#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ozl h GLN 11 N 0.00 -0.09 -6.62 -0.52 4.15 -2.01 -3.45 115.11 106.57 1ozl h GLN 11 Ca 0.00 0.01 -0.53 0.00 0.77 0.00 0.00 58.65 58.90 1ozl h GLN 11 Cb 0.00 0.02 0.03 0.00 0.21 0.00 0.00 27.48 27.73 1ozl h GLN 11 CO 0.00 -0.06 0.65 -0.51 -1.93 0.00 0.00 178.83 176.98 1ozl s ASP 12 N -4.46 6.93 0.27 -0.69 1.01 -1.26 -4.92 116.67 113.55 1ozl s ASP 12 Ca -0.01 2.31 -0.01 0.00 0.71 0.00 0.00 52.55 55.56 1ozl s ASP 12 Cb 0.00 -2.60 0.49 0.00 1.01 0.00 0.00 42.92 41.82 1ozl s ASP 12 CO 0.04 -0.53 1.85 0.25 0.21 0.00 0.00 175.17 176.99 1ozl h LEU 13 N 5.87 0.93 -0.63 1.23 5.85 -1.88 0.76 115.31 127.43 1ozl h LEU 13 Ca -0.44 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.35 1ozl h LEU 13 Cb 1.21 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 42.05 1ozl h LEU 13 CO 0.80 0.53 0.40 0.77 -0.34 0.00 0.00 178.44 180.59 1ozl h SER 14 N 1.02 0.65 0.07 1.25 4.64 -1.89 0.12 113.55 119.42 1ozl h SER 14 Ca 0.47 -0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.61 1ozl h SER 14 Cb 0.38 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1ozl h SER 14 CO -0.24 0.45 -0.62 -0.33 -0.87 0.00 0.00 176.83 175.23 1ozl h GLU 15 N 0.78 0.54 -0.31 4.77 5.08 -1.70 -2.47 114.58 121.26 1ozl h GLU 15 Ca 0.25 -0.37 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 1ozl h GLU 15 Cb 0.01 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1ozl h GLU 15 CO -0.10 0.99 0.16 0.00 -1.00 0.00 0.00 179.01 179.06 1ozl h ALA 16 N 0.93 0.40 -0.25 3.43 0.00 -0.25 -1.61 119.26 121.91 1ozl h ALA 16 Ca -0.01 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1ozl h ALA 16 Cb 1.18 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1ozl h ALA 16 CO 0.11 -0.05 0.15 -0.07 0.00 0.00 0.00 179.25 179.39 1ozl h LEU 17 N 0.38 0.30 -0.25 0.00 3.38 -0.75 0.15 115.31 118.53 1ozl h LEU 17 Ca 0.11 -0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.04 1ozl h LEU 17 Cb 0.09 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 1ozl h LEU 17 CO -0.02 0.28 0.09 0.50 0.09 0.00 0.00 178.44 179.38 1ozl h LYS 18 N 0.31 0.20 -0.45 1.13 3.64 -1.30 -1.63 116.57 118.47 1ozl h LYS 18 Ca 0.09 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.39 1ozl h LYS 18 Cb 0.03 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 1ozl h LYS 18 CO -0.02 0.13 0.01 1.49 -2.27 0.00 0.00 179.45 178.80 1ozl h GLU 19 N 0.21 0.79 0.00 1.90 4.81 -1.16 -2.72 114.58 118.41 1ozl h GLU 19 Ca 0.11 -0.25 -0.05 0.00 -0.13 0.00 0.00 59.36 59.04 1ozl h GLU 19 Cb 0.07 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1ozl h GLU 19 CO -0.11 0.85 -0.23 0.00 -0.73 0.00 0.00 179.01 178.78 1ozl h ALA 20 N 0.92 1.17 -0.26 2.92 0.00 -0.77 -3.10 119.26 120.13 1ozl h ALA 20 Ca 0.13 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1ozl h ALA 20 Cb 0.48 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1ozl h ALA 20 CO 0.02 0.29 0.00 0.25 0.00 0.00 0.00 179.25 179.81 1ozl n THR 21 N -3.62 0.38 -0.24 0.00 -2.24 -0.63 -4.53 114.28 103.41 1ozl n THR 21 Ca -0.01 -0.69 0.00 0.00 -2.27 0.00 0.00 64.05 61.08 1ozl n THR 21 Cb 0.37 1.08 0.12 0.00 -2.10 0.00 0.00 70.33 69.80 1ozl n THR 21 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1ozl h LYS 22 N 3.95 0.60 0.02 -0.78 3.64 -1.41 -0.10 116.57 122.50 1ozl h LYS 22 Ca 0.00 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1ozl h LYS 22 Cb 0.89 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 1ozl h LYS 22 CO 0.00 0.40 -0.01 1.49 -2.27 0.00 0.00 179.45 179.06 1ozl h GLU 23 N 0.62 -0.03 0.00 1.90 4.81 -1.82 -2.32 114.58 117.74 1ozl h GLU 23 Ca 0.33 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.49 1ozl h GLU 23 Cb 0.31 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 1ozl h GLU 23 CO -0.24 0.21 -0.33 -0.39 -0.73 0.00 0.00 179.01 177.52 1ozl h VAL 24 N -0.26 1.10 -0.52 0.32 -1.51 -1.80 -1.09 116.25 112.50 1ozl h VAL 24 Ca -0.00 -1.19 -0.06 0.00 -1.23 0.00 0.00 66.70 64.22 1ozl h VAL 24 Cb 0.25 1.67 -0.02 0.00 -2.13 0.00 0.00 31.29 31.05 1ozl h VAL 24 CO 0.00 0.32 0.10 -0.74 -1.23 0.00 0.00 177.57 176.03 1ozl h HIS 25 N 0.00 0.89 -0.61 5.19 -0.00 -0.89 0.03 115.15 119.77 1ozl h HIS 25 Ca -0.00 -0.12 -0.06 0.00 -0.00 0.00 0.00 60.37 60.19 1ozl h HIS 25 Cb 0.64 -0.25 -0.03 0.00 -0.00 0.00 0.00 27.41 27.77 1ozl h HIS 25 CO 0.00 0.80 0.14 1.15 -0.00 0.00 0.00 177.93 180.02 1ozl h THR 26 N 0.73 1.24 -1.00 6.26 2.02 -0.91 -0.33 112.91 120.93 1ozl h THR 26 Ca 0.16 -0.90 0.01 0.00 0.77 0.00 0.00 66.41 66.45 1ozl h THR 26 Cb 0.37 0.63 -0.05 0.00 -1.74 0.00 0.00 68.15 67.36 1ozl h THR 26 CO 0.01 0.34 0.65 -0.61 0.37 0.00 0.00 175.52 176.28 1ozl h GLN 27 N 0.91 1.32 -0.49 6.66 4.15 -0.57 0.17 115.11 127.25 1ozl h GLN 27 Ca 0.19 -0.08 -0.08 0.00 0.77 0.00 0.00 58.65 59.45 1ozl h GLN 27 Cb 0.34 -0.29 -0.02 0.00 0.21 0.00 0.00 27.48 27.71 1ozl h GLN 27 CO 0.00 0.88 0.01 0.00 -1.93 0.00 0.00 178.83 177.78 1ozl h ALA 28 N 1.37 0.67 -0.00 3.38 0.00 -0.11 -1.55 119.26 123.01 1ozl h ALA 28 Ca 0.36 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1ozl h ALA 28 Cb -0.15 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1ozl h ALA 28 CO -0.08 0.47 -0.22 0.93 0.00 0.00 0.00 179.25 180.35 1ozl h GLU 29 N 0.73 0.00 0.00 0.00 5.08 -0.20 -2.41 114.58 117.78 1ozl h GLU 29 Ca 0.14 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1ozl h GLU 29 Cb 0.51 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1ozl h GLU 29 CO 0.02 0.22 -0.24 0.09 -1.00 0.00 0.00 179.01 178.11 1ozl n ASN 30 N -4.28 0.27 -4.71 1.42 3.02 0.51 -4.10 115.26 107.38 1ozl n ASN 30 Ca -0.02 0.16 -0.43 0.00 -0.03 0.00 0.00 54.58 54.26 1ozl n ASN 30 Cb 0.28 -0.16 -0.02 0.00 -0.61 0.00 0.00 39.78 39.26 1ozl n ASN 30 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ozl n ALA 31 N -1.52 2.07 -0.25 5.41 0.00 -0.63 -4.70 120.51 120.88 1ozl n ALA 31 Ca 0.06 0.40 0.01 0.00 0.00 0.00 0.00 53.44 53.91 1ozl n ALA 31 Cb 0.34 -2.41 0.08 0.00 0.00 0.00 0.00 19.45 17.47 1ozl n ALA 31 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1ozl h GLU 32 N 5.04 0.00 -0.89 0.00 4.81 -1.90 0.48 114.58 122.12 1ozl h GLU 32 Ca -0.46 -0.00 0.04 0.00 -0.13 0.00 0.00 59.36 58.81 1ozl h GLU 32 Cb 1.24 -0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.56 1ozl h GLU 32 CO 0.82 0.00 0.57 0.35 -0.73 0.00 0.00 179.01 180.02 1ozl h PHE 33 N 0.00 1.07 0.00 0.92 3.57 -1.90 -1.84 116.94 118.77 1ozl h PHE 33 Ca 0.35 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.76 1ozl h PHE 33 Cb 0.54 -0.35 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 1ozl h PHE 33 CO -0.59 0.60 -0.58 0.52 -2.23 0.00 0.00 178.31 176.04 1ozl h MET 34 N 1.10 0.00 -0.15 1.11 2.86 -1.06 -2.49 114.93 116.29 1ozl h MET 34 Ca 0.36 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.98 1ozl h MET 34 Cb 0.03 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 1ozl h MET 34 CO -0.13 0.58 0.03 0.00 1.06 0.00 0.00 176.91 178.46 1ozl h ARG 35 N 0.00 0.25 -0.83 1.72 3.08 0.51 -0.58 114.38 118.54 1ozl h ARG 35 Ca -0.01 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 1ozl h ARG 35 Cb 1.30 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 31.28 1ozl h ARG 35 CO 0.08 0.41 0.49 -0.91 -1.07 0.00 0.00 179.97 178.96 1ozl h ASN 36 N 0.05 1.00 -0.26 7.04 2.35 -1.35 -0.48 115.58 123.93 1ozl h ASN 36 Ca 0.05 -0.07 0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1ozl h ASN 36 Cb 0.27 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 1ozl h ASN 36 CO 0.00 0.78 0.14 0.15 -1.65 0.00 0.00 177.43 176.85 1ozl h PHE 37 N 1.14 0.25 0.00 1.19 3.04 -1.19 0.38 116.94 121.75 1ozl h PHE 37 Ca 0.29 0.01 -0.07 0.00 3.98 0.00 0.00 57.97 62.18 1ozl h PHE 37 Cb -0.02 -0.08 -0.01 0.00 2.56 0.00 0.00 35.95 38.40 1ozl h PHE 37 CO -0.00 0.15 -0.34 1.96 -2.02 0.00 0.00 178.31 178.05 1ozl h GLN 38 N 0.28 0.00 0.00 1.11 4.20 -0.73 -1.12 115.11 118.86 1ozl h GLN 38 Ca 0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.81 1ozl h GLN 38 Cb 0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.80 1ozl h GLN 38 CO -0.06 0.34 0.00 1.63 -0.67 0.00 0.00 178.83 180.07 1ozl n LYS 39 N -4.05 0.93 -1.07 1.46 5.02 -0.22 -4.84 118.16 115.39 1ozl n LYS 39 Ca -0.02 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.25 1ozl n LYS 39 Cb 0.39 -1.33 -0.01 0.00 -0.02 0.00 0.00 35.03 34.06 1ozl n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ozl n GLY 40 N 0.71 0.56 2.04 0.72 0.00 -0.42 -4.92 105.19 103.88 1ozl n GLY 40 Ca 0.15 -0.38 -0.23 0.00 0.00 0.00 0.00 46.02 45.56 1ozl n GLY 40 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ozl n GLN 41 N -2.41 2.14 -3.26 1.61 6.02 0.13 -4.89 117.38 116.71 1ozl n GLN 41 Ca -0.02 -2.38 -0.39 0.00 -0.01 0.00 0.00 57.00 54.20 1ozl n GLN 41 Cb 0.14 -1.93 -0.06 0.00 1.02 0.00 0.00 30.24 29.41 1ozl n GLN 41 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1ozl s VAL 42 N -3.16 4.93 0.34 5.09 0.11 -1.25 -4.66 120.40 121.79 1ozl s VAL 42 Ca 0.46 1.16 0.07 0.00 -2.93 0.00 0.00 61.98 60.74 1ozl s VAL 42 Cb 0.37 -3.89 -0.01 0.00 -1.53 0.00 0.00 36.38 31.32 1ozl s VAL 42 CO 0.03 0.44 0.44 0.42 -3.33 0.00 0.00 175.10 173.10 1ozl s THR 43 N -0.30 3.91 0.22 5.04 -4.23 -1.26 -4.75 115.64 114.27 1ozl s THR 43 Ca 0.29 -1.07 -0.08 0.00 -1.18 0.00 0.00 61.69 59.65 1ozl s THR 43 Cb -0.18 -3.35 0.18 0.00 1.34 0.00 0.00 72.50 70.49 1ozl s THR 43 CO 0.16 -0.15 1.84 -0.09 -0.54 0.00 0.00 174.62 175.84 1ozl h ARG 44 N 0.95 1.14 -0.65 3.99 2.43 -1.94 0.49 114.38 120.79 1ozl h ARG 44 Ca -0.45 -0.13 -0.05 0.00 -0.81 0.00 0.00 59.98 58.53 1ozl h ARG 44 Cb 1.26 -0.23 -0.03 0.00 -0.42 0.00 0.00 29.97 30.55 1ozl h ARG 44 CO 0.53 0.84 0.19 -0.44 -1.51 0.00 0.00 179.97 179.58 1ozl h ASP 45 N 1.14 0.94 -0.29 -3.80 3.32 -2.00 -1.05 116.42 114.69 1ozl h ASP 45 Ca 0.29 -0.17 -0.09 0.00 0.02 0.00 0.00 57.03 57.08 1ozl h ASP 45 Cb 0.02 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 1ozl h ASP 45 CO -0.05 0.89 -0.18 1.23 -1.72 0.00 0.00 179.24 179.42 1ozl h GLY 46 N 1.05 0.69 1.16 2.75 0.00 -1.79 -2.88 103.07 104.06 1ozl h GLY 46 Ca 0.21 -0.64 -0.05 0.00 0.00 0.00 0.00 47.33 46.85 1ozl h GLY 46 CO -0.01 0.58 0.24 -2.75 0.00 0.00 0.00 176.54 174.60 1ozl h PHE 47 N 0.38 1.08 -0.57 5.60 3.57 -0.73 -2.37 116.94 123.91 1ozl h PHE 47 Ca 0.06 -0.09 0.04 0.00 3.53 0.00 0.00 57.97 61.50 1ozl h PHE 47 Cb 0.71 -0.32 -0.04 0.00 2.79 0.00 0.00 35.95 39.09 1ozl h PHE 47 CO 0.06 0.85 0.33 0.87 -2.23 0.00 0.00 178.31 178.19 1ozl h LYS 48 N 1.02 0.62 -0.84 1.11 1.57 -1.15 -0.37 116.57 118.53 1ozl h LYS 48 Ca 0.23 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.96 1ozl h LYS 48 Cb 0.26 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.39 1ozl h LYS 48 CO -0.01 0.41 0.46 -0.07 -0.57 0.00 0.00 179.45 179.66 1ozl h LEU 49 N 0.63 1.04 -0.28 2.94 3.38 -1.25 -0.22 115.31 121.55 1ozl h LEU 49 Ca 0.24 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 1ozl h LEU 49 Cb 0.08 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1ozl h LEU 49 CO -0.13 0.84 0.09 0.58 0.09 0.00 0.00 178.44 179.91 1ozl h VAL 50 N 1.17 1.20 -0.64 1.22 2.07 -0.87 -1.06 116.25 119.35 1ozl h VAL 50 Ca 0.30 -0.64 -0.05 0.00 0.82 0.00 0.00 66.70 67.13 1ozl h VAL 50 Cb 0.03 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1ozl h VAL 50 CO -0.05 0.21 0.18 0.24 0.02 0.00 0.00 177.57 178.17 1ozl h MET 51 N 0.29 0.98 -0.53 1.57 2.86 -0.69 -0.46 114.93 118.94 1ozl h MET 51 Ca 0.09 -0.20 -0.02 0.00 -2.06 0.00 0.00 59.70 57.50 1ozl h MET 51 Cb 0.24 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 1ozl h MET 51 CO -0.00 0.85 0.24 0.00 1.06 0.00 0.00 176.91 179.06 1ozl h ALA 52 N 1.25 0.69 -0.25 6.32 0.00 -0.86 -1.43 119.26 124.98 1ozl h ALA 52 Ca 0.21 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1ozl h ALA 52 Cb 0.30 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1ozl h ALA 52 CO -0.00 0.27 0.11 0.77 0.00 0.00 0.00 179.25 180.39 1ozl h SER 53 N 0.71 0.14 -0.78 0.00 0.02 -0.59 -2.51 113.55 110.55 1ozl h SER 53 Ca 0.18 0.02 0.04 0.00 -0.84 0.00 0.00 61.79 61.18 1ozl h SER 53 Cb 0.15 -0.01 -0.05 0.00 0.14 0.00 0.00 62.40 62.64 1ozl h SER 53 CO -0.02 0.12 0.50 -0.07 -1.14 0.00 0.00 176.83 176.21 1ozl h LEU 54 N 0.23 0.81 0.06 5.07 3.38 -0.80 -1.16 115.31 122.91 1ozl h LEU 54 Ca 0.10 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.09 1ozl h LEU 54 Cb 0.05 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 1ozl h LEU 54 CO -0.09 0.55 -0.16 0.22 0.09 0.00 0.00 178.44 179.05 1ozl h TYR 55 N 0.96 -0.42 -0.67 1.13 3.20 -0.90 -0.07 116.97 120.20 1ozl h TYR 55 Ca 0.32 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.20 1ozl h TYR 55 Cb 0.04 0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 1ozl h TYR 55 CO -0.03 -0.24 0.41 0.45 -1.64 0.00 0.00 178.16 177.11 1ozl h HIS 56 N -0.30 0.87 0.04 -3.82 3.86 -1.09 -0.63 115.15 114.08 1ozl h HIS 56 Ca 0.03 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1ozl h HIS 56 Cb 0.34 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 28.52 1ozl h HIS 56 CO -0.19 0.58 -0.02 0.82 0.86 0.00 0.00 177.93 179.99 1ozl h ILE 57 N 0.90 1.03 -0.01 2.45 2.04 -0.96 -2.33 117.51 120.64 1ozl h ILE 57 Ca 0.24 -0.23 -0.10 0.00 1.00 0.00 0.00 64.86 65.76 1ozl h ILE 57 Cb -0.04 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 1ozl h ILE 57 CO -0.05 0.06 -0.49 1.88 0.00 0.00 0.00 178.15 179.56 1ozl h TYR 58 N -0.16 0.04 -0.29 1.37 0.05 -0.90 -0.36 116.97 116.72 1ozl h TYR 58 Ca -0.01 -0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.75 1ozl h TYR 58 Cb 0.14 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 37.86 1ozl h TYR 58 CO -0.04 0.51 0.12 0.28 -1.05 0.00 0.00 178.16 177.98 1ozl h VAL 59 N 0.03 1.17 -0.14 -2.88 2.07 -1.01 0.06 116.25 115.54 1ozl h VAL 59 Ca -0.00 -0.53 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 1ozl h VAL 59 Cb 0.87 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 1ozl h VAL 59 CO 0.06 0.18 0.02 0.00 0.02 0.00 0.00 177.57 177.85 1ozl h ALA 60 N 0.96 0.19 -0.25 1.67 0.00 -1.18 -1.72 119.26 118.94 1ozl h ALA 60 Ca 0.10 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1ozl h ALA 60 Cb 0.17 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1ozl h ALA 60 CO -0.01 -0.13 0.09 1.25 0.00 0.00 0.00 179.25 180.45 1ozl h LEU 61 N 0.01 0.12 -1.14 0.00 5.85 -0.97 -2.14 115.31 117.03 1ozl h LEU 61 Ca 0.04 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 1ozl h LEU 61 Cb 0.32 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1ozl h LEU 61 CO 0.00 0.10 -0.20 -0.33 -0.34 0.00 0.00 178.44 177.68 1ozl h GLU 62 N 0.21 0.00 -0.26 1.25 5.08 -0.96 0.07 114.58 119.97 1ozl h GLU 62 Ca 0.11 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.32 1ozl h GLU 62 Cb 0.06 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 1ozl h GLU 62 CO -0.10 0.20 -0.39 1.49 -1.00 0.00 0.00 179.01 179.21 1ozl h GLU 63 N 0.00 0.73 -0.08 2.33 4.81 -0.96 -2.03 114.58 119.38 1ozl h GLU 63 Ca -0.00 -0.43 -0.14 0.00 -0.13 0.00 0.00 59.36 58.65 1ozl h GLU 63 Cb 0.72 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 1ozl h GLU 63 CO 0.03 1.06 -0.59 0.93 -0.73 0.00 0.00 179.01 179.71 1ozl h GLU 64 N 0.47 0.26 -0.38 1.92 4.39 -1.00 -2.21 114.58 118.02 1ozl h GLU 64 Ca 0.03 -0.17 -0.06 0.00 0.34 0.00 0.00 59.36 59.50 1ozl h GLU 64 Cb 0.99 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.64 1ozl h GLU 64 CO 0.09 0.77 0.02 0.82 -1.16 0.00 0.00 179.01 179.55 1ozl h ILE 65 N 0.19 1.25 -0.50 3.13 2.04 -0.93 -1.96 117.51 120.74 1ozl h ILE 65 Ca -0.00 -0.95 -0.02 0.00 1.00 0.00 0.00 64.86 64.89 1ozl h ILE 65 Cb 1.09 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 38.27 1ozl h ILE 65 CO 0.09 0.32 0.24 -0.33 0.00 0.00 0.00 178.15 178.47 1ozl h GLU 66 N 0.48 0.69 -0.37 2.37 4.39 -1.24 0.20 114.58 121.10 1ozl h GLU 66 Ca 0.11 -0.08 -0.10 0.00 0.34 0.00 0.00 59.36 59.63 1ozl h GLU 66 Cb 0.43 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.93 1ozl h GLU 66 CO 0.02 0.53 -0.17 -0.09 -1.16 0.00 0.00 179.01 178.14 1ozl h ARG 67 N 0.69 0.69 -0.38 2.33 2.43 -1.05 -3.21 114.38 115.88 1ozl h ARG 67 Ca 0.17 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1ozl h ARG 67 Cb 0.07 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1ozl h ARG 67 CO -0.02 0.82 0.00 0.09 -1.51 0.00 0.00 179.97 179.35 1ozl n ASN 68 N -4.15 3.95 0.24 -3.80 4.13 -0.77 -4.70 115.26 110.16 1ozl n ASN 68 Ca 0.01 -2.63 0.10 0.00 1.68 0.00 0.00 54.58 53.74 1ozl n ASN 68 Cb 0.39 -0.48 0.69 0.00 -1.54 0.00 0.00 39.78 38.84 1ozl n ASN 68 CO 0.00 0.00 0.00 0.07 0.28 0.00 0.00 177.26 177.61 1ozl h LYS 69 N 2.47 0.00 0.00 3.52 2.10 -0.63 -1.96 116.57 122.07 1ozl h LYS 69 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1ozl h LYS 69 Cb 1.30 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.63 1ozl h LYS 69 CO 0.19 0.00 -0.56 0.39 -2.00 0.00 0.00 179.45 177.46 1ozl n GLU 70 N -4.40 0.01 -2.22 0.07 -0.58 -1.26 -3.71 120.64 108.55 1ozl n GLU 70 Ca -0.02 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.32 1ozl n GLU 70 Cb 0.14 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.48 1ozl n GLU 70 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1ozl s SER 71 N -3.03 6.91 0.39 1.62 0.15 -0.73 -4.78 113.70 114.22 1ozl s SER 71 Ca 0.11 2.56 0.28 0.00 0.70 0.00 0.00 55.95 59.60 1ozl s SER 71 Cb 0.17 -2.64 1.38 0.00 -1.71 0.00 0.00 66.02 63.22 1ozl s SER 71 CO 0.72 -0.42 1.84 -0.65 1.20 0.00 0.00 173.24 175.93 1ozl h PRO 72 N 3.49 0.00 -0.00 5.44 0.11 -1.91 0.32 132.00 139.44 1ozl h PRO 72 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1ozl h PRO 72 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1ozl h PRO 72 CO 0.66 0.00 -0.14 1.33 -0.21 0.00 0.00 178.00 179.64 1ozl n VAL 73 N -2.49 0.00 0.00 3.15 0.24 -1.26 -4.43 118.33 113.53 1ozl n VAL 73 Ca -0.01 -0.03 0.00 0.00 -2.04 0.00 0.00 64.34 62.26 1ozl n VAL 73 Cb 0.12 -0.16 0.00 0.00 -1.47 0.00 0.00 33.84 32.34 1ozl n VAL 73 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 1ozl n PHE 74 N -1.17 0.00 -0.29 6.34 7.35 -0.56 -4.76 117.46 124.37 1ozl n PHE 74 Ca 0.12 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 56.93 1ozl n PHE 74 Cb 0.29 0.00 0.24 0.00 0.35 0.00 0.00 39.48 40.36 1ozl n PHE 74 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1ozl n ALA 75 N -0.87 0.42 0.11 3.13 0.00 0.10 -0.45 120.51 122.95 1ozl n ALA 75 Ca 0.00 0.89 0.18 0.00 0.00 0.00 0.00 53.44 54.52 1ozl n ALA 75 Cb 0.05 -0.65 0.75 0.00 0.00 0.00 0.00 19.45 19.60 1ozl n ALA 75 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1ozl h PRO 76 N 0.00 0.00 -0.30 0.00 0.11 -1.83 -1.85 132.00 128.13 1ozl h PRO 76 Ca 0.50 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.57 1ozl h PRO 76 Cb 1.02 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.11 1ozl h PRO 76 CO -0.79 0.00 0.01 1.33 -0.21 0.00 0.00 178.00 178.34 1ozl n VAL 77 N -4.04 2.37 -2.82 3.15 0.24 0.40 -4.79 118.33 112.84 1ozl n VAL 77 Ca 0.05 -2.02 -0.43 0.00 -2.04 0.00 0.00 64.34 59.91 1ozl n VAL 77 Cb 0.47 -0.27 -0.04 0.00 -1.47 0.00 0.00 33.84 32.53 1ozl n VAL 77 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1ozl s TYR 78 N -2.92 2.82 -0.47 6.34 5.04 -0.70 -4.93 117.35 122.54 1ozl s TYR 78 Ca 0.43 0.11 0.07 0.00 -2.44 0.00 0.00 57.07 55.24 1ozl s TYR 78 Cb 0.36 -4.06 0.24 0.00 0.35 0.00 0.00 41.96 38.84 1ozl s TYR 78 CO 0.07 -1.29 0.55 1.19 -1.34 0.00 0.00 175.55 174.73 1ozl n PHE 79 N 7.43 0.66 -0.08 4.97 3.72 -1.26 -5.01 117.46 127.89 1ozl n PHE 79 Ca 0.03 -3.70 -0.07 0.00 -0.05 0.00 0.00 57.45 53.66 1ozl n PHE 79 Cb 0.48 -0.33 -0.00 0.00 -0.94 0.00 0.00 39.48 38.68 1ozl n PHE 79 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1ozl h PRO 80 N 4.31 0.16 -0.49 -1.08 0.13 -1.97 -1.99 132.00 131.08 1ozl h PRO 80 Ca 0.13 -0.01 -0.12 0.00 -0.87 0.00 0.00 66.00 65.13 1ozl h PRO 80 Cb 0.83 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.91 1ozl h PRO 80 CO 0.55 0.11 -0.16 0.93 -0.23 0.00 0.00 178.00 179.20 1ozl h GLU 81 N 0.17 0.97 -0.10 0.86 4.39 -1.96 -1.06 114.58 117.86 1ozl h GLU 81 Ca 0.14 -0.39 -0.15 0.00 0.34 0.00 0.00 59.36 59.30 1ozl h GLU 81 Cb 0.14 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.74 1ozl h GLU 81 CO -0.18 1.06 -0.59 0.93 -1.16 0.00 0.00 179.01 179.07 1ozl h GLU 82 N 0.82 0.32 0.00 2.33 3.07 -1.81 -3.40 114.58 115.91 1ozl h GLU 82 Ca 0.12 -0.21 -0.05 0.00 -0.50 0.00 0.00 59.36 58.72 1ozl h GLU 82 Cb 0.73 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.65 1ozl h GLU 82 CO 0.06 0.81 -1.45 1.28 -1.40 0.00 0.00 179.01 178.31 1ozl n LEU 83 N -3.90 0.00 -4.57 1.33 4.77 -0.75 -4.59 117.00 109.29 1ozl n LEU 83 Ca -0.03 0.00 -0.51 0.00 -0.03 0.00 0.00 56.01 55.44 1ozl n LEU 83 Cb 0.61 0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.72 1ozl n LEU 83 CO 0.45 0.07 0.80 0.00 -1.33 0.00 0.00 177.39 177.37 1ozl n HIS 84 N -1.97 1.33 0.10 -1.77 1.44 -0.40 -4.89 115.22 109.05 1ozl n HIS 84 Ca -0.06 0.69 0.02 0.00 -2.01 0.00 0.00 57.72 56.36 1ozl n HIS 84 Cb 0.41 -2.29 -0.02 0.00 0.12 0.00 0.00 29.99 28.21 1ozl n HIS 84 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 1ozl n ARG 85 N 2.15 3.81 -0.03 -1.40 5.12 -1.26 -4.79 116.66 120.26 1ozl n ARG 85 Ca 0.17 -0.01 -0.08 0.00 -1.93 0.00 0.00 57.85 56.00 1ozl n ARG 85 Cb 0.20 -0.81 -0.02 0.00 -1.16 0.00 0.00 32.46 30.67 1ozl n ARG 85 CO 0.00 0.00 0.00 -0.22 -1.93 0.00 0.00 177.63 175.48 1ozl h LYS 86 N 0.00 -0.18 -0.96 5.56 3.64 -1.90 -0.92 116.57 121.81 1ozl h LYS 86 Ca 0.00 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.42 1ozl h LYS 86 Cb 0.10 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 31.91 1ozl h LYS 86 CO 0.00 -0.12 0.63 0.00 -2.27 0.00 0.00 179.45 177.69 1ozl h ALA 87 N 0.90 1.36 -0.71 5.00 0.00 -2.00 -0.37 119.26 123.45 1ozl h ALA 87 Ca 0.12 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1ozl h ALA 87 Cb 0.37 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1ozl h ALA 87 CO -0.31 0.56 0.16 0.00 0.00 0.00 0.00 179.25 179.65 1ozl h ALA 88 N 1.43 0.93 -0.16 0.00 0.00 -1.70 -2.03 119.26 117.73 1ozl h ALA 88 Ca 0.37 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 1ozl h ALA 88 Cb -0.04 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1ozl h ALA 88 CO -0.11 0.67 -0.45 -0.07 0.00 0.00 0.00 179.25 179.29 1ozl h LEU 89 N 1.07 0.41 -0.28 0.00 3.38 -0.52 -1.07 115.31 118.30 1ozl h LEU 89 Ca 0.22 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1ozl h LEU 89 Cb 0.39 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1ozl h LEU 89 CO 0.01 0.81 0.14 -0.33 0.09 0.00 0.00 178.44 179.15 1ozl h GLU 90 N 0.31 0.41 -0.24 1.13 5.08 -0.82 0.13 114.58 120.58 1ozl h GLU 90 Ca 0.02 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1ozl h GLU 90 Cb 0.91 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.07 1ozl h GLU 90 CO 0.08 0.39 0.11 1.96 -1.00 0.00 0.00 179.01 180.54 1ozl h GLN 91 N 0.33 0.23 -0.57 2.33 1.08 -1.11 -2.18 115.11 115.21 1ozl h GLN 91 Ca 0.10 -0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.25 1ozl h GLN 91 Cb 0.11 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.47 1ozl h GLN 91 CO -0.01 0.15 0.22 -0.44 -0.95 0.00 0.00 178.83 177.80 1ozl h ASP 92 N 0.24 0.79 0.19 1.46 3.45 -0.89 -2.85 116.42 118.80 1ozl h ASP 92 Ca 0.10 -0.17 -0.07 0.00 0.43 0.00 0.00 57.03 57.32 1ozl h ASP 92 Cb 0.04 -0.21 -0.01 0.00 -0.56 0.00 0.00 39.33 38.60 1ozl h ASP 92 CO -0.08 0.75 -0.28 -0.07 -1.57 0.00 0.00 179.24 177.99 1ozl h LEU 93 N 0.79 0.15 -1.58 1.55 3.38 -0.58 -0.06 115.31 118.96 1ozl h LEU 93 Ca 0.19 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 1ozl h LEU 93 Cb 0.21 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1ozl h LEU 93 CO -0.01 0.43 -0.15 0.00 0.09 0.00 0.00 178.44 178.80 1ozl h ALA 94 N 1.58 1.66 0.01 1.53 0.00 -1.17 0.22 119.26 123.08 1ozl h ALA 94 Ca 0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1ozl h ALA 94 Cb 0.57 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1ozl h ALA 94 CO 0.04 0.26 -0.10 0.35 0.00 0.00 0.00 179.25 179.80 1ozl h PHE 95 N 0.08 0.08 -0.24 0.00 3.57 -1.05 -1.89 116.94 117.48 1ozl h PHE 95 Ca 0.02 -0.05 -0.14 0.00 3.53 0.00 0.00 57.97 61.33 1ozl h PHE 95 Cb 0.31 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 1ozl h PHE 95 CO 0.00 0.94 -0.42 -1.49 -2.23 0.00 0.00 178.31 175.11 1ozl h TRP 96 N -0.80 0.71 -0.01 0.41 4.06 -0.81 -3.33 115.95 116.18 1ozl h TRP 96 Ca -0.02 -0.21 0.00 0.00 2.06 0.00 0.00 58.89 60.72 1ozl h TRP 96 Cb 0.97 -0.15 0.00 0.00 -1.00 0.00 0.00 29.16 28.98 1ozl h TRP 96 CO 0.23 0.92 -0.02 0.66 -3.56 0.00 0.00 178.44 176.67 1ozl n TYR 97 N -4.02 0.00 0.00 0.49 4.01 0.74 -5.07 117.16 113.32 1ozl n TYR 97 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 1ozl n TYR 97 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.56 1ozl n TYR 97 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ozl n GLY 98 N 0.52 -0.38 0.31 2.72 0.00 -0.71 -4.12 105.19 103.53 1ozl n GLY 98 Ca 0.05 -1.80 0.17 0.00 0.00 0.00 0.00 46.02 44.43 1ozl n GLY 98 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ozl h PRO 99 N 0.00 0.00 -0.87 1.61 0.13 -1.91 -1.76 132.00 129.20 1ozl h PRO 99 Ca 0.00 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.72 1ozl h PRO 99 Cb 0.00 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 30.89 1ozl h PRO 99 CO 0.00 0.00 0.48 0.54 -0.23 0.00 0.00 178.00 178.79 1ozl n ARG 100 N -3.69 2.60 -0.34 0.86 1.74 -1.26 -4.67 116.66 111.90 1ozl n ARG 100 Ca -0.03 -3.05 0.15 0.00 -0.77 0.00 0.00 57.85 54.15 1ozl n ARG 100 Cb 0.08 -2.15 0.36 0.00 -1.02 0.00 0.00 32.46 29.73 1ozl n ARG 100 CO 0.00 0.00 0.00 0.11 -1.52 0.00 0.00 177.63 176.22 1ozl h TRP 101 N 1.44 0.97 -0.24 -1.55 5.08 -1.47 -0.73 115.95 119.46 1ozl h TRP 101 Ca 0.50 0.03 0.04 0.00 1.08 0.00 0.00 58.89 60.54 1ozl h TRP 101 Cb 2.61 -0.29 -0.01 0.00 -3.00 0.00 0.00 29.16 28.47 1ozl h TRP 101 CO 1.46 0.21 0.16 1.96 -1.28 0.00 0.00 178.44 180.95 1ozl h GLN 102 N 0.69 0.15 0.00 0.12 1.08 -1.87 0.11 115.11 115.38 1ozl h GLN 102 Ca 0.57 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.76 1ozl h GLN 102 Cb 0.99 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.38 1ozl h GLN 102 CO -0.35 0.10 -0.43 0.39 -0.95 0.00 0.00 178.83 177.59 1ozl n GLU 103 N -4.49 0.25 0.00 1.46 1.02 -0.29 -4.37 120.64 114.21 1ozl n GLU 103 Ca 0.02 0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 1ozl n GLU 103 Cb 0.20 -1.69 0.00 0.00 -0.02 0.00 0.00 31.44 29.93 1ozl n GLU 103 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 1ozl n VAL 104 N -2.07 0.00 -2.00 2.62 0.24 -0.64 -5.03 118.33 111.45 1ozl n VAL 104 Ca 0.04 -0.27 -0.41 0.00 -2.04 0.00 0.00 64.34 61.66 1ozl n VAL 104 Cb 0.42 0.78 -0.02 0.00 -1.47 0.00 0.00 33.84 33.55 1ozl n VAL 104 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1ozl s ILE 105 N -1.38 2.50 0.51 1.34 -4.36 0.27 -4.96 121.20 115.12 1ozl s ILE 105 Ca 0.00 0.49 -0.19 0.00 -0.26 0.00 0.00 60.65 60.68 1ozl s ILE 105 Cb 0.00 -3.31 -0.07 0.00 1.25 0.00 0.00 42.46 40.33 1ozl s ILE 105 CO 0.00 0.11 1.04 -2.16 0.24 0.00 0.00 174.94 174.17 1ozl s PRO 106 N -1.64 3.71 -0.40 0.37 0.04 -1.26 -5.01 135.00 130.80 1ozl s PRO 106 Ca 0.52 1.30 0.02 0.00 0.04 0.00 0.00 61.00 62.88 1ozl s PRO 106 Cb -0.42 -2.08 0.15 0.00 0.04 0.00 0.00 34.50 32.18 1ozl s PRO 106 CO 0.54 -0.50 0.26 -0.47 0.04 0.00 0.00 177.00 176.87 1ozl s TYR 107 N -2.12 1.24 0.68 0.56 5.04 -1.26 -4.81 117.35 116.69 1ozl s TYR 107 Ca 0.66 -2.06 -0.11 0.00 -2.44 0.00 0.00 57.07 53.11 1ozl s TYR 107 Cb -0.16 -1.23 0.00 0.00 0.35 0.00 0.00 41.96 40.93 1ozl s TYR 107 CO 0.24 -0.80 1.07 0.95 -1.34 0.00 0.00 175.55 175.67 1ozl s THR 108 N 0.53 3.72 0.31 4.34 -4.23 -1.26 -4.86 115.64 114.20 1ozl s THR 108 Ca 0.22 0.52 0.03 0.00 -1.18 0.00 0.00 61.69 61.28 1ozl s THR 108 Cb -0.16 -3.55 0.29 0.00 1.34 0.00 0.00 72.50 70.43 1ozl s THR 108 CO -0.05 -0.71 1.88 -0.65 -0.54 0.00 0.00 174.62 174.55 1ozl h PRO 109 N -0.56 0.88 -0.09 3.99 0.11 -2.00 0.59 132.00 134.93 1ozl h PRO 109 Ca -0.45 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 65.49 1ozl h PRO 109 Cb 1.24 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 1ozl h PRO 109 CO 0.63 0.58 -0.49 0.00 -0.21 0.00 0.00 178.00 178.51 1ozl h ALA 110 N 1.55 1.00 -0.34 -0.75 0.00 -1.94 -0.16 119.26 118.62 1ozl h ALA 110 Ca 0.43 -0.47 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 1ozl h ALA 110 Cb 0.43 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1ozl h ALA 110 CO -0.19 0.65 -0.25 0.52 0.00 0.00 0.00 179.25 179.97 1ozl h MET 111 N 0.18 0.77 -0.74 0.00 2.86 -1.64 -2.91 114.93 113.44 1ozl h MET 111 Ca 0.01 -0.37 -0.02 0.00 -2.06 0.00 0.00 59.70 57.25 1ozl h MET 111 Cb 0.94 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.56 1ozl h MET 111 CO 0.08 1.00 0.37 1.96 1.06 0.00 0.00 176.91 181.38 1ozl h GLN 112 N 0.54 1.05 -0.59 1.72 4.20 -0.55 -1.02 115.11 120.46 1ozl h GLN 112 Ca 0.06 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1ozl h GLN 112 Cb 0.82 -0.20 -0.03 0.00 0.30 0.00 0.00 27.48 28.37 1ozl h GLN 112 CO 0.07 0.79 0.37 -0.09 -0.67 0.00 0.00 178.83 179.30 1ozl h ARG 113 N 1.05 0.79 0.01 1.46 2.43 -0.93 0.19 114.38 119.38 1ozl h ARG 113 Ca 0.26 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.37 1ozl h ARG 113 Cb 0.08 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 1ozl h ARG 113 CO -0.04 0.55 -0.00 -0.92 -1.51 0.00 0.00 179.97 178.05 1ozl h TYR 114 N 0.80 -0.01 -0.83 2.20 5.03 -1.27 -2.30 116.97 120.58 1ozl h TYR 114 Ca 0.21 -0.00 0.04 0.00 2.58 0.00 0.00 58.73 61.57 1ozl h TYR 114 Cb -0.05 0.00 -0.05 0.00 1.55 0.00 0.00 36.73 38.18 1ozl h TYR 114 CO -0.03 0.24 0.53 0.28 -1.32 0.00 0.00 178.16 177.86 1ozl h VAL 115 N -0.27 1.10 -0.66 1.81 2.07 -0.96 -1.54 116.25 117.79 1ozl h VAL 115 Ca -0.00 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1ozl h VAL 115 Cb 0.26 0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.00 1ozl h VAL 115 CO 0.00 0.18 0.42 0.50 0.02 0.00 0.00 177.57 178.70 1ozl h LYS 116 N 1.00 0.89 -0.54 1.57 3.64 -0.51 -1.40 116.57 121.22 1ozl h LYS 116 Ca 0.34 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.58 1ozl h LYS 116 Cb 0.07 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 1ozl h LYS 116 CO -0.14 0.61 0.04 -0.09 -2.27 0.00 0.00 179.45 177.61 1ozl h ARG 117 N 0.90 0.92 -0.58 1.90 9.65 -0.89 -0.35 114.38 125.92 1ozl h ARG 117 Ca 0.24 -0.27 0.04 0.00 -1.10 0.00 0.00 59.98 58.89 1ozl h ARG 117 Cb -0.07 -0.09 -0.04 0.00 -1.39 0.00 0.00 29.97 28.37 1ozl h ARG 117 CO -0.05 0.91 0.32 -0.07 2.80 0.00 0.00 179.97 183.89 1ozl h LEU 118 N 0.80 0.50 -0.64 3.80 3.38 -0.84 0.33 115.31 122.63 1ozl h LEU 118 Ca 0.16 0.02 -0.14 0.00 0.09 0.00 0.00 57.88 58.01 1ozl h LEU 118 Cb 0.47 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1ozl h LEU 118 CO 0.02 0.34 -0.43 0.45 0.09 0.00 0.00 178.44 178.90 1ozl h HIS 119 N 0.63 0.68 -0.62 1.13 3.86 -1.07 -1.05 115.15 118.71 1ozl h HIS 119 Ca 0.25 -0.20 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 1ozl h HIS 119 Cb 0.11 -0.14 -0.03 0.00 1.06 0.00 0.00 27.41 28.41 1ozl h HIS 119 CO -0.08 0.90 0.32 0.93 0.86 0.00 0.00 177.93 180.86 1ozl h GLU 120 N 0.46 0.87 -0.00 2.45 5.08 -0.42 -1.19 114.58 121.83 1ozl h GLU 120 Ca 0.03 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1ozl h GLU 120 Cb 0.94 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 30.03 1ozl h GLU 120 CO 0.08 0.68 -0.00 0.28 -1.00 0.00 0.00 179.01 179.06 1ozl h VAL 121 N 0.84 1.27 0.00 3.13 2.07 -0.80 -0.64 116.25 122.13 1ozl h VAL 121 Ca 0.21 -0.81 -0.02 0.00 0.82 0.00 0.00 66.70 66.91 1ozl h VAL 121 Cb 0.08 1.82 -0.00 0.00 -1.52 0.00 0.00 31.29 31.66 1ozl h VAL 121 CO -0.03 0.21 -0.09 1.23 0.02 0.00 0.00 177.57 178.91 1ozl h GLY 122 N -0.34 0.00 0.16 2.17 0.00 -1.07 0.18 103.07 104.17 1ozl h GLY 122 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.14 1ozl h GLY 122 CO 0.00 0.00 -2.07 0.54 0.00 0.00 0.00 176.54 175.01 1ozl n ARG 123 N -3.92 0.67 0.00 4.80 1.74 -0.46 -4.46 116.66 115.03 1ozl n ARG 123 Ca -0.02 -0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.01 1ozl n ARG 123 Cb 0.18 -1.57 0.00 0.00 -1.02 0.00 0.00 32.46 30.06 1ozl n ARG 123 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1ozl n THR 124 N -2.57 0.00 -2.88 0.55 -2.24 -0.25 -4.86 114.28 102.03 1ozl n THR 124 Ca -0.18 -0.12 -0.14 0.00 -2.27 0.00 0.00 64.05 61.35 1ozl n THR 124 Cb 0.87 0.57 0.00 0.00 -2.10 0.00 0.00 70.33 69.67 1ozl n THR 124 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ozl n GLU 125 N -0.81 1.19 -0.26 -0.78 1.02 0.40 -4.95 120.64 116.46 1ozl n GLU 125 Ca 0.00 -3.38 0.27 0.00 -0.02 0.00 0.00 57.16 54.03 1ozl n GLU 125 Cb 0.00 -1.49 0.64 0.00 -0.02 0.00 0.00 31.44 30.57 1ozl n GLU 125 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 1ozl h PRO 126 N 2.99 0.17 0.00 3.49 0.11 -1.14 0.11 132.00 137.72 1ozl h PRO 126 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1ozl h PRO 126 Cb 1.07 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1ozl h PRO 126 CO 0.52 0.11 0.04 1.05 -0.21 0.00 0.00 178.00 179.51 1ozl h GLU 127 N 0.17 0.00 -0.02 1.05 9.09 -1.87 -0.82 114.58 122.19 1ozl h GLU 127 Ca 0.51 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.92 1ozl h GLU 127 Cb 1.68 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.78 1ozl h GLU 127 CO -0.11 0.00 -0.36 1.28 0.05 0.00 0.00 179.01 179.87 1ozl n LEU 128 N -2.74 1.91 0.06 3.06 4.77 0.37 -4.34 117.00 120.09 1ozl n LEU 128 Ca -0.02 -0.67 0.05 0.00 -0.03 0.00 0.00 56.01 55.33 1ozl n LEU 128 Cb 0.09 -0.03 0.46 0.00 -2.33 0.00 0.00 43.42 41.62 1ozl n LEU 128 CO 0.15 0.35 1.12 0.25 -1.33 0.00 0.00 177.39 177.93 1ozl h LEU 129 N 2.44 0.36 -1.97 2.23 5.85 -1.25 -1.59 115.31 121.38 1ozl h LEU 129 Ca 0.00 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.75 1ozl h LEU 129 Cb 0.72 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 1ozl h LEU 129 CO 0.00 0.28 0.14 1.62 -0.34 0.00 0.00 178.44 180.14 1ozl h VAL 130 N 0.42 0.92 -0.61 1.05 3.04 -1.77 -0.13 116.25 119.17 1ozl h VAL 130 Ca 0.11 -0.01 -0.10 0.00 -1.01 0.00 0.00 66.70 65.69 1ozl h VAL 130 Cb -0.01 0.88 -0.02 0.00 -2.01 0.00 0.00 31.29 30.13 1ozl h VAL 130 CO -0.02 0.01 -0.00 0.00 -1.01 0.00 0.00 177.57 176.55 1ozl h ALA 131 N 1.90 0.84 -0.01 3.17 0.00 -1.58 0.87 119.26 124.45 1ozl h ALA 131 Ca 0.09 -0.31 -0.25 0.00 0.00 0.00 0.00 54.91 54.44 1ozl h ALA 131 Cb 0.32 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 17.90 1ozl h ALA 131 CO -0.00 0.67 -0.98 0.45 0.00 0.00 0.00 179.25 179.38 1ozl h HIS 132 N 0.98 0.89 -0.64 0.00 -0.00 -1.25 -1.94 115.15 113.19 1ozl h HIS 132 Ca 0.17 -0.48 -0.08 0.00 -0.00 0.00 0.00 60.37 59.99 1ozl h HIS 132 Cb 0.56 -0.10 -0.03 0.00 -0.00 0.00 0.00 27.41 27.84 1ozl h HIS 132 CO 0.04 1.30 0.08 0.00 -0.00 0.00 0.00 177.93 179.35 1ozl h ALA 133 N 0.54 0.93 0.47 2.45 0.00 -0.98 -1.37 119.26 121.29 1ozl h ALA 133 Ca -0.11 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 1ozl h ALA 133 Cb 1.63 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1ozl h ALA 133 CO 0.19 0.66 -0.23 -0.92 0.00 0.00 0.00 179.25 178.95 1ozl h TYR 134 N 1.00 -0.58 -0.97 0.00 3.20 -0.79 -0.35 116.97 118.47 1ozl h TYR 134 Ca 0.19 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.05 1ozl h TYR 134 Cb 0.46 0.19 -0.05 0.00 1.54 0.00 0.00 36.73 38.88 1ozl h TYR 134 CO 0.03 -0.34 0.61 1.79 -1.64 0.00 0.00 178.16 178.62 1ozl h THR 135 N -0.69 1.26 0.21 1.81 1.35 -1.26 -1.50 112.91 114.10 1ozl h THR 135 Ca -0.06 -0.51 -0.01 0.00 -0.55 0.00 0.00 66.41 65.27 1ozl h THR 135 Cb 0.51 -0.14 0.00 0.00 -1.73 0.00 0.00 68.15 66.80 1ozl h THR 135 CO 0.11 0.26 -0.10 0.03 -0.25 0.00 0.00 175.52 175.56 1ozl h ARG 136 N 1.32 -0.28 -0.10 4.72 2.47 -1.21 -3.14 114.38 118.16 1ozl h ARG 136 Ca 0.35 0.02 -0.02 0.00 -1.26 0.00 0.00 59.98 59.07 1ozl h ARG 136 Cb -0.11 0.06 -0.00 0.00 -1.65 0.00 0.00 29.97 28.27 1ozl h ARG 136 CO -0.07 -0.18 -0.02 1.88 0.56 0.00 0.00 179.97 182.13 1ozl h TYR 137 N -0.94 0.21 -0.13 3.04 0.05 -1.13 -1.03 116.97 117.03 1ozl h TYR 137 Ca -0.03 -0.04 -0.09 0.00 0.05 0.00 0.00 58.73 58.62 1ozl h TYR 137 Cb 0.22 -0.05 -0.01 0.00 1.01 0.00 0.00 36.73 37.90 1ozl h TYR 137 CO 0.01 0.49 -0.31 1.25 -1.05 0.00 0.00 178.16 178.54 1ozl h LEU 138 N -0.14 0.26 -0.18 3.88 5.85 -1.39 -0.53 115.31 123.07 1ozl h LEU 138 Ca 0.02 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.62 1ozl h LEU 138 Cb 0.42 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 1ozl h LEU 138 CO 0.01 0.57 -0.01 1.23 -0.34 0.00 0.00 178.44 179.90 1ozl h GLY 139 N 1.06 0.35 1.52 3.75 0.00 -1.49 -0.34 103.07 107.92 1ozl h GLY 139 Ca 0.03 -0.27 -0.05 0.00 0.00 0.00 0.00 47.33 47.04 1ozl h GLY 139 CO 0.05 0.25 0.03 0.00 0.00 0.00 0.00 176.54 176.87 1ozl h ALA 140 N 0.76 1.34 0.00 3.60 0.00 -0.95 -0.74 119.26 123.26 1ozl h ALA 140 Ca 0.05 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1ozl h ALA 140 Cb 0.41 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1ozl h ALA 140 CO 0.01 0.46 -0.42 1.25 0.00 0.00 0.00 179.25 180.55 1ozl h LEU 141 N 0.57 0.00 0.00 0.00 5.85 -0.96 -1.06 115.31 119.71 1ozl h LEU 141 Ca 0.12 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.76 1ozl h LEU 141 Cb 0.32 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 1ozl h LEU 141 CO 0.01 0.42 -0.72 0.28 -0.34 0.00 0.00 178.44 178.09 1ozl h SER 142 N 0.00 0.00 -0.50 1.25 0.02 -0.59 -3.41 113.55 110.31 1ozl h SER 142 Ca -0.00 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 1ozl h SER 142 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1ozl h SER 142 CO 0.05 1.00 0.00 0.61 -1.14 0.00 0.00 176.83 177.36 1ozl n GLY 143 N 1.56 2.20 0.36 -3.77 0.00 -0.33 -4.54 105.19 100.68 1ozl n GLY 143 Ca -0.15 -0.65 -0.03 0.00 0.00 0.00 0.00 46.02 45.19 1ozl n GLY 143 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ozl h GLY 144 N 3.64 1.34 0.93 -0.02 0.00 -1.25 -1.57 103.07 106.15 1ozl h GLY 144 Ca 0.00 -0.53 -0.05 0.00 0.00 0.00 0.00 47.33 46.75 1ozl h GLY 144 CO 0.00 0.51 0.04 1.46 0.00 0.00 0.00 176.54 178.56 1ozl h GLN 145 N 1.28 0.66 -0.04 4.80 7.50 -1.80 -0.08 115.11 127.43 1ozl h GLN 145 Ca 0.34 -0.19 -0.00 0.00 0.50 0.00 0.00 58.65 59.30 1ozl h GLN 145 Cb -0.10 -0.07 -0.00 0.00 0.05 0.00 0.00 27.48 27.35 1ozl h GLN 145 CO -0.07 0.73 0.02 0.28 -1.50 0.00 0.00 178.83 178.29 1ozl h VAL 146 N 0.50 1.03 -0.34 -0.54 2.07 -1.79 -1.24 116.25 115.94 1ozl h VAL 146 Ca 0.12 -0.09 -0.07 0.00 0.82 0.00 0.00 66.70 67.48 1ozl h VAL 146 Cb 0.40 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 1ozl h VAL 146 CO 0.01 0.03 -0.08 -0.07 0.02 0.00 0.00 177.57 177.48 1ozl h LEU 147 N 0.03 0.54 -0.20 2.57 3.38 -1.23 -2.65 115.31 117.76 1ozl h LEU 147 Ca 0.01 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 1ozl h LEU 147 Cb 0.03 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1ozl h LEU 147 CO -0.00 0.67 -0.09 0.50 0.09 0.00 0.00 178.44 179.61 1ozl h LYS 148 N 0.53 0.41 -0.96 1.13 3.64 -0.79 -2.00 116.57 118.54 1ozl h LYS 148 Ca 0.10 -0.17 0.04 0.00 -1.27 0.00 0.00 60.65 59.35 1ozl h LYS 148 Cb 0.46 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.21 1ozl h LYS 148 CO 0.02 0.69 0.62 0.87 -2.27 0.00 0.00 179.45 179.39 1ozl h LYS 149 N 0.10 1.15 -0.56 1.90 1.57 -1.12 -1.70 116.57 117.91 1ozl h LYS 149 Ca 0.04 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.65 1ozl h LYS 149 Cb 0.57 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 1ozl h LYS 149 CO 0.03 0.76 -0.07 0.82 -0.57 0.00 0.00 179.45 180.42 1ozl h ILE 150 N 1.19 1.27 0.92 1.86 2.04 -1.42 -2.93 117.51 120.44 1ozl h ILE 150 Ca 0.39 -1.23 -0.05 0.00 1.00 0.00 0.00 64.86 64.97 1ozl h ILE 150 Cb 0.03 0.91 0.01 0.00 -0.74 0.00 0.00 36.82 37.04 1ozl h ILE 150 CO -0.13 0.44 -0.44 0.00 0.00 0.00 0.00 178.15 178.01 1ozl h ALA 151 N 0.95 -1.28 -0.22 1.87 0.00 -0.56 -2.88 119.26 117.13 1ozl h ALA 151 Ca 0.15 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.81 1ozl h ALA 151 Cb 0.64 0.48 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1ozl h ALA 151 CO 0.04 -1.19 0.15 -0.56 0.00 0.00 0.00 179.25 177.69 1ozl h GLN 152 N -1.29 0.20 -0.00 0.00 3.07 -1.43 0.21 115.11 115.86 1ozl h GLN 152 Ca -0.13 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.60 1ozl h GLN 152 Cb 0.95 -0.04 0.00 0.00 0.08 0.00 0.00 27.48 28.47 1ozl h GLN 152 CO 0.21 0.13 -0.02 1.63 0.09 0.00 0.00 178.83 180.87 1ozl n LYS 153 N -4.50 0.87 -0.01 0.06 4.76 -1.11 -2.90 118.16 115.33 1ozl n LYS 153 Ca 0.01 -0.13 -0.01 0.00 -2.87 0.00 0.00 58.31 55.31 1ozl n LYS 153 Cb 0.15 -1.50 -0.03 0.00 -1.84 0.00 0.00 35.03 31.81 1ozl n LYS 153 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ozl n ALA 154 N -0.95 1.95 0.19 7.82 0.00 -0.30 -4.66 120.51 124.55 1ozl n ALA 154 Ca 0.20 -0.19 0.09 0.00 0.00 0.00 0.00 53.44 53.53 1ozl n ALA 154 Cb 0.19 0.15 0.12 0.00 0.00 0.00 0.00 19.45 19.91 1ozl n ALA 154 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1ozl h LEU 155 N 0.00 0.00 -2.75 0.00 4.07 -0.71 -3.48 115.31 112.44 1ozl h LEU 155 Ca -0.08 0.00 -0.46 0.00 0.08 0.00 0.00 57.88 57.42 1ozl h LEU 155 Cb 1.07 0.00 0.04 0.00 1.08 0.00 0.00 40.66 42.85 1ozl h LEU 155 CO 0.00 0.16 -0.92 -0.67 -1.08 0.00 0.00 178.44 175.93 1ozl n ASP 156 N -3.13 -3.45 -4.77 -0.43 2.03 -1.14 -4.91 116.55 100.75 1ozl n ASP 156 Ca 0.03 -1.02 -0.33 0.00 0.52 0.00 0.00 54.79 54.00 1ozl n ASP 156 Cb 0.60 -3.24 0.05 0.00 -0.72 0.00 0.00 41.12 37.80 1ozl n ASP 156 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1ozl s LEU 157 N -6.68 3.40 0.00 -2.67 1.43 -1.26 -5.04 118.68 107.85 1ozl s LEU 157 Ca 0.30 2.01 0.00 0.00 -1.03 0.00 0.00 54.13 55.41 1ozl s LEU 157 Cb -0.11 -4.55 0.00 0.00 0.03 0.00 0.00 46.19 41.56 1ozl s LEU 157 CO 0.87 -1.62 0.00 -0.81 0.23 0.00 0.00 176.35 175.02 1ozl n PRO 158 N -2.38 0.43 -2.45 1.29 -0.04 -1.26 -4.93 135.00 125.66 1ozl n PRO 158 Ca 0.10 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.26 1ozl n PRO 158 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 1ozl n PRO 158 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1ozl n SER 159 N -0.89 5.40 -0.61 3.54 7.64 -1.26 -4.74 113.62 122.70 1ozl n SER 159 Ca 0.00 -3.74 0.12 0.00 1.01 0.00 0.00 58.87 56.26 1ozl n SER 159 Cb 0.00 -0.64 0.40 0.00 -1.01 0.00 0.00 64.21 62.96 1ozl n SER 159 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1ozl n SER 160 N -0.43 1.85 -1.87 6.43 3.41 -1.26 -4.96 113.62 116.78 1ozl n SER 160 Ca 0.41 -1.67 -0.17 0.00 -0.26 0.00 0.00 58.87 57.18 1ozl n SER 160 Cb 0.51 -0.07 -0.02 0.00 -0.26 0.00 0.00 64.21 64.37 1ozl n SER 160 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ozl n GLY 161 N 1.20 -0.10 3.39 5.00 0.00 -1.26 -5.00 105.19 108.42 1ozl n GLY 161 Ca 0.17 -0.17 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 1ozl n GLY 161 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ozl s GLU 162 N -4.69 1.25 0.00 1.61 2.02 -1.26 -4.98 118.70 112.65 1ozl s GLU 162 Ca 0.00 -1.17 0.00 0.00 0.02 0.00 0.00 54.97 53.82 1ozl s GLU 162 Cb 0.00 0.40 0.00 0.00 0.10 0.00 0.00 34.13 34.63 1ozl s GLU 162 CO 0.00 -0.48 0.00 0.41 0.02 0.00 0.00 175.26 175.21 1ozl n GLY 163 N -0.26 2.30 0.68 -1.39 0.00 -1.26 -4.93 105.19 100.33 1ozl n GLY 163 Ca -0.06 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.01 1ozl n GLY 163 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ozl n LEU 164 N 0.00 1.86 0.05 0.99 4.77 -1.26 -4.78 117.00 118.62 1ozl n LEU 164 Ca 0.00 -2.88 0.07 0.00 -0.03 0.00 0.00 56.01 53.17 1ozl n LEU 164 Cb 0.00 -0.31 0.50 0.00 -2.33 0.00 0.00 43.42 41.28 1ozl n LEU 164 CO 0.00 0.88 1.15 0.00 -1.33 0.00 0.00 177.39 178.09 1ozl h ALA 165 N 0.64 1.87 -0.86 -1.18 0.00 -1.92 -1.98 119.26 115.84 1ozl h ALA 165 Ca -0.05 -0.02 0.20 0.00 0.00 0.00 0.00 54.91 55.04 1ozl h ALA 165 Cb 1.27 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.90 1ozl h ALA 165 CO 0.02 0.08 0.58 0.35 0.00 0.00 0.00 179.25 180.29 1ozl h PHE 166 N 0.37 0.40 -0.02 0.00 3.57 -1.87 -0.73 116.94 118.66 1ozl h PHE 166 Ca 0.14 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.66 1ozl h PHE 166 Cb 0.12 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1ozl h PHE 166 CO -0.00 0.11 0.00 1.19 -2.23 0.00 0.00 178.31 177.38 1ozl n PHE 167 N -4.45 0.02 -4.53 0.41 3.72 -0.74 -4.72 117.46 107.16 1ozl n PHE 167 Ca 0.18 -0.01 -0.30 0.00 -0.05 0.00 0.00 57.45 57.27 1ozl n PHE 167 Cb 0.72 0.00 -0.17 0.00 -0.94 0.00 0.00 39.48 39.10 1ozl n PHE 167 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1ozl s THR 168 N -1.98 1.72 -0.76 4.37 2.01 -0.28 -4.80 115.64 115.92 1ozl s THR 168 Ca 0.37 -0.77 -0.13 0.00 0.31 0.00 0.00 61.69 61.46 1ozl s THR 168 Cb 0.17 -1.55 0.20 0.00 0.01 0.00 0.00 72.50 71.34 1ozl s THR 168 CO 0.29 0.48 0.69 -0.36 -0.69 0.00 0.00 174.62 175.03 1ozl s PHE 169 N 0.93 3.65 0.56 4.92 0.40 -1.26 -4.94 117.98 122.24 1ozl s PHE 169 Ca -0.07 -1.96 0.30 0.00 -0.60 0.00 0.00 56.93 54.60 1ozl s PHE 169 Cb -0.15 -3.75 1.76 0.00 0.51 0.00 0.00 43.02 41.39 1ozl s PHE 169 CO -0.02 -0.98 2.22 -1.00 0.70 0.00 0.00 175.22 176.14 1ozl h PRO 170 N 7.88 0.00 -0.54 0.24 0.13 -1.93 -2.85 132.00 134.94 1ozl h PRO 170 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 1ozl h PRO 170 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1ozl h PRO 170 CO 0.79 0.02 0.00 0.09 -0.23 0.00 0.00 178.00 178.68 1ozl n ASN 171 N -3.79 2.92 -4.06 1.44 5.03 -1.26 -4.71 115.26 110.82 1ozl n ASN 171 Ca -0.03 -2.12 -0.32 0.00 0.87 0.00 0.00 54.58 52.99 1ozl n ASN 171 Cb 0.11 -0.38 -0.15 0.00 -1.02 0.00 0.00 39.78 38.33 1ozl n ASN 171 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1ozl s ILE 172 N -1.50 2.05 0.12 2.41 1.01 -1.08 -4.65 121.20 119.56 1ozl s ILE 172 Ca 0.34 -1.39 -0.08 0.00 0.00 0.00 0.00 60.65 59.52 1ozl s ILE 172 Cb 0.19 -2.09 -0.18 0.00 0.01 0.00 0.00 42.46 40.39 1ozl s ILE 172 CO 0.20 0.12 1.29 0.00 0.00 0.00 0.00 174.94 176.55 1ozl h ALA 173 N 7.84 0.32 -3.28 9.38 0.00 -1.85 -3.43 119.26 128.24 1ozl h ALA 173 Ca -0.26 -0.68 -0.50 0.00 0.00 0.00 0.00 54.91 53.47 1ozl h ALA 173 Cb 1.07 -0.00 -0.39 0.00 0.00 0.00 0.00 17.79 18.47 1ozl h ALA 173 CO 0.50 0.76 -0.77 0.45 0.00 0.00 0.00 179.25 180.18 1ozl s SER 174 N -7.13 2.48 0.24 0.00 0.15 -1.26 -5.01 113.70 103.16 1ozl s SER 174 Ca -0.07 -0.55 -0.06 0.00 0.70 0.00 0.00 55.95 55.97 1ozl s SER 174 Cb 0.08 -0.64 0.23 0.00 -1.71 0.00 0.00 66.02 63.98 1ozl s SER 174 CO 0.88 -0.23 1.84 0.00 1.20 0.00 0.00 173.24 176.93 1ozl h ALA 175 N 8.23 1.16 -0.24 5.45 0.00 -1.96 -0.59 119.26 131.32 1ozl h ALA 175 Ca -0.20 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 1ozl h ALA 175 Cb 1.12 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1ozl h ALA 175 CO 0.33 0.65 0.10 1.79 0.00 0.00 0.00 179.25 182.12 1ozl h THR 176 N 1.20 1.16 -0.40 0.00 1.35 -1.95 -0.08 112.91 114.20 1ozl h THR 176 Ca 0.30 -0.49 -0.02 0.00 -0.55 0.00 0.00 66.41 65.64 1ozl h THR 176 Cb 0.08 1.05 -0.02 0.00 -1.73 0.00 0.00 68.15 67.53 1ozl h THR 176 CO -0.04 0.16 0.17 0.11 -0.25 0.00 0.00 175.52 175.68 1ozl h LYS 177 N 0.23 0.58 -0.57 4.72 1.79 -1.92 -2.55 116.57 118.85 1ozl h LYS 177 Ca 0.08 -0.10 -0.07 0.00 -2.18 0.00 0.00 60.65 58.38 1ozl h LYS 177 Cb 0.17 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 30.70 1ozl h LYS 177 CO -0.01 0.53 0.08 0.35 -1.08 0.00 0.00 179.45 179.33 1ozl h PHE 178 N 0.50 1.02 -0.58 -1.35 3.57 -0.98 -1.89 116.94 117.23 1ozl h PHE 178 Ca 0.13 -0.15 0.01 0.00 3.53 0.00 0.00 57.97 61.49 1ozl h PHE 178 Cb 0.15 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 38.59 1ozl h PHE 178 CO -0.01 0.89 0.38 0.87 -2.23 0.00 0.00 178.31 178.22 1ozl h LYS 179 N 0.85 0.76 -0.41 1.11 1.57 -0.90 0.36 116.57 119.91 1ozl h LYS 179 Ca 0.17 -0.05 -0.13 0.00 -1.87 0.00 0.00 60.65 58.77 1ozl h LYS 179 Cb 0.43 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1ozl h LYS 179 CO 0.01 0.50 -0.27 1.96 -0.57 0.00 0.00 179.45 181.09 1ozl h GLN 180 N 0.78 0.90 -0.31 3.15 4.20 -1.16 -1.16 115.11 121.51 1ozl h GLN 180 Ca 0.21 -0.43 -0.04 0.00 0.06 0.00 0.00 58.65 58.45 1ozl h GLN 180 Cb -0.09 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 1ozl h GLN 180 CO -0.05 1.08 0.03 1.25 -0.67 0.00 0.00 178.83 180.47 1ozl h LEU 181 N 0.72 0.51 -0.89 1.46 5.85 -0.47 -1.26 115.31 121.22 1ozl h LEU 181 Ca 0.08 -0.28 -0.06 0.00 0.84 0.00 0.00 57.88 58.47 1ozl h LEU 181 Cb 0.85 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.72 1ozl h LEU 181 CO 0.07 0.66 0.18 0.22 -0.34 0.00 0.00 178.44 179.24 1ozl h TYR 182 N 0.34 1.03 -0.55 1.25 5.03 -0.27 -1.38 116.97 122.43 1ozl h TYR 182 Ca 0.09 -0.10 -0.11 0.00 2.58 0.00 0.00 58.73 61.19 1ozl h TYR 182 Cb 0.38 -0.30 -0.02 0.00 1.55 0.00 0.00 36.73 38.34 1ozl h TYR 182 CO 0.03 0.83 -0.08 0.00 -1.32 0.00 0.00 178.16 177.62 1ozl h ARG 183 N 0.96 1.01 -0.69 1.82 3.08 -1.09 -1.65 114.38 117.81 1ozl h ARG 183 Ca 0.21 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.90 1ozl h ARG 183 Cb 0.30 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.24 1ozl h ARG 183 CO -0.00 1.04 0.41 1.03 -1.07 0.00 0.00 179.97 181.37 1ozl h SER 184 N 0.91 0.83 -0.54 7.04 0.87 -0.70 -0.91 113.55 121.04 1ozl h SER 184 Ca 0.15 -0.07 -0.06 0.00 -1.23 0.00 0.00 61.79 60.58 1ozl h SER 184 Cb 0.63 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.36 1ozl h SER 184 CO 0.04 0.65 0.10 0.03 -0.53 0.00 0.00 176.83 177.12 1ozl h ARG 185 N 0.94 0.88 -0.76 2.24 2.47 -1.03 -1.84 114.38 117.27 1ozl h ARG 185 Ca 0.25 -0.23 0.00 0.00 -1.26 0.00 0.00 59.98 58.74 1ozl h ARG 185 Cb -0.02 -0.11 -0.04 0.00 -1.65 0.00 0.00 29.97 28.16 1ozl h ARG 185 CO -0.05 0.86 0.49 0.52 0.56 0.00 0.00 179.97 182.35 1ozl h MET 186 N 0.77 1.01 0.00 0.04 2.86 -0.94 -0.93 114.93 117.74 1ozl h MET 186 Ca 0.16 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1ozl h MET 186 Cb 0.39 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 31.83 1ozl h MET 186 CO 0.01 0.68 0.00 0.09 1.06 0.00 0.00 176.91 178.75 1ozl n ASN 187 N -4.54 0.44 0.15 1.22 3.02 -0.38 -2.09 115.26 113.09 1ozl n ASN 187 Ca 0.07 0.61 0.11 0.00 -0.03 0.00 0.00 54.58 55.35 1ozl n ASN 187 Cb 0.03 -0.70 0.07 0.00 -0.61 0.00 0.00 39.78 38.57 1ozl n ASN 187 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1ozl h SER 188 N 0.00 0.00 -3.27 6.41 4.64 -0.33 -3.47 113.55 117.53 1ozl h SER 188 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1ozl h SER 188 Cb 0.31 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.48 1ozl h SER 188 CO 0.00 0.03 0.88 -0.76 -0.87 0.00 0.00 176.83 176.12 1ozl s LEU 189 N -5.78 4.35 -0.23 5.97 1.43 -0.89 -4.99 118.68 118.54 1ozl s LEU 189 Ca 0.03 2.91 -0.08 0.00 -1.03 0.00 0.00 54.13 55.96 1ozl s LEU 189 Cb 0.07 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.63 1ozl s LEU 189 CO 0.74 -0.90 0.08 -1.61 0.23 0.00 0.00 176.35 174.89 1ozl s GLU 190 N -0.31 3.75 0.02 1.70 2.02 -1.26 -5.08 118.70 119.54 1ozl s GLU 190 Ca 0.64 -0.43 -0.13 0.00 0.02 0.00 0.00 54.97 55.06 1ozl s GLU 190 Cb -0.47 -3.32 0.02 0.00 0.10 0.00 0.00 34.13 30.46 1ozl s GLU 190 CO 0.46 -0.07 0.28 0.00 0.02 0.00 0.00 175.26 175.95 1ozl s MET 191 N 1.31 0.72 0.58 1.61 0.23 -1.26 -5.01 119.30 117.48 1ozl s MET 191 Ca 0.05 -0.39 -0.18 0.00 -1.03 0.00 0.00 55.69 54.14 1ozl s MET 191 Cb -0.15 0.31 -0.04 0.00 -1.53 0.00 0.00 34.83 33.42 1ozl s MET 191 CO 0.04 -0.21 1.13 0.95 -2.03 0.00 0.00 175.02 174.89 1ozl s THR 192 N -1.99 3.16 0.41 3.16 -4.23 -1.26 -4.75 115.64 110.14 1ozl s THR 192 Ca -0.09 0.66 0.18 0.00 -1.18 0.00 0.00 61.69 61.26 1ozl s THR 192 Cb -0.03 -3.23 0.39 0.00 1.34 0.00 0.00 72.50 70.97 1ozl s THR 192 CO -0.00 -0.21 1.82 -0.65 -0.54 0.00 0.00 174.62 175.04 1ozl h PRO 193 N 0.84 0.40 -0.33 3.99 0.11 -2.01 0.59 132.00 135.59 1ozl h PRO 193 Ca -0.49 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 1ozl h PRO 193 Cb 1.26 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1ozl h PRO 193 CO 0.56 0.26 0.14 0.00 -0.21 0.00 0.00 178.00 178.76 1ozl h ALA 194 N 1.61 0.42 0.00 -0.75 0.00 -1.99 -0.67 119.26 117.88 1ozl h ALA 194 Ca 0.53 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.32 1ozl h ALA 194 Cb 1.32 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1ozl h ALA 194 CO -0.23 0.00 -0.00 0.28 0.00 0.00 0.00 179.25 179.31 1ozl h VAL 195 N 0.39 1.15 -0.98 0.00 2.07 -1.32 -2.23 116.25 115.33 1ozl h VAL 195 Ca 0.11 -0.47 0.16 0.00 0.82 0.00 0.00 66.70 67.33 1ozl h VAL 195 Cb 0.15 1.47 -0.10 0.00 -1.52 0.00 0.00 31.29 31.30 1ozl h VAL 195 CO -0.01 0.12 0.59 -0.09 0.02 0.00 0.00 177.57 178.20 1ozl h ARG 196 N -0.21 0.79 -0.63 1.57 2.43 -0.92 0.20 114.38 117.62 1ozl h ARG 196 Ca -0.00 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1ozl h ARG 196 Cb 0.20 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 1ozl h ARG 196 CO 0.00 0.52 0.35 1.96 -1.51 0.00 0.00 179.97 181.30 1ozl h GLN 197 N 0.82 0.87 0.00 0.20 4.20 -0.81 -1.63 115.11 118.76 1ozl h GLN 197 Ca 0.54 -0.10 -0.10 0.00 0.06 0.00 0.00 58.65 59.05 1ozl h GLN 197 Cb 0.74 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 1ozl h GLN 197 CO -0.34 0.65 -0.47 0.00 -0.67 0.00 0.00 178.83 178.00 1ozl h ARG 198 N 0.85 0.00 -0.29 1.46 3.08 -0.14 -1.67 114.38 117.67 1ozl h ARG 198 Ca 0.22 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.21 1ozl h ARG 198 Cb 0.03 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1ozl h ARG 198 CO -0.04 0.47 -0.05 0.28 -1.07 0.00 0.00 179.97 179.56 1ozl h VAL 199 N 0.00 1.27 -0.22 2.04 2.07 -0.28 0.16 116.25 121.29 1ozl h VAL 199 Ca -0.00 -1.05 0.01 0.00 0.82 0.00 0.00 66.70 66.47 1ozl h VAL 199 Cb 0.84 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.97 1ozl h VAL 199 CO 0.06 0.34 0.11 0.40 0.02 0.00 0.00 177.57 178.50 1ozl h ILE 200 N 0.32 1.00 -0.64 4.57 1.08 -1.12 -1.44 117.51 121.28 1ozl h ILE 200 Ca 0.08 -0.08 -0.04 0.00 -0.39 0.00 0.00 64.86 64.42 1ozl h ILE 200 Cb 0.52 0.74 -0.03 0.00 -3.07 0.00 0.00 36.82 34.98 1ozl h ILE 200 CO 0.02 0.04 0.22 -0.33 -0.69 0.00 0.00 178.15 177.42 1ozl h GLU 201 N 0.24 0.96 -0.37 2.37 4.39 -1.17 -2.37 114.58 118.64 1ozl h GLU 201 Ca 0.09 -0.18 -0.05 0.00 0.34 0.00 0.00 59.36 59.57 1ozl h GLU 201 Cb 0.02 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.49 1ozl h GLU 201 CO -0.06 0.81 0.03 1.49 -1.16 0.00 0.00 179.01 180.13 1ozl h GLU 202 N 0.94 0.56 -0.63 2.33 4.57 -0.17 -0.45 114.58 121.73 1ozl h GLU 202 Ca 0.21 -0.11 -0.07 0.00 -1.18 0.00 0.00 59.36 58.21 1ozl h GLU 202 Cb 0.23 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.71 1ozl h GLU 202 CO -0.01 0.56 0.14 0.00 -1.18 0.00 0.00 179.01 178.52 1ozl h ALA 203 N 1.50 0.83 -0.42 2.92 0.00 -0.76 -0.19 119.26 123.14 1ozl h ALA 203 Ca 0.12 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1ozl h ALA 203 Cb 0.30 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1ozl h ALA 203 CO 0.01 0.56 -0.12 0.87 0.00 0.00 0.00 179.25 180.56 1ozl h LYS 204 N 0.93 0.75 -0.70 0.00 1.57 -1.10 -2.39 116.57 115.63 1ozl h LYS 204 Ca 0.20 -0.25 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 1ozl h LYS 204 Cb 0.38 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.59 1ozl h LYS 204 CO 0.00 0.84 0.32 1.15 -0.57 0.00 0.00 179.45 181.20 1ozl h THR 205 N 0.68 1.23 -0.27 -0.16 2.02 -0.53 -1.19 112.91 114.69 1ozl h THR 205 Ca 0.11 -0.67 0.01 0.00 0.77 0.00 0.00 66.41 66.64 1ozl h THR 205 Cb 0.59 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 1ozl h THR 205 CO 0.04 0.28 0.16 0.00 0.37 0.00 0.00 175.52 176.37 1ozl h ALA 206 N 1.35 0.33 -0.60 6.16 0.00 -0.55 -0.07 119.26 125.89 1ozl h ALA 206 Ca 0.24 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1ozl h ALA 206 Cb 0.13 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1ozl h ALA 206 CO -0.03 -0.22 0.40 0.74 0.00 0.00 0.00 179.25 180.14 1ozl h PHE 207 N 0.33 0.75 -0.79 0.00 -1.00 -1.10 -1.60 116.94 113.53 1ozl h PHE 207 Ca 0.10 0.02 -0.00 0.00 2.81 0.00 0.00 57.97 60.90 1ozl h PHE 207 Cb -0.02 -0.25 -0.04 0.00 3.61 0.00 0.00 35.95 39.25 1ozl h PHE 207 CO -0.07 0.48 0.49 -0.07 -1.61 0.00 0.00 178.31 177.52 1ozl h LEU 208 N 0.81 0.94 -0.95 1.54 3.38 -0.70 0.13 115.31 120.46 1ozl h LEU 208 Ca 0.22 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 58.06 1ozl h LEU 208 Cb -0.09 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.40 1ozl h LEU 208 CO -0.05 0.72 -0.12 -0.07 0.09 0.00 0.00 178.44 179.01 1ozl h LEU 209 N 1.09 0.62 -0.27 1.67 3.38 -0.53 -0.80 115.31 120.47 1ozl h LEU 209 Ca 0.29 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 1ozl h LEU 209 Cb -0.06 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1ozl h LEU 209 CO -0.06 0.77 -0.05 0.78 0.09 0.00 0.00 178.44 179.98 1ozl h ASN 210 N 0.58 0.50 -0.63 -0.43 2.35 -0.28 -2.00 115.58 115.67 1ozl h ASN 210 Ca 0.10 -0.35 -0.02 0.00 -0.55 0.00 0.00 56.30 55.48 1ozl h ASN 210 Cb 0.55 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.75 1ozl h ASN 210 CO 0.03 0.73 0.32 0.40 -1.65 0.00 0.00 177.43 177.27 1ozl h ILE 211 N 0.26 1.21 -0.29 2.81 2.04 -0.50 0.75 117.51 123.79 1ozl h ILE 211 Ca 0.07 -0.57 -0.06 0.00 1.00 0.00 0.00 64.86 65.29 1ozl h ILE 211 Cb 0.51 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 1ozl h ILE 211 CO 0.02 0.24 -0.10 0.06 0.00 0.00 0.00 178.15 178.37 1ozl h GLN 212 N 0.86 0.47 -0.44 2.37 3.07 -1.11 -1.03 115.11 119.29 1ozl h GLN 212 Ca 0.22 -0.13 -0.05 0.00 0.09 0.00 0.00 58.65 58.78 1ozl h GLN 212 Cb 0.09 -0.06 -0.02 0.00 0.08 0.00 0.00 27.48 27.58 1ozl h GLN 212 CO -0.03 0.58 0.09 1.25 0.09 0.00 0.00 178.83 180.81 1ozl h LEU 213 N 0.44 0.68 -0.91 0.06 5.85 -0.56 -1.53 115.31 119.34 1ozl h LEU 213 Ca 0.09 -0.25 0.02 0.00 0.84 0.00 0.00 57.88 58.58 1ozl h LEU 213 Cb 0.45 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 1ozl h LEU 213 CO 0.02 0.75 0.60 -0.26 -0.34 0.00 0.00 178.44 179.21 1ozl h PHE 214 N 0.58 1.12 -0.67 1.25 0.04 -0.26 0.27 116.94 119.27 1ozl h PHE 214 Ca 0.14 0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.87 1ozl h PHE 214 Cb 0.35 -0.38 -0.03 0.00 2.20 0.00 0.00 35.95 38.09 1ozl h PHE 214 CO 0.02 0.68 0.18 0.93 -0.60 0.00 0.00 178.31 179.52 1ozl h GLU 215 N 1.19 1.05 -0.26 1.51 5.08 -0.90 -1.16 114.58 121.08 1ozl h GLU 215 Ca 0.35 -0.23 -0.06 0.00 -1.00 0.00 0.00 59.36 58.41 1ozl h GLU 215 Cb -0.07 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 1ozl h GLU 215 CO -0.10 0.92 -0.08 1.49 -1.00 0.00 0.00 179.01 180.24 1ozl h GLU 216 N 1.00 0.52 -0.74 2.33 4.81 -0.45 -2.24 114.58 119.80 1ozl h GLU 216 Ca 0.22 -0.21 -0.04 0.00 -0.13 0.00 0.00 59.36 59.20 1ozl h GLU 216 Cb 0.33 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 1ozl h GLU 216 CO -0.00 0.74 0.32 -0.07 -0.73 0.00 0.00 179.01 179.27 1ozl h LEU 217 N 0.26 1.00 -0.85 1.64 3.38 -0.78 -1.10 115.31 118.87 1ozl h LEU 217 Ca 0.06 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1ozl h LEU 217 Cb 0.56 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 1ozl h LEU 217 CO 0.03 0.87 0.41 -0.61 0.09 0.00 0.00 178.44 179.23 1ozl h GLN 218 N 1.07 1.22 -0.41 1.13 5.75 -1.13 -2.08 115.11 120.66 1ozl h GLN 218 Ca 0.25 -0.18 -0.04 0.00 -0.15 0.00 0.00 58.65 58.54 1ozl h GLN 218 Cb 0.17 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 28.49 1ozl h GLN 218 CO -0.02 0.94 0.12 1.49 -2.65 0.00 0.00 178.83 178.70 1ozl h GLU 219 N 1.20 0.64 0.00 1.69 4.22 -0.79 -2.76 114.58 118.79 1ozl h GLU 219 Ca 0.29 -0.14 -0.03 0.00 0.08 0.00 0.00 59.36 59.55 1ozl h GLU 219 Cb 0.12 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 1ozl h GLU 219 CO -0.04 0.65 -0.15 -0.07 -2.18 0.00 0.00 179.01 177.22 1ozl h LEU 220 N 0.51 0.00 0.00 1.64 3.38 -0.88 -2.93 115.31 117.03 1ozl h LEU 220 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1ozl h LEU 220 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1ozl h LEU 220 CO -0.00 0.15 -0.52 0.18 0.09 0.00 0.00 178.44 178.34 1ozl n LEU 221 N -4.24 0.52 -2.47 1.67 4.77 -0.81 -4.37 117.00 112.06 1ozl n LEU 221 Ca -0.02 0.09 -0.35 0.00 -0.03 0.00 0.00 56.01 55.69 1ozl n LEU 221 Cb 0.22 -0.24 0.06 0.00 -2.33 0.00 0.00 43.42 41.13 1ozl n LEU 221 CO 0.35 0.07 1.37 0.35 -1.33 0.00 0.00 177.39 178.19 1ozl n THR 222 N -1.67 3.52 0.21 -5.08 -2.24 -1.06 -5.10 114.28 102.87 1ozl n THR 222 Ca 0.05 -3.44 0.03 0.00 -2.27 0.00 0.00 64.05 58.41 1ozl n THR 222 Cb 0.36 -1.18 0.02 0.00 -2.10 0.00 0.00 70.33 67.43 1ozl n THR 222 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91