#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qzh s ILE 6 N 0.00 4.22 0.00 1.34 -4.36 -1.26 -5.13 121.20 116.01 1qzh s ILE 6 Ca 0.00 -0.52 0.00 0.00 -0.26 0.00 0.00 60.65 59.87 1qzh s ILE 6 Cb 0.00 -2.86 0.00 0.00 1.25 0.00 0.00 42.46 40.85 1qzh s ILE 6 CO 0.00 0.42 0.00 -0.90 0.24 0.00 0.00 174.94 174.70 1qzh n ASP 7 N 1.53 0.00 0.16 4.36 3.85 -1.26 -4.95 116.55 120.23 1qzh n ASP 7 Ca -0.15 -0.92 0.13 0.00 -0.71 0.00 0.00 54.79 53.13 1qzh n ASP 7 Cb 0.53 0.00 0.54 0.00 -1.35 0.00 0.00 41.12 40.84 1qzh n ASP 7 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.20 176.96 1qzh h SER 8 N 0.00 0.00 0.33 -1.12 4.64 -2.00 -2.95 113.55 112.46 1qzh h SER 8 Ca 0.00 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.99 1qzh h SER 8 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1qzh h SER 8 CO 0.00 0.00 -1.70 0.25 -0.87 0.00 0.00 176.83 174.51 1qzh h LEU 9 N 0.00 0.39 -0.83 5.97 5.85 -2.01 -3.32 115.31 121.37 1qzh h LEU 9 Ca 0.00 -0.64 -0.11 0.00 0.84 0.00 0.00 57.88 57.96 1qzh h LEU 9 Cb 0.35 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1qzh h LEU 9 CO 0.00 1.55 -0.33 1.56 -0.34 0.00 0.00 178.44 180.88 1qzh h GLN 10 N 0.07 0.48 -0.21 1.25 4.20 -1.92 -2.55 115.11 116.43 1qzh h GLN 10 Ca -0.31 -0.21 0.02 0.00 0.06 0.00 0.00 58.65 58.20 1qzh h GLN 10 Cb 2.04 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 29.79 1qzh h GLN 10 CO 0.14 0.76 0.09 1.25 -0.67 0.00 0.00 178.83 180.39 1qzh h LEU 11 N 0.41 0.13 -0.72 1.46 6.46 -1.65 -1.54 115.31 119.86 1qzh h LEU 11 Ca 0.05 0.01 -0.03 0.00 -0.12 0.00 0.00 57.88 57.79 1qzh h LEU 11 Cb 0.78 -0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.67 1qzh h LEU 11 CO 0.06 0.10 0.33 0.78 -0.62 0.00 0.00 178.44 179.10 1qzh h ASN 12 N 0.20 0.95 0.10 1.25 2.35 -1.63 -2.30 115.58 116.51 1qzh h ASN 12 Ca 0.09 -0.14 0.01 0.00 -0.55 0.00 0.00 56.30 55.70 1qzh h ASN 12 Cb 0.03 -0.25 -0.04 0.00 0.05 0.00 0.00 38.32 38.12 1qzh h ASN 12 CO -0.07 0.83 -0.43 -0.33 -1.65 0.00 0.00 177.43 175.78 1qzh h GLU 13 N 1.01 -0.59 0.05 0.81 5.08 -0.99 -1.31 114.58 118.64 1qzh h GLU 13 Ca 0.24 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 1qzh h GLU 13 Cb 0.14 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 1qzh h GLU 13 CO -0.03 -0.40 -0.21 -0.07 -1.00 0.00 0.00 179.01 177.31 1qzh h LEU 14 N -0.62 -0.62 -0.78 1.33 3.38 -1.22 -3.10 115.31 113.68 1qzh h LEU 14 Ca -0.01 0.07 0.15 0.00 0.09 0.00 0.00 57.88 58.18 1qzh h LEU 14 Cb 0.62 0.23 -0.15 0.00 0.09 0.00 0.00 40.66 41.45 1qzh h LEU 14 CO -0.24 -0.22 -0.24 -0.07 0.09 0.00 0.00 178.44 177.76 1qzh h LEU 15 N -0.30 -0.88 -0.47 1.67 3.38 -1.38 0.11 115.31 117.45 1qzh h LEU 15 Ca -0.00 0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1qzh h LEU 15 Cb 0.30 0.54 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1qzh h LEU 15 CO -0.11 -0.27 0.00 0.59 0.09 0.00 0.00 178.44 178.73 1qzh n ASN 16 N -5.50 0.10 -0.15 -0.43 3.02 -0.50 -1.20 115.26 110.60 1qzh n ASN 16 Ca 0.10 -0.41 0.03 0.00 -0.03 0.00 0.00 54.58 54.27 1qzh n ASN 16 Cb 0.40 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.52 1qzh n ASN 16 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1qzh n ALA 17 N -0.08 2.56 0.00 5.41 0.00 0.03 -5.04 120.51 123.39 1qzh n ALA 17 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.04 1qzh n ALA 17 Cb 0.02 -0.20 0.00 0.00 0.00 0.00 0.00 19.45 19.28 1qzh n ALA 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qzh n GLY 18 N 0.63 2.12 3.93 0.00 0.00 -0.34 -4.91 105.19 106.62 1qzh n GLY 18 Ca 0.03 -0.40 -0.26 0.00 0.00 0.00 0.00 46.02 45.38 1qzh n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1qzh s GLU 19 N 0.00 3.50 -0.06 1.61 2.02 -1.26 -1.64 118.70 122.87 1qzh s GLU 19 Ca 0.00 -0.40 -0.29 0.00 0.02 0.00 0.00 54.97 54.29 1qzh s GLU 19 Cb 0.00 -2.85 0.10 0.00 0.10 0.00 0.00 34.13 31.48 1qzh s GLU 19 CO 0.00 0.40 0.81 1.52 0.02 0.00 0.00 175.26 178.01 1qzh s TYR 20 N -1.89 -0.49 0.10 1.61 -0.85 -0.49 -4.84 117.35 110.48 1qzh s TYR 20 Ca 0.38 0.72 0.06 0.00 -0.52 0.00 0.00 57.07 57.70 1qzh s TYR 20 Cb -0.11 0.46 -0.04 0.00 0.38 0.00 0.00 41.96 42.65 1qzh s TYR 20 CO 0.29 -0.53 -0.05 0.15 -1.52 0.00 0.00 175.55 173.89 1qzh s LYS 21 N -1.76 2.35 -0.18 -3.49 3.01 -1.26 0.80 119.74 119.20 1qzh s LYS 21 Ca -0.04 -0.92 -0.06 0.00 -1.01 0.00 0.00 55.97 53.93 1qzh s LYS 21 Cb -0.00 -2.43 0.08 0.00 -1.01 0.00 0.00 37.83 34.47 1qzh s LYS 21 CO 0.01 0.53 0.38 0.42 0.51 0.00 0.00 175.35 177.20 1qzh s ILE 22 N -1.26 -0.57 0.00 2.17 1.01 -0.79 -4.97 121.20 116.79 1qzh s ILE 22 Ca 0.23 0.20 0.00 0.00 0.00 0.00 0.00 60.65 61.08 1qzh s ILE 22 Cb -0.11 -0.60 0.00 0.00 0.01 0.00 0.00 42.46 41.75 1qzh s ILE 22 CO 0.16 0.08 0.00 0.61 0.00 0.00 0.00 174.94 175.79 1qzh n GLY 23 N 5.35 1.64 1.76 6.18 0.00 -1.26 -2.68 105.19 116.18 1qzh n GLY 23 Ca -0.08 -0.64 0.02 0.00 0.00 0.00 0.00 46.02 45.32 1qzh n GLY 23 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1qzh n GLU 24 N 12.95 4.03 -4.54 1.61 4.71 -1.26 -4.95 120.64 133.20 1qzh n GLU 24 Ca 0.00 -3.09 -0.23 0.00 -0.01 0.00 0.00 57.16 53.83 1qzh n GLU 24 Cb 0.00 -2.17 -0.14 0.00 -1.01 0.00 0.00 31.44 28.12 1qzh n GLU 24 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1qzh s LEU 25 N -2.89 2.14 -0.18 -4.62 1.43 -1.09 -5.13 118.68 108.33 1qzh s LEU 25 Ca 0.53 -0.44 -0.12 0.00 -1.03 0.00 0.00 54.13 53.06 1qzh s LEU 25 Cb 0.42 -0.78 -0.05 0.00 0.03 0.00 0.00 46.19 45.81 1qzh s LEU 25 CO 0.13 0.11 0.23 -0.89 0.23 0.00 0.00 176.35 176.17 1qzh s THR 26 N -0.72 5.34 0.20 5.49 2.01 -1.26 -1.88 115.64 124.82 1qzh s THR 26 Ca 0.05 0.40 0.08 0.00 0.31 0.00 0.00 61.69 62.53 1qzh s THR 26 Cb -0.08 -3.57 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 1qzh s THR 26 CO 0.01 0.40 0.00 -0.36 -0.69 0.00 0.00 174.62 173.98 1qzh s PHE 27 N 0.52 2.80 -0.11 4.92 0.40 0.24 -4.31 117.98 122.44 1qzh s PHE 27 Ca 0.13 -0.17 0.00 0.00 -0.60 0.00 0.00 56.93 56.29 1qzh s PHE 27 Cb -0.12 -1.32 -0.02 0.00 0.51 0.00 0.00 43.02 42.06 1qzh s PHE 27 CO 0.02 0.55 -0.10 -1.14 0.70 0.00 0.00 175.22 175.24 1qzh s GLN 28 N -3.18 3.14 0.62 0.44 2.00 -1.03 -1.40 119.66 120.25 1qzh s GLN 28 Ca 0.29 -0.62 -0.16 0.00 -2.00 0.00 0.00 55.36 52.86 1qzh s GLN 28 Cb -0.08 -2.63 -0.02 0.00 0.80 0.00 0.00 33.01 31.08 1qzh s GLN 28 CO 0.19 0.39 1.09 -1.54 -0.50 0.00 0.00 175.29 174.92 1qzh s SER 29 N -0.10 5.44 0.18 6.67 1.04 -0.65 -4.65 113.70 121.63 1qzh s SER 29 Ca -0.00 1.94 -0.14 0.00 0.48 0.00 0.00 55.95 58.23 1qzh s SER 29 Cb -0.13 -2.55 0.15 0.00 0.10 0.00 0.00 66.02 63.59 1qzh s SER 29 CO 0.03 -1.41 1.72 0.40 0.98 0.00 0.00 173.24 174.97 1qzh h ILE 30 N 0.31 0.77 0.01 -1.02 1.08 -1.92 -1.22 117.51 115.52 1qzh h ILE 30 Ca -0.47 -0.08 0.03 0.00 -0.39 0.00 0.00 64.86 63.95 1qzh h ILE 30 Cb 1.24 0.51 -0.05 0.00 -3.07 0.00 0.00 36.82 35.45 1qzh h ILE 30 CO 0.56 0.04 -0.28 -0.09 -0.69 0.00 0.00 178.15 177.69 1qzh h ARG 31 N 0.23 -0.42 0.00 2.37 9.65 -1.92 -2.17 114.38 122.13 1qzh h ARG 31 Ca 0.22 0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 59.11 1qzh h ARG 31 Cb 0.28 0.10 -0.00 0.00 -1.39 0.00 0.00 29.97 28.95 1qzh h ARG 31 CO -0.28 -0.28 -0.09 0.66 2.80 0.00 0.00 179.97 182.77 1qzh h SER 32 N -0.44 0.00 -0.39 -3.80 4.64 -1.84 -2.68 113.55 109.05 1qzh h SER 32 Ca 0.06 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.24 1qzh h SER 32 Cb 0.52 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.60 1qzh h SER 32 CO -0.23 0.09 -0.31 0.28 -0.87 0.00 0.00 176.83 175.79 1qzh h SER 33 N 0.00 0.94 0.00 4.97 0.02 -0.60 -2.76 113.55 116.12 1qzh h SER 33 Ca -0.00 -0.45 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1qzh h SER 33 Cb 0.44 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.72 1qzh h SER 33 CO 0.01 1.18 0.00 0.00 -1.14 0.00 0.00 176.83 176.89 1qzh n GLN 34 N -4.14 0.55 -0.47 3.45 6.02 -0.98 -4.29 117.38 117.51 1qzh n GLN 34 Ca -0.02 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.84 1qzh n GLN 34 Cb 0.50 -1.36 -0.02 0.00 1.02 0.00 0.00 30.24 30.38 1qzh n GLN 34 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1qzh n GLU 35 N -0.86 1.27 0.00 -1.09 1.02 -1.04 -4.66 120.64 115.28 1qzh n GLU 35 Ca 0.09 -0.97 0.00 0.00 -0.02 0.00 0.00 57.16 56.27 1qzh n GLU 35 Cb 0.04 -2.16 0.00 0.00 -0.02 0.00 0.00 31.44 29.30 1qzh n GLU 35 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1qzh n LEU 36 N 4.06 0.00 -4.49 -4.62 4.77 -1.26 -4.89 117.00 110.57 1qzh n LEU 36 Ca 0.27 0.00 -0.35 0.00 -0.03 0.00 0.00 56.01 55.90 1qzh n LEU 36 Cb 0.15 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.12 1qzh n LEU 36 CO 0.53 0.00 -0.31 -1.10 -1.33 0.00 0.00 177.39 175.18 1qzh s GLN 37 N 0.00 3.70 0.13 3.23 -1.52 -1.26 -5.01 119.66 118.93 1qzh s GLN 37 Ca 0.00 -0.48 -0.19 0.00 -1.95 0.00 0.00 55.36 52.74 1qzh s GLN 37 Cb 0.00 -3.14 -0.04 0.00 -0.22 0.00 0.00 33.01 29.62 1qzh s GLN 37 CO 0.00 0.04 1.77 -0.22 -0.25 0.00 0.00 175.29 176.63 1qzh h LYS 38 N 7.41 0.25 -6.40 2.91 3.64 -1.96 -3.42 116.57 119.01 1qzh h LYS 38 Ca -0.36 -0.02 -0.54 0.00 -1.27 0.00 0.00 60.65 58.47 1qzh h LYS 38 Cb 1.18 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 1qzh h LYS 38 CO 0.62 0.17 0.85 0.15 -2.27 0.00 0.00 179.45 178.97 1qzh s LYS 39 N -6.17 4.27 -0.58 1.90 1.02 -1.26 -4.85 119.74 114.07 1qzh s LYS 39 Ca -0.13 2.03 -0.27 0.00 0.02 0.00 0.00 55.97 57.62 1qzh s LYS 39 Cb 0.09 -3.56 -0.00 0.00 -0.52 0.00 0.00 37.83 33.84 1qzh s LYS 39 CO 0.70 -0.59 1.60 -0.80 -0.92 0.00 0.00 175.35 175.34 1qzh s ASN 40 N 1.92 5.79 0.09 2.83 0.02 -1.26 -4.93 114.94 119.40 1qzh s ASN 40 Ca 0.65 0.32 0.02 0.00 -1.02 0.00 0.00 52.86 52.84 1qzh s ASN 40 Cb -0.33 -2.54 -0.04 0.00 0.02 0.00 0.00 41.25 38.36 1qzh s ASN 40 CO 0.28 -1.98 0.15 0.42 0.02 0.00 0.00 177.10 175.99 1qzh s THR 41 N 7.23 4.87 -0.24 1.60 -4.23 -1.25 -4.90 115.64 118.73 1qzh s THR 41 Ca 0.59 -0.69 -0.13 0.00 -1.18 0.00 0.00 61.69 60.28 1qzh s THR 41 Cb -0.12 -3.40 -0.05 0.00 1.34 0.00 0.00 72.50 70.27 1qzh s THR 41 CO 0.23 0.07 0.25 -0.63 -0.54 0.00 0.00 174.62 174.00 1qzh s ILE 42 N -1.52 5.29 0.44 2.99 1.01 -1.26 -1.44 121.20 126.71 1qzh s ILE 42 Ca 0.32 0.37 0.03 0.00 0.00 0.00 0.00 60.65 61.37 1qzh s ILE 42 Cb -0.12 -3.59 -0.02 0.00 0.01 0.00 0.00 42.46 38.74 1qzh s ILE 42 CO 0.25 0.29 0.09 0.68 0.00 0.00 0.00 174.94 176.25 1qzh s VAL 43 N 1.30 0.74 0.09 2.92 -7.23 -0.09 -4.89 120.40 113.25 1qzh s VAL 43 Ca 0.12 -2.00 0.10 0.00 -1.81 0.00 0.00 61.98 58.38 1qzh s VAL 43 Cb -0.14 -2.27 -0.04 0.00 0.56 0.00 0.00 36.38 34.49 1qzh s VAL 43 CO 0.07 0.00 -0.25 0.20 -0.31 0.00 0.00 175.10 174.81 1qzh s ASN 44 N -3.69 3.39 0.10 4.85 0.01 -1.26 -0.80 114.94 117.53 1qzh s ASN 44 Ca 0.18 -0.65 0.03 0.00 -0.71 0.00 0.00 52.86 51.71 1qzh s ASN 44 Cb 0.02 -0.32 -0.04 0.00 0.41 0.00 0.00 41.25 41.32 1qzh s ASN 44 CO 0.11 0.21 -0.08 -0.76 -1.51 0.00 0.00 177.10 175.07 1qzh s LEU 45 N -1.77 2.47 -0.22 0.60 1.43 -0.04 -2.46 118.68 118.69 1qzh s LEU 45 Ca 0.14 -0.93 -0.04 0.00 -1.03 0.00 0.00 54.13 52.27 1qzh s LEU 45 Cb -0.10 -0.17 0.11 0.00 0.03 0.00 0.00 46.19 46.06 1qzh s LEU 45 CO 0.05 -0.38 0.37 0.12 0.23 0.00 0.00 176.35 176.74 1qzh s PHE 46 N -3.16 -0.76 0.00 0.29 5.99 -1.26 -0.77 117.98 118.32 1qzh s PHE 46 Ca 0.10 1.00 0.00 0.00 0.00 0.00 0.00 56.93 58.02 1qzh s PHE 46 Cb 0.02 0.07 0.00 0.00 0.00 0.00 0.00 43.02 43.11 1qzh s PHE 46 CO -0.02 -0.62 0.00 0.41 -0.00 0.00 0.00 175.22 174.99 1qzh n GLY 47 N 5.37 2.93 3.45 13.12 0.00 -0.66 -4.90 105.19 124.49 1qzh n GLY 47 Ca -0.05 -0.81 -0.33 0.00 0.00 0.00 0.00 46.02 44.83 1qzh n GLY 47 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qzh s ILE 48 N -2.96 3.08 -0.54 -0.61 -1.09 0.56 0.15 121.20 119.79 1qzh s ILE 48 Ca 0.00 -0.70 -0.27 0.00 -2.23 0.00 0.00 60.65 57.45 1qzh s ILE 48 Cb 0.00 -2.23 -0.02 0.00 -1.58 0.00 0.00 42.46 38.63 1qzh s ILE 48 CO 0.00 0.57 1.79 -0.69 -1.23 0.00 0.00 174.94 175.38 1qzh s VAL 49 N -0.44 3.44 0.18 2.92 1.01 0.58 -0.97 120.40 127.12 1qzh s VAL 49 Ca 0.05 0.33 0.06 0.00 0.00 0.00 0.00 61.98 62.43 1qzh s VAL 49 Cb -0.12 -3.94 -0.14 0.00 0.00 0.00 0.00 36.38 32.18 1qzh s VAL 49 CO 0.02 -0.83 1.41 0.50 0.00 0.00 0.00 175.10 176.20 1qzh h LYS 50 N 13.97 0.08 -1.79 2.72 1.63 -1.24 0.05 116.57 131.99 1qzh h LYS 50 Ca -0.28 -0.09 0.15 0.00 -0.85 0.00 0.00 60.65 59.59 1qzh h LYS 50 Cb 1.15 0.03 -0.19 0.00 -0.60 0.00 0.00 32.23 32.62 1qzh h LYS 50 CO 1.17 0.88 0.62 0.34 -3.45 0.00 0.00 179.45 179.01 1qzh s ASP 51 N -6.84 -0.28 0.18 4.20 2.15 -1.23 -4.84 116.67 110.01 1qzh s ASP 51 Ca -0.01 0.11 -0.20 0.00 0.43 0.00 0.00 52.55 52.88 1qzh s ASP 51 Cb 0.11 0.27 0.04 0.00 -0.30 0.00 0.00 42.92 43.04 1qzh s ASP 51 CO 0.81 -0.40 0.56 0.72 -0.17 0.00 0.00 175.17 176.69 1qzh s PHE 52 N -2.26 -0.29 -0.07 -5.34 -0.12 -1.26 -0.97 117.98 107.66 1qzh s PHE 52 Ca 0.05 -0.01 0.05 0.00 -0.05 0.00 0.00 56.93 56.97 1qzh s PHE 52 Cb -0.01 0.48 -0.01 0.00 -0.63 0.00 0.00 43.02 42.85 1qzh s PHE 52 CO -0.05 -0.91 -0.24 0.99 -0.05 0.00 0.00 175.22 174.96 1qzh s THR 53 N -3.82 2.03 0.94 -4.49 2.01 0.92 -4.98 115.64 108.24 1qzh s THR 53 Ca 0.06 -1.03 -0.10 0.00 0.31 0.00 0.00 61.69 60.92 1qzh s THR 53 Cb -0.01 -1.74 0.16 0.00 0.01 0.00 0.00 72.50 70.92 1qzh s THR 53 CO -0.07 0.56 1.14 -2.84 -0.69 0.00 0.00 174.62 172.72 1qzh s PRO 54 N 0.06 0.83 0.13 4.92 0.02 -1.26 -2.74 135.00 136.96 1qzh s PRO 54 Ca -0.10 1.49 -0.31 0.00 0.02 0.00 0.00 61.00 62.10 1qzh s PRO 54 Cb -0.15 -1.71 -0.10 0.00 0.02 0.00 0.00 34.50 32.56 1qzh s PRO 54 CO 0.06 -2.74 1.71 -1.12 -0.33 0.00 0.00 177.00 174.57 1qzh s SER 55 N -2.65 6.50 -0.01 2.53 0.01 -1.26 -4.66 113.70 114.16 1qzh s SER 55 Ca 0.67 2.68 -0.06 0.00 1.31 0.00 0.00 55.95 60.54 1qzh s SER 55 Cb -0.23 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.43 1qzh s SER 55 CO 0.59 -0.93 0.13 0.00 0.41 0.00 0.00 173.24 173.44 1qzh s ARG 56 N 2.11 0.38 0.15 12.44 1.70 -0.92 -4.97 118.95 129.85 1qzh s ARG 56 Ca 0.76 -0.24 -0.25 0.00 -0.47 0.00 0.00 55.73 55.52 1qzh s ARG 56 Cb -0.45 0.16 -0.08 0.00 -0.57 0.00 0.00 34.95 34.02 1qzh s ARG 56 CO 0.33 -0.08 0.78 -1.14 -1.08 0.00 0.00 175.30 174.11 1qzh s GLN 57 N -0.97 4.56 0.37 3.89 0.74 -1.26 -1.07 119.66 125.92 1qzh s GLN 57 Ca -0.11 1.15 -0.27 0.00 0.05 0.00 0.00 55.36 56.18 1qzh s GLN 57 Cb -0.06 -3.28 -0.09 0.00 1.10 0.00 0.00 33.01 30.68 1qzh s GLN 57 CO 0.01 0.52 1.24 -1.12 -0.55 0.00 0.00 175.29 175.40 1qzh s SER 58 N -0.96 6.58 0.00 6.67 0.01 -0.47 -4.94 113.70 120.59 1qzh s SER 58 Ca 0.36 2.53 0.27 0.00 1.31 0.00 0.00 55.95 60.42 1qzh s SER 58 Cb -0.23 -2.63 0.80 0.00 0.21 0.00 0.00 66.02 64.17 1qzh s SER 58 CO 0.26 -0.65 1.60 0.18 0.41 0.00 0.00 173.24 175.03 1qzh n LEU 59 N 0.38 0.87 0.00 2.44 4.77 -1.26 -4.49 117.00 119.70 1qzh n LEU 59 Ca 0.02 -0.18 -0.08 0.00 -0.03 0.00 0.00 56.01 55.75 1qzh n LEU 59 Cb 0.44 -0.15 -0.03 0.00 -2.33 0.00 0.00 43.42 41.35 1qzh n LEU 59 CO 0.55 0.17 -0.04 1.41 -1.33 0.00 0.00 177.39 178.15 1qzh n HIS 60 N -0.81 -0.32 -3.92 -1.77 8.25 -1.26 -4.97 115.22 110.42 1qzh n HIS 60 Ca 0.12 -1.09 0.00 0.00 -0.26 0.00 0.00 57.72 56.49 1qzh n HIS 60 Cb 0.34 0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.56 1qzh n HIS 60 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1qzh n GLY 61 N -0.25 3.00 0.11 -1.41 0.00 -1.26 -0.87 105.19 104.52 1qzh n GLY 61 Ca 0.03 -0.31 0.08 0.00 0.00 0.00 0.00 46.02 45.82 1qzh n GLY 61 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1qzh n THR 62 N 0.00 0.05 -3.89 2.61 -2.24 -1.26 -4.92 114.28 104.63 1qzh n THR 62 Ca 0.00 -0.07 -0.27 0.00 -2.27 0.00 0.00 64.05 61.43 1qzh n THR 62 Cb 0.00 -0.13 0.02 0.00 -2.10 0.00 0.00 70.33 68.12 1qzh n THR 62 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1qzh n LYS 63 N -0.53 -4.77 -1.77 -0.78 5.02 -0.05 -4.97 118.16 110.31 1qzh n LYS 63 Ca 0.13 0.55 -0.31 0.00 -2.02 0.00 0.00 58.31 56.66 1qzh n LYS 63 Cb 0.11 -5.21 0.02 0.00 -0.02 0.00 0.00 35.03 29.93 1qzh n LYS 63 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1qzh s ASP 64 N -3.79 5.89 0.23 4.39 1.01 -1.26 -4.20 116.67 118.94 1qzh s ASP 64 Ca 0.37 1.52 -0.30 0.00 0.71 0.00 0.00 52.55 54.85 1qzh s ASP 64 Cb -0.19 -2.48 -0.09 0.00 1.01 0.00 0.00 42.92 41.17 1qzh s ASP 64 CO 0.84 -1.10 1.11 0.26 0.21 0.00 0.00 175.17 176.49 1qzh s TRP 65 N -3.09 3.57 -0.05 4.23 0.52 -0.88 -1.37 118.94 121.87 1qzh s TRP 65 Ca 0.57 1.63 -0.02 0.00 0.02 0.00 0.00 56.10 58.30 1qzh s TRP 65 Cb -0.12 -3.30 0.03 0.00 -1.15 0.00 0.00 33.47 28.93 1qzh s TRP 65 CO 0.53 -0.64 0.10 0.54 0.02 0.00 0.00 176.95 177.50 1qzh s VAL 66 N -0.71 -0.05 0.08 4.03 0.11 -0.23 -0.96 120.40 122.68 1qzh s VAL 66 Ca 0.47 0.17 0.10 0.00 -2.93 0.00 0.00 61.98 59.79 1qzh s VAL 66 Cb -0.31 -0.17 -0.03 0.00 -1.53 0.00 0.00 36.38 34.33 1qzh s VAL 66 CO 0.38 0.07 -0.26 0.28 -3.33 0.00 0.00 175.10 172.25 1qzh s THR 67 N 1.01 2.11 -0.09 5.04 -1.32 -0.73 -2.16 115.64 119.50 1qzh s THR 67 Ca -0.08 -1.53 0.04 0.00 -1.21 0.00 0.00 61.69 58.92 1qzh s THR 67 Cb -0.11 -1.84 0.00 0.00 -1.51 0.00 0.00 72.50 69.04 1qzh s THR 67 CO -0.04 0.22 -0.23 -0.89 -2.21 0.00 0.00 174.62 171.47 1qzh s THR 68 N -0.93 1.97 0.08 5.08 2.01 -1.11 -1.08 115.64 121.66 1qzh s THR 68 Ca 0.12 -0.97 0.06 0.00 0.31 0.00 0.00 61.69 61.21 1qzh s THR 68 Cb -0.10 -1.70 -0.03 0.00 0.01 0.00 0.00 72.50 70.68 1qzh s THR 68 CO 0.04 0.54 -0.17 0.68 -0.69 0.00 0.00 174.62 175.02 1qzh s VAL 69 N 0.31 1.37 -0.25 3.82 -7.23 -0.29 -0.06 120.40 118.07 1qzh s VAL 69 Ca -0.17 -1.38 -0.02 0.00 -1.81 0.00 0.00 61.98 58.59 1qzh s VAL 69 Cb -0.17 -1.27 0.02 0.00 0.56 0.00 0.00 36.38 35.52 1qzh s VAL 69 CO 0.08 -0.14 -0.04 -0.31 -0.31 0.00 0.00 175.10 174.38 1qzh s TYR 70 N -1.19 3.07 0.01 2.82 1.51 -0.14 -0.37 117.35 123.06 1qzh s TYR 70 Ca 0.02 -1.46 -0.16 0.00 -1.01 0.00 0.00 57.07 54.45 1qzh s TYR 70 Cb -0.10 -2.09 -0.06 0.00 -0.11 0.00 0.00 41.96 39.61 1qzh s TYR 70 CO 0.03 -0.70 0.46 -0.51 -1.11 0.00 0.00 175.55 173.71 1qzh s LEU 71 N 1.35 4.47 0.04 -1.29 1.43 0.52 -0.73 118.68 124.46 1qzh s LEU 71 Ca 0.01 1.02 0.06 0.00 -1.03 0.00 0.00 54.13 54.19 1qzh s LEU 71 Cb -0.17 -2.68 -0.02 0.00 0.03 0.00 0.00 46.19 43.35 1qzh s LEU 71 CO -0.04 0.27 -0.18 0.86 0.23 0.00 0.00 176.35 177.50 1qzh s TRP 72 N -0.88 1.53 0.23 0.29 -0.00 -0.15 -0.64 118.94 119.33 1qzh s TRP 72 Ca 0.25 -0.36 -0.12 0.00 -0.00 0.00 0.00 56.10 55.87 1qzh s TRP 72 Cb -0.17 -0.91 -0.00 0.00 -0.00 0.00 0.00 33.47 32.38 1qzh s TRP 72 CO 0.14 0.07 0.44 0.16 -0.00 0.00 0.00 176.95 177.77 1qzh s ASP 73 N -1.19 -0.08 0.42 5.86 1.47 -1.26 -0.33 116.67 121.56 1qzh s ASP 73 Ca 0.05 -0.90 0.23 0.00 1.18 0.00 0.00 52.55 53.11 1qzh s ASP 73 Cb -0.08 0.56 1.23 0.00 -0.34 0.00 0.00 42.92 44.29 1qzh s ASP 73 CO 0.02 -1.09 1.72 -0.65 0.68 0.00 0.00 175.17 175.84 1qzh h PRO 74 N 2.30 0.26 0.00 2.11 0.11 -1.97 -1.01 132.00 133.80 1qzh h PRO 74 Ca -0.27 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1qzh h PRO 74 Cb 1.25 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1qzh h PRO 74 CO 0.38 0.17 0.00 0.25 -0.21 0.00 0.00 178.00 178.59 1qzh n THR 75 N -4.64 0.00 -3.89 -1.15 -2.24 -1.26 -4.70 114.28 96.40 1qzh n THR 75 Ca 0.30 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.85 1qzh n THR 75 Cb 1.09 -0.73 -0.05 0.00 -2.10 0.00 0.00 70.33 68.53 1qzh n THR 75 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qzh s ASP 77 N -3.99 6.98 0.00 0.00 1.01 -1.26 -4.89 116.67 114.52 1qzh s ASP 77 Ca 0.44 1.18 0.00 0.00 0.71 0.00 0.00 52.55 54.87 1qzh s ASP 77 Cb 0.00 -2.39 0.00 0.00 1.01 0.00 0.00 42.92 41.54 1qzh s ASP 77 CO 0.25 0.01 0.57 0.41 0.21 0.00 0.00 175.17 176.62 1qzh n THR 78 N 3.18 0.66 -0.11 -1.27 -1.04 -1.26 -0.21 114.28 114.22 1qzh n THR 78 Ca -0.04 0.30 -0.22 0.00 -2.04 0.00 0.00 64.05 62.05 1qzh n THR 78 Cb 0.51 -1.30 -0.10 0.00 -1.82 0.00 0.00 70.33 67.62 1qzh n THR 78 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1qzh n SER 79 N -1.07 1.89 -4.44 8.00 3.41 -1.26 -4.98 113.62 115.16 1qzh n SER 79 Ca 0.00 0.41 -0.40 0.00 -0.26 0.00 0.00 58.87 58.63 1qzh n SER 79 Cb 0.14 -0.90 0.02 0.00 -0.26 0.00 0.00 64.21 63.20 1qzh n SER 79 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1qzh n SER 80 N -4.40 -1.26 0.15 4.04 2.88 0.70 -4.89 113.62 110.85 1qzh n SER 80 Ca -0.36 0.80 0.03 0.00 -1.33 0.00 0.00 58.87 58.01 1qzh n SER 80 Cb 0.69 -1.11 0.16 0.00 -0.75 0.00 0.00 64.21 63.20 1qzh n SER 80 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 1qzh h ILE 81 N 0.45 0.96 0.00 2.46 5.03 -1.94 -3.46 117.51 121.02 1qzh h ILE 81 Ca -0.43 -2.01 0.00 0.00 -0.12 0.00 0.00 64.86 62.31 1qzh h ILE 81 Cb 1.40 2.23 0.00 0.00 -3.03 0.00 0.00 36.82 37.42 1qzh h ILE 81 CO 0.48 0.48 0.00 0.61 -0.68 0.00 0.00 178.15 179.04 1qzh n GLY 82 N 0.76 -1.86 3.72 5.37 0.00 -1.26 -4.56 105.19 107.36 1qzh n GLY 82 Ca 0.01 -2.13 -0.41 0.00 0.00 0.00 0.00 46.02 43.48 1qzh n GLY 82 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1qzh s LEU 83 N 0.00 4.41 -0.19 0.99 2.96 0.19 -4.73 118.68 122.31 1qzh s LEU 83 Ca 0.00 1.58 -0.24 0.00 -0.22 0.00 0.00 54.13 55.25 1qzh s LEU 83 Cb 0.00 -3.43 -0.02 0.00 0.50 0.00 0.00 46.19 43.24 1qzh s LEU 83 CO 0.00 -0.13 0.76 -1.58 -1.32 0.00 0.00 176.35 174.08 1qzh s GLN 84 N 0.51 4.25 -0.09 1.98 0.74 -1.26 -0.36 119.66 125.44 1qzh s GLN 84 Ca 0.46 0.87 0.01 0.00 0.05 0.00 0.00 55.36 56.75 1qzh s GLN 84 Cb -0.21 -3.59 0.02 0.00 1.10 0.00 0.00 33.01 30.33 1qzh s GLN 84 CO 0.26 -0.33 -0.11 0.42 -0.55 0.00 0.00 175.29 174.99 1qzh s ILE 85 N 2.17 1.11 -0.27 -2.34 1.01 0.50 0.10 121.20 123.49 1qzh s ILE 85 Ca 0.35 -0.41 -0.10 0.00 0.00 0.00 0.00 60.65 60.48 1qzh s ILE 85 Cb -0.16 -1.05 -0.04 0.00 0.01 0.00 0.00 42.46 41.21 1qzh s ILE 85 CO 0.11 0.36 0.16 -1.00 0.00 0.00 0.00 174.94 174.57 1qzh s HIS 86 N 1.07 3.19 -0.26 3.97 3.76 0.17 -1.14 115.29 126.05 1qzh s HIS 86 Ca -0.07 -0.01 -0.08 0.00 -0.15 0.00 0.00 55.06 54.75 1qzh s HIS 86 Cb -0.14 -2.34 -0.03 0.00 1.11 0.00 0.00 32.58 31.17 1qzh s HIS 86 CO -0.01 -0.20 0.11 -0.51 -0.85 0.00 0.00 174.74 173.28 1qzh s LEU 87 N 1.69 3.65 0.16 0.89 1.43 -0.24 -1.92 118.68 124.33 1qzh s LEU 87 Ca 0.07 -0.19 0.06 0.00 -1.03 0.00 0.00 54.13 53.04 1qzh s LEU 87 Cb -0.16 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 44.04 1qzh s LEU 87 CO 0.09 -0.05 0.05 -0.36 0.23 0.00 0.00 176.35 176.31 1qzh s PHE 88 N 1.65 2.99 -0.07 0.29 0.40 -1.26 -1.78 117.98 120.20 1qzh s PHE 88 Ca 0.06 -0.07 -0.03 0.00 -0.60 0.00 0.00 56.93 56.29 1qzh s PHE 88 Cb -0.16 -1.46 0.04 0.00 0.51 0.00 0.00 43.02 41.96 1qzh s PHE 88 CO 0.06 0.51 0.13 0.45 0.70 0.00 0.00 175.22 177.07 1qzh s SER 89 N -2.89 0.87 0.16 1.36 0.15 -0.13 -4.91 113.70 108.32 1qzh s SER 89 Ca 0.29 0.26 0.23 0.00 0.70 0.00 0.00 55.95 57.42 1qzh s SER 89 Cb -0.10 0.15 0.17 0.00 -1.71 0.00 0.00 66.02 64.54 1qzh s SER 89 CO 0.20 -0.25 1.19 0.11 1.20 0.00 0.00 173.24 175.70 1qzh h LYS 90 N 8.39 0.00 -1.19 5.44 1.57 -1.91 -2.35 116.57 126.52 1qzh h LYS 90 Ca -0.13 0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 57.96 1qzh h LYS 90 Cb 1.12 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 33.13 1qzh h LYS 90 CO 0.14 0.00 0.82 0.00 -0.57 0.00 0.00 179.45 179.85 1qzh n GLN 91 N -2.39 2.75 0.00 3.15 10.64 -1.26 -5.00 117.38 125.27 1qzh n GLN 91 Ca 0.02 -3.39 0.00 0.00 -1.83 0.00 0.00 57.00 51.80 1qzh n GLN 91 Cb 0.49 -2.29 0.00 0.00 -0.86 0.00 0.00 30.24 27.59 1qzh n GLN 91 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1qzh n GLY 92 N -0.83 -2.26 3.47 2.61 0.00 -1.26 -4.70 105.19 102.22 1qzh n GLY 92 Ca 0.60 -1.56 -0.43 0.00 0.00 0.00 0.00 46.02 44.63 1qzh n GLY 92 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1qzh s ASN 93 N -3.10 6.45 -0.11 1.61 3.04 -1.26 -4.64 114.94 116.92 1qzh s ASN 93 Ca 0.00 -1.57 0.15 0.00 0.04 0.00 0.00 52.86 51.47 1qzh s ASN 93 Cb 0.00 -2.43 0.33 0.00 -1.54 0.00 0.00 41.25 37.61 1qzh s ASN 93 CO 0.00 -1.27 1.16 -0.90 -3.04 0.00 0.00 177.10 173.05 1qzh n ASP 94 N 7.31 1.44 -4.85 -4.21 5.68 -1.26 -5.01 116.55 115.64 1qzh n ASP 94 Ca 0.15 -2.98 -0.30 0.00 -0.50 0.00 0.00 54.79 51.16 1qzh n ASP 94 Cb 0.48 -0.40 0.06 0.00 -1.14 0.00 0.00 41.12 40.11 1qzh n ASP 94 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1qzh s LEU 95 N -1.90 2.86 0.21 -2.12 1.43 -1.26 -4.57 118.68 113.33 1qzh s LEU 95 Ca 0.30 1.25 -0.32 0.00 -1.03 0.00 0.00 54.13 54.33 1qzh s LEU 95 Cb 0.30 -4.02 -0.12 0.00 0.03 0.00 0.00 46.19 42.37 1qzh s LEU 95 CO -0.06 -1.49 1.68 -2.65 0.23 0.00 0.00 176.35 174.07 1qzh n PRO 96 N -3.12 2.65 -3.22 1.29 -0.02 -1.26 -4.73 135.00 126.59 1qzh n PRO 96 Ca 0.07 0.95 -0.46 0.00 -2.02 0.00 0.00 63.50 62.05 1qzh n PRO 96 Cb 0.56 -2.78 -0.04 0.00 -0.02 0.00 0.00 33.50 31.23 1qzh n PRO 96 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1qzh s VAL 97 N 0.98 5.17 -0.17 -1.45 1.01 -1.26 -4.92 120.40 119.77 1qzh s VAL 97 Ca 0.74 -1.64 -0.19 0.00 0.00 0.00 0.00 61.98 60.89 1qzh s VAL 97 Cb -0.54 -4.46 -0.04 0.00 0.00 0.00 0.00 36.38 31.35 1qzh s VAL 97 CO 0.35 -1.05 0.52 -0.63 0.00 0.00 0.00 175.10 174.29 1qzh s ILE 98 N 1.59 5.13 -0.14 2.22 1.01 -1.26 -4.73 121.20 125.02 1qzh s ILE 98 Ca 0.12 0.99 -0.12 0.00 0.00 0.00 0.00 60.65 61.64 1qzh s ILE 98 Cb -0.20 -3.85 -0.25 0.00 0.01 0.00 0.00 42.46 38.17 1qzh s ILE 98 CO -0.01 0.23 0.36 0.50 0.00 0.00 0.00 174.94 176.03 1qzh h LYS 99 N 7.17 0.20 -2.68 2.79 3.64 -1.96 -3.50 116.57 122.23 1qzh h LYS 99 Ca -0.36 -0.34 -0.07 0.00 -1.27 0.00 0.00 60.65 58.60 1qzh h LYS 99 Cb 1.16 0.13 -0.17 0.00 -0.41 0.00 0.00 32.23 32.94 1qzh h LYS 99 CO 0.75 1.16 0.00 1.14 -2.27 0.00 0.00 179.45 180.24 1qzh s GLN 100 N -2.50 0.97 0.48 1.90 -2.07 -1.26 -5.14 119.66 112.04 1qzh s GLN 100 Ca -0.23 -0.14 -0.23 0.00 -1.82 0.00 0.00 55.36 52.94 1qzh s GLN 100 Cb 0.06 0.44 -0.08 0.00 -1.09 0.00 0.00 33.01 32.34 1qzh s GLN 100 CO 0.73 -0.33 1.15 0.28 -1.32 0.00 0.00 175.29 175.80 1qzh n VAL 101 N 0.66 2.99 0.00 3.63 0.31 -1.26 -3.03 118.33 121.62 1qzh n VAL 101 Ca -0.19 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.64 1qzh n VAL 101 Cb 0.59 -1.39 0.00 0.00 -0.91 0.00 0.00 33.84 32.13 1qzh n VAL 101 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1qzh n GLY 102 N 1.00 2.55 3.74 2.92 0.00 0.00 -4.99 105.19 110.42 1qzh n GLY 102 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1qzh n GLY 102 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1qzh s GLN 103 N -0.36 4.42 0.21 1.61 -0.21 -1.17 -4.61 119.66 119.55 1qzh s GLN 103 Ca 0.00 2.02 -0.30 0.00 0.02 0.00 0.00 55.36 57.11 1qzh s GLN 103 Cb 0.00 -3.19 -0.08 0.00 1.00 0.00 0.00 33.01 30.74 1qzh s GLN 103 CO 0.00 -0.19 1.13 -2.14 -2.12 0.00 0.00 175.29 171.97 1qzh s PRO 104 N -0.39 4.58 -0.04 2.91 0.02 -1.24 -0.31 135.00 140.53 1qzh s PRO 104 Ca 0.54 1.79 0.01 0.00 0.02 0.00 0.00 61.00 63.36 1qzh s PRO 104 Cb -0.36 -3.24 0.02 0.00 0.02 0.00 0.00 34.50 30.94 1qzh s PRO 104 CO 0.40 0.06 -0.04 -1.17 -0.33 0.00 0.00 177.00 175.92 1qzh s LEU 105 N -0.63 1.29 -0.23 -5.54 2.96 0.12 -1.94 118.68 114.71 1qzh s LEU 105 Ca 0.49 -0.11 -0.06 0.00 -0.22 0.00 0.00 54.13 54.23 1qzh s LEU 105 Cb -0.31 -0.41 -0.02 0.00 0.50 0.00 0.00 46.19 45.95 1qzh s LEU 105 CO 0.37 -0.06 0.04 -0.22 -1.32 0.00 0.00 176.35 175.15 1qzh s LEU 106 N 0.94 3.31 -0.15 -0.68 0.20 0.15 -1.65 118.68 120.79 1qzh s LEU 106 Ca -0.11 -0.24 -0.01 0.00 0.69 0.00 0.00 54.13 54.47 1qzh s LEU 106 Cb -0.14 -1.87 -0.01 0.00 -0.43 0.00 0.00 46.19 43.74 1qzh s LEU 106 CO -0.00 -0.01 -0.12 -0.76 -0.29 0.00 0.00 176.35 175.17 1qzh s LEU 107 N 1.46 2.69 -0.24 -0.68 1.43 0.05 -1.17 118.68 122.24 1qzh s LEU 107 Ca 0.05 -0.37 -0.05 0.00 -1.03 0.00 0.00 54.13 52.73 1qzh s LEU 107 Cb -0.15 -1.62 -0.01 0.00 0.03 0.00 0.00 46.19 44.44 1qzh s LEU 107 CO 0.02 0.11 0.00 -2.28 0.23 0.00 0.00 176.35 174.43 1qzh s HIS 108 N 0.68 3.01 0.00 0.29 5.65 -0.23 -0.86 115.29 123.84 1qzh s HIS 108 Ca -0.06 -0.80 0.00 0.00 0.25 0.00 0.00 55.06 54.45 1qzh s HIS 108 Cb -0.15 -2.16 0.00 0.00 -1.18 0.00 0.00 32.58 29.09 1qzh s HIS 108 CO 0.02 -0.50 0.00 1.04 -0.65 0.00 0.00 174.74 174.65 1qzh n GLN 109 N 4.84 0.00 -4.98 2.88 1.13 -1.08 -2.57 117.38 117.60 1qzh n GLN 109 Ca -0.17 0.47 -0.32 0.00 -1.94 0.00 0.00 57.00 55.04 1qzh n GLN 109 Cb 0.51 -1.42 -0.17 0.00 0.11 0.00 0.00 30.24 29.27 1qzh n GLN 109 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1qzh s ILE 110 N -2.40 2.16 -0.03 5.09 -1.09 0.02 -1.94 121.20 123.01 1qzh s ILE 110 Ca 0.00 -0.97 -0.26 0.00 -2.23 0.00 0.00 60.65 57.19 1qzh s ILE 110 Cb 0.00 -1.84 -0.04 0.00 -1.58 0.00 0.00 42.46 39.00 1qzh s ILE 110 CO 0.00 0.55 0.79 -0.89 -1.23 0.00 0.00 174.94 174.16 1qzh s THR 111 N 0.52 4.96 -0.12 2.92 2.01 0.35 -0.91 115.64 125.37 1qzh s THR 111 Ca -0.14 1.65 -0.14 0.00 0.31 0.00 0.00 61.69 63.37 1qzh s THR 111 Cb -0.17 -4.13 -0.05 0.00 0.01 0.00 0.00 72.50 68.16 1qzh s THR 111 CO 0.05 0.24 0.31 -0.76 -0.69 0.00 0.00 174.62 173.77 1qzh s LEU 112 N 0.76 4.30 0.27 4.42 1.02 -0.52 -0.64 118.68 128.30 1qzh s LEU 112 Ca 0.42 0.61 -0.21 0.00 0.02 0.00 0.00 54.13 54.97 1qzh s LEU 112 Cb -0.19 -2.40 0.02 0.00 0.02 0.00 0.00 46.19 43.64 1qzh s LEU 112 CO 0.22 0.16 0.71 0.00 0.02 0.00 0.00 176.35 177.46 1qzh s ARG 113 N 0.05 1.75 -0.04 1.70 1.04 -0.28 -3.81 118.95 119.36 1qzh s ARG 113 Ca 0.18 -0.97 -0.10 0.00 -1.04 0.00 0.00 55.73 53.81 1qzh s ARG 113 Cb -0.14 0.60 -0.05 0.00 -2.04 0.00 0.00 34.95 33.33 1qzh s ARG 113 CO 0.06 -0.80 0.28 -1.12 -0.04 0.00 0.00 175.30 173.68 1qzh s SER 114 N -2.91 6.58 -0.16 -2.89 0.01 -1.26 0.76 113.70 113.83 1qzh s SER 114 Ca 0.11 0.69 -0.04 0.00 1.31 0.00 0.00 55.95 58.02 1qzh s SER 114 Cb -0.06 -2.15 0.07 0.00 0.21 0.00 0.00 66.02 64.10 1qzh s SER 114 CO 0.06 0.33 0.19 -0.47 0.41 0.00 0.00 173.24 173.76 1qzh s TYR 115 N -1.12 -0.18 -1.30 2.43 6.14 -0.35 -4.86 117.35 118.11 1qzh s TYR 115 Ca 0.22 0.29 -0.00 0.00 0.64 0.00 0.00 57.07 58.21 1qzh s TYR 115 Cb -0.14 -0.37 0.00 0.00 0.42 0.00 0.00 41.96 41.87 1qzh s TYR 115 CO 0.11 -0.48 0.73 0.54 0.64 0.00 0.00 175.55 177.09 1qzh n ARG 116 N 5.32 -5.09 -3.63 4.97 1.74 -1.26 -3.02 116.66 115.69 1qzh n ARG 116 Ca -0.05 0.64 -0.27 0.00 -0.77 0.00 0.00 57.85 57.40 1qzh n ARG 116 Cb 0.50 -5.25 0.01 0.00 -1.02 0.00 0.00 32.46 26.70 1qzh n ARG 116 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1qzh n ASP 117 N -3.06 -5.35 -3.63 0.55 4.64 -1.26 -4.99 116.55 103.44 1qzh n ASP 117 Ca -0.30 -0.62 -0.07 0.00 -1.38 0.00 0.00 54.79 52.43 1qzh n ASP 117 Cb 0.68 -2.05 -0.06 0.00 -1.04 0.00 0.00 41.12 38.64 1qzh n ASP 117 CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 1qzh s ARG 118 N -4.00 0.36 0.34 -0.67 0.52 -1.17 -5.16 118.95 109.18 1qzh s ARG 118 Ca 0.12 0.31 -0.25 0.00 -0.52 0.00 0.00 55.73 55.39 1qzh s ARG 118 Cb -0.01 0.17 -0.10 0.00 0.52 0.00 0.00 34.95 35.53 1qzh s ARG 118 CO 0.88 -0.07 0.96 0.99 0.02 0.00 0.00 175.30 178.08 1qzh s THR 119 N -0.22 4.15 -0.02 0.02 2.01 -1.26 -1.21 115.64 119.11 1qzh s THR 119 Ca 0.04 1.72 -0.04 0.00 0.31 0.00 0.00 61.69 63.72 1qzh s THR 119 Cb -0.04 -3.93 0.00 0.00 0.01 0.00 0.00 72.50 68.55 1qzh s THR 119 CO -0.07 0.08 0.09 -1.58 -0.69 0.00 0.00 174.62 172.45 1qzh s GLN 120 N -2.21 0.25 -0.19 4.92 0.74 0.23 -4.54 119.66 118.87 1qzh s GLN 120 Ca 0.52 -0.12 -0.09 0.00 0.05 0.00 0.00 55.36 55.72 1qzh s GLN 120 Cb -0.18 0.11 -0.05 0.00 1.10 0.00 0.00 33.01 33.99 1qzh s GLN 120 CO 0.23 -0.05 0.11 0.20 -0.55 0.00 0.00 175.29 175.24 1qzh s GLY 121 N -0.58 2.02 -0.12 2.59 0.00 0.29 -1.13 107.32 110.38 1qzh s GLY 121 Ca -0.07 -0.70 0.01 0.00 0.00 0.00 0.00 44.72 43.97 1qzh s GLY 121 CO 0.00 0.07 -0.15 1.08 0.00 0.00 0.00 173.10 174.10 1qzh s LEU 122 N 0.22 1.69 0.46 0.66 1.02 0.19 0.42 118.68 123.34 1qzh s LEU 122 Ca 0.08 -0.45 -0.23 0.00 0.02 0.00 0.00 54.13 53.55 1qzh s LEU 122 Cb -0.11 -1.12 -0.07 0.00 0.02 0.00 0.00 46.19 44.90 1qzh s LEU 122 CO -0.01 -0.01 1.14 -0.94 0.02 0.00 0.00 176.35 176.55 1qzh s SER 123 N 1.19 6.20 0.54 2.29 1.04 -0.81 0.13 113.70 124.28 1qzh s SER 123 Ca -0.02 2.24 -0.13 0.00 0.48 0.00 0.00 55.95 58.53 1qzh s SER 123 Cb -0.14 -2.60 -0.06 0.00 0.10 0.00 0.00 66.02 63.32 1qzh s SER 123 CO -0.05 -0.89 0.97 -0.54 0.98 0.00 0.00 173.24 173.70 1qzh s LYS 124 N -2.76 3.77 0.32 4.02 -0.14 -0.82 -4.76 119.74 119.38 1qzh s LYS 124 Ca 0.64 0.77 0.06 0.00 -1.36 0.00 0.00 55.97 56.08 1qzh s LYS 124 Cb -0.27 -2.16 0.72 0.00 -1.68 0.00 0.00 37.83 34.45 1qzh s LYS 124 CO 0.32 -0.36 1.82 -0.44 -0.76 0.00 0.00 175.35 175.94 1qzh h ASP 125 N 0.43 0.78 -0.69 2.83 3.32 -1.90 -2.06 116.42 119.12 1qzh h ASP 125 Ca -0.46 0.07 -0.30 0.00 0.02 0.00 0.00 57.03 56.35 1qzh h ASP 125 Cb 1.19 -0.08 -0.18 0.00 0.22 0.00 0.00 39.33 40.47 1qzh h ASP 125 CO 0.62 0.35 0.38 0.00 -1.72 0.00 0.00 179.24 178.87 1qzh n GLN 126 N -4.66 2.45 -1.96 3.56 3.00 -1.26 -4.93 117.38 113.59 1qzh n GLN 126 Ca 0.20 -2.34 -0.38 0.00 -0.01 0.00 0.00 57.00 54.48 1qzh n GLN 126 Cb 0.49 -1.95 0.02 0.00 0.00 0.00 0.00 30.24 28.81 1qzh n GLN 126 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.06 176.47 1qzh s PHE 127 N -2.49 2.48 0.30 1.08 -0.12 -0.78 -4.97 117.98 113.49 1qzh s PHE 127 Ca 0.43 1.44 0.05 0.00 -0.05 0.00 0.00 56.93 58.81 1qzh s PHE 127 Cb 0.36 -3.63 -0.06 0.00 -0.63 0.00 0.00 43.02 39.06 1qzh s PHE 127 CO 0.09 -2.37 0.01 1.03 -0.05 0.00 0.00 175.22 173.93 1qzh s ARG 128 N -2.89 1.59 0.33 1.99 1.81 -1.06 -4.81 118.95 115.90 1qzh s ARG 128 Ca 0.70 -1.85 -0.17 0.00 -1.72 0.00 0.00 55.73 52.69 1qzh s ARG 128 Cb -0.35 -0.96 0.03 0.00 -0.45 0.00 0.00 34.95 33.22 1qzh s ARG 128 CO 0.42 -0.10 0.72 1.52 -0.68 0.00 0.00 175.30 177.18 1qzh s TYR 129 N -3.19 0.05 -0.08 -0.53 -0.85 -0.19 -1.06 117.35 111.50 1qzh s TYR 129 Ca 0.33 -0.59 -0.06 0.00 -0.52 0.00 0.00 57.07 56.23 1qzh s TYR 129 Cb 0.07 0.69 0.03 0.00 0.38 0.00 0.00 41.96 43.12 1qzh s TYR 129 CO 0.14 -1.37 0.20 0.00 -1.52 0.00 0.00 175.55 173.00 1qzh s ALA 130 N -3.16 -0.46 0.03 9.51 0.00 -0.31 -1.11 121.76 126.25 1qzh s ALA 130 Ca 0.15 0.67 0.06 0.00 0.00 0.00 0.00 51.96 52.84 1qzh s ALA 130 Cb -0.05 -0.41 -0.02 0.00 0.00 0.00 0.00 23.12 22.64 1qzh s ALA 130 CO 0.10 -0.13 -0.19 -1.17 0.00 0.00 0.00 175.76 174.37 1qzh s LEU 131 N 0.53 2.13 0.15 0.00 0.20 -1.26 -0.68 118.68 119.75 1qzh s LEU 131 Ca -0.04 -0.46 0.07 0.00 0.69 0.00 0.00 54.13 54.40 1qzh s LEU 131 Cb -0.05 -0.91 -0.04 0.00 -0.43 0.00 0.00 46.19 44.76 1qzh s LEU 131 CO -0.03 0.16 -0.17 0.26 -0.29 0.00 0.00 176.35 176.28 1qzh s TRP 132 N -0.71 1.66 0.68 5.38 0.51 -0.82 -5.03 118.94 120.62 1qzh s TRP 132 Ca 0.06 -0.50 -0.16 0.00 -2.12 0.00 0.00 56.10 53.38 1qzh s TRP 132 Cb -0.08 -0.85 0.01 0.00 -0.81 0.00 0.00 33.47 31.74 1qzh s TRP 132 CO 0.01 0.25 1.21 -2.14 -0.51 0.00 0.00 176.95 175.78 1qzh s PRO 133 N -2.71 2.43 -1.16 4.98 0.02 -1.26 -3.71 135.00 133.60 1qzh s PRO 133 Ca 0.13 1.80 -0.21 0.00 0.02 0.00 0.00 61.00 62.74 1qzh s PRO 133 Cb -0.06 -1.86 0.04 0.00 0.02 0.00 0.00 34.50 32.64 1qzh s PRO 133 CO 0.05 -1.62 1.67 0.34 -0.33 0.00 0.00 177.00 177.11 1qzh s ASP 134 N -1.86 6.40 0.29 2.53 2.15 -1.26 -4.58 116.67 120.34 1qzh s ASP 134 Ca 0.76 -1.88 0.01 0.00 0.43 0.00 0.00 52.55 51.87 1qzh s ASP 134 Cb -0.30 -2.58 0.71 0.00 -0.30 0.00 0.00 42.92 40.45 1qzh s ASP 134 CO 0.41 -1.61 1.60 -0.26 -0.17 0.00 0.00 175.17 175.14 1qzh h PHE 135 N 8.87 0.08 0.00 -5.34 -1.00 -1.89 -1.64 116.94 116.02 1qzh h PHE 135 Ca 0.31 0.06 0.00 0.00 2.81 0.00 0.00 57.97 61.15 1qzh h PHE 135 Cb 0.94 0.11 0.00 0.00 3.61 0.00 0.00 35.95 40.61 1qzh h PHE 135 CO 1.34 -0.35 0.00 -1.13 -1.61 0.00 0.00 178.31 176.56 1qzh n SER 136 N -5.39 2.00 -4.59 2.17 3.41 -1.26 -4.81 113.62 105.14 1qzh n SER 136 Ca 0.22 -1.36 -0.27 0.00 -0.26 0.00 0.00 58.87 57.19 1qzh n SER 136 Cb 0.71 -0.34 -0.09 0.00 -0.26 0.00 0.00 64.21 64.23 1qzh n SER 136 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1qzh s SER 137 N 0.96 4.39 0.00 4.04 0.15 -0.62 -4.98 113.70 117.64 1qzh s SER 137 Ca 0.00 -0.50 0.19 0.00 0.70 0.00 0.00 55.95 56.34 1qzh s SER 137 Cb 0.00 -0.81 1.14 0.00 -1.71 0.00 0.00 66.02 64.64 1qzh s SER 137 CO 0.00 0.12 1.59 0.59 1.20 0.00 0.00 173.24 176.73 1qzh n ASN 138 N 0.15 0.00 -4.68 5.45 3.02 -1.26 -4.70 115.26 113.24 1qzh n ASN 138 Ca -0.11 -0.92 -0.30 0.00 -0.03 0.00 0.00 54.58 53.22 1qzh n ASN 138 Cb 0.55 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.63 1qzh n ASN 138 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1qzh s SER 139 N -1.84 4.98 0.00 6.41 0.01 -1.26 -5.02 113.70 116.98 1qzh s SER 139 Ca 0.29 -0.17 0.05 0.00 1.31 0.00 0.00 55.95 57.43 1qzh s SER 139 Cb 0.13 -1.19 -0.05 0.00 0.21 0.00 0.00 66.02 65.13 1qzh s SER 139 CO 0.22 0.19 0.21 1.17 0.41 0.00 0.00 173.24 175.44 1qzh n LYS 140 N 0.72 5.32 -0.78 12.44 4.81 -1.26 -4.51 118.16 134.90 1qzh n LYS 140 Ca -0.12 -0.02 -0.01 0.00 -0.87 0.00 0.00 58.31 57.29 1qzh n LYS 140 Cb 0.52 -0.73 0.26 0.00 0.02 0.00 0.00 35.03 35.10 1qzh n LYS 140 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1qzh n ASP 141 N -1.07 3.83 0.19 3.14 3.85 -1.26 -4.62 116.55 120.62 1qzh n ASP 141 Ca 0.01 -3.33 0.18 0.00 -0.71 0.00 0.00 54.79 50.94 1qzh n ASP 141 Cb 0.07 -0.65 0.82 0.00 -1.35 0.00 0.00 41.12 40.01 1qzh n ASP 141 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.20 176.90 1qzh h THR 142 N 1.84 0.43 -3.60 2.12 1.35 -1.94 -3.36 112.91 109.75 1qzh h THR 142 Ca 0.18 0.00 -0.70 0.00 -0.55 0.00 0.00 66.41 65.34 1qzh h THR 142 Cb 1.88 0.80 -0.22 0.00 -1.73 0.00 0.00 68.15 68.88 1qzh h THR 142 CO 0.49 0.00 -0.49 -0.22 -0.25 0.00 0.00 175.52 175.05 1qzh s LEU 143 N -7.47 4.68 0.37 3.87 2.96 -1.26 -4.48 118.68 117.35 1qzh s LEU 143 Ca -0.05 -0.79 -0.02 0.00 -0.22 0.00 0.00 54.13 53.06 1qzh s LEU 143 Cb 0.15 -2.08 -0.04 0.00 0.50 0.00 0.00 46.19 44.73 1qzh s LEU 143 CO 0.53 -0.34 0.61 0.00 -1.32 0.00 0.00 176.35 175.83 1qzh n PRO 145 N -1.73 1.22 -4.09 0.00 -0.04 -1.26 -4.98 135.00 124.13 1qzh n PRO 145 Ca -0.03 0.43 -0.30 0.00 -0.04 0.00 0.00 63.50 63.56 1qzh n PRO 145 Cb 0.55 -1.81 -0.07 0.00 -0.04 0.00 0.00 33.50 32.13 1qzh n PRO 145 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1qzh s GLN 146 N -1.17 2.73 0.44 0.54 -1.52 -1.26 -4.90 119.66 114.53 1qzh s GLN 146 Ca 0.63 -0.75 -0.25 0.00 -1.95 0.00 0.00 55.36 53.04 1qzh s GLN 146 Cb -0.76 -2.65 -0.08 0.00 -0.22 0.00 0.00 33.01 29.31 1qzh s GLN 146 CO 0.57 0.56 1.36 -2.14 -0.25 0.00 0.00 175.29 175.39 1qzh s PRO 147 N -2.34 3.74 -0.01 2.91 0.02 -1.26 -4.96 135.00 133.09 1qzh s PRO 147 Ca 0.28 2.26 -0.21 0.00 0.02 0.00 0.00 61.00 63.35 1qzh s PRO 147 Cb -0.12 -2.64 -0.24 0.00 0.02 0.00 0.00 34.50 31.52 1qzh s PRO 147 CO 0.20 -0.72 1.06 0.52 -0.33 0.00 0.00 177.00 177.74 1qzh h MET 148 N 2.35 0.36 -0.56 5.54 2.86 -1.97 -3.37 114.93 120.14 1qzh h MET 148 Ca -0.50 -0.40 0.08 0.00 -2.06 0.00 0.00 59.70 56.82 1qzh h MET 148 Cb 1.26 0.12 -0.09 0.00 0.06 0.00 0.00 31.60 32.95 1qzh h MET 148 CO 0.61 1.09 -0.24 -2.30 1.06 0.00 0.00 176.91 177.13 1qzh n PRO 149 N -4.26 -0.15 -0.29 -0.22 -0.02 -1.26 -0.74 135.00 128.05 1qzh n PRO 149 Ca -0.11 0.86 0.12 0.00 -2.02 0.00 0.00 63.50 62.35 1qzh n PRO 149 Cb 0.66 -1.28 0.27 0.00 -0.02 0.00 0.00 33.50 33.13 1qzh n PRO 149 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1qzh n ARG 150 N -4.81 2.62 -2.41 -0.52 1.74 -1.26 -4.98 116.66 107.04 1qzh n ARG 150 Ca 0.05 -2.48 -0.42 0.00 -0.77 0.00 0.00 57.85 54.23 1qzh n ARG 150 Cb 0.21 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.08 1qzh n ARG 150 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1qzh s LEU 151 N -1.21 4.40 -0.06 0.55 1.43 0.08 -1.03 118.68 122.83 1qzh s LEU 151 Ca 0.44 2.08 -0.06 0.00 -1.03 0.00 0.00 54.13 55.55 1qzh s LEU 151 Cb 0.24 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.83 1qzh s LEU 151 CO 0.32 -0.44 0.19 -0.04 0.23 0.00 0.00 176.35 176.61 1qzh s MET 152 N 0.68 3.49 -0.10 1.70 -1.94 -0.27 -4.88 119.30 117.98 1qzh s MET 152 Ca 0.57 -0.14 -0.23 0.00 -1.71 0.00 0.00 55.69 54.18 1qzh s MET 152 Cb -0.30 -3.15 -0.03 0.00 2.01 0.00 0.00 34.83 33.36 1qzh s MET 152 CO 0.31 0.72 0.69 -1.59 -0.01 0.00 0.00 175.02 175.15 1qzh s LYS 153 N -1.40 4.38 0.19 2.03 0.00 -1.26 -4.81 119.74 118.87 1qzh s LYS 153 Ca 0.21 0.83 0.11 0.00 0.00 0.00 0.00 55.97 57.12 1qzh s LYS 153 Cb -0.13 -3.48 -0.04 0.00 0.00 0.00 0.00 37.83 34.18 1qzh s LYS 153 CO 0.11 -0.02 -0.22 0.95 0.00 0.00 0.00 175.35 176.17 1qzh s THR 154 N 1.10 2.47 0.00 3.79 -4.23 -1.26 -5.15 115.64 112.36 1qzh s THR 154 Ca 0.35 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.87 1qzh s THR 154 Cb -0.17 -2.19 0.00 0.00 1.34 0.00 0.00 72.50 71.48 1qzh s THR 154 CO 0.16 -0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.72 1qzh n GLY 155 N 0.21 1.94 0.16 3.99 0.00 -1.26 -5.00 105.19 105.22 1qzh n GLY 155 Ca -0.12 -2.04 0.12 0.00 0.00 0.00 0.00 46.02 43.98 1qzh n GLY 155 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1qzh h ASP 156 N 0.00 0.00 0.46 1.61 1.82 -2.01 -3.05 116.42 115.25 1qzh h ASP 156 Ca 0.00 -0.02 -0.02 0.00 -0.39 0.00 0.00 57.03 56.60 1qzh h ASP 156 Cb 0.00 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.01 1qzh h ASP 156 CO 0.00 0.01 -0.22 0.11 -1.61 0.00 0.00 179.24 177.53 1qzh h LYS 157 N 0.00 -0.59 0.00 0.28 1.79 -2.00 -0.33 116.57 115.72 1qzh h LYS 157 Ca 0.00 0.04 -0.06 0.00 -2.18 0.00 0.00 60.65 58.45 1qzh h LYS 157 Cb 0.93 0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 31.70 1qzh h LYS 157 CO 0.00 -0.36 -0.28 1.05 -1.08 0.00 0.00 179.45 178.78 1qzh h GLU 158 N -0.68 0.00 -0.61 3.15 9.09 -1.94 -2.49 114.58 121.09 1qzh h GLU 158 Ca -0.06 0.00 -0.07 0.00 0.05 0.00 0.00 59.36 59.28 1qzh h GLU 158 Cb 0.51 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.58 1qzh h GLU 158 CO 0.10 0.28 0.10 1.49 0.05 0.00 0.00 179.01 181.04 1qzh h GLU 159 N 0.00 1.01 -0.26 1.06 4.57 -1.38 0.10 114.58 119.67 1qzh h GLU 159 Ca -0.00 -0.27 -0.05 0.00 -1.18 0.00 0.00 59.36 57.86 1qzh h GLU 159 Cb 0.81 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.27 1qzh h GLU 159 CO 0.04 0.94 -0.03 1.96 -1.18 0.00 0.00 179.01 180.74 1qzh h GLN 160 N 0.91 0.49 -0.66 1.92 1.08 -0.80 -1.87 115.11 116.19 1qzh h GLN 160 Ca 0.19 -0.17 -0.03 0.00 -1.45 0.00 0.00 58.65 57.19 1qzh h GLN 160 Cb 0.42 -0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.78 1qzh h GLN 160 CO 0.01 0.67 0.30 0.35 -0.95 0.00 0.00 178.83 179.22 1qzh h PHE 161 N 0.25 0.94 -0.52 2.96 3.57 -1.22 -1.00 116.94 121.92 1qzh h PHE 161 Ca 0.07 -0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.46 1qzh h PHE 161 Cb 0.47 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 1qzh h PHE 161 CO 0.04 0.69 0.05 0.00 -2.23 0.00 0.00 178.31 176.87 1qzh h ALA 162 N 1.40 0.69 0.47 2.41 0.00 -0.67 -1.62 119.26 121.94 1qzh h ALA 162 Ca 0.23 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1qzh h ALA 162 Cb 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1qzh h ALA 162 CO -0.03 0.46 -0.23 -0.07 0.00 0.00 0.00 179.25 179.39 1qzh h LEU 163 N 0.75 -0.53 -0.06 0.00 3.38 -0.84 -1.97 115.31 116.03 1qzh h LEU 163 Ca 0.15 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.13 1qzh h LEU 163 Cb 0.45 0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.29 1qzh h LEU 163 CO 0.02 -0.34 -0.43 -0.07 0.09 0.00 0.00 178.44 177.71 1qzh h LEU 164 N -0.69 -1.36 -0.66 1.67 4.07 -1.13 0.13 115.31 117.34 1qzh h LEU 164 Ca -0.06 0.16 0.12 0.00 0.08 0.00 0.00 57.88 58.18 1qzh h LEU 164 Cb 0.51 0.53 -0.13 0.00 1.08 0.00 0.00 40.66 42.65 1qzh h LEU 164 CO 0.11 -0.40 -0.28 -0.07 -1.08 0.00 0.00 178.44 176.72 1qzh h LEU 165 N -0.50 -0.99 -1.36 1.67 3.38 -1.30 0.34 115.31 116.55 1qzh h LEU 165 Ca 0.02 0.23 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 1qzh h LEU 165 Cb 0.56 0.54 -0.02 0.00 0.09 0.00 0.00 40.66 41.82 1qzh h LEU 165 CO -0.32 -0.28 0.26 -1.13 0.09 0.00 0.00 178.44 177.05 1qzh h ASN 166 N -0.09 0.62 0.31 -0.43 -0.73 -0.84 0.69 115.58 115.10 1qzh h ASN 166 Ca 0.28 -0.05 -0.02 0.00 1.87 0.00 0.00 56.30 58.39 1qzh h ASN 166 Cb 0.55 -0.16 0.00 0.00 0.27 0.00 0.00 38.32 38.98 1qzh h ASN 166 CO -0.72 0.52 -0.15 0.50 -0.37 0.00 0.00 177.43 177.21 1qzh h LYS 167 N 0.70 -0.40 -0.41 6.67 3.64 0.23 -0.57 116.57 126.43 1qzh h LYS 167 Ca 0.18 0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.59 1qzh h LYS 167 Cb 0.05 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1qzh h LYS 167 CO -0.03 -0.09 0.27 0.82 -2.27 0.00 0.00 179.45 178.16 1qzh h ILE 168 N -0.73 1.10 -0.26 2.00 2.04 -0.34 -1.61 117.51 119.70 1qzh h ILE 168 Ca -0.04 -0.19 -0.12 0.00 1.00 0.00 0.00 64.86 65.51 1qzh h ILE 168 Cb 0.49 0.51 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1qzh h ILE 168 CO 0.07 0.10 -0.31 -0.25 0.00 0.00 0.00 178.15 177.75 1qzh h TRP 169 N 0.54 0.82 -0.85 1.37 7.01 -0.79 -2.77 115.95 121.28 1qzh h TRP 169 Ca 0.15 -0.26 -0.02 0.00 2.11 0.00 0.00 58.89 60.87 1qzh h TRP 169 Cb -0.04 -0.17 -0.04 0.00 -2.10 0.00 0.00 29.16 26.81 1qzh h TRP 169 CO -0.00 1.01 0.46 0.22 -2.79 0.00 0.00 178.44 177.33 1qzh h ASP 170 N 0.40 1.07 0.29 2.65 3.58 -0.33 -3.05 116.42 121.03 1qzh h ASP 170 Ca 0.03 -0.11 -0.01 0.00 0.42 0.00 0.00 57.03 57.36 1qzh h ASP 170 Cb 0.89 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.67 1qzh h ASP 170 CO 0.08 0.87 -0.14 -0.33 -2.88 0.00 0.00 179.24 176.84 1qzh h GLU 171 N 1.19 -0.38 0.00 0.28 5.08 -1.32 -2.12 114.58 117.31 1qzh h GLU 171 Ca 0.30 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1qzh h GLU 171 Cb 0.04 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1qzh h GLU 171 CO -0.05 -0.10 0.00 1.04 -1.00 0.00 0.00 179.01 178.90 1qzh n GLN 172 N -5.16 0.19 -0.46 2.33 6.02 -1.05 -2.24 117.38 117.02 1qzh n GLN 172 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.89 1qzh n GLN 172 Cb 0.24 -1.15 0.00 0.00 1.02 0.00 0.00 30.24 30.35 1qzh n GLN 172 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1qzh n THR 173 N -0.65 0.00 1.31 5.09 -2.24 -1.10 -4.91 114.28 111.77 1qzh n THR 173 Ca 0.01 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.93 1qzh n THR 173 Cb 0.01 0.38 0.36 0.00 -2.10 0.00 0.00 70.33 68.98 1qzh n THR 173 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09