#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ocz s ALA 2 N 0.00 3.71 0.27 3.17 0.00 -1.26 -4.83 121.76 122.83 1ocz s ALA 2 Ca 0.00 -0.72 0.06 0.00 0.00 0.00 0.00 51.96 51.30 1ocz s ALA 2 Cb 0.00 -1.80 -0.02 0.00 0.00 0.00 0.00 23.12 21.30 1ocz s ALA 2 CO 0.00 0.63 0.40 1.52 0.00 0.00 0.00 175.76 178.31 1ocz s TYR 3 N -1.04 3.33 0.59 0.00 1.13 -1.26 -5.07 117.35 115.03 1ocz s TYR 3 Ca 0.17 -0.09 -0.19 0.00 -1.41 0.00 0.00 57.07 55.54 1ocz s TYR 3 Cb -0.12 -1.72 -0.03 0.00 -1.10 0.00 0.00 41.96 38.99 1ocz s TYR 3 CO 0.06 0.28 1.25 -2.14 -2.51 0.00 0.00 175.55 172.50 1ocz s PRO 4 N -4.05 2.95 -1.69 -3.49 0.02 -1.26 -3.18 135.00 124.31 1ocz s PRO 4 Ca 0.38 1.96 -0.00 0.00 0.02 0.00 0.00 61.00 63.35 1ocz s PRO 4 Cb -0.09 -2.00 0.00 0.00 0.02 0.00 0.00 34.50 32.43 1ocz s PRO 4 CO 0.30 -1.25 0.06 -1.33 -0.33 0.00 0.00 177.00 174.44 1ocz n MET 5 N -1.48 -1.90 -2.15 5.54 2.81 -1.26 -4.98 117.12 113.70 1ocz n MET 5 Ca 0.13 0.96 -0.38 0.00 -1.81 0.00 0.00 57.70 56.60 1ocz n MET 5 Cb 0.48 -5.59 -0.00 0.00 -0.71 0.00 0.00 33.22 27.40 1ocz n MET 5 CO 0.00 0.00 0.00 -1.14 1.51 0.00 0.00 175.97 176.34 1ocz s GLN 6 N -5.06 3.79 -0.13 0.03 0.74 -1.19 -4.97 119.66 112.87 1ocz s GLN 6 Ca 0.03 1.95 -0.10 0.00 0.05 0.00 0.00 55.36 57.28 1ocz s GLN 6 Cb -0.01 -2.54 -0.06 0.00 1.10 0.00 0.00 33.01 31.50 1ocz s GLN 6 CO 0.03 -0.57 -0.23 1.28 -0.55 0.00 0.00 175.29 175.25 1ocz n LEU 7 N -0.27 1.47 0.00 3.68 4.32 -1.26 -5.10 117.00 119.84 1ocz n LEU 7 Ca 0.06 0.24 0.00 0.00 -0.02 0.00 0.00 56.01 56.29 1ocz n LEU 7 Cb 0.46 -0.57 0.00 0.00 -1.62 0.00 0.00 43.42 41.69 1ocz n LEU 7 CO 0.51 -0.06 0.00 0.61 -1.22 0.00 0.00 177.39 177.23 1ocz n GLY 8 N 2.03 2.86 3.76 -0.72 0.00 -1.26 -5.10 105.19 106.77 1ocz n GLY 8 Ca -0.21 -1.93 -0.34 0.00 0.00 0.00 0.00 46.02 43.53 1ocz n GLY 8 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ocz s PHE 9 N 2.44 2.53 0.42 1.61 0.08 -1.26 -5.01 117.98 118.80 1ocz s PHE 9 Ca 0.00 1.55 -0.23 0.00 0.12 0.00 0.00 56.93 58.37 1ocz s PHE 9 Cb 0.00 -3.29 -0.08 0.00 -0.57 0.00 0.00 43.02 39.08 1ocz s PHE 9 CO 0.00 -1.84 1.09 -0.65 -0.10 0.00 0.00 175.22 173.72 1ocz s GLN 10 N -3.71 4.01 0.15 0.44 -0.21 -1.26 -4.92 119.66 114.16 1ocz s GLN 10 Ca 0.71 1.58 -0.34 0.00 0.02 0.00 0.00 55.36 57.34 1ocz s GLN 10 Cb -0.24 -2.47 -0.16 0.00 1.00 0.00 0.00 33.01 31.14 1ocz s GLN 10 CO 0.36 -0.29 1.15 -0.25 -2.12 0.00 0.00 175.29 174.14 1ocz n ASP 11 N -0.27 1.18 -4.66 5.90 9.92 -1.26 -4.80 116.55 122.56 1ocz n ASP 11 Ca 0.06 1.14 -0.42 0.00 -0.53 0.00 0.00 54.79 55.03 1ocz n ASP 11 Cb 0.49 -1.18 -0.03 0.00 -0.64 0.00 0.00 41.12 39.77 1ocz n ASP 11 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ocz s ALA 12 N -0.12 3.63 -0.93 2.24 0.00 -1.26 -4.73 121.76 120.59 1ocz s ALA 12 Ca 0.76 0.79 0.23 0.00 0.00 0.00 0.00 51.96 53.74 1ocz s ALA 12 Cb -0.90 -3.70 0.18 0.00 0.00 0.00 0.00 23.12 18.70 1ocz s ALA 12 CO 0.52 -1.29 1.17 2.41 0.00 0.00 0.00 175.76 178.57 1ocz n THR 13 N 5.39 0.03 -4.16 0.00 -1.04 0.89 -4.83 114.28 110.55 1ocz n THR 13 Ca 0.16 -0.04 -0.12 0.00 -2.04 0.00 0.00 64.05 62.01 1ocz n THR 13 Cb 0.43 0.50 -0.10 0.00 -1.82 0.00 0.00 70.33 69.34 1ocz n THR 13 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1ocz s SER 14 N -3.16 1.22 0.34 8.00 1.04 -1.25 -2.65 113.70 117.25 1ocz s SER 14 Ca 0.09 -0.91 0.06 0.00 0.48 0.00 0.00 55.95 55.67 1ocz s SER 14 Cb 0.16 0.06 0.73 0.00 0.10 0.00 0.00 66.02 67.07 1ocz s SER 14 CO 0.78 -0.38 1.90 1.55 0.98 0.00 0.00 173.24 178.07 1ocz h PRO 15 N 3.26 0.77 -0.10 4.02 0.13 -1.92 -1.77 132.00 136.39 1ocz h PRO 15 Ca -0.36 -0.05 -0.22 0.00 -0.87 0.00 0.00 66.00 64.51 1ocz h PRO 15 Cb 1.18 -0.17 0.01 0.00 0.13 0.00 0.00 31.00 32.15 1ocz h PRO 15 CO 0.59 0.51 -0.79 -0.84 -0.23 0.00 0.00 178.00 177.23 1ocz h ILE 16 N 0.79 1.30 0.00 -3.56 -0.00 -1.93 0.01 117.51 114.12 1ocz h ILE 16 Ca 0.40 -2.02 0.00 0.00 -0.00 0.00 0.00 64.86 63.24 1ocz h ILE 16 Cb 0.48 2.15 0.00 0.00 -0.00 0.00 0.00 36.82 39.45 1ocz h ILE 16 CO -0.17 0.63 0.00 -0.03 -0.00 0.00 0.00 178.15 178.58 1ocz h MET 17 N 0.41 0.00 0.01 0.16 4.05 -1.53 0.21 114.93 118.24 1ocz h MET 17 Ca -0.07 0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.31 1ocz h MET 17 Cb 1.44 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 32.24 1ocz h MET 17 CO 0.16 0.00 -0.20 0.93 0.23 0.00 0.00 176.91 178.03 1ocz h GLU 18 N 0.00 0.02 -1.00 0.39 5.08 -1.09 -3.17 114.58 114.81 1ocz h GLU 18 Ca 0.00 -0.04 0.22 0.00 -1.00 0.00 0.00 59.36 58.54 1ocz h GLU 18 Cb 0.06 0.01 -0.11 0.00 0.50 0.00 0.00 28.75 29.21 1ocz h GLU 18 CO 0.00 1.02 0.61 1.49 -1.00 0.00 0.00 179.01 181.13 1ocz h GLU 19 N -0.95 0.62 -0.08 2.33 4.57 0.63 -1.09 114.58 120.62 1ocz h GLU 19 Ca -0.05 -0.04 -0.19 0.00 -1.18 0.00 0.00 59.36 57.90 1ocz h GLU 19 Cb 1.08 -0.14 -0.00 0.00 -0.16 0.00 0.00 28.75 29.53 1ocz h GLU 19 CO -0.01 0.41 -0.75 -0.07 -1.18 0.00 0.00 179.01 177.41 1ocz h LEU 20 N 0.64 0.53 -0.75 1.64 3.38 -0.79 -2.39 115.31 117.58 1ocz h LEU 20 Ca 0.60 -0.36 0.09 0.00 0.09 0.00 0.00 57.88 58.30 1ocz h LEU 20 Cb 1.10 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 41.62 1ocz h LEU 20 CO -0.40 1.11 0.41 -0.07 0.09 0.00 0.00 178.44 179.58 1ocz h LEU 21 N 0.30 0.58 -0.27 1.67 3.38 -1.17 0.13 115.31 119.92 1ocz h LEU 21 Ca -0.04 0.05 -0.19 0.00 0.09 0.00 0.00 57.88 57.79 1ocz h LEU 21 Cb 1.34 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.03 1ocz h LEU 21 CO 0.13 0.34 -0.60 0.45 0.09 0.00 0.00 178.44 178.85 1ocz h HIS 22 N 0.71 1.09 -0.07 1.13 3.86 -1.35 -1.50 115.15 119.02 1ocz h HIS 22 Ca 0.36 -0.41 -0.05 0.00 -1.16 0.00 0.00 60.37 59.11 1ocz h HIS 22 Cb 0.32 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 28.59 1ocz h HIS 22 CO -0.08 1.24 -0.17 0.35 0.86 0.00 0.00 177.93 180.13 1ocz h PHE 23 N 0.64 0.12 -0.02 2.45 3.57 -0.89 -0.89 116.94 121.92 1ocz h PHE 23 Ca -0.00 -0.01 -0.19 0.00 3.53 0.00 0.00 57.97 61.30 1ocz h PHE 23 Cb 1.22 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.91 1ocz h PHE 23 CO 0.08 0.28 -0.81 1.25 -2.23 0.00 0.00 178.31 176.88 1ocz h HIS 24 N 0.11 0.31 -0.12 0.41 2.76 -0.60 -1.79 115.15 116.23 1ocz h HIS 24 Ca 0.02 -0.16 -0.01 0.00 -2.20 0.00 0.00 60.37 58.03 1ocz h HIS 24 Cb 0.37 -0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.29 1ocz h HIS 24 CO 0.00 0.93 0.05 -0.44 -1.30 0.00 0.00 177.93 177.18 1ocz h ASP 25 N 0.13 0.16 0.16 3.26 3.32 -0.18 0.38 116.42 123.65 1ocz h ASP 25 Ca -0.04 -0.14 0.02 0.00 0.02 0.00 0.00 57.03 56.89 1ocz h ASP 25 Cb 1.41 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 40.88 1ocz h ASP 25 CO 0.12 0.26 -0.40 -0.74 -1.72 0.00 0.00 179.24 176.76 1ocz h HIS 26 N 0.05 -1.12 0.02 4.55 -0.00 -1.20 0.30 115.15 117.75 1ocz h HIS 26 Ca 0.04 0.03 0.01 0.00 -0.00 0.00 0.00 60.37 60.44 1ocz h HIS 26 Cb 0.14 0.47 -0.01 0.00 -0.00 0.00 0.00 27.41 28.01 1ocz h HIS 26 CO -0.02 -0.51 -0.06 1.15 -0.00 0.00 0.00 177.93 178.49 1ocz h THR 27 N -0.66 0.86 0.00 6.26 2.02 -1.20 -2.30 112.91 117.89 1ocz h THR 27 Ca 0.02 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.19 1ocz h THR 27 Cb 0.67 0.86 -0.00 0.00 -1.74 0.00 0.00 68.15 67.94 1ocz h THR 27 CO -0.21 0.00 -0.03 0.25 0.37 0.00 0.00 175.52 175.90 1ocz h LEU 28 N -0.11 0.00 -0.16 2.58 5.85 0.20 -0.79 115.31 122.88 1ocz h LEU 28 Ca 0.02 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 1ocz h LEU 28 Cb 0.13 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 1ocz h LEU 28 CO -0.05 0.03 -0.02 -0.03 -0.34 0.00 0.00 178.44 178.03 1ocz h MET 29 N 0.00 0.30 -0.32 1.25 4.05 0.16 -2.86 114.93 117.51 1ocz h MET 29 Ca -0.00 -0.11 -0.02 0.00 -0.28 0.00 0.00 59.70 59.29 1ocz h MET 29 Cb 0.12 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 30.89 1ocz h MET 29 CO 0.00 0.56 0.11 0.82 0.23 0.00 0.00 176.91 178.63 1ocz h ILE 30 N 0.02 1.20 -0.02 1.77 2.04 -0.96 -2.18 117.51 119.38 1ocz h ILE 30 Ca 0.04 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.27 1ocz h ILE 30 Cb 0.44 1.01 -0.00 0.00 -0.74 0.00 0.00 36.82 37.53 1ocz h ILE 30 CO 0.01 0.22 0.01 -0.37 0.00 0.00 0.00 178.15 178.03 1ocz h VAL 31 N 0.37 0.68 -0.16 1.67 -1.51 -1.31 -0.84 116.25 115.15 1ocz h VAL 31 Ca 0.11 0.00 -0.13 0.00 -1.23 0.00 0.00 66.70 65.45 1ocz h VAL 31 Cb 0.23 0.99 0.00 0.00 -2.13 0.00 0.00 31.29 30.38 1ocz h VAL 31 CO -0.00 0.00 -0.40 -0.26 -1.23 0.00 0.00 177.57 175.68 1ocz h PHE 32 N 0.00 0.71 0.61 5.19 0.04 -1.19 -1.47 116.94 120.83 1ocz h PHE 32 Ca 0.01 -0.27 -0.02 0.00 2.80 0.00 0.00 57.97 60.48 1ocz h PHE 32 Cb 0.04 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.04 1ocz h PHE 32 CO 0.00 1.02 -0.51 1.25 -0.60 0.00 0.00 178.31 179.47 1ocz h LEU 33 N 0.20 -1.36 0.11 1.54 5.85 -0.59 -1.28 115.31 119.77 1ocz h LEU 33 Ca -0.00 0.10 0.01 0.00 0.84 0.00 0.00 57.88 58.83 1ocz h LEU 33 Cb 1.01 0.43 -0.02 0.00 0.37 0.00 0.00 40.66 42.45 1ocz h LEU 33 CO 0.09 -0.71 -0.16 0.40 -0.34 0.00 0.00 178.44 177.72 1ocz h ILE 34 N -1.09 0.63 0.00 4.05 1.08 -1.38 0.27 117.51 121.06 1ocz h ILE 34 Ca -0.08 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.38 1ocz h ILE 34 Cb 0.92 0.63 -0.00 0.00 -3.07 0.00 0.00 36.82 35.30 1ocz h ILE 34 CO -0.01 0.00 -0.04 0.77 -0.69 0.00 0.00 178.15 178.18 1ocz h SER 35 N -0.32 0.00 0.50 1.72 4.64 -1.23 0.51 113.55 119.37 1ocz h SER 35 Ca 0.02 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.05 1ocz h SER 35 Cb 0.33 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.38 1ocz h SER 35 CO -0.08 0.04 -1.64 0.77 -0.87 0.00 0.00 176.83 175.05 1ocz h SER 36 N 0.00 0.09 -0.29 4.97 4.64 -0.68 -2.95 113.55 119.33 1ocz h SER 36 Ca -0.00 -0.17 -0.01 0.00 -0.47 0.00 0.00 61.79 61.13 1ocz h SER 36 Cb 0.19 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 1ocz h SER 36 CO 0.01 1.15 0.13 0.25 -0.87 0.00 0.00 176.83 177.49 1ocz h LEU 37 N 0.02 0.40 -0.53 5.97 5.85 0.66 -1.71 115.31 125.96 1ocz h LEU 37 Ca -0.27 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.27 1ocz h LEU 37 Cb 1.99 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.89 1ocz h LEU 37 CO 0.09 0.44 0.22 0.58 -0.34 0.00 0.00 178.44 179.43 1ocz h VAL 38 N 0.33 1.22 0.00 1.05 2.07 -1.06 -1.79 116.25 118.06 1ocz h VAL 38 Ca 0.10 -0.67 -0.05 0.00 0.82 0.00 0.00 66.70 66.90 1ocz h VAL 38 Cb 0.16 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1ocz h VAL 38 CO -0.01 0.26 -0.22 0.25 0.02 0.00 0.00 177.57 177.87 1ocz h LEU 39 N 0.72 0.00 0.43 2.57 5.85 -1.34 -2.00 115.31 121.53 1ocz h LEU 39 Ca 0.18 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 1ocz h LEU 39 Cb 0.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.23 1ocz h LEU 39 CO -0.02 0.22 -0.21 0.22 -0.34 0.00 0.00 178.44 178.32 1ocz h TYR 40 N 0.00 -0.53 -0.97 1.25 5.03 -0.96 -2.41 116.97 118.37 1ocz h TYR 40 Ca -0.00 -0.01 0.25 0.00 2.58 0.00 0.00 58.73 61.55 1ocz h TYR 40 Cb 0.39 0.18 -0.13 0.00 1.55 0.00 0.00 36.73 38.71 1ocz h TYR 40 CO 0.00 -0.33 0.53 0.82 -1.32 0.00 0.00 178.16 177.86 1ocz h ILE 41 N -1.09 0.48 0.28 1.81 1.08 -1.30 0.10 117.51 118.87 1ocz h ILE 41 Ca -0.06 -0.17 -0.01 0.00 -0.39 0.00 0.00 64.86 64.23 1ocz h ILE 41 Cb 0.44 -0.05 0.00 0.00 -3.07 0.00 0.00 36.82 34.14 1ocz h ILE 41 CO 0.10 0.09 -0.13 0.40 -0.69 0.00 0.00 178.15 177.91 1ocz h ILE 42 N 0.49 0.76 -0.02 -0.67 2.04 -1.42 -0.90 117.51 117.79 1ocz h ILE 42 Ca 0.64 -0.28 -0.04 0.00 1.00 0.00 0.00 64.86 66.18 1ocz h ILE 42 Cb 1.25 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 38.24 1ocz h ILE 42 CO -0.51 0.06 -0.18 0.77 0.00 0.00 0.00 178.15 178.29 1ocz h SER 43 N -0.52 0.03 0.28 1.72 4.64 -0.71 -2.03 113.55 116.96 1ocz h SER 43 Ca -0.04 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.26 1ocz h SER 43 Cb 0.39 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1ocz h SER 43 CO 0.06 0.21 -0.13 0.25 -0.87 0.00 0.00 176.83 176.35 1ocz h LEU 44 N 0.03 -0.31 -1.42 5.97 5.85 -0.61 -1.80 115.31 123.02 1ocz h LEU 44 Ca 0.01 -0.08 0.11 0.00 0.84 0.00 0.00 57.88 58.75 1ocz h LEU 44 Cb 0.34 0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.39 1ocz h LEU 44 CO 0.02 -0.11 0.50 0.24 -0.34 0.00 0.00 178.44 178.76 1ocz h MET 45 N -0.51 0.62 -0.01 1.25 2.86 -0.61 0.34 114.93 118.87 1ocz h MET 45 Ca -0.04 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1ocz h MET 45 Cb 0.38 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.90 1ocz h MET 45 CO 0.06 0.41 -0.10 1.28 1.06 0.00 0.00 176.91 179.62 1ocz n LEU 46 N -4.50 0.94 -2.30 1.22 4.77 -0.82 -4.40 117.00 111.92 1ocz n LEU 46 Ca 0.13 -0.25 -0.31 0.00 -0.03 0.00 0.00 56.01 55.55 1ocz n LEU 46 Cb 0.37 -0.08 0.05 0.00 -2.33 0.00 0.00 43.42 41.43 1ocz n LEU 46 CO 0.32 0.17 0.96 0.35 -1.33 0.00 0.00 177.39 177.86 1ocz n THR 47 N -0.48 3.18 -3.80 -5.08 -2.24 0.11 -4.99 114.28 100.98 1ocz n THR 47 Ca 0.16 -3.64 -0.12 0.00 -2.27 0.00 0.00 64.05 58.19 1ocz n THR 47 Cb 0.31 -1.17 -0.09 0.00 -2.10 0.00 0.00 70.33 67.28 1ocz n THR 47 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1ocz s THR 48 N -4.83 0.08 -0.52 4.28 -1.32 -1.26 -5.03 115.64 107.04 1ocz s THR 48 Ca 0.58 -0.65 0.23 0.00 -1.21 0.00 0.00 61.69 60.64 1ocz s THR 48 Cb 0.46 -0.72 -0.06 0.00 -1.51 0.00 0.00 72.50 70.67 1ocz s THR 48 CO -0.05 -0.36 1.07 0.29 -2.21 0.00 0.00 174.62 173.37 1ocz n LYS 49 N 1.03 0.37 -1.90 7.08 4.76 -1.26 -4.92 118.16 123.31 1ocz n LYS 49 Ca -0.21 0.03 -0.42 0.00 -2.87 0.00 0.00 58.31 54.85 1ocz n LYS 49 Cb 0.57 -1.65 -0.03 0.00 -1.84 0.00 0.00 35.03 32.08 1ocz n LYS 49 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1ocz s LEU 50 N -4.29 4.37 0.35 -0.35 1.43 -1.26 -5.02 118.68 113.91 1ocz s LEU 50 Ca 0.03 2.68 0.08 0.00 -1.03 0.00 0.00 54.13 55.89 1ocz s LEU 50 Cb 0.13 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.71 1ocz s LEU 50 CO 0.78 -0.84 0.13 0.42 0.23 0.00 0.00 176.35 177.08 1ocz s THR 51 N 0.95 2.90 -0.39 5.49 -4.23 -1.26 -5.07 115.64 114.03 1ocz s THR 51 Ca 0.69 -1.73 -0.02 0.00 -1.18 0.00 0.00 61.69 59.45 1ocz s THR 51 Cb -0.45 -2.95 0.20 0.00 1.34 0.00 0.00 72.50 70.64 1ocz s THR 51 CO 0.34 -0.17 0.95 -2.28 -0.54 0.00 0.00 174.62 172.92 1ocz s HIS 52 N -2.45 -0.79 -2.45 3.99 5.04 -1.26 -5.04 115.29 112.33 1ocz s HIS 52 Ca 0.38 -0.17 0.25 0.00 -1.54 0.00 0.00 55.06 53.98 1ocz s HIS 52 Cb -0.02 0.15 0.39 0.00 0.04 0.00 0.00 32.58 33.15 1ocz s HIS 52 CO 0.22 -0.60 1.36 0.25 -2.34 0.00 0.00 174.74 173.63 1ocz n THR 53 N 3.03 0.00 -0.99 0.89 -2.24 -1.26 -4.94 114.28 108.77 1ocz n THR 53 Ca 0.12 -0.33 -0.28 0.00 -2.27 0.00 0.00 64.05 61.29 1ocz n THR 53 Cb 0.62 1.07 0.24 0.00 -2.10 0.00 0.00 70.33 70.15 1ocz n THR 53 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1ocz n SER 54 N 0.43 -2.12 -4.75 3.42 3.41 -1.26 -4.95 113.62 107.80 1ocz n SER 54 Ca 0.13 -1.12 -0.38 0.00 -0.26 0.00 0.00 58.87 57.24 1ocz n SER 54 Cb 0.48 -0.95 0.04 0.00 -0.26 0.00 0.00 64.21 63.51 1ocz n SER 54 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1ocz s THR 55 N -2.84 2.17 0.03 6.66 -1.32 -1.26 -5.04 115.64 114.04 1ocz s THR 55 Ca 0.67 0.13 0.06 0.00 -1.21 0.00 0.00 61.69 61.33 1ocz s THR 55 Cb -0.07 -3.06 -0.02 0.00 -1.51 0.00 0.00 72.50 67.84 1ocz s THR 55 CO 0.52 -0.00 -0.16 -0.04 -2.21 0.00 0.00 174.62 172.72 1ocz s MET 56 N -2.87 1.11 0.06 7.08 1.00 -1.26 -5.14 119.30 119.28 1ocz s MET 56 Ca 0.70 -0.78 -0.30 0.00 0.00 0.00 0.00 55.69 55.31 1ocz s MET 56 Cb -0.39 -1.14 -0.05 0.00 0.00 0.00 0.00 34.83 33.25 1ocz s MET 56 CO 0.47 0.29 0.98 0.34 0.00 0.00 0.00 175.02 177.10 1ocz s ASP 57 N -1.04 7.42 0.55 3.03 2.15 -1.26 -5.06 116.67 122.46 1ocz s ASP 57 Ca 0.04 1.75 0.07 0.00 0.43 0.00 0.00 52.55 54.84 1ocz s ASP 57 Cb -0.08 -2.58 0.07 0.00 -0.30 0.00 0.00 42.92 40.03 1ocz s ASP 57 CO 0.01 -0.17 0.58 0.00 -0.17 0.00 0.00 175.17 175.42 1ocz n ALA 58 N 3.33 1.01 0.00 3.66 0.00 -1.26 -4.77 120.51 122.48 1ocz n ALA 58 Ca 0.04 -2.10 0.00 0.00 0.00 0.00 0.00 53.44 51.38 1ocz n ALA 58 Cb 0.50 0.73 0.00 0.00 0.00 0.00 0.00 19.45 20.68 1ocz n ALA 58 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1ocz n GLN 59 N -1.98 0.00 -0.20 0.00 6.02 -1.26 -4.46 117.38 115.49 1ocz n GLN 59 Ca 0.07 0.00 0.28 0.00 -0.01 0.00 0.00 57.00 57.34 1ocz n GLN 59 Cb 0.60 -0.06 0.70 0.00 1.02 0.00 0.00 30.24 32.50 1ocz n GLN 59 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.06 177.10 1ocz h GLU 60 N 0.00 0.06 0.00 -1.09 -0.00 -2.02 0.48 114.58 112.01 1ocz h GLU 60 Ca 0.00 -0.00 -0.37 0.00 -0.00 0.00 0.00 59.36 58.99 1ocz h GLU 60 Cb 0.00 -0.01 -0.07 0.00 -0.00 0.00 0.00 28.75 28.67 1ocz h GLU 60 CO 0.00 0.04 -2.39 1.55 -0.00 0.00 0.00 179.01 178.21 1ocz n VAL 61 N -4.30 1.40 0.25 -1.06 3.14 -1.26 -4.21 118.33 112.29 1ocz n VAL 61 Ca 0.19 -0.84 0.11 0.00 -2.96 0.00 0.00 64.34 60.85 1ocz n VAL 61 Cb 0.96 -0.53 0.53 0.00 -1.06 0.00 0.00 33.84 33.73 1ocz n VAL 61 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1ocz n GLU 62 N -2.79 0.16 0.04 1.45 1.02 0.13 -1.12 120.64 119.52 1ocz n GLU 62 Ca -0.34 0.55 -0.16 0.00 -0.02 0.00 0.00 57.16 57.19 1ocz n GLU 62 Cb 1.15 -1.91 -0.06 0.00 -0.02 0.00 0.00 31.44 30.60 1ocz n GLU 62 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 1ocz h THR 63 N 0.00 1.34 0.84 2.62 1.35 -0.52 -3.12 112.91 115.42 1ocz h THR 63 Ca 0.00 -2.26 -0.04 0.00 -0.55 0.00 0.00 66.41 63.56 1ocz h THR 63 Cb 0.14 2.28 0.01 0.00 -1.73 0.00 0.00 68.15 68.85 1ocz h THR 63 CO 0.00 0.69 -0.40 0.40 -0.25 0.00 0.00 175.52 175.96 1ocz h ILE 64 N 0.34 0.01 0.00 6.82 2.04 -1.35 0.46 117.51 125.83 1ocz h ILE 64 Ca -0.08 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.61 1ocz h ILE 64 Cb 1.54 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.63 1ocz h ILE 64 CO 0.17 0.00 0.00 -2.67 0.00 0.00 0.00 178.15 175.65 1ocz n TRP 65 N -5.52 0.00 0.00 1.37 2.14 -0.96 -1.79 117.44 112.68 1ocz n TRP 65 Ca -0.14 -0.19 0.00 0.00 2.07 0.00 0.00 57.50 59.24 1ocz n TRP 65 Cb 0.45 -0.15 0.00 0.00 -0.81 0.00 0.00 31.31 30.80 1ocz n TRP 65 CO 0.00 0.00 0.00 -2.37 2.07 0.00 0.00 177.69 177.39 1ocz n THR 66 N 0.41 0.00 -0.03 -1.67 5.66 -1.12 -4.72 114.28 112.81 1ocz n THR 66 Ca 0.00 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.89 1ocz n THR 66 Cb 0.28 -0.85 0.02 0.00 -1.55 0.00 0.00 70.33 68.23 1ocz n THR 66 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 175.07 172.42 1ocz h ILE 67 N 0.00 1.30 0.79 1.09 5.03 -0.65 -3.20 117.51 121.87 1ocz h ILE 67 Ca 0.00 -1.77 -0.04 0.00 -0.12 0.00 0.00 64.86 62.94 1ocz h ILE 67 Cb 0.53 1.71 0.00 0.00 -3.03 0.00 0.00 36.82 36.03 1ocz h ILE 67 CO 0.00 0.56 -0.44 0.25 -0.68 0.00 0.00 178.15 177.84 1ocz h LEU 68 N 0.52 -1.09 -1.91 1.44 5.85 -1.57 -2.57 115.31 115.98 1ocz h LEU 68 Ca 0.01 0.05 0.18 0.00 0.84 0.00 0.00 57.88 58.96 1ocz h LEU 68 Cb 1.11 0.31 -0.03 0.00 0.37 0.00 0.00 40.66 42.41 1ocz h LEU 68 CO 0.11 -0.71 0.47 -0.65 -0.34 0.00 0.00 178.44 177.33 1ocz h PRO 69 N -1.14 0.09 -0.45 5.25 0.11 -1.81 0.85 132.00 134.89 1ocz h PRO 69 Ca -0.10 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.92 1ocz h PRO 69 Cb 0.90 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.97 1ocz h PRO 69 CO 0.13 0.06 -0.06 0.00 -0.21 0.00 0.00 178.00 177.92 1ocz h ALA 70 N 1.67 1.06 0.03 -0.75 0.00 -1.49 -0.93 119.26 118.86 1ocz h ALA 70 Ca 0.32 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ocz h ALA 70 Cb 1.15 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1ocz h ALA 70 CO -0.03 0.58 -0.02 0.82 0.00 0.00 0.00 179.25 180.60 1ocz h ILE 71 N 0.71 1.20 -0.94 0.00 2.04 -0.46 -2.73 117.51 117.32 1ocz h ILE 71 Ca 0.13 -0.73 0.10 0.00 1.00 0.00 0.00 64.86 65.36 1ocz h ILE 71 Cb 0.52 1.68 -0.07 0.00 -0.74 0.00 0.00 36.82 38.21 1ocz h ILE 71 CO 0.03 0.19 0.60 0.40 0.00 0.00 0.00 178.15 179.37 1ocz h ILE 72 N -0.36 0.96 -0.32 -0.67 2.04 -1.09 0.91 117.51 118.98 1ocz h ILE 72 Ca -0.00 -0.32 -0.09 0.00 1.00 0.00 0.00 64.86 65.44 1ocz h ILE 72 Cb 0.34 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.34 1ocz h ILE 72 CO 0.01 0.17 -0.19 -0.07 0.00 0.00 0.00 178.15 178.07 1ocz h LEU 73 N 0.94 0.59 -1.08 1.44 3.38 -1.16 -1.66 115.31 117.76 1ocz h LEU 73 Ca 0.44 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 58.15 1ocz h LEU 73 Cb 0.42 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1ocz h LEU 73 CO -0.20 0.79 -0.10 0.40 0.09 0.00 0.00 178.44 179.41 1ocz h ILE 74 N 0.53 1.23 0.00 1.22 2.04 -0.54 0.21 117.51 122.20 1ocz h ILE 74 Ca 0.08 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 64.94 1ocz h ILE 74 Cb 0.63 1.10 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 1ocz h ILE 74 CO 0.04 0.33 0.00 0.18 0.00 0.00 0.00 178.15 178.71 1ocz n LEU 75 N -4.21 0.55 -0.11 1.44 4.77 -0.60 -2.23 117.00 116.60 1ocz n LEU 75 Ca 0.01 0.64 -0.23 0.00 -0.03 0.00 0.00 56.01 56.40 1ocz n LEU 75 Cb 0.32 -0.58 -0.08 0.00 -2.33 0.00 0.00 43.42 40.74 1ocz n LEU 75 CO 0.40 -0.54 -1.26 -0.38 -1.33 0.00 0.00 177.39 174.29 1ocz n ILE 76 N -2.12 1.22 -0.34 -0.08 5.41 -0.79 -4.57 119.36 118.10 1ocz n ILE 76 Ca 0.02 -0.33 0.10 0.00 1.00 0.00 0.00 62.75 63.55 1ocz n ILE 76 Cb 0.20 -1.74 0.28 0.00 -0.71 0.00 0.00 39.64 37.68 1ocz n ILE 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ocz h ALA 77 N -0.71 1.52 0.64 -1.39 0.00 -0.57 -1.69 119.26 117.06 1ocz h ALA 77 Ca -0.56 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 1ocz h ALA 77 Cb 1.52 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 19.24 1ocz h ALA 77 CO -0.31 -0.03 -0.31 -0.07 0.00 0.00 0.00 179.25 178.53 1ocz h LEU 78 N 0.75 -0.73 -0.51 0.00 3.38 -1.68 0.18 115.31 116.69 1ocz h LEU 78 Ca 0.53 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.52 1ocz h LEU 78 Cb 0.77 0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.68 1ocz h LEU 78 CO -0.36 -0.44 0.30 -0.65 0.09 0.00 0.00 178.44 177.37 1ocz h PRO 79 N -0.98 0.57 0.02 1.13 0.11 -1.76 -0.16 132.00 130.93 1ocz h PRO 79 Ca -0.09 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.00 1ocz h PRO 79 Cb 0.69 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.65 1ocz h PRO 79 CO 0.14 0.38 -0.11 1.03 -0.21 0.00 0.00 178.00 179.23 1ocz h SER 80 N 0.59 -0.31 -0.82 -2.05 0.87 -1.19 -1.44 113.55 109.19 1ocz h SER 80 Ca 0.21 0.04 0.05 0.00 -1.23 0.00 0.00 61.79 60.86 1ocz h SER 80 Cb 0.05 0.13 -0.06 0.00 -0.44 0.00 0.00 62.40 62.08 1ocz h SER 80 CO -0.11 -0.16 0.51 -0.07 -0.53 0.00 0.00 176.83 176.48 1ocz h LEU 81 N -0.20 0.83 0.22 2.23 3.38 -0.31 -0.64 115.31 120.82 1ocz h LEU 81 Ca 0.03 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.02 1ocz h LEU 81 Cb 0.24 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 1ocz h LEU 81 CO -0.10 0.55 -0.38 -0.09 0.09 0.00 0.00 178.44 178.51 1ocz h ARG 82 N 0.97 -0.66 -0.41 1.13 2.43 -0.40 -1.65 114.38 115.79 1ocz h ARG 82 Ca 0.35 0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.61 1ocz h ARG 82 Cb 0.10 0.15 -0.05 0.00 -0.42 0.00 0.00 29.97 29.75 1ocz h ARG 82 CO -0.15 -0.44 0.13 0.82 -1.51 0.00 0.00 179.97 178.83 1ocz h ILE 83 N -0.68 0.85 -0.50 1.20 2.04 -0.92 -1.88 117.51 117.62 1ocz h ILE 83 Ca 0.00 -0.10 0.10 0.00 1.00 0.00 0.00 64.86 65.87 1ocz h ILE 83 Cb 0.67 0.54 -0.10 0.00 -0.74 0.00 0.00 36.82 37.19 1ocz h ILE 83 CO -0.16 0.05 -0.13 0.25 0.00 0.00 0.00 178.15 178.15 1ocz h LEU 84 N 0.29 -0.49 -0.28 1.44 5.85 -0.21 0.54 115.31 122.44 1ocz h LEU 84 Ca 0.19 0.15 -0.06 0.00 0.84 0.00 0.00 57.88 59.01 1ocz h LEU 84 Cb 0.19 0.32 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 1ocz h LEU 84 CO -0.21 -0.17 -0.06 1.88 -0.34 0.00 0.00 178.44 179.54 1ocz h TYR 85 N -0.01 0.60 -0.95 1.25 0.05 -1.25 -2.24 116.97 114.43 1ocz h TYR 85 Ca 0.24 -0.13 0.21 0.00 0.05 0.00 0.00 58.73 59.10 1ocz h TYR 85 Cb 0.38 -0.15 -0.08 0.00 1.01 0.00 0.00 36.73 37.89 1ocz h TYR 85 CO -0.43 0.73 0.61 1.98 -1.05 0.00 0.00 178.16 180.00 1ocz h MET 86 N 0.30 0.49 0.16 4.88 1.85 -0.42 0.16 114.93 122.35 1ocz h MET 86 Ca 0.07 -0.03 -0.01 0.00 -0.61 0.00 0.00 59.70 59.13 1ocz h MET 86 Cb 0.53 -0.11 0.00 0.00 0.43 0.00 0.00 31.60 32.46 1ocz h MET 86 CO 0.03 0.32 -0.08 0.52 -0.40 0.00 0.00 176.91 177.31 1ocz h MET 87 N 0.50 -0.20 -2.13 0.39 2.86 -0.64 -2.85 114.93 112.86 1ocz h MET 87 Ca 0.51 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 58.17 1ocz h MET 87 Cb 1.14 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.84 1ocz h MET 87 CO -0.24 0.20 0.06 -3.47 1.06 0.00 0.00 176.91 174.52 1ocz n ASP 88 N -4.97 0.00 -3.61 1.22 2.03 0.04 -4.24 116.55 107.01 1ocz n ASP 88 Ca -0.09 -0.97 -0.29 0.00 0.52 0.00 0.00 54.79 53.96 1ocz n ASP 88 Cb 0.26 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.53 1ocz n ASP 88 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 1ocz s GLU 89 N 1.95 1.05 0.02 -0.67 -1.05 -1.08 -4.97 118.70 113.96 1ocz s GLU 89 Ca 0.00 -1.83 -0.28 0.00 -0.15 0.00 0.00 54.97 52.71 1ocz s GLU 89 Cb 0.00 -1.96 -0.16 0.00 -0.44 0.00 0.00 34.13 31.57 1ocz s GLU 89 CO 0.00 -1.20 1.27 0.97 0.95 0.00 0.00 175.26 177.25 1ocz h ILE 90 N 5.10 0.31 -6.06 1.83 2.10 -1.87 -3.50 117.51 115.42 1ocz h ILE 90 Ca 0.04 -0.33 0.00 0.00 1.08 0.00 0.00 64.86 65.65 1ocz h ILE 90 Cb 0.93 0.42 0.00 0.00 -1.09 0.00 0.00 36.82 37.08 1ocz h ILE 90 CO 0.41 0.04 -0.20 0.59 -1.08 0.00 0.00 178.15 177.91 1ocz n ASN 91 N -5.33 -7.27 -3.39 2.19 3.02 -1.26 -4.55 115.26 98.67 1ocz n ASN 91 Ca -0.12 0.83 -0.32 0.00 -0.03 0.00 0.00 54.58 54.94 1ocz n ASN 91 Cb 0.34 -1.51 0.03 0.00 -0.61 0.00 0.00 39.78 38.03 1ocz n ASN 91 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1ocz n ASN 92 N 2.26 -5.98 -4.80 6.41 2.04 -1.26 -5.03 115.26 108.90 1ocz n ASN 92 Ca 0.00 -0.08 -0.34 0.00 -0.44 0.00 0.00 54.58 53.73 1ocz n ASN 92 Cb 0.10 -2.45 -0.04 0.00 -2.53 0.00 0.00 39.78 34.86 1ocz n ASN 92 CO 0.00 0.00 0.00 -2.16 -0.44 0.00 0.00 177.26 174.66 1ocz s PRO 93 N -2.66 3.85 -0.22 -0.53 0.04 -1.26 -4.80 135.00 129.42 1ocz s PRO 93 Ca 0.33 1.33 0.13 0.00 0.04 0.00 0.00 61.00 62.83 1ocz s PRO 93 Cb -0.04 -2.10 0.45 0.00 0.04 0.00 0.00 34.50 32.85 1ocz s PRO 93 CO 0.86 -0.38 1.35 -1.13 0.04 0.00 0.00 177.00 177.73 1ocz n SER 94 N -0.92 2.64 -3.63 6.66 3.41 -0.76 -4.99 113.62 116.02 1ocz n SER 94 Ca 0.09 -3.49 -0.03 0.00 -0.26 0.00 0.00 58.87 55.18 1ocz n SER 94 Cb 0.53 -0.55 -0.04 0.00 -0.26 0.00 0.00 64.21 63.88 1ocz n SER 94 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1ocz s LEU 95 N -3.08 -0.07 -0.21 1.04 2.96 -1.26 -5.03 118.68 113.03 1ocz s LEU 95 Ca 0.40 0.07 -0.04 0.00 -0.22 0.00 0.00 54.13 54.34 1ocz s LEU 95 Cb 0.36 1.18 0.09 0.00 0.50 0.00 0.00 46.19 48.32 1ocz s LEU 95 CO 0.01 -0.08 0.19 -0.89 -1.32 0.00 0.00 176.35 174.26 1ocz s THR 96 N -1.22 -0.25 0.19 3.68 2.01 -1.26 -1.83 115.64 116.96 1ocz s THR 96 Ca 0.08 -0.23 0.05 0.00 0.31 0.00 0.00 61.69 61.90 1ocz s THR 96 Cb -0.01 -0.71 -0.04 0.00 0.01 0.00 0.00 72.50 71.75 1ocz s THR 96 CO -0.06 -0.30 0.22 -0.69 -0.69 0.00 0.00 174.62 173.09 1ocz s VAL 97 N 2.26 4.82 0.23 3.82 1.01 -0.55 -4.36 120.40 127.62 1ocz s VAL 97 Ca 0.06 -1.03 0.09 0.00 0.00 0.00 0.00 61.98 61.11 1ocz s VAL 97 Cb -0.16 -3.52 -0.05 0.00 0.00 0.00 0.00 36.38 32.66 1ocz s VAL 97 CO -0.16 -0.19 -0.17 -0.54 0.00 0.00 0.00 175.10 174.05 1ocz s LYS 98 N -3.42 1.45 -0.01 2.72 1.02 0.21 -1.90 119.74 119.82 1ocz s LYS 98 Ca 0.33 -1.63 -0.08 0.00 0.02 0.00 0.00 55.97 54.61 1ocz s LYS 98 Cb -0.10 -1.39 0.01 0.00 -0.52 0.00 0.00 37.83 35.83 1ocz s LYS 98 CO 0.26 0.25 0.16 -0.08 -0.92 0.00 0.00 175.35 175.02 1ocz s THR 99 N -2.69 0.07 -0.06 2.17 -1.32 -0.57 -0.95 115.64 112.28 1ocz s THR 99 Ca 0.24 -0.57 -0.02 0.00 -1.21 0.00 0.00 61.69 60.13 1ocz s THR 99 Cb -0.03 -0.42 0.03 0.00 -1.51 0.00 0.00 72.50 70.57 1ocz s THR 99 CO 0.10 -0.31 0.06 -0.04 -2.21 0.00 0.00 174.62 172.22 1ocz s MET 100 N -1.15 0.00 0.33 7.08 -1.94 -0.01 -2.03 119.30 121.57 1ocz s MET 100 Ca -0.12 0.28 -0.29 0.00 -1.71 0.00 0.00 55.69 53.85 1ocz s MET 100 Cb -0.06 -0.77 -0.10 0.00 2.01 0.00 0.00 34.83 35.91 1ocz s MET 100 CO 0.02 -0.38 1.26 0.20 -0.01 0.00 0.00 175.02 176.10 1ocz s GLY 101 N 2.15 3.01 0.10 -0.03 0.00 0.94 -1.77 107.32 111.71 1ocz s GLY 101 Ca 0.04 1.17 0.02 0.00 0.00 0.00 0.00 44.72 45.95 1ocz s GLY 101 CO -0.04 1.80 -0.07 0.30 0.00 0.00 0.00 173.10 175.09 1ocz s HIS 102 N -1.16 0.89 -0.90 1.90 3.76 -0.40 -1.31 115.29 118.07 1ocz s HIS 102 Ca 0.49 -0.89 -0.25 0.00 -0.15 0.00 0.00 55.06 54.25 1ocz s HIS 102 Cb -0.38 -0.51 -0.08 0.00 1.11 0.00 0.00 32.58 32.72 1ocz s HIS 102 CO 0.50 -0.14 2.08 -0.65 -0.85 0.00 0.00 174.74 175.68 1ocz s GLN 103 N -3.73 2.24 0.00 1.40 -0.21 -1.26 -2.48 119.66 115.62 1ocz s GLN 103 Ca 0.11 -0.14 0.00 0.00 0.02 0.00 0.00 55.36 55.35 1ocz s GLN 103 Cb 0.04 -5.00 0.00 0.00 1.00 0.00 0.00 33.01 29.06 1ocz s GLN 103 CO -0.04 -3.80 0.00 0.91 -2.12 0.00 0.00 175.29 170.24 1ocz n TRP 104 N 15.52 0.00 0.00 0.91 8.01 -1.26 -5.08 117.44 135.53 1ocz n TRP 104 Ca 0.42 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.61 1ocz n TRP 104 Cb 0.46 -1.08 0.00 0.00 -2.01 0.00 0.00 31.31 28.68 1ocz n TRP 104 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 177.69 179.16 1ocz n TYR 105 N -0.90 0.00 -4.93 -5.99 0.18 -1.03 -4.81 117.16 99.67 1ocz n TYR 105 Ca 0.00 0.00 -0.32 0.00 1.88 0.00 0.00 57.90 59.46 1ocz n TYR 105 Cb 0.32 0.00 -0.14 0.00 -0.38 0.00 0.00 39.34 39.14 1ocz n TYR 105 CO 0.00 0.00 0.00 -1.58 -2.08 0.00 0.00 176.86 173.20 1ocz s TRP 106 N -2.00 2.56 -0.03 -3.48 0.52 -1.07 -1.27 118.94 114.17 1ocz s TRP 106 Ca 0.00 -0.26 0.03 0.00 0.02 0.00 0.00 56.10 55.89 1ocz s TRP 106 Cb 0.00 -1.54 -0.03 0.00 -1.15 0.00 0.00 33.47 30.75 1ocz s TRP 106 CO 0.00 0.15 -0.09 -1.54 0.02 0.00 0.00 176.95 175.48 1ocz s SER 107 N -0.91 4.44 0.08 2.95 1.04 -0.73 -0.51 113.70 120.07 1ocz s SER 107 Ca 0.12 -0.13 0.08 0.00 0.48 0.00 0.00 55.95 56.50 1ocz s SER 107 Cb -0.10 -1.03 -0.04 0.00 0.10 0.00 0.00 66.02 64.95 1ocz s SER 107 CO 0.01 0.32 -0.19 -0.31 0.98 0.00 0.00 173.24 174.06 1ocz s TYR 108 N -0.87 2.53 -0.09 5.02 1.51 -0.03 -0.83 117.35 124.59 1ocz s TYR 108 Ca 0.14 -0.27 -0.02 0.00 -1.01 0.00 0.00 57.07 55.91 1ocz s TYR 108 Cb -0.11 -1.39 0.03 0.00 -0.11 0.00 0.00 41.96 40.38 1ocz s TYR 108 CO 0.04 0.32 0.01 -1.21 -1.11 0.00 0.00 175.55 173.60 1ocz s GLU 109 N -1.83 0.55 -0.25 -0.62 2.02 -0.13 -2.11 118.70 116.34 1ocz s GLU 109 Ca 0.16 0.06 -0.05 0.00 0.02 0.00 0.00 54.97 55.16 1ocz s GLU 109 Cb -0.10 -1.10 -0.01 0.00 0.10 0.00 0.00 34.13 33.02 1ocz s GLU 109 CO 0.08 -0.35 0.02 0.71 0.02 0.00 0.00 175.26 175.73 1ocz s TYR 110 N 1.98 3.05 0.00 1.61 1.51 0.67 -0.62 117.35 125.55 1ocz s TYR 110 Ca 0.04 -0.86 0.13 0.00 -1.01 0.00 0.00 57.07 55.37 1ocz s TYR 110 Cb -0.13 -2.18 0.21 0.00 -0.11 0.00 0.00 41.96 39.76 1ocz s TYR 110 CO -0.06 -0.52 1.07 0.25 -1.11 0.00 0.00 175.55 175.18 1ocz n THR 111 N 4.84 0.00 -0.27 -0.71 -2.24 -1.26 -1.67 114.28 112.97 1ocz n THR 111 Ca -0.17 -0.50 -0.03 0.00 -2.27 0.00 0.00 64.05 61.09 1ocz n THR 111 Cb 0.50 0.73 0.09 0.00 -2.10 0.00 0.00 70.33 69.55 1ocz n THR 111 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1ocz h ASP 112 N 0.50 0.80 0.00 3.42 3.32 -1.94 -3.43 116.42 119.09 1ocz h ASP 112 Ca -0.13 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.91 1ocz h ASP 112 Cb 1.64 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 41.01 1ocz h ASP 112 CO 0.04 0.55 0.00 -1.22 -1.72 0.00 0.00 179.24 176.89 1ocz n TYR 113 N -4.62 0.00 -1.44 4.55 4.01 -1.26 -5.09 117.16 113.31 1ocz n TYR 113 Ca 0.09 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.53 1ocz n TYR 113 Cb 0.08 0.00 0.10 0.00 -0.31 0.00 0.00 39.34 39.22 1ocz n TYR 113 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 1ocz s GLU 114 N 0.12 1.84 -1.07 -0.72 2.56 -1.26 -4.95 118.70 115.21 1ocz s GLU 114 Ca 0.00 0.70 -0.03 0.00 0.00 0.00 0.00 54.97 55.64 1ocz s GLU 114 Cb 0.00 -1.89 0.31 0.00 2.00 0.00 0.00 34.13 34.55 1ocz s GLU 114 CO 0.00 -1.81 1.60 -0.25 -0.56 0.00 0.00 175.26 174.24 1ocz n ASP 115 N -3.57 6.68 -4.66 -1.70 9.92 -1.26 -4.15 116.55 117.80 1ocz n ASP 115 Ca 0.07 -3.48 -0.43 0.00 -0.53 0.00 0.00 54.79 50.42 1ocz n ASP 115 Cb 0.56 -1.25 -0.02 0.00 -0.64 0.00 0.00 41.12 39.77 1ocz n ASP 115 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1ocz s LEU 116 N -3.14 4.21 -0.17 0.64 2.96 -0.67 -4.95 118.68 117.55 1ocz s LEU 116 Ca 0.34 1.78 -0.08 0.00 -0.22 0.00 0.00 54.13 55.94 1ocz s LEU 116 Cb 0.09 -3.54 0.07 0.00 0.50 0.00 0.00 46.19 43.31 1ocz s LEU 116 CO 0.04 -0.78 0.40 -0.94 -1.32 0.00 0.00 176.35 173.76 1ocz s SER 117 N 2.14 -0.39 0.26 3.68 1.04 -1.26 -0.24 113.70 118.93 1ocz s SER 117 Ca 0.57 0.90 0.02 0.00 0.48 0.00 0.00 55.95 57.92 1ocz s SER 117 Cb -0.24 0.93 -0.04 0.00 0.10 0.00 0.00 66.02 66.77 1ocz s SER 117 CO 0.17 -0.21 0.18 0.72 0.98 0.00 0.00 173.24 175.09 1ocz s PHE 118 N 1.81 1.41 0.59 5.02 -0.71 -0.90 -4.98 117.98 120.22 1ocz s PHE 118 Ca -0.07 -1.47 0.08 0.00 -1.04 0.00 0.00 56.93 54.43 1ocz s PHE 118 Cb -0.10 -0.65 0.09 0.00 -1.21 0.00 0.00 43.02 41.15 1ocz s PHE 118 CO -0.12 -0.70 0.82 -0.51 -1.34 0.00 0.00 175.22 173.36 1ocz s ASP 119 N -3.26 5.00 -0.29 1.98 1.11 -1.26 -0.85 116.67 119.10 1ocz s ASP 119 Ca 0.39 -0.74 0.04 0.00 0.18 0.00 0.00 52.55 52.42 1ocz s ASP 119 Cb 0.05 0.19 0.18 0.00 1.07 0.00 0.00 42.92 44.41 1ocz s ASP 119 CO 0.18 -1.40 0.51 -0.55 1.18 0.00 0.00 175.17 175.09 1ocz s SER 120 N -4.66 -0.78 0.20 0.27 0.15 0.34 -4.55 113.70 104.67 1ocz s SER 120 Ca 0.62 0.01 0.07 0.00 0.70 0.00 0.00 55.95 57.35 1ocz s SER 120 Cb -0.06 1.65 -0.04 0.00 -1.71 0.00 0.00 66.02 65.87 1ocz s SER 120 CO 0.40 -0.32 0.09 -0.31 1.20 0.00 0.00 173.24 174.29 1ocz s TYR 121 N 2.71 2.98 0.37 3.44 1.51 -1.26 -2.59 117.35 124.51 1ocz s TYR 121 Ca 0.11 -0.10 -0.25 0.00 -1.01 0.00 0.00 57.07 55.82 1ocz s TYR 121 Cb -0.11 -1.40 -0.09 0.00 -0.11 0.00 0.00 41.96 40.24 1ocz s TYR 121 CO -0.27 0.53 1.00 1.41 -1.11 0.00 0.00 175.55 177.12 1ocz s MET 122 N -3.29 4.35 -0.36 -0.62 -2.45 -1.26 0.37 119.30 116.04 1ocz s MET 122 Ca 0.30 1.42 -0.27 0.00 -1.25 0.00 0.00 55.69 55.90 1ocz s MET 122 Cb -0.09 -2.64 0.02 0.00 1.25 0.00 0.00 34.83 33.37 1ocz s MET 122 CO 0.22 0.04 0.96 0.42 1.05 0.00 0.00 175.02 177.72 1ocz s ILE 123 N -1.66 4.56 0.21 10.11 1.01 0.15 -4.77 121.20 130.80 1ocz s ILE 123 Ca 0.55 1.32 -0.31 0.00 0.00 0.00 0.00 60.65 62.20 1ocz s ILE 123 Cb -0.20 -4.36 -0.15 0.00 0.01 0.00 0.00 42.46 37.76 1ocz s ILE 123 CO 0.26 -0.54 1.05 -2.65 0.00 0.00 0.00 174.94 173.05 1ocz n PRO 124 N 6.83 1.10 -0.41 2.79 -0.02 -1.26 -4.79 135.00 139.23 1ocz n PRO 124 Ca 0.08 0.39 0.33 0.00 -2.02 0.00 0.00 63.50 62.28 1ocz n PRO 124 Cb 0.48 -1.79 0.62 0.00 -0.02 0.00 0.00 33.50 32.78 1ocz n PRO 124 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1ocz h THR 125 N 2.28 0.24 0.76 3.45 2.02 -1.94 -0.27 112.91 119.44 1ocz h THR 125 Ca -0.41 -0.06 -0.04 0.00 0.77 0.00 0.00 66.41 66.68 1ocz h THR 125 Cb 1.35 0.06 0.01 0.00 -1.74 0.00 0.00 68.15 67.83 1ocz h THR 125 CO 0.65 0.03 -0.36 0.77 0.37 0.00 0.00 175.52 176.98 1ocz h SER 126 N 0.16 -0.86 0.00 4.18 4.64 -1.96 -2.99 113.55 116.73 1ocz h SER 126 Ca 0.75 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 62.10 1ocz h SER 126 Cb 2.29 0.22 0.00 0.00 -0.31 0.00 0.00 62.40 64.60 1ocz h SER 126 CO -0.37 -0.60 0.00 -0.62 -0.87 0.00 0.00 176.83 174.37 1ocz n GLU 127 N -4.84 0.22 -3.19 4.77 1.02 -0.12 -4.77 120.64 113.73 1ocz n GLU 127 Ca -0.13 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 56.63 1ocz n GLU 127 Cb 0.40 -1.12 -0.06 0.00 -0.02 0.00 0.00 31.44 30.65 1ocz n GLU 127 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1ocz s LEU 128 N 0.00 4.39 -0.06 -4.62 1.43 -1.13 -4.84 118.68 113.85 1ocz s LEU 128 Ca 0.00 1.14 -0.19 0.00 -1.03 0.00 0.00 54.13 54.05 1ocz s LEU 128 Cb 0.00 -2.93 -0.05 0.00 0.03 0.00 0.00 46.19 43.25 1ocz s LEU 128 CO 0.00 0.06 0.53 -0.54 0.23 0.00 0.00 176.35 176.63 1ocz s LYS 129 N 0.01 4.29 -0.10 1.70 1.02 -1.26 -4.96 119.74 120.44 1ocz s LYS 129 Ca 0.31 0.58 -0.26 0.00 0.02 0.00 0.00 55.97 56.63 1ocz s LYS 129 Cb -0.18 -3.38 -0.12 0.00 -0.52 0.00 0.00 37.83 33.63 1ocz s LYS 129 CO 0.17 0.29 0.76 -2.30 -0.92 0.00 0.00 175.35 173.34 1ocz n PRO 130 N 3.13 0.00 0.00 -1.68 -0.02 -1.26 -1.51 135.00 133.67 1ocz n PRO 130 Ca -0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 1ocz n PRO 130 Cb 0.51 -0.92 0.00 0.00 -0.02 0.00 0.00 33.50 33.08 1ocz n PRO 130 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ocz n GLY 131 N 1.41 1.98 3.77 -1.23 0.00 -1.26 -5.06 105.19 104.79 1ocz n GLY 131 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1ocz n GLY 131 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ocz s GLU 132 N -0.99 4.50 -0.21 1.61 2.02 -0.57 -4.97 118.70 120.10 1ocz s GLU 132 Ca 0.00 1.63 -0.29 0.00 0.02 0.00 0.00 54.97 56.33 1ocz s GLU 132 Cb 0.00 -2.95 -0.03 0.00 0.10 0.00 0.00 34.13 31.25 1ocz s GLU 132 CO 0.00 0.13 1.57 -0.51 0.02 0.00 0.00 175.26 176.47 1ocz s LEU 133 N -1.86 3.96 0.18 1.80 1.43 -1.26 -4.93 118.68 117.99 1ocz s LEU 133 Ca 0.49 1.65 -0.05 0.00 -1.03 0.00 0.00 54.13 55.19 1ocz s LEU 133 Cb -0.27 -3.53 0.29 0.00 0.03 0.00 0.00 46.19 42.71 1ocz s LEU 133 CO 0.34 -1.18 1.00 -1.14 0.23 0.00 0.00 176.35 175.61 1ocz n ARG 134 N 7.51 -0.06 0.00 1.70 0.63 -1.26 -2.45 116.66 122.72 1ocz n ARG 134 Ca 0.18 1.00 0.00 0.00 -0.92 0.00 0.00 57.85 58.11 1ocz n ARG 134 Cb 0.45 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.86 1ocz n ARG 134 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1ocz n LEU 135 N -5.05 1.17 0.01 6.15 4.77 -1.26 -4.50 117.00 118.29 1ocz n LEU 135 Ca 0.10 -1.17 0.11 0.00 -0.03 0.00 0.00 56.01 55.03 1ocz n LEU 135 Cb 0.32 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.38 1ocz n LEU 135 CO -0.08 0.29 -0.09 0.18 -1.33 0.00 0.00 177.39 176.37 1ocz n LEU 136 N -0.10 0.63 -4.72 2.23 4.77 -1.03 -4.68 117.00 114.11 1ocz n LEU 136 Ca 0.00 -0.16 -0.42 0.00 -0.03 0.00 0.00 56.01 55.40 1ocz n LEU 136 Cb 0.06 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.05 1ocz n LEU 136 CO 0.00 0.10 0.84 -1.61 -1.33 0.00 0.00 177.39 175.40 1ocz s GLU 137 N -3.17 4.48 0.09 3.23 0.41 -1.14 -4.66 118.70 117.93 1ocz s GLU 137 Ca 0.04 1.72 0.09 0.00 -0.41 0.00 0.00 54.97 56.41 1ocz s GLU 137 Cb 0.15 -3.34 -0.04 0.00 -1.78 0.00 0.00 34.13 29.12 1ocz s GLU 137 CO 0.83 -0.17 -0.22 0.54 -0.49 0.00 0.00 175.26 175.75 1ocz s VAL 138 N 0.79 2.52 0.20 2.63 0.11 -1.26 0.29 120.40 125.68 1ocz s VAL 138 Ca 0.56 -1.49 -0.09 0.00 -2.93 0.00 0.00 61.98 58.03 1ocz s VAL 138 Cb -0.29 -2.09 0.13 0.00 -1.53 0.00 0.00 36.38 32.60 1ocz s VAL 138 CO 0.30 0.20 1.76 -2.24 -3.33 0.00 0.00 175.10 171.80 1ocz h ASP 139 N 4.16 1.00 -3.80 3.54 2.03 -0.39 -3.40 116.42 119.56 1ocz h ASP 139 Ca -0.49 -0.17 -0.66 0.00 -0.73 0.00 0.00 57.03 54.98 1ocz h ASP 139 Cb 1.16 -0.26 -0.37 0.00 -0.83 0.00 0.00 39.33 39.03 1ocz h ASP 139 CO 0.44 0.90 -0.80 0.20 -1.03 0.00 0.00 179.24 178.95 1ocz s ASN 140 N -6.26 4.31 0.41 4.15 -0.87 -1.26 -5.02 114.94 110.40 1ocz s ASN 140 Ca -0.13 -1.34 -0.23 0.00 -1.57 0.00 0.00 52.86 49.60 1ocz s ASN 140 Cb 0.15 -1.50 -0.09 0.00 -0.02 0.00 0.00 41.25 39.79 1ocz s ASN 140 CO 0.82 -0.19 1.03 -0.13 -2.57 0.00 0.00 177.10 176.07 1ocz s ARG 141 N 1.15 4.14 -0.37 -0.60 0.52 -1.26 -4.76 118.95 117.77 1ocz s ARG 141 Ca -0.08 1.44 -0.26 0.00 -0.52 0.00 0.00 55.73 56.31 1ocz s ARG 141 Cb -0.20 -2.45 0.02 0.00 0.52 0.00 0.00 34.95 32.84 1ocz s ARG 141 CO -0.05 -0.15 0.94 0.14 0.02 0.00 0.00 175.30 176.19 1ocz s VAL 142 N -1.76 4.57 -0.01 3.52 -7.23 -0.26 -4.85 120.40 114.38 1ocz s VAL 142 Ca 0.59 1.22 -0.20 0.00 -1.81 0.00 0.00 61.98 61.78 1ocz s VAL 142 Cb -0.20 -4.34 -0.05 0.00 0.56 0.00 0.00 36.38 32.35 1ocz s VAL 142 CO 0.25 -0.55 0.59 -0.69 -0.31 0.00 0.00 175.10 174.39 1ocz s VAL 143 N 3.50 4.93 0.03 1.32 1.01 -1.26 -0.46 120.40 129.47 1ocz s VAL 143 Ca 0.39 1.23 -0.06 0.00 0.00 0.00 0.00 61.98 63.53 1ocz s VAL 143 Cb -0.12 -3.92 -0.01 0.00 0.00 0.00 0.00 36.38 32.33 1ocz s VAL 143 CO 0.19 0.42 0.12 -0.76 0.00 0.00 0.00 175.10 175.06 1ocz s LEU 144 N -0.16 1.69 -0.43 3.92 1.43 -0.37 -4.96 118.68 119.80 1ocz s LEU 144 Ca 0.31 -0.43 -0.29 0.00 -1.03 0.00 0.00 54.13 52.69 1ocz s LEU 144 Cb -0.18 0.66 0.01 0.00 0.03 0.00 0.00 46.19 46.71 1ocz s LEU 144 CO 0.17 -0.48 1.40 -2.16 0.23 0.00 0.00 176.35 175.51 1ocz s PRO 145 N -2.28 3.56 0.85 1.29 0.04 -1.26 -2.02 135.00 135.18 1ocz s PRO 145 Ca -0.08 0.88 -0.13 0.00 0.04 0.00 0.00 61.00 61.70 1ocz s PRO 145 Cb -0.03 -4.03 0.04 0.00 0.04 0.00 0.00 34.50 30.53 1ocz s PRO 145 CO -0.03 -1.59 0.76 0.00 0.04 0.00 0.00 177.00 176.18 1ocz n MET 146 N 8.11 -0.02 -2.38 4.56 0.00 0.65 -3.20 117.12 124.85 1ocz n MET 146 Ca 0.16 0.06 -0.19 0.00 0.00 0.00 0.00 57.70 57.73 1ocz n MET 146 Cb 0.48 -2.08 -0.01 0.00 0.00 0.00 0.00 33.22 31.61 1ocz n MET 146 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1ocz n GLU 147 N -2.22 -1.81 -4.45 3.17 1.02 -1.11 -4.71 120.64 110.54 1ocz n GLU 147 Ca 0.10 0.92 -0.22 0.00 -0.02 0.00 0.00 57.16 57.94 1ocz n GLU 147 Cb 0.51 -5.56 -0.14 0.00 -0.02 0.00 0.00 31.44 26.24 1ocz n GLU 147 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1ocz s MET 148 N -4.99 1.07 -0.57 3.49 -1.94 -1.19 -4.99 119.30 110.19 1ocz s MET 148 Ca 0.00 -0.79 -0.28 0.00 -1.71 0.00 0.00 55.69 52.91 1ocz s MET 148 Cb 0.00 -1.11 0.03 0.00 2.01 0.00 0.00 34.83 35.76 1ocz s MET 148 CO 0.00 0.28 1.17 0.99 -0.01 0.00 0.00 175.02 177.45 1ocz s THR 149 N -0.80 4.06 -0.04 2.05 2.01 -1.26 -4.36 115.64 117.30 1ocz s THR 149 Ca 0.03 0.91 -0.01 0.00 0.31 0.00 0.00 61.69 62.93 1ocz s THR 149 Cb -0.08 -4.70 -0.04 0.00 0.01 0.00 0.00 72.50 67.69 1ocz s THR 149 CO 0.01 -1.29 0.06 -0.63 -0.69 0.00 0.00 174.62 172.09 1ocz s ILE 150 N 4.83 4.67 -0.24 1.82 1.01 -0.17 -1.82 121.20 131.29 1ocz s ILE 150 Ca 0.43 -0.32 -0.08 0.00 0.00 0.00 0.00 60.65 60.69 1ocz s ILE 150 Cb -0.08 -3.08 -0.03 0.00 0.01 0.00 0.00 42.46 39.28 1ocz s ILE 150 CO 0.26 0.44 0.08 -0.60 0.00 0.00 0.00 174.94 175.13 1ocz s ARG 151 N -1.44 3.72 -0.10 2.79 3.52 -0.76 -0.75 118.95 125.94 1ocz s ARG 151 Ca 0.19 -0.44 -0.03 0.00 -0.13 0.00 0.00 55.73 55.31 1ocz s ARG 151 Cb -0.12 -3.34 -0.04 0.00 -1.56 0.00 0.00 34.95 29.89 1ocz s ARG 151 CO 0.10 -0.13 0.04 -1.64 -0.81 0.00 0.00 175.30 172.86 1ocz s MET 152 N 1.47 3.16 -0.28 5.12 -1.94 0.10 -1.48 119.30 125.46 1ocz s MET 152 Ca 0.06 -0.33 0.02 0.00 -1.71 0.00 0.00 55.69 53.73 1ocz s MET 152 Cb -0.15 -2.92 0.07 0.00 2.01 0.00 0.00 34.83 33.85 1ocz s MET 152 CO 0.04 0.70 -0.04 -0.51 -0.01 0.00 0.00 175.02 175.20 1ocz s LEU 153 N -0.84 3.50 0.15 -0.03 1.43 -0.80 -1.29 118.68 120.80 1ocz s LEU 153 Ca 0.13 -1.57 -0.16 0.00 -1.03 0.00 0.00 54.13 51.51 1ocz s LEU 153 Cb -0.12 -1.43 -0.07 0.00 0.03 0.00 0.00 46.19 44.61 1ocz s LEU 153 CO 0.03 -0.27 0.58 -0.69 0.23 0.00 0.00 176.35 176.22 1ocz s VAL 154 N 1.16 4.80 0.19 -1.59 1.01 0.13 -1.51 120.40 124.60 1ocz s VAL 154 Ca -0.01 0.93 -0.14 0.00 0.00 0.00 0.00 61.98 62.76 1ocz s VAL 154 Cb -0.19 -3.77 0.05 0.00 0.00 0.00 0.00 36.38 32.47 1ocz s VAL 154 CO -0.08 0.27 0.72 -0.24 0.00 0.00 0.00 175.10 175.77 1ocz n SER 155 N 0.88 -1.46 -3.91 3.32 2.88 -0.86 -2.03 113.62 112.44 1ocz n SER 155 Ca -0.05 -1.86 -0.09 0.00 -1.33 0.00 0.00 58.87 55.53 1ocz n SER 155 Cb 0.52 2.39 -0.08 0.00 -0.75 0.00 0.00 64.21 66.29 1ocz n SER 155 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1ocz s SER 156 N -2.74 0.15 0.00 -3.46 0.15 -1.26 -0.04 113.70 106.50 1ocz s SER 156 Ca 0.15 -0.76 0.09 0.00 0.70 0.00 0.00 55.95 56.14 1ocz s SER 156 Cb -0.03 0.34 0.12 0.00 -1.71 0.00 0.00 66.02 64.74 1ocz s SER 156 CO 0.06 -0.75 0.89 -0.62 1.20 0.00 0.00 173.24 174.02 1ocz n GLU 157 N -0.08 0.93 0.00 5.44 1.02 -0.43 -4.08 120.64 123.45 1ocz n GLU 157 Ca -0.13 -1.27 0.00 0.00 -0.02 0.00 0.00 57.16 55.74 1ocz n GLU 157 Cb 0.62 -1.18 0.00 0.00 -0.02 0.00 0.00 31.44 30.86 1ocz n GLU 157 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1ocz n ASP 158 N 0.45 0.00 -3.96 1.62 5.68 -1.26 -5.04 116.55 114.04 1ocz n ASP 158 Ca 0.06 0.00 -0.30 0.00 -0.50 0.00 0.00 54.79 54.05 1ocz n ASP 158 Cb 0.27 0.00 0.21 0.00 -1.14 0.00 0.00 41.12 40.45 1ocz n ASP 158 CO 0.00 0.00 0.00 0.68 -1.33 0.00 0.00 177.20 176.55 1ocz s VAL 159 N 1.87 1.98 0.50 2.12 -7.23 -1.26 -4.59 120.40 113.79 1ocz s VAL 159 Ca 0.00 0.00 -0.19 0.00 -1.81 0.00 0.00 61.98 59.98 1ocz s VAL 159 Cb 0.00 -2.98 -0.08 0.00 0.56 0.00 0.00 36.38 33.89 1ocz s VAL 159 CO 0.00 0.00 1.04 -0.76 -0.31 0.00 0.00 175.10 175.07 1ocz s LEU 160 N -6.01 3.79 0.29 1.32 1.43 -1.26 -4.67 118.68 113.57 1ocz s LEU 160 Ca 0.76 1.89 -0.02 0.00 -1.03 0.00 0.00 54.13 55.73 1ocz s LEU 160 Cb -0.03 -4.55 -0.01 0.00 0.03 0.00 0.00 46.19 41.63 1ocz s LEU 160 CO 0.54 -0.82 0.37 -1.00 0.23 0.00 0.00 176.35 175.67 1ocz s HIS 161 N -2.08 1.08 -0.17 0.29 3.76 -0.31 -4.60 115.29 113.25 1ocz s HIS 161 Ca 0.66 -1.28 -0.06 0.00 -0.15 0.00 0.00 55.06 54.24 1ocz s HIS 161 Cb -0.16 -0.25 0.08 0.00 1.11 0.00 0.00 32.58 33.37 1ocz s HIS 161 CO 0.23 -0.96 0.35 0.45 -0.85 0.00 0.00 174.74 173.96 1ocz s SER 162 N -3.21 0.01 -0.43 1.40 0.15 -1.26 0.20 113.70 110.56 1ocz s SER 162 Ca 0.33 0.82 -0.25 0.00 0.70 0.00 0.00 55.95 57.55 1ocz s SER 162 Cb 0.02 1.06 0.02 0.00 -1.71 0.00 0.00 66.02 65.41 1ocz s SER 162 CO 0.18 -0.23 0.88 0.86 1.20 0.00 0.00 173.24 176.12 1ocz s TRP 163 N 2.52 2.99 -0.01 3.44 -0.00 -0.66 -1.40 118.94 125.82 1ocz s TRP 163 Ca -0.01 0.44 0.03 0.00 -0.00 0.00 0.00 56.10 56.57 1ocz s TRP 163 Cb -0.12 -3.76 -0.01 0.00 -0.00 0.00 0.00 33.47 29.58 1ocz s TRP 163 CO -0.11 -0.97 -0.10 0.00 -0.00 0.00 0.00 176.95 175.77 1ocz s ALA 164 N 3.51 0.83 -0.41 5.86 0.00 -1.26 -1.42 121.76 128.88 1ocz s ALA 164 Ca 0.35 -0.42 0.04 0.00 0.00 0.00 0.00 51.96 51.93 1ocz s ALA 164 Cb -0.11 -0.22 0.17 0.00 0.00 0.00 0.00 23.12 22.95 1ocz s ALA 164 CO 0.23 0.20 0.36 0.08 0.00 0.00 0.00 175.76 176.62 1ocz s VAL 165 N -0.19 0.16 0.23 0.00 1.01 0.12 -3.01 120.40 118.73 1ocz s VAL 165 Ca 0.03 -2.31 -0.12 0.00 0.00 0.00 0.00 61.98 59.57 1ocz s VAL 165 Cb -0.04 -1.10 0.31 0.00 0.00 0.00 0.00 36.38 35.55 1ocz s VAL 165 CO -0.00 -1.07 1.44 -2.65 0.00 0.00 0.00 175.10 172.81 1ocz n PRO 166 N 3.07 -0.16 -0.02 2.72 -0.02 -1.26 -0.96 135.00 138.36 1ocz n PRO 166 Ca 0.26 1.43 0.23 0.00 -2.02 0.00 0.00 63.50 63.40 1ocz n PRO 166 Cb 0.47 -2.13 0.72 0.00 -0.02 0.00 0.00 33.50 32.54 1ocz n PRO 166 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1ocz h SER 167 N 0.00 0.00 -0.01 2.55 0.02 -1.84 0.55 113.55 114.82 1ocz h SER 167 Ca 0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 1ocz h SER 167 Cb 0.61 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.15 1ocz h SER 167 CO -0.93 0.00 -0.69 0.18 -1.14 0.00 0.00 176.83 174.25 1ocz n LEU 168 N -3.95 1.31 -1.41 5.07 4.77 -0.14 -0.08 117.00 122.59 1ocz n LEU 168 Ca 0.12 -0.61 -0.05 0.00 -0.03 0.00 0.00 56.01 55.43 1ocz n LEU 168 Cb 0.77 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.88 1ocz n LEU 168 CO 0.32 0.28 0.05 0.61 -1.33 0.00 0.00 177.39 177.32 1ocz n GLY 169 N 1.39 0.45 3.09 -0.72 0.00 0.19 -4.08 105.19 105.51 1ocz n GLY 169 Ca 0.06 -0.40 -0.20 0.00 0.00 0.00 0.00 46.02 45.47 1ocz n GLY 169 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1ocz s LEU 170 N -2.78 2.07 -0.29 0.99 2.34 -1.19 -4.85 118.68 114.97 1ocz s LEU 170 Ca 0.09 -0.29 -0.13 0.00 0.06 0.00 0.00 54.13 53.86 1ocz s LEU 170 Cb -0.04 -0.59 0.12 0.00 -0.56 0.00 0.00 46.19 45.12 1ocz s LEU 170 CO 0.18 0.10 0.73 -0.75 -1.06 0.00 0.00 176.35 175.56 1ocz s LYS 171 N -0.55 0.57 -0.19 1.48 2.20 -1.25 0.15 119.74 122.14 1ocz s LYS 171 Ca 0.03 1.23 -0.04 0.00 -0.36 0.00 0.00 55.97 56.83 1ocz s LYS 171 Cb -0.06 0.53 0.09 0.00 -1.51 0.00 0.00 37.83 36.88 1ocz s LYS 171 CO 0.00 -0.16 0.22 0.99 -0.36 0.00 0.00 175.35 176.04 1ocz s THR 172 N 2.32 -0.33 0.28 3.43 2.01 -0.50 -4.98 115.64 117.86 1ocz s THR 172 Ca -0.07 -0.06 -0.29 0.00 0.31 0.00 0.00 61.69 61.58 1ocz s THR 172 Cb -0.08 -0.64 -0.14 0.00 0.01 0.00 0.00 72.50 71.65 1ocz s THR 172 CO -0.19 -0.16 1.20 0.47 -0.69 0.00 0.00 174.62 175.25 1ocz n ASP 173 N 5.32 2.07 -4.45 3.53 9.92 -1.26 -1.66 116.55 130.03 1ocz n ASP 173 Ca -0.05 1.17 -0.44 0.00 -0.53 0.00 0.00 54.79 54.94 1ocz n ASP 173 Cb 0.50 -1.37 -0.07 0.00 -0.64 0.00 0.00 41.12 39.53 1ocz n ASP 173 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ocz s ALA 174 N -0.73 3.44 -0.16 2.24 0.00 0.52 -4.76 121.76 122.32 1ocz s ALA 174 Ca 0.62 -1.75 -0.00 0.00 0.00 0.00 0.00 51.96 50.82 1ocz s ALA 174 Cb -0.67 -3.18 -0.00 0.00 0.00 0.00 0.00 23.12 19.27 1ocz s ALA 174 CO 0.57 -1.79 -0.14 0.42 0.00 0.00 0.00 175.76 174.82 1ocz s ILE 175 N 2.21 2.80 0.23 0.00 1.01 -1.26 -1.17 121.20 125.03 1ocz s ILE 175 Ca 0.11 -0.72 -0.32 0.00 0.00 0.00 0.00 60.65 59.72 1ocz s ILE 175 Cb -0.20 -2.19 -0.13 0.00 0.01 0.00 0.00 42.46 39.95 1ocz s ILE 175 CO 0.11 0.51 1.49 -0.81 0.00 0.00 0.00 174.94 176.24 1ocz n PRO 176 N 4.03 2.21 -0.52 2.79 -0.04 -1.26 -0.74 135.00 141.47 1ocz n PRO 176 Ca -0.19 0.79 0.00 0.00 -0.04 0.00 0.00 63.50 64.06 1ocz n PRO 176 Cb 0.52 -2.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.48 1ocz n PRO 176 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ocz n GLY 177 N 2.47 1.34 3.23 0.55 0.00 -1.26 -4.98 105.19 106.54 1ocz n GLY 177 Ca 0.12 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 1ocz n GLY 177 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ocz s ARG 178 N -0.23 1.44 -0.40 1.61 3.52 0.08 -5.10 118.95 119.86 1ocz s ARG 178 Ca 0.00 -0.85 -0.01 0.00 -0.13 0.00 0.00 55.73 54.74 1ocz s ARG 178 Cb 0.00 -1.49 0.11 0.00 -1.56 0.00 0.00 34.95 32.01 1ocz s ARG 178 CO 0.00 0.39 0.17 -0.51 -0.81 0.00 0.00 175.30 174.54 1ocz s LEU 179 N -0.93 5.12 0.03 -0.88 1.43 -1.26 -4.52 118.68 117.67 1ocz s LEU 179 Ca 0.07 -2.11 -0.14 0.00 -1.03 0.00 0.00 54.13 50.92 1ocz s LEU 179 Cb -0.08 -1.78 -0.06 0.00 0.03 0.00 0.00 46.19 44.30 1ocz s LEU 179 CO 0.01 -0.49 0.43 0.20 0.23 0.00 0.00 176.35 176.73 1ocz s ASN 180 N 1.53 6.81 0.10 2.29 0.01 -0.86 -4.92 114.94 119.90 1ocz s ASN 180 Ca 0.09 0.98 0.01 0.00 -0.71 0.00 0.00 52.86 53.23 1ocz s ASN 180 Cb -0.22 -2.25 -0.04 0.00 0.41 0.00 0.00 41.25 39.15 1ocz s ASN 180 CO -0.05 0.29 0.23 -1.58 -1.51 0.00 0.00 177.10 174.48 1ocz s GLN 181 N -1.25 3.38 -0.24 -0.60 0.74 -1.26 -0.69 119.66 119.74 1ocz s GLN 181 Ca 0.26 -0.54 -0.20 0.00 0.05 0.00 0.00 55.36 54.93 1ocz s GLN 181 Cb -0.16 -2.97 0.07 0.00 1.10 0.00 0.00 33.01 31.04 1ocz s GLN 181 CO 0.15 0.56 0.64 -0.08 -0.55 0.00 0.00 175.29 176.01 1ocz s THR 182 N -1.61 -0.00 -0.33 -0.34 -1.32 -0.41 -4.96 115.64 106.66 1ocz s THR 182 Ca 0.34 0.01 -0.13 0.00 -1.21 0.00 0.00 61.69 60.70 1ocz s THR 182 Cb -0.12 -0.90 -0.02 0.00 -1.51 0.00 0.00 72.50 69.95 1ocz s THR 182 CO 0.28 0.00 0.27 -0.89 -2.21 0.00 0.00 174.62 172.07 1ocz s THR 183 N 0.72 5.26 0.07 5.08 2.01 -1.26 0.01 115.64 127.52 1ocz s THR 183 Ca -0.03 -0.08 -0.01 0.00 0.31 0.00 0.00 61.69 61.88 1ocz s THR 183 Cb -0.05 -3.72 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 1ocz s THR 183 CO -0.05 0.01 0.24 -0.22 -0.69 0.00 0.00 174.62 173.90 1ocz s LEU 184 N 1.81 4.35 -0.33 4.42 0.20 0.08 -4.96 118.68 124.24 1ocz s LEU 184 Ca 0.08 0.33 -0.02 0.00 0.69 0.00 0.00 54.13 55.20 1ocz s LEU 184 Cb -0.17 -2.99 0.19 0.00 -0.43 0.00 0.00 46.19 42.79 1ocz s LEU 184 CO 0.11 0.16 0.85 -0.32 -0.29 0.00 0.00 176.35 176.86 1ocz s MET 185 N -2.49 0.41 0.76 1.98 1.75 -1.26 -1.00 119.30 119.44 1ocz s MET 185 Ca 0.35 0.06 -0.09 0.00 -1.25 0.00 0.00 55.69 54.77 1ocz s MET 185 Cb -0.13 0.10 0.09 0.00 2.84 0.00 0.00 34.83 37.73 1ocz s MET 185 CO 0.27 -0.65 1.09 0.45 -0.65 0.00 0.00 175.02 175.53 1ocz s SER 186 N 2.36 4.47 0.00 1.11 0.15 -1.26 -4.51 113.70 116.02 1ocz s SER 186 Ca 0.17 0.43 0.03 0.00 0.70 0.00 0.00 55.95 57.28 1ocz s SER 186 Cb -0.03 -0.94 0.05 0.00 -1.71 0.00 0.00 66.02 63.39 1ocz s SER 186 CO -0.17 -1.84 0.95 -1.54 1.20 0.00 0.00 173.24 171.83 1ocz n SER 187 N -3.11 0.09 -3.66 5.45 3.41 -1.08 -2.75 113.62 111.96 1ocz n SER 187 Ca 0.10 -1.86 -0.10 0.00 -0.26 0.00 0.00 58.87 56.75 1ocz n SER 187 Cb 0.60 -0.17 -0.08 0.00 -0.26 0.00 0.00 64.21 64.30 1ocz n SER 187 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1ocz s ARG 188 N 0.00 0.64 0.36 4.33 3.52 -1.26 -4.90 118.95 121.64 1ocz s ARG 188 Ca 0.04 1.02 -0.21 0.00 -0.13 0.00 0.00 55.73 56.45 1ocz s ARG 188 Cb 0.04 0.16 -0.10 0.00 -1.56 0.00 0.00 34.95 33.50 1ocz s ARG 188 CO -0.02 -0.13 0.89 -1.25 -0.81 0.00 0.00 175.30 173.98 1ocz s PRO 189 N 1.21 4.29 0.00 5.12 0.04 -1.26 -4.87 135.00 139.53 1ocz s PRO 189 Ca -0.07 1.08 0.00 0.00 0.04 0.00 0.00 61.00 62.05 1ocz s PRO 189 Cb -0.06 -2.45 0.00 0.00 0.04 0.00 0.00 34.50 32.03 1ocz s PRO 189 CO -0.12 0.12 0.00 0.41 0.04 0.00 0.00 177.00 177.45 1ocz n GLY 190 N -0.15 -0.52 2.95 0.56 0.00 -0.88 -4.96 105.19 102.20 1ocz n GLY 190 Ca 0.04 -0.81 -0.29 0.00 0.00 0.00 0.00 46.02 44.96 1ocz n GLY 190 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ocz s LEU 191 N 0.00 1.90 -0.29 0.99 1.43 -1.26 -1.38 118.68 120.08 1ocz s LEU 191 Ca 0.00 -0.74 -0.03 0.00 -1.03 0.00 0.00 54.13 52.33 1ocz s LEU 191 Cb 0.00 -1.07 0.04 0.00 0.03 0.00 0.00 46.19 45.19 1ocz s LEU 191 CO 0.00 -0.16 -0.00 -0.31 0.23 0.00 0.00 176.35 176.11 1ocz s TYR 192 N 1.52 3.19 0.37 0.29 2.02 -0.11 -4.61 117.35 120.02 1ocz s TYR 192 Ca 0.00 -1.66 -0.04 0.00 -0.37 0.00 0.00 57.07 55.01 1ocz s TYR 192 Cb -0.15 -2.12 -0.04 0.00 -0.40 0.00 0.00 41.96 39.25 1ocz s TYR 192 CO -0.08 -0.75 0.64 0.71 -1.57 0.00 0.00 175.55 174.49 1ocz s TYR 193 N 1.31 3.51 0.26 2.71 1.51 -1.26 -0.38 117.35 125.00 1ocz s TYR 193 Ca -0.03 0.64 -0.17 0.00 -1.01 0.00 0.00 57.07 56.51 1ocz s TYR 193 Cb -0.19 -2.13 0.01 0.00 -0.11 0.00 0.00 41.96 39.54 1ocz s TYR 193 CO -0.01 0.00 0.58 0.20 -1.11 0.00 0.00 175.55 175.21 1ocz s GLY 194 N -3.69 0.23 0.07 0.71 0.00 0.21 -4.52 107.32 100.34 1ocz s GLY 194 Ca 0.44 -0.59 0.01 0.00 0.00 0.00 0.00 44.72 44.58 1ocz s GLY 194 CO 0.36 -0.38 -0.06 1.20 0.00 0.00 0.00 173.10 174.23 1ocz s GLN 195 N -3.97 0.71 -0.55 2.90 -0.21 -1.16 -0.33 119.66 117.05 1ocz s GLN 195 Ca 0.17 -1.18 -0.26 0.00 0.02 0.00 0.00 55.36 54.10 1ocz s GLN 195 Cb -0.03 -0.11 -0.04 0.00 1.00 0.00 0.00 33.01 33.84 1ocz s GLN 195 CO 0.07 -0.03 2.05 0.00 -2.12 0.00 0.00 175.29 175.27 1ocz n SER 197 N 13.71 7.64 -3.20 0.00 7.64 -0.49 -4.74 113.62 134.19 1ocz n SER 197 Ca 0.26 -2.89 0.04 0.00 1.01 0.00 0.00 58.87 57.30 1ocz n SER 197 Cb 0.53 -1.41 -0.03 0.00 -1.01 0.00 0.00 64.21 62.29 1ocz n SER 197 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1ocz s GLU 198 N 0.05 0.14 0.14 1.43 2.56 -1.26 -4.39 118.70 117.36 1ocz s GLU 198 Ca 0.61 0.29 -0.34 0.00 0.00 0.00 0.00 54.97 55.54 1ocz s GLU 198 Cb 0.23 0.17 -0.16 0.00 2.00 0.00 0.00 34.13 36.37 1ocz s GLU 198 CO -0.09 -0.11 1.21 1.51 -0.56 0.00 0.00 175.26 177.22 1ocz n ILE 199 N 5.17 0.56 -2.02 -3.70 3.06 -1.26 -4.65 119.36 116.53 1ocz n ILE 199 Ca -0.08 -0.14 -0.01 0.00 -2.50 0.00 0.00 62.75 60.02 1ocz n ILE 199 Cb 0.54 -0.80 -0.01 0.00 0.54 0.00 0.00 39.64 39.91 1ocz n ILE 199 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1ocz n GLY 201 N 0.02 0.97 0.33 0.00 0.00 -1.26 -4.77 105.19 100.47 1ocz n GLY 201 Ca -0.05 -2.22 0.21 0.00 0.00 0.00 0.00 46.02 43.96 1ocz n GLY 201 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ocz h SER 202 N 0.00 0.34 -0.81 1.61 0.02 -2.02 0.13 113.55 112.82 1ocz h SER 202 Ca 0.00 0.20 -0.54 0.00 -0.84 0.00 0.00 61.79 60.60 1ocz h SER 202 Cb 0.00 0.19 -0.31 0.00 0.14 0.00 0.00 62.40 62.41 1ocz h SER 202 CO 0.00 -0.15 0.10 0.59 -1.14 0.00 0.00 176.83 176.23 1ocz n ASN 203 N -5.12 5.63 -0.12 3.07 4.13 -1.26 -4.64 115.26 116.96 1ocz n ASN 203 Ca 0.29 -3.77 0.18 0.00 1.68 0.00 0.00 54.58 52.96 1ocz n ASN 203 Cb 0.90 -0.69 0.57 0.00 -1.54 0.00 0.00 39.78 39.02 1ocz n ASN 203 CO 0.00 0.00 0.00 -0.74 0.28 0.00 0.00 177.26 176.80 1ocz h HIS 204 N 1.85 0.31 0.00 3.10 -0.00 -1.04 0.72 115.15 120.09 1ocz h HIS 204 Ca 0.46 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.84 1ocz h HIS 204 Cb 1.34 -0.10 0.00 0.00 -0.00 0.00 0.00 27.41 28.65 1ocz h HIS 204 CO 1.18 0.12 -0.34 0.43 -0.00 0.00 0.00 177.93 179.31 1ocz n SER 205 N -4.44 0.44 -2.64 3.26 7.64 -1.26 -4.40 113.62 112.22 1ocz n SER 205 Ca 0.13 0.12 -0.32 0.00 1.01 0.00 0.00 58.87 59.82 1ocz n SER 205 Cb 0.58 -0.08 0.01 0.00 -1.01 0.00 0.00 64.21 63.71 1ocz n SER 205 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1ocz n PHE 206 N -1.71 3.27 -3.10 1.43 3.72 0.25 -4.75 117.46 116.55 1ocz n PHE 206 Ca 0.05 -2.84 -0.17 0.00 -0.05 0.00 0.00 57.45 54.44 1ocz n PHE 206 Cb 0.37 -0.47 -0.02 0.00 -0.94 0.00 0.00 39.48 38.42 1ocz n PHE 206 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ocz n MET 207 N -0.50 0.93 -0.38 -1.08 0.00 -1.26 -4.52 117.12 110.31 1ocz n MET 207 Ca 0.44 -3.06 -0.29 0.00 0.00 0.00 0.00 57.70 54.79 1ocz n MET 207 Cb 0.51 -1.51 0.28 0.00 0.00 0.00 0.00 33.22 32.49 1ocz n MET 207 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 1ocz n PRO 208 N 0.54 -3.42 -4.08 3.17 -0.04 -1.26 -3.97 135.00 125.93 1ocz n PRO 208 Ca 0.21 -0.99 -0.19 0.00 -0.04 0.00 0.00 63.50 62.49 1ocz n PRO 208 Cb 0.64 -2.06 -0.16 0.00 -0.04 0.00 0.00 33.50 31.88 1ocz n PRO 208 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1ocz s ILE 209 N -2.29 0.39 -0.06 0.52 1.01 0.55 -4.84 121.20 116.49 1ocz s ILE 209 Ca 0.68 -0.05 0.00 0.00 0.00 0.00 0.00 60.65 61.29 1ocz s ILE 209 Cb -0.21 -0.44 0.02 0.00 0.01 0.00 0.00 42.46 41.84 1ocz s ILE 209 CO 0.63 0.19 -0.04 -0.69 0.00 0.00 0.00 174.94 175.03 1ocz s VAL 210 N 0.92 0.56 -0.27 2.92 1.01 -1.26 0.68 120.40 124.96 1ocz s VAL 210 Ca -0.11 -0.09 -0.08 0.00 0.00 0.00 0.00 61.98 61.70 1ocz s VAL 210 Cb -0.14 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.59 1ocz s VAL 210 CO -0.00 0.25 0.11 -0.76 0.00 0.00 0.00 175.10 174.69 1ocz s LEU 211 N 1.25 3.68 -0.35 3.92 1.02 0.49 -1.11 118.68 127.59 1ocz s LEU 211 Ca -0.06 -0.25 -0.11 0.00 0.02 0.00 0.00 54.13 53.73 1ocz s LEU 211 Cb -0.14 -1.97 0.00 0.00 0.02 0.00 0.00 46.19 44.11 1ocz s LEU 211 CO -0.02 -0.07 0.20 -0.70 0.02 0.00 0.00 176.35 175.78 1ocz s GLU 212 N 1.63 3.17 -0.31 1.70 2.12 0.40 -0.93 118.70 126.48 1ocz s GLU 212 Ca 0.06 -0.85 -0.06 0.00 0.36 0.00 0.00 54.97 54.48 1ocz s GLU 212 Cb -0.16 -3.70 0.02 0.00 0.26 0.00 0.00 34.13 30.56 1ocz s GLU 212 CO 0.05 -0.54 0.07 -0.51 -0.54 0.00 0.00 175.26 173.79 1ocz s LEU 213 N 1.62 3.95 0.38 2.70 1.02 -0.48 -1.24 118.68 126.64 1ocz s LEU 213 Ca 0.04 -0.91 0.08 0.00 0.02 0.00 0.00 54.13 53.35 1ocz s LEU 213 Cb -0.18 -1.84 -0.07 0.00 0.02 0.00 0.00 46.19 44.11 1ocz s LEU 213 CO 0.07 -0.24 -0.02 0.68 0.02 0.00 0.00 176.35 176.86 1ocz s VAL 214 N 1.43 2.03 0.79 -1.59 -7.23 -0.86 -2.06 120.40 112.91 1ocz s VAL 214 Ca 0.00 -2.07 -0.12 0.00 -1.81 0.00 0.00 61.98 57.99 1ocz s VAL 214 Cb -0.18 -2.87 0.07 0.00 0.56 0.00 0.00 36.38 33.96 1ocz s VAL 214 CO 0.02 -0.07 1.14 -2.84 -0.31 0.00 0.00 175.10 173.03 1ocz s PRO 215 N -3.69 1.96 0.08 4.82 0.02 -1.26 -0.25 135.00 136.67 1ocz s PRO 215 Ca 0.34 1.44 -0.16 0.00 0.02 0.00 0.00 61.00 62.65 1ocz s PRO 215 Cb 0.07 -1.84 -0.04 0.00 0.02 0.00 0.00 34.50 32.72 1ocz s PRO 215 CO 0.17 -1.91 1.17 -0.11 -0.33 0.00 0.00 177.00 175.99 1ocz n LEU 216 N -3.38 -0.53 -0.34 -5.54 0.00 -1.26 -1.75 117.00 104.20 1ocz n LEU 216 Ca 0.11 1.29 -0.01 0.00 0.00 0.00 0.00 56.01 57.40 1ocz n LEU 216 Cb 0.52 -0.31 0.04 0.00 0.00 0.00 0.00 43.42 43.67 1ocz n LEU 216 CO 0.50 -0.93 0.53 1.17 0.00 0.00 0.00 177.39 178.66 1ocz n LYS 217 N -4.14 -0.20 0.25 1.96 4.81 -1.26 0.10 118.16 119.68 1ocz n LYS 217 Ca 0.01 1.37 0.13 0.00 -0.87 0.00 0.00 58.31 58.95 1ocz n LYS 217 Cb 0.13 -2.04 0.64 0.00 0.02 0.00 0.00 35.03 33.78 1ocz n LYS 217 CO 0.00 0.00 0.00 1.88 1.17 0.00 0.00 177.40 180.45 1ocz h TYR 218 N 0.00 0.00 0.10 5.64 -1.99 -1.70 -2.56 116.97 116.46 1ocz h TYR 218 Ca 0.32 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 61.04 1ocz h TYR 218 Cb 0.54 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.27 1ocz h TYR 218 CO -0.78 0.14 -0.05 0.35 -0.00 0.00 0.00 178.16 177.82 1ocz h PHE 219 N 0.00 -0.13 -0.46 4.88 3.57 0.13 -2.34 116.94 122.59 1ocz h PHE 219 Ca -0.00 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.59 1ocz h PHE 219 Cb 0.52 0.04 -0.08 0.00 2.79 0.00 0.00 35.95 39.22 1ocz h PHE 219 CO 0.00 0.34 -0.04 0.93 -2.23 0.00 0.00 178.31 177.31 1ocz h GLU 220 N -0.67 0.06 -0.45 1.11 5.08 -0.78 0.12 114.58 119.06 1ocz h GLU 220 Ca -0.01 -0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 1ocz h GLU 220 Cb 0.52 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 1ocz h GLU 220 CO 0.02 0.04 0.09 0.87 -1.00 0.00 0.00 179.01 179.04 1ocz h LYS 221 N 0.07 0.74 -0.55 2.33 1.57 -1.57 -2.36 116.57 116.79 1ocz h LYS 221 Ca 0.23 -0.19 0.08 0.00 -1.87 0.00 0.00 60.65 58.90 1ocz h LYS 221 Cb 0.34 -0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.50 1ocz h LYS 221 CO -0.42 0.75 0.20 2.35 -0.57 0.00 0.00 179.45 181.76 1ocz h TRP 222 N 0.61 0.34 0.36 -1.35 7.01 -0.69 0.73 115.95 122.95 1ocz h TRP 222 Ca 0.14 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.16 1ocz h TRP 222 Cb 0.36 -0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.34 1ocz h TRP 222 CO 0.02 0.09 -0.24 1.03 -2.79 0.00 0.00 178.44 176.56 1ocz h SER 223 N 0.37 -0.60 -0.15 2.65 0.87 -0.61 -0.53 113.55 115.55 1ocz h SER 223 Ca 0.27 0.04 0.03 0.00 -1.23 0.00 0.00 61.79 60.90 1ocz h SER 223 Cb 0.32 0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 62.43 1ocz h SER 223 CO -0.28 -0.37 -0.03 0.00 -0.53 0.00 0.00 176.83 175.61 1ocz h ALA 224 N 0.02 0.10 0.00 6.23 0.00 -0.93 0.35 119.26 125.03 1ocz h ALA 224 Ca -0.04 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ocz h ALA 224 Cb 0.49 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1ocz h ALA 224 CO 0.03 -0.48 0.00 0.66 0.00 0.00 0.00 179.25 179.46 1ocz h SER 225 N 0.00 0.00 0.20 0.00 4.64 -0.75 0.36 113.55 118.01 1ocz h SER 225 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1ocz h SER 225 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1ocz h SER 225 CO -0.15 0.00 -0.13 0.80 -0.87 0.00 0.00 176.83 176.48 1ocz n MET 226 N -2.90 0.99 0.00 4.77 0.00 0.12 -5.08 117.12 115.01 1ocz n MET 226 Ca -0.02 -0.49 0.00 0.00 0.00 0.00 0.00 57.70 57.19 1ocz n MET 226 Cb 0.08 -1.49 0.00 0.00 0.00 0.00 0.00 33.22 31.81 1ocz n MET 226 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25