 58.88 2pb4 h TYR 148 Cb 0.74 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.47 2pb4 h TYR 148 CO -0.00 0.02 -0.55 -0.92 -0.00 0.00 0.00 178.16 176.71 2pb4 h TYR 149 N 0.00 1.11 -0.08 0.10 5.03 -1.34 -2.61 116.97 119.18 2pb4 h TYR 149 Ca -0.00 -0.40 -0.10 0.00 2.58 0.00 0.00 58.73 60.81 2pb4 h TYR 149 Cb 0.05 -0.21 -0.01 0.00 1.55 0.00 0.00 36.73 38.11 2pb4 h TYR 149 CO 0.00 1.23 -0.42 -0.44 -1.32 0.00 0.00 178.16 177.21 2pb4 h ASP 150 N 0.67 0.18 0.02 -2.11 3.32 -1.02 -1.78 116.42 115.69 2pb4 h ASP 150 Ca 0.01 -0.07 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 2pb4 h ASP 150 Cb 1.16 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.66 2pb4 h ASP 150 CO 0.12 0.58 -0.01 0.58 -1.72 0.00 0.00 179.24 178.79 2pb4 h VAL 151 N 0.14 1.12 -0.51 -1.35 2.07 -1.20 -1.05 116.25 115.48 2pb4 h VAL 151 Ca 0.01 -0.43 0.08 0.00 0.82 0.00 0.00 66.70 67.18 2pb4 h VAL 151 Cb 0.80 1.41 -0.06 0.00 -1.52 0.00 0.00 31.29 31.92 2pb4 h VAL 151 CO 0.06 0.11 0.14 0.40 0.02 0.00 0.00 177.57 178.30 2pb4 h ILE 152 N -0.21 0.77 0.03 4.57 2.04 -1.29 -0.95 117.51 122.46 2pb4 h ILE 152 Ca -0.00 -0.10 0.02 0.00 1.00 0.00 0.00 64.86 65.78 2pb4 h ILE 152 Cb 0.20 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 36.69 2pb4 h ILE 152 CO 0.00 0.05 -0.18 0.50 0.00 0.00 0.00 178.15 178.53 2pb4 h LYS 153 N 0.30 -0.29 -0.69 2.37 3.64 -1.01 -0.74 116.57 120.15 2pb4 h LYS 153 Ca 0.25 0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.61 2pb4 h LYS 153 Cb 0.31 0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 2pb4 h LYS 153 CO -0.29 -0.19 0.25 0.93 -2.27 0.00 0.00 179.45 177.87 2pb4 h GLU 154 N -0.30 1.03 0.48 1.90 4.39 -0.84 -1.95 114.58 119.29 2pb4 h GLU 154 Ca 0.05 -0.19 -0.02 0.00 0.34 0.00 0.00 59.36 59.53 2pb4 h GLU 154 Cb 0.36 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 2pb4 h GLU 154 CO -0.15 0.86 -0.23 -0.91 -1.16 0.00 0.00 179.01 177.42 2pb4 h ASN 155 N 1.00 -0.55 -0.78 1.42 2.35 -0.95 -3.07 115.58 115.00 2pb4 h ASN 155 Ca 0.23 -0.07 0.13 0.00 -0.55 0.00 0.00 56.30 56.03 2pb4 h ASN 155 Cb 0.23 0.14 -0.05 0.00 0.05 0.00 0.00 38.32 38.69 2pb4 h ASN 155 CO -0.01 -0.16 0.52 0.00 -1.65 0.00 0.00 177.43 176.12 2pb4 h ALA 156 N -0.76 1.92 -0.72 -0.83 0.00 -1.09 0.10 119.26 117.88 2pb4 h ALA 156 Ca -0.07 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.88 2pb4 h ALA 156 Cb 0.59 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 2pb4 h ALA 156 CO 0.11 -0.12 0.47 1.49 0.00 0.00 0.00 179.25 181.21 2pb4 h GLU 157 N 0.58 0.84 -0.65 0.00 4.81 -1.37 -1.03 114.58 117.76 2pb4 h GLU 157 Ca 0.38 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.56 2pb4 h GLU 157 Cb 0.66 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.85 2pb4 h GLU 157 CO -0.14 0.56 0.00 0.54 -0.73 0.00 0.00 179.01 179.23 2pb4 n ARG 158 N -4.46 3.37 -1.82 1.92 1.74 0.14 -4.93 116.66 112.63 2pb4 n ARG 158 Ca 0.09 -2.57 -0.08 0.00 -0.77 0.00 0.00 57.85 54.52 2pb4 n ARG 158 Cb 0.13 -1.80 -0.01 0.00 -1.02 0.00 0.00 32.46 29.75 2pb4 n ARG 158 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2pb4 n GLY 159 N 1.14 0.38 3.71 -0.13 0.00 -0.39 -5.03 105.19 104.87 2pb4 n GLY 159 Ca 0.23 -0.61 -0.28 0.00 0.00 0.00 0.00 46.02 45.37 2pb4 n GLY 159 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2pb4 s LEU 160 N -2.07 3.51 0.43 0.99 1.43 -0.03 -4.46 118.68 118.47 2pb4 s LEU 160 Ca 0.00 -0.24 -0.14 0.00 -1.03 0.00 0.00 54.13 52.72 2pb4 s LEU 160 Cb 0.00 -2.18 -0.08 0.00 0.03 0.00 0.00 46.19 43.97 2pb4 s LEU 160 CO 0.00 0.12 0.84 -1.00 0.23 0.00 0.00 176.35 176.54 2pb4 s HIS 161 N -1.58 3.44 -0.19 0.29 3.76 0.06 -3.16 115.29 117.90 2pb4 s HIS 161 Ca 0.28 1.24 0.01 0.00 -0.15 0.00 0.00 55.06 56.44 2pb4 s HIS 161 Cb -0.10 -2.59 0.03 0.00 1.11 0.00 0.00 32.58 31.02 2pb4 s HIS 161 CO 0.20 -0.16 -0.16 0.99 -0.85 0.00 0.00 174.74 174.76 2pb4 s THR 162 N -2.38 1.93 -0.20 1.30 2.01 -0.56 -0.44 115.64 117.31 2pb4 s THR 162 Ca 0.55 -1.01 -0.23 0.00 0.31 0.00 0.00 61.69 61.30 2pb4 s THR 162 Cb -0.10 -1.84 -0.02 0.00 0.01 0.00 0.00 72.50 70.55 2pb4 s THR 162 CO 0.28 0.38 0.76 -0.22 -0.69 0.00 0.00 174.62 175.13 2pb4 s LEU 163 N 1.31 4.14 -0.25 4.42 2.96 -1.26 -1.78 118.68 128.21 2pb4 s LEU 163 Ca 0.02 1.02 -0.02 0.00 -0.22 0.00 0.00 54.13 54.93 2pb4 s LEU 163 Cb -0.15 -3.10 0.02 0.00 0.50 0.00 0.00 46.19 43.47 2pb4 s LEU 163 CO -0.11 -0.38 -0.04 -0.76 -1.32 0.00 0.00 176.35 173.74 2pb4 s LEU 164 N 2.23 3.27 0.21 -0.68 1.43 0.13 -2.41 118.68 122.86 2pb4 s LEU 164 Ca 0.34 -0.86 -0.26 0.00 -1.03 0.00 0.00 54.13 52.32 2pb4 s LEU 164 Cb -0.16 -1.69 -0.08 0.00 0.03 0.00 0.00 46.19 44.29 2pb4 s LEU 164 CO 0.11 -0.14 0.83 -0.36 0.23 0.00 0.00 176.35 177.02 2pb4 s PHE 165 N 1.34 3.89 -0.02 0.29 0.08 -0.14 -2.09 117.98 121.33 2pb4 s PHE 165 Ca 0.00 1.71 -0.02 0.00 0.12 0.00 0.00 56.93 58.74 2pb4 s PHE 165 Cb -0.17 -2.83 -0.04 0.00 -0.57 0.00 0.00 43.02 39.42 2pb4 s PHE 165 CO -0.04 0.46 0.12 -0.51 -0.10 0.00 0.00 175.22 175.15 2pb4 s LEU 166 N -1.32 4.12 0.39 -0.37 1.43 -1.26 0.17 118.68 121.85 2pb4 s LEU 166 Ca 0.39 0.26 -0.24 0.00 -1.03 0.00 0.00 54.13 53.51 2pb4 s LEU 166 Cb -0.23 -2.37 -0.12 0.00 0.03 0.00 0.00 46.19 43.49 2pb4 s LEU 166 CO 0.27 0.29 0.76 -0.67 0.23 0.00 0.00 176.35 177.23 2pb4 n ASP 167 N 1.20 0.09 -3.79 2.29 -0.08 -0.59 -4.74 116.55 110.93 2pb4 n ASP 167 Ca -0.13 1.00 -0.13 0.00 -1.51 0.00 0.00 54.79 54.03 2pb4 n ASP 167 Cb 0.53 -1.20 -0.12 0.00 2.34 0.00 0.00 41.12 42.67 2pb4 n ASP 167 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 2pb4 s ILE 168 N -1.31 -0.00 -0.68 5.18 2.07 -1.26 -1.25 121.20 123.93 2pb4 s ILE 168 Ca 0.63 0.02 0.05 0.00 -1.41 0.00 0.00 60.65 59.93 2pb4 s ILE 168 Cb -0.63 -0.33 0.17 0.00 0.13 0.00 0.00 42.46 41.80 2pb4 s ILE 168 CO 0.58 0.01 0.48 -0.54 -1.91 0.00 0.00 174.94 173.56 2pb4 s LYS 169 N 0.25 2.35 0.15 3.50 1.02 -0.49 -5.00 119.74 121.53 2pb4 s LYS 169 Ca -0.01 -3.26 -0.28 0.00 0.02 0.00 0.00 55.97 52.44 2pb4 s LYS 169 Cb -0.03 -3.28 -0.06 0.00 -0.52 0.00 0.00 37.83 33.94 2pb4 s LYS 169 CO -0.01 -1.29 1.46 0.00 -0.92 0.00 0.00 175.35 174.59 2pb4 n ALA 170 N 2.04 -0.58 -0.13 5.17 0.00 -1.26 -0.02 120.51 125.73 2pb4 n ALA 170 Ca 0.20 0.77 -0.04 0.00 0.00 0.00 0.00 53.44 54.38 2pb4 n ALA 170 Cb 0.36 -0.10 0.03 0.00 0.00 0.00 0.00 19.45 19.74 2pb4 n ALA 170 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2pb4 h GLU 171 N 0.00 0.06 0.00 0.00 9.09 -1.92 0.32 114.58 122.12 2pb4 h GLU 171 Ca 0.15 -0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.55 2pb4 h GLU 171 Cb 0.37 -0.01 0.00 0.00 -1.65 0.00 0.00 28.75 27.46 2pb4 h GLU 171 CO -0.85 0.04 0.00 1.63 0.05 0.00 0.00 179.01 179.87 2pb4 n LYS 172 N -5.25 0.87 -4.07 1.06 5.02 -0.65 -4.89 118.16 110.24 2pb4 n LYS 172 Ca 0.03 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 56.00 2pb4 n LYS 172 Cb 0.23 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.73 2pb4 n LYS 172 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2pb4 n ARG 173 N -1.04 -4.03 -4.58 1.97 1.74 0.11 -4.96 116.66 105.88 2pb4 n ARG 173 Ca 0.21 0.46 -0.33 0.00 -0.77 0.00 0.00 57.85 57.42 2pb4 n ARG 173 Cb 0.12 -5.16 -0.13 0.00 -1.02 0.00 0.00 32.46 26.27 2pb4 n ARG 173 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2pb4 s MET 174 N -6.75 3.52 -0.09 5.56 -1.94 -0.87 -4.99 119.30 113.74 2pb4 s MET 174 Ca 0.60 -0.59 0.01 0.00 -1.71 0.00 0.00 55.69 53.99 2pb4 s MET 174 Cb -0.31 -2.78 -0.02 0.00 2.01 0.00 0.00 34.83 33.72 2pb4 s MET 174 CO 0.89 0.25 -0.10 0.71 -0.01 0.00 0.00 175.02 176.75 2pb4 s TYR 175 N 0.31 2.85 0.04 -0.03 1.51 -1.26 -1.39 117.35 119.39 2pb4 s TYR 175 Ca -0.07 -0.26 -0.30 0.00 -1.01 0.00 0.00 57.07 55.43 2pb4 s TYR 175 Cb -0.15 -1.77 -0.05 0.00 -0.11 0.00 0.00 41.96 39.88 2pb4 s TYR 175 CO 0.04 0.09 1.21 1.41 -1.11 0.00 0.00 175.55 177.18 2pb4 s MET 176 N -0.28 4.41 0.48 -0.62 -2.45 -0.38 -5.03 119.30 115.43 2pb4 s MET 176 Ca 0.03 1.77 -0.04 0.00 -1.25 0.00 0.00 55.69 56.20 2pb4 s MET 176 Cb -0.13 -3.38 -0.03 0.00 1.25 0.00 0.00 34.83 32.54 2pb4 s MET 176 CO 0.03 -0.30 0.76 0.95 1.05 0.00 0.00 175.02 177.51 2pb4 s THR 177 N 1.27 4.66 0.31 10.11 -4.23 -1.26 -4.58 115.64 121.91 2pb4 s THR 177 Ca 0.59 0.02 0.00 0.00 -1.18 0.00 0.00 61.69 61.11 2pb4 s THR 177 Cb -0.29 -3.77 0.27 0.00 1.34 0.00 0.00 72.50 70.06 2pb4 s THR 177 CO 0.28 -0.71 1.94 0.00 -0.54 0.00 0.00 174.62 175.59 2pb4 h ALA 178 N 0.25 1.49 -0.52 3.99 0.00 -1.95 -0.69 119.26 121.83 2pb4 h ALA 178 Ca -0.47 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.42 2pb4 h ALA 178 Cb 1.22 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 2pb4 h ALA 178 CO 0.61 0.41 0.32 -0.91 0.00 0.00 0.00 179.25 179.68 2pb4 h ASN 179 N 1.04 0.53 -0.32 0.00 4.21 -1.90 -0.86 115.58 118.29 2pb4 h ASN 179 Ca 0.35 -0.00 -0.11 0.00 1.21 0.00 0.00 56.30 57.75 2pb4 h ASN 179 Cb 0.08 -0.11 -0.02 0.00 -1.12 0.00 0.00 38.32 37.15 2pb4 h ASN 179 CO -0.11 0.38 -0.18 -0.33 -1.29 0.00 0.00 177.43 175.89 2pb4 h GLU 180 N 0.64 0.78 -0.63 0.81 5.08 -1.63 -2.34 114.58 117.30 2pb4 h GLU 180 Ca 0.20 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 2pb4 h GLU 180 Cb -0.01 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 2pb4 h GLU 180 CO -0.08 0.91 0.37 0.00 -1.00 0.00 0.00 179.01 179.21 2pb4 h ALA 181 N 1.10 0.81 -0.42 3.43 0.00 -0.59 -1.43 119.26 122.15 2pb4 h ALA 181 Ca 0.10 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2pb4 h ALA 181 Cb 0.69 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2pb4 h ALA 181 CO 0.05 0.30 0.22 0.52 0.00 0.00 0.00 179.25 180.34 2pb4 h MET 182 N 0.86 0.59 -0.50 0.00 2.86 -0.96 -1.15 114.93 116.64 2pb4 h MET 182 Ca 0.22 -0.07 0.03 0.00 -2.06 0.00 0.00 59.70 57.82 2pb4 h MET 182 Cb -0.00 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.51 2pb4 h MET 182 CO -0.04 0.49 0.27 0.93 1.06 0.00 0.00 176.91 179.62 2pb4 h GLU 183 N 0.54 0.52 -0.40 1.72 4.39 -1.14 -0.44 114.58 119.77 2pb4 h GLU 183 Ca 0.15 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.82 2pb4 h GLU 183 Cb 0.08 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 2pb4 h GLU 183 CO -0.02 0.35 0.25 -0.07 -1.16 0.00 0.00 179.01 178.36 2pb4 h LEU 184 N 0.54 0.46 -0.93 1.33 3.38 -0.98 -1.26 115.31 117.85 2pb4 h LEU 184 Ca 0.21 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 2pb4 h LEU 184 Cb 0.08 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 2pb4 h LEU 184 CO -0.12 0.35 0.35 -0.07 0.09 0.00 0.00 178.44 179.04 2pb4 h LEU 185 N 0.53 1.02 -1.11 1.67 3.38 -0.74 0.26 115.31 120.32 2pb4 h LEU 185 Ca 0.14 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 2pb4 h LEU 185 Cb -0.04 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 2pb4 h LEU 185 CO -0.03 0.88 -0.03 -0.07 0.09 0.00 0.00 178.44 179.28 2pb4 h LEU 186 N 1.11 0.56 -0.46 1.67 3.38 -0.81 0.13 115.31 120.89 2pb4 h LEU 186 Ca 0.27 -0.12 -0.15 0.00 0.09 0.00 0.00 57.88 57.96 2pb4 h LEU 186 Cb 0.14 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 2pb4 h LEU 186 CO -0.03 0.65 -0.38 0.50 0.09 0.00 0.00 178.44 179.27 2pb4 h LYS 187 N 0.56 0.86 -0.34 1.13 3.64 -0.10 -1.48 116.57 120.85 2pb4 h LYS 187 Ca 0.11 -0.44 -0.11 0.00 -1.27 0.00 0.00 60.65 58.94 2pb4 h LYS 187 Cb 0.40 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 2pb4 h LYS 187 CO 0.02 1.09 -0.26 0.28 -2.27 0.00 0.00 179.45 178.30 2pb4 h VAL 188 N 0.71 1.27 -0.71 2.00 2.07 0.06 -2.89 116.25 118.76 2pb4 h VAL 188 Ca 0.06 -1.36 -0.06 0.00 0.82 0.00 0.00 66.70 66.15 2pb4 h VAL 188 Cb 0.95 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.99 2pb4 h VAL 188 CO 0.09 0.45 0.19 -0.08 0.02 0.00 0.00 177.57 178.24 2pb4 h GLU 189 N 0.59 1.12 0.00 1.57 4.57 -0.54 -0.28 114.58 121.61 2pb4 h GLU 189 Ca 0.08 -0.26 -0.02 0.00 -1.18 0.00 0.00 59.36 57.98 2pb4 h GLU 189 Cb 0.75 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 29.19 2pb4 h GLU 189 CO 0.06 0.98 -0.08 0.22 -1.18 0.00 0.00 179.01 179.01 2pb4 h ASP 190 N 1.06 0.00 0.01 1.04 3.58 -1.08 0.84 116.42 121.87 2pb4 h ASP 190 Ca 0.22 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.56 2pb4 h ASP 190 Cb 0.35 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.38 2pb4 h ASP 190 CO -0.00 0.08 -0.64 0.24 -2.88 0.00 0.00 179.24 176.04 2pb4 h MET 191 N 0.00 0.01 0.00 0.28 2.86 -1.20 -3.39 114.93 113.49 2pb4 h MET 191 Ca -0.00 -0.02 -0.14 0.00 -2.06 0.00 0.00 59.70 57.48 2pb4 h MET 191 Cb 0.16 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.80 2pb4 h MET 191 CO 0.01 1.01 -0.89 0.87 1.06 0.00 0.00 176.91 178.97 2pb4 h LYS 192 N -0.97 0.00 -6.72 1.72 1.57 -0.99 -3.48 116.57 107.69 2pb4 h LYS 192 Ca -0.17 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.06 2pb4 h LYS 192 Cb 1.17 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.44 2pb4 h LYS 192 CO -0.09 0.50 -0.96 1.63 -0.57 0.00 0.00 179.45 179.95 2pb4 n LYS 193 N -3.13 -1.27 -0.07 3.15 5.02 0.29 -4.85 118.16 117.30 2pb4 n LYS 193 Ca -0.02 0.23 0.11 0.00 -2.02 0.00 0.00 58.31 56.61 2pb4 n LYS 193 Cb 0.80 -3.54 0.14 0.00 -0.02 0.00 0.00 35.03 32.41 2pb4 n LYS 193 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2pb4 n GLY 194 N -2.09 1.16 3.00 0.72 0.00 -1.26 -4.95 105.19 101.76 2pb4 n GLY 194 Ca -0.20 -0.66 -0.18 0.00 0.00 0.00 0.00 46.02 44.98 2pb4 n GLY 194 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pb4 n GLY 195 N 1.30 -0.22 0.13 -0.02 0.00 -1.26 -4.94 105.19 100.18 2pb4 n GLY 195 Ca 0.15 0.01 -0.18 0.00 0.00 0.00 0.00 46.02 45.99 2pb4 n GLY 195 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2pb4 n VAL 196 N -4.38 1.49 -3.62 1.61 0.31 -1.26 -4.94 118.33 107.54 2pb4 n VAL 196 Ca -0.02 -0.57 -0.24 0.00 -0.01 0.00 0.00 64.34 63.50 2pb4 n VAL 196 Cb 0.56 -1.43 -0.17 0.00 -0.91 0.00 0.00 33.84 31.89 2pb4 n VAL 196 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 2pb4 s PHE 197 N -2.52 0.14 0.28 3.52 2.19 -1.26 -4.98 117.98 115.36 2pb4 s PHE 197 Ca -0.35 -0.16 0.06 0.00 0.33 0.00 0.00 56.93 56.81 2pb4 s PHE 197 Cb 0.09 -0.63 -0.02 0.00 -1.31 0.00 0.00 43.02 41.15 2pb4 s PHE 197 CO 0.60 -0.44 0.21 0.25 1.83 0.00 0.00 175.22 177.67 2pb4 n THR 198 N 5.29 0.00 0.32 0.12 -2.24 -1.26 -4.61 114.28 111.89 2pb4 n THR 198 Ca -0.06 -1.99 0.19 0.00 -2.27 0.00 0.00 64.05 59.92 2pb4 n THR 198 Cb 0.49 0.95 1.08 0.00 -2.10 0.00 0.00 70.33 70.76 2pb4 n THR 198 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2pb4 h ASP 199 N 1.63 0.00 -0.07 3.42 3.32 -1.99 -0.90 116.42 121.82 2pb4 h ASP 199 Ca -0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.85 2pb4 h ASP 199 Cb 0.99 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.54 2pb4 h ASP 199 CO 0.30 0.00 0.00 0.47 -1.72 0.00 0.00 179.24 178.29 2pb4 n ASP 200 N -3.41 2.30 -4.73 6.45 8.00 -1.26 -1.55 116.55 122.34 2pb4 n ASP 200 Ca -0.03 -1.77 -0.41 0.00 0.71 0.00 0.00 54.79 53.29 2pb4 n ASP 200 Cb 0.08 -0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.12 2pb4 n ASP 200 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2pb4 s THR 201 N -1.94 3.59 -0.04 -3.53 2.01 -0.34 -4.80 115.64 110.60 2pb4 s THR 201 Ca 0.33 1.31 -0.25 0.00 0.31 0.00 0.00 61.69 63.40 2pb4 s THR 201 Cb 0.20 -3.84 -0.04 0.00 0.01 0.00 0.00 72.50 68.84 2pb4 s THR 201 CO 0.31 0.20 0.75 -0.22 -0.69 0.00 0.00 174.62 174.97 2pb4 s LEU 202 N -0.09 4.35 0.18 4.42 2.96 -1.26 -1.08 118.68 128.16 2pb4 s LEU 202 Ca 0.54 1.30 0.02 0.00 -0.22 0.00 0.00 54.13 55.77 2pb4 s LEU 202 Cb -0.33 -3.18 -0.05 0.00 0.50 0.00 0.00 46.19 43.14 2pb4 s LEU 202 CO 0.36 -0.11 -0.00 0.68 -1.32 0.00 0.00 176.35 175.95 2pb4 s VAL 203 N 0.68 0.77 -0.02 1.68 -7.23 0.07 -4.16 120.40 112.19 2pb4 s VAL 203 Ca 0.40 -1.99 0.04 0.00 -1.81 0.00 0.00 61.98 58.62 2pb4 s VAL 203 Cb -0.19 -2.15 -0.01 0.00 0.56 0.00 0.00 36.38 34.60 2pb4 s VAL 203 CO 0.20 -0.46 -0.14 -0.69 -0.31 0.00 0.00 175.10 173.70 2pb4 s VAL 204 N -3.60 1.15 -0.09 1.32 1.01 -0.29 -1.62 120.40 118.28 2pb4 s VAL 204 Ca 0.24 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 61.65 2pb4 s VAL 204 Cb 0.06 -0.97 0.00 0.00 0.00 0.00 0.00 36.38 35.47 2pb4 s VAL 204 CO 0.05 0.33 -0.21 -0.69 0.00 0.00 0.00 175.10 174.58 2pb4 s VAL 205 N -0.21 1.80 -0.13 2.92 1.01 0.16 -1.15 120.40 124.80 2pb4 s VAL 205 Ca 0.03 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.17 2pb4 s VAL 205 Cb -0.07 -1.58 0.01 0.00 0.00 0.00 0.00 36.38 34.74 2pb4 s VAL 205 CO -0.00 0.50 -0.21 -0.22 0.00 0.00 0.00 175.10 175.18 2pb4 s LEU 206 N 0.47 2.01 -0.01 3.92 2.96 -0.66 -1.29 118.68 126.09 2pb4 s LEU 206 Ca -0.17 -0.56 0.05 0.00 -0.22 0.00 0.00 54.13 53.23 2pb4 s LEU 206 Cb -0.17 -1.35 -0.01 0.00 0.50 0.00 0.00 46.19 45.15 2pb4 s LEU 206 CO 0.07 0.07 -0.16 0.00 -1.32 0.00 0.00 176.35 175.01 2pb4 s ALA 207 N 0.80 1.30 -1.33 5.97 0.00 -0.02 -0.72 121.76 127.76 2pb4 s ALA 207 Ca -0.08 -0.68 -0.03 0.00 0.00 0.00 0.00 51.96 51.17 2pb4 s ALA 207 Cb -0.16 -0.33 0.02 0.00 0.00 0.00 0.00 23.12 22.65 2pb4 s ALA 207 CO -0.01 0.32 0.83 0.54 0.00 0.00 0.00 175.76 177.44 2pb4 n ARG 208 N 2.68 -5.49 -1.89 0.00 1.74 -1.14 -1.42 116.66 111.14 2pb4 n ARG 208 Ca -0.14 0.67 -0.40 0.00 -0.77 0.00 0.00 57.85 57.20 2pb4 n ARG 208 Cb 0.55 -5.39 0.00 0.00 -1.02 0.00 0.00 32.46 26.60 2pb4 n ARG 208 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2pb4 s ALA 209 N -3.54 3.35 0.00 7.54 0.00 -1.26 -2.09 121.76 125.76 2pb4 s ALA 209 Ca 0.15 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.54 2pb4 s ALA 209 Cb -0.07 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.48 2pb4 s ALA 209 CO 0.80 -1.03 0.00 0.41 0.00 0.00 0.00 175.76 175.94 2pb4 n GLY 210 N 0.59 2.88 3.75 0.00 0.00 -1.26 -4.13 105.19 107.00 2pb4 n GLY 210 Ca 0.03 -0.71 -0.30 0.00 0.00 0.00 0.00 46.02 45.04 2pb4 n GLY 210 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2pb4 s SER 211 N 0.11 3.93 0.19 1.61 1.04 -0.89 -4.78 113.70 114.90 2pb4 s SER 211 Ca 0.00 1.54 0.25 0.00 0.48 0.00 0.00 55.95 58.22 2pb4 s SER 211 Cb 0.00 -2.24 0.90 0.00 0.10 0.00 0.00 66.02 64.78 2pb4 s SER 211 CO 0.00 -2.36 1.76 0.18 0.98 0.00 0.00 173.24 173.80 2pb4 n LEU 212 N -3.71 0.64 -3.09 2.42 4.77 -1.26 -3.94 117.00 112.84 2pb4 n LEU 212 Ca 0.07 0.59 -0.23 0.00 -0.03 0.00 0.00 56.01 56.42 2pb4 n LEU 212 Cb 0.55 -0.42 -0.04 0.00 -2.33 0.00 0.00 43.42 41.18 2pb4 n LEU 212 CO 0.55 -0.28 -0.05 0.59 -1.33 0.00 0.00 177.39 176.87 2pb4 n ASN 213 N -2.13 2.53 -4.74 -1.43 3.02 -1.26 -5.11 115.26 106.14 2pb4 n ASN 213 Ca 0.05 -3.31 -0.31 0.00 -0.03 0.00 0.00 54.58 50.97 2pb4 n ASN 213 Cb 0.35 -0.60 0.11 0.00 -0.61 0.00 0.00 39.78 39.03 2pb4 n ASN 213 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2pb4 s PRO 214 N -2.85 1.88 -0.27 3.52 0.04 -1.25 -5.01 135.00 131.05 2pb4 s PRO 214 Ca 0.44 1.11 -0.10 0.00 0.04 0.00 0.00 61.00 62.49 2pb4 s PRO 214 Cb 0.31 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.94 2pb4 s PRO 214 CO -0.11 -1.89 0.15 0.99 0.04 0.00 0.00 177.00 176.18 2pb4 s THR 215 N -2.88 4.99 -0.25 1.26 2.01 -0.51 -4.97 115.64 115.30 2pb4 s THR 215 Ca 0.62 0.06 0.01 0.00 0.31 0.00 0.00 61.69 62.70 2pb4 s THR 215 Cb -0.18 -3.36 0.06 0.00 0.01 0.00 0.00 72.50 69.03 2pb4 s THR 215 CO 0.57 0.28 -0.05 -0.63 -0.69 0.00 0.00 174.62 174.10 2pb4 s ILE 216 N 1.67 1.63 -0.03 1.82 1.01 -1.26 -0.84 121.20 125.21 2pb4 s ILE 216 Ca 0.07 -1.35 0.04 0.00 0.00 0.00 0.00 60.65 59.40 2pb4 s ILE 216 Cb -0.16 -1.91 -0.00 0.00 0.01 0.00 0.00 42.46 40.40 2pb4 s ILE 216 CO 0.08 -0.14 -0.13 -0.13 0.00 0.00 0.00 174.94 174.62 2pb4 s ARG 217 N 1.33 1.29 -0.01 2.79 1.81 -0.41 -4.41 118.95 121.34 2pb4 s ARG 217 Ca -0.05 -0.47 0.03 0.00 -1.72 0.00 0.00 55.73 53.52 2pb4 s ARG 217 Cb -0.19 -1.18 -0.01 0.00 -0.45 0.00 0.00 34.95 33.12 2pb4 s ARG 217 CO -0.07 0.22 -0.09 0.00 -0.68 0.00 0.00 175.30 174.68 2pb4 s ALA 218 N -0.04 0.74 0.00 2.13 0.00 -1.06 0.40 121.76 123.93 2pb4 s ALA 218 Ca -0.00 -0.38 0.00 0.00 0.00 0.00 0.00 51.96 51.57 2pb4 s ALA 218 Cb -0.08 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.85 2pb4 s ALA 218 CO 0.01 0.18 0.00 0.41 0.00 0.00 0.00 175.76 176.36 2pb4 n GLY 219 N 2.86 -1.77 3.82 0.00 0.00 -0.64 -3.71 105.19 105.74 2pb4 n GLY 219 Ca -0.13 -1.12 -0.34 0.00 0.00 0.00 0.00 46.02 44.43 2pb4 n GLY 219 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2pb4 s TYR 220 N -2.08 3.37 0.26 1.61 2.02 -1.26 -0.75 117.35 120.52 2pb4 s TYR 220 Ca 0.00 1.62 -0.01 0.00 -0.37 0.00 0.00 57.07 58.31 2pb4 s TYR 220 Cb 0.00 -2.85 0.55 0.00 -0.40 0.00 0.00 41.96 39.26 2pb4 s TYR 220 CO 0.00 -0.05 1.75 0.28 -1.57 0.00 0.00 175.55 175.95 2pb4 h VAL 221 N 2.02 0.68 -0.11 0.71 2.07 -1.06 -0.88 116.25 119.68 2pb4 h VAL 221 Ca -0.49 -0.19 0.03 0.00 0.82 0.00 0.00 66.70 66.87 2pb4 h VAL 221 Cb 1.18 0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 2pb4 h VAL 221 CO 0.62 0.10 0.11 0.07 0.02 0.00 0.00 177.57 178.49 2pb4 h LYS 222 N 0.56 0.00 0.00 1.57 2.10 -1.57 -0.92 116.57 118.31 2pb4 h LYS 222 Ca 0.47 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 59.00 2pb4 h LYS 222 Cb 0.71 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.02 2pb4 h LYS 222 CO -0.39 0.00 -2.00 -0.25 -2.00 0.00 0.00 179.45 174.81 2pb4 n ASP 223 N -4.04 0.13 -0.01 7.07 8.00 -0.41 -4.56 116.55 122.73 2pb4 n ASP 223 Ca -0.00 0.05 0.10 0.00 0.71 0.00 0.00 54.79 55.65 2pb4 n ASP 223 Cb 0.22 1.47 -0.16 0.00 -0.02 0.00 0.00 41.12 42.63 2pb4 n ASP 223 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2pb4 n LEU 224 N -2.48 0.07 0.10 0.64 4.32 -0.76 -4.47 117.00 114.43 2pb4 n LEU 224 Ca -0.12 0.03 0.20 0.00 -0.02 0.00 0.00 56.01 56.10 2pb4 n LEU 224 Cb 0.76 0.03 0.73 0.00 -1.62 0.00 0.00 43.42 43.31 2pb4 n LEU 224 CO 0.45 0.02 1.18 -0.29 -1.22 0.00 0.00 177.39 177.52 2pb4 h ILE 225 N 0.00 0.31 -0.07 -0.08 2.10 -1.42 -0.30 117.51 118.05 2pb4 h ILE 225 Ca -0.04 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.90 2pb4 h ILE 225 Cb 1.08 0.60 0.00 0.00 -1.09 0.00 0.00 36.82 37.42 2pb4 h ILE 225 CO 0.00 0.00 0.00 0.54 -1.08 0.00 0.00 178.15 177.61 2pb4 n ARG 226 N -3.59 2.88 -2.50 2.19 1.74 -1.26 -4.67 116.66 111.45 2pb4 n ARG 226 Ca 0.07 -1.58 -0.33 0.00 -0.77 0.00 0.00 57.85 55.24 2pb4 n ARG 226 Cb 0.66 -1.05 -0.03 0.00 -1.02 0.00 0.00 32.46 31.01 2pb4 n ARG 226 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2pb4 s GLU 227 N -0.98 3.83 -0.40 5.56 2.12 -0.13 -5.01 118.70 123.70 2pb4 s GLU 227 Ca 0.04 1.24 -0.17 0.00 0.36 0.00 0.00 54.97 56.44 2pb4 s GLU 227 Cb 0.02 -2.11 0.01 0.00 0.26 0.00 0.00 34.13 32.32 2pb4 s GLU 227 CO 0.03 -0.39 0.44 0.34 -0.54 0.00 0.00 175.26 175.14 2pb4 s ASP 228 N -2.29 6.21 0.00 -1.70 2.15 -1.26 -4.88 116.67 114.90 2pb4 s ASP 228 Ca 0.65 -0.49 0.24 0.00 0.43 0.00 0.00 52.55 53.37 2pb4 s ASP 228 Cb -0.14 -2.23 0.66 0.00 -0.30 0.00 0.00 42.92 40.91 2pb4 s ASP 228 CO 0.23 -0.53 1.52 0.49 -0.17 0.00 0.00 175.17 176.70 2pb4 n PHE 229 N 5.61 0.18 -1.45 -5.34 3.72 -1.26 -5.06 117.46 113.86 2pb4 n PHE 229 Ca -0.07 -0.09 0.00 0.00 -0.05 0.00 0.00 57.45 57.24 2pb4 n PHE 229 Cb 0.48 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.02 2pb4 n PHE 229 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2pb4 n GLY 230 N 1.26 -1.79 3.79 1.37 0.00 -1.26 -4.85 105.19 103.71 2pb4 n GLY 230 Ca 0.17 -1.78 -0.35 0.00 0.00 0.00 0.00 46.02 44.07 2pb4 n GLY 230 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2pb4 s ASP 231 N -4.00 6.14 1.27 1.61 1.01 -1.26 -5.04 116.67 116.40 2pb4 s ASP 231 Ca 0.00 2.03 -0.19 0.00 0.71 0.00 0.00 52.55 55.10 2pb4 s ASP 231 Cb 0.00 -2.57 0.31 0.00 1.01 0.00 0.00 42.92 41.67 2pb4 s ASP 231 CO 0.00 -0.93 1.01 -2.84 0.21 0.00 0.00 175.17 172.63 2pb4 s PRO 232 N -3.21 -1.75 0.49 8.23 0.02 -1.26 -4.59 135.00 132.92 2pb4 s PRO 232 Ca 0.69 0.26 -0.15 0.00 0.02 0.00 0.00 61.00 61.82 2pb4 s PRO 232 Cb -0.19 -1.50 -0.08 0.00 0.02 0.00 0.00 34.50 32.75 2pb4 s PRO 232 CO 0.23 -4.13 0.93 -1.25 -0.33 0.00 0.00 177.00 172.45 2pb4 s PRO 233 N -5.01 3.91 0.01 5.54 0.04 -1.26 -4.70 135.00 133.54 2pb4 s PRO 233 Ca 0.69 0.84 0.05 0.00 0.04 0.00 0.00 61.00 62.62 2pb4 s PRO 233 Cb -0.15 -2.20 -0.03 0.00 0.04 0.00 0.00 34.50 32.16 2pb4 s PRO 233 CO 0.59 -0.21 -0.14 -1.01 0.04 0.00 0.00 177.00 176.27 2pb4 s HIS 234 N -2.55 2.67 -0.08 0.56 3.76 -1.26 -2.90 115.29 115.48 2pb4 s HIS 234 Ca 0.57 -0.18 0.04 0.00 -0.15 0.00 0.00 55.06 55.34 2pb4 s HIS 234 Cb -0.10 -1.53 0.00 0.00 1.11 0.00 0.00 32.58 32.06 2pb4 s HIS 234 CO 0.31 0.27 -0.21 0.42 -0.85 0.00 0.00 174.74 174.68 2pb4 s ILE 235 N -0.91 1.77 -0.11 0.60 -1.09 0.11 -4.34 121.20 117.23 2pb4 s ILE 235 Ca 0.15 -0.87 -0.01 0.00 -2.23 0.00 0.00 60.65 57.69 2pb4 s ILE 235 Cb -0.11 -1.54 -0.03 0.00 -1.58 0.00 0.00 42.46 39.21 2pb4 s ILE 235 CO 0.05 0.50 -0.06 -0.22 -1.23 0.00 0.00 174.94 173.98 2pb4 s LEU 236 N 0.28 3.17 -0.06 2.97 2.96 -0.89 -1.65 118.68 125.45 2pb4 s LEU 236 Ca -0.13 -0.09 0.03 0.00 -0.22 0.00 0.00 54.13 53.72 2pb4 s LEU 236 Cb -0.16 -1.72 0.01 0.00 0.50 0.00 0.00 46.19 44.82 2pb4 s LEU 236 CO 0.06 0.27 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.59 2pb4 s ILE 237 N -0.24 1.25 -0.50 6.68 1.01 -0.30 0.23 121.20 129.33 2pb4 s ILE 237 Ca 0.03 -0.57 -0.07 0.00 0.00 0.00 0.00 60.65 60.05 2pb4 s ILE 237 Cb -0.13 -1.12 0.13 0.00 0.01 0.00 0.00 42.46 41.36 2pb4 s ILE 237 CO 0.03 0.38 0.35 -0.69 0.00 0.00 0.00 174.94 175.00 2pb4 s VAL 238 N 0.46 3.99 0.55 2.92 1.01 -0.74 -1.13 120.40 127.46 2pb4 s VAL 238 Ca -0.12 -2.07 -0.20 0.00 0.00 0.00 0.00 61.98 59.59 2pb4 s VAL 238 Cb -0.14 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 32.55 2pb4 s VAL 238 CO 0.04 -0.79 1.20 -2.84 0.00 0.00 0.00 175.10 172.71 2pb4 s PRO 239 N 1.03 3.25 0.03 2.72 0.02 -1.26 -1.49 135.00 139.30 2pb4 s PRO 239 Ca 0.09 1.82 -0.00 0.00 0.02 0.00 0.00 61.00 62.93 2pb4 s PRO 239 Cb -0.24 -2.09 0.01 0.00 0.02 0.00 0.00 34.50 32.20 2pb4 s PRO 239 CO -0.02 -0.99 0.05 0.41 -0.33 0.00 0.00 177.00 176.12 2pb4 n GLY 240 N 0.45 -0.56 3.61 0.52 0.00 -1.19 -4.88 105.19 103.14 2pb4 n GLY 240 Ca 0.11 -1.76 -0.45 0.00 0.00 0.00 0.00 46.02 43.92 2pb4 n GLY 240 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2pb4 n LYS 241 N -1.10 1.47 -3.49 1.61 4.81 -1.26 -4.92 118.16 115.28 2pb4 n LYS 241 Ca 0.01 0.52 -0.34 0.00 -0.87 0.00 0.00 58.31 57.63 2pb4 n LYS 241 Cb 0.02 -1.98 -0.05 0.00 0.02 0.00 0.00 35.03 33.04 2pb4 n LYS 241 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2pb4 s LEU 242 N 0.33 4.30 0.33 3.14 1.43 -0.15 -4.91 118.68 123.14 2pb4 s LEU 242 Ca 0.63 0.88 -0.28 0.00 -1.03 0.00 0.00 54.13 54.33 2pb4 s LEU 242 Cb -0.72 -3.25 -0.09 0.00 0.03 0.00 0.00 46.19 42.15 2pb4 s LEU 242 CO 0.57 0.08 1.13 -2.28 0.23 0.00 0.00 176.35 176.08 2pb4 s HIS 243 N -1.54 3.37 0.41 0.29 5.65 -1.26 -4.53 115.29 117.68 2pb4 s HIS 243 Ca 0.38 1.63 0.16 0.00 0.25 0.00 0.00 55.06 57.49 2pb4 s HIS 243 Cb -0.13 -3.33 1.05 0.00 -1.18 0.00 0.00 32.58 28.99 2pb4 s HIS 243 CO 0.20 -0.87 1.86 0.97 -0.65 0.00 0.00 174.74 176.26 2pb4 h ILE 244 N 2.79 0.71 -0.05 0.89 6.09 -1.98 0.28 117.51 126.24 2pb4 h ILE 244 Ca -0.48 -0.15 -0.07 0.00 -1.37 0.00 0.00 64.86 62.79 2pb4 h ILE 244 Cb 1.22 0.23 -0.01 0.00 0.47 0.00 0.00 36.82 38.73 2pb4 h ILE 244 CO 0.65 0.08 -0.29 0.58 -3.07 0.00 0.00 178.15 176.10 2pb4 h VAL 245 N 0.44 1.23 -0.27 2.19 2.07 -1.98 -0.09 116.25 119.85 2pb4 h VAL 245 Ca 0.46 -1.11 -0.09 0.00 0.82 0.00 0.00 66.70 66.78 2pb4 h VAL 245 Cb 1.09 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 32.38 2pb4 h VAL 245 CO -0.18 0.32 -0.20 -0.33 0.02 0.00 0.00 177.57 177.20 2pb4 h GLU 246 N 0.08 0.61 -0.77 1.57 5.08 -0.73 -2.32 114.58 118.11 2pb4 h GLU 246 Ca 0.01 -0.30 -0.02 0.00 -1.00 0.00 0.00 59.36 58.05 2pb4 h GLU 246 Cb 0.57 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 2pb4 h GLU 246 CO 0.04 0.89 0.40 0.00 -1.00 0.00 0.00 179.01 179.34 2pb4 h ALA 247 N 0.71 0.98 -0.75 3.43 0.00 -0.87 -1.41 119.26 121.35 2pb4 h ALA 247 Ca 0.05 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2pb4 h ALA 247 Cb 0.75 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2pb4 h ALA 247 CO 0.05 0.52 0.35 0.93 0.00 0.00 0.00 179.25 181.11 2pb4 h GLU 248 N 1.07 1.08 -0.20 0.00 5.08 -0.96 -1.25 114.58 119.40 2pb4 h GLU 248 Ca 0.27 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2pb4 h GLU 248 Cb 0.07 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 2pb4 h GLU 248 CO -0.04 0.85 0.12 -0.92 -1.00 0.00 0.00 179.01 178.02 2pb4 h TYR 249 N 1.06 0.27 -0.88 4.33 5.03 -1.03 0.01 116.97 125.76 2pb4 h TYR 249 Ca 0.26 -0.00 0.03 0.00 2.58 0.00 0.00 58.73 61.59 2pb4 h TYR 249 Cb 0.13 -0.09 -0.05 0.00 1.55 0.00 0.00 36.73 38.27 2pb4 h TYR 249 CO 0.01 0.23 0.58 -0.07 -1.32 0.00 0.00 178.16 177.58 2pb4 h LEU 250 N 0.24 0.95 0.04 2.82 3.38 -0.91 0.32 115.31 122.14 2pb4 h LEU 250 Ca 0.07 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 2pb4 h LEU 250 Cb 0.04 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.57 2pb4 h LEU 250 CO -0.01 0.66 -0.02 0.58 0.09 0.00 0.00 178.44 179.74 2pb4 h VAL 251 N 1.11 1.32 -0.00 1.22 2.07 -1.05 -0.00 116.25 120.91 2pb4 h VAL 251 Ca 0.34 -1.21 -0.15 0.00 0.82 0.00 0.00 66.70 66.49 2pb4 h VAL 251 Cb -0.00 2.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 2pb4 h VAL 251 CO -0.10 0.30 -0.73 -0.33 0.02 0.00 0.00 177.57 176.74 2pb4 h GLU 252 N -0.59 0.03 0.00 1.57 4.39 -0.84 -3.18 114.58 115.96 2pb4 h GLU 252 Ca -0.01 -0.02 -0.20 0.00 0.34 0.00 0.00 59.36 59.47 2pb4 h GLU 252 Cb 0.54 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.16 2pb4 h GLU 252 CO 0.01 0.74 -1.77 -0.89 -1.16 0.00 0.00 179.01 175.94 2pb4 n ILE 253 N -3.69 0.78 -0.48 3.13 2.08 0.11 -4.69 119.36 116.60 2pb4 n ILE 253 Ca -0.01 -0.36 0.10 0.00 0.56 0.00 0.00 62.75 63.04 2pb4 n ILE 253 Cb 0.71 -0.90 0.32 0.00 -0.75 0.00 0.00 39.64 39.02 2pb4 n ILE 253 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2pb4 n ALA 254 N -2.73 2.68 -1.88 -1.39 0.00 -0.58 -4.94 120.51 111.68 2pb4 n ALA 254 Ca -0.22 -1.45 -0.19 0.00 0.00 0.00 0.00 53.44 51.57 2pb4 n ALA 254 Cb 0.79 -0.89 -0.05 0.00 0.00 0.00 0.00 19.45 19.30 2pb4 n ALA 254 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pb4 n GLY 255 N 1.20 0.96 3.76 0.00 0.00 -0.92 -2.55 105.19 107.64 2pb4 n GLY 255 Ca 0.23 -0.09 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 2pb4 n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pb4 s ALA 256 N -2.81 2.52 0.24 4.61 0.00 -0.12 -4.80 121.76 121.40 2pb4 s ALA 256 Ca 0.00 0.89 -0.30 0.00 0.00 0.00 0.00 51.96 52.55 2pb4 s ALA 256 Cb 0.00 -3.41 -0.09 0.00 0.00 0.00 0.00 23.12 19.61 2pb4 s ALA 256 CO 0.00 -1.17 1.29 -1.25 0.00 0.00 0.00 175.76 174.63 2pb4 s PRO 257 N -3.49 4.41 0.61 0.00 0.04 -1.26 -4.50 135.00 130.80 2pb4 s PRO 257 Ca 0.75 2.08 0.28 0.00 0.04 0.00 0.00 61.00 64.14 2pb4 s PRO 257 Cb -0.27 -3.16 1.43 0.00 0.04 0.00 0.00 34.50 32.54 2pb4 s PRO 257 CO 0.34 -0.19 1.84 0.07 0.04 0.00 0.00 177.00 179.10 2pb4 h ARG 258 N 4.67 0.00 -0.79 4.56 0.11 -1.95 -1.22 114.38 119.76 2pb4 h ARG 258 Ca -0.46 0.00 0.23 0.00 0.10 0.00 0.00 59.98 59.85 2pb4 h ARG 258 Cb 1.22 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.27 2pb4 h ARG 258 CO 0.73 0.00 0.57 1.49 0.10 0.00 0.00 179.97 182.85 2pb4 h GLU 259 N 0.00 0.01 0.00 0.08 4.81 -2.02 0.13 114.58 117.59 2pb4 h GLU 259 Ca 0.19 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.41 2pb4 h GLU 259 Cb 1.22 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.60 2pb4 h GLU 259 CO -0.00 0.01 -0.04 -0.84 -0.73 0.00 0.00 179.01 177.40 2pb4 h ILE 260 N 0.01 0.22 0.00 2.32 3.07 -1.60 -1.20 117.51 120.34 2pb4 h ILE 260 Ca 0.37 -0.34 -0.00 0.00 1.55 0.00 0.00 64.86 66.44 2pb4 h ILE 260 Cb 1.49 1.27 -0.00 0.00 -0.27 0.00 0.00 36.82 39.31 2pb4 h ILE 260 CO -0.01 0.04 -0.01 -0.07 -1.05 0.00 0.00 178.15 177.06 2pb4 h LEU 261 N 0.00 0.00 0.00 0.16 3.38 -1.18 -1.97 115.31 115.70 2pb4 h LEU 261 Ca -0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2pb4 h LEU 261 Cb 0.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2pb4 h LEU 261 CO 0.01 0.01 -1.16 -2.11 0.09 0.00 0.00 178.44 175.28 2pb4 n ARG 262 N -3.14 3.45 0.08 1.13 1.85 -0.87 -4.62 116.66 114.55 2pb4 n ARG 262 Ca -0.02 -0.00 -0.22 0.00 -1.00 0.00 0.00 57.85 56.61 2pb4 n ARG 262 Cb 0.17 -1.06 -0.15 0.00 -1.05 0.00 0.00 32.46 30.37 2pb4 n ARG 262 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 2pb4 h VAL 263 N 0.00 1.31 -0.42 8.89 2.07 -1.24 -3.38 116.25 123.49 2pb4 h VAL 263 Ca -0.06 -2.57 -0.11 0.00 0.82 0.00 0.00 66.70 64.78 2pb4 h VAL 263 Cb 1.14 3.04 -0.06 0.00 -1.52 0.00 0.00 31.29 33.89 2pb4 h VAL 263 CO 0.00 0.76 0.06 0.59 0.02 0.00 0.00 177.57 179.00 2pb4 n ASN 264 N -3.91 3.79 0.00 0.57 4.13 -0.74 -5.05 115.26 114.05 2pb4 n ASN 264 Ca -0.17 -3.27 0.00 0.00 1.68 0.00 0.00 54.58 52.81 2pb4 n ASN 264 Cb 0.96 -0.63 0.00 0.00 -1.54 0.00 0.00 39.78 38.57 2pb4 n ASN 264 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06