#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qxh s GLN 3 N 0.00 0.33 -0.05 -1.46 -0.21 -0.57 -4.87 119.66 112.83 1qxh s GLN 3 Ca 0.00 -0.61 -0.00 0.00 0.02 0.00 0.00 55.36 54.77 1qxh s GLN 3 Cb 0.00 0.05 0.03 0.00 1.00 0.00 0.00 33.01 34.09 1qxh s GLN 3 CO 0.00 -0.03 -0.00 -0.08 -2.12 0.00 0.00 175.29 173.05 1qxh s THR 4 N -1.39 0.29 0.00 -0.19 -1.32 -1.26 -0.08 115.64 111.68 1qxh s THR 4 Ca -0.15 0.09 0.00 0.00 -1.21 0.00 0.00 61.69 60.42 1qxh s THR 4 Cb -0.10 -0.41 0.00 0.00 -1.51 0.00 0.00 72.50 70.49 1qxh s THR 4 CO -0.01 0.20 0.00 1.33 -2.21 0.00 0.00 174.62 173.94 1qxh n VAL 5 N 4.57 0.00 -4.13 5.08 0.24 0.45 -4.91 118.33 119.63 1qxh n VAL 5 Ca -0.17 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.04 1qxh n VAL 5 Cb 0.50 -0.01 -0.10 0.00 -1.47 0.00 0.00 33.84 32.76 1qxh n VAL 5 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1qxh s HIS 6 N -0.38 0.72 -0.29 6.34 3.76 0.56 0.55 115.29 126.55 1qxh s HIS 6 Ca 0.00 -1.00 -0.17 0.00 -0.15 0.00 0.00 55.06 53.74 1qxh s HIS 6 Cb 0.00 -0.46 0.12 0.00 1.11 0.00 0.00 32.58 33.35 1qxh s HIS 6 CO 0.00 -0.27 0.88 0.12 -0.85 0.00 0.00 174.74 174.63 1qxh s PHE 7 N -3.77 -0.73 -1.75 1.40 5.36 0.20 -1.70 117.98 117.00 1qxh s PHE 7 Ca 0.10 1.48 0.00 0.00 -0.96 0.00 0.00 56.93 57.55 1qxh s PHE 7 Cb 0.07 0.43 0.00 0.00 -0.34 0.00 0.00 43.02 43.18 1qxh s PHE 7 CO -0.07 -0.36 0.00 1.04 -1.46 0.00 0.00 175.22 174.37 1qxh n GLN 8 N 3.74 -1.58 -0.71 10.12 6.02 -1.26 -0.89 117.38 132.82 1qxh n GLN 8 Ca -0.18 0.98 0.00 0.00 -0.01 0.00 0.00 57.00 57.78 1qxh n GLN 8 Cb 0.58 -5.43 0.00 0.00 1.02 0.00 0.00 30.24 26.41 1qxh n GLN 8 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1qxh n GLY 9 N -0.57 0.70 3.25 1.08 0.00 -1.26 -5.04 105.19 103.34 1qxh n GLY 9 Ca -0.19 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.55 1qxh n GLY 9 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1qxh s ASN 10 N -2.24 2.62 0.70 1.61 0.02 -0.07 -5.13 114.94 112.45 1qxh s ASN 10 Ca 0.00 -0.40 -0.14 0.00 -1.02 0.00 0.00 52.86 51.29 1qxh s ASN 10 Cb 0.00 -0.29 0.02 0.00 0.02 0.00 0.00 41.25 41.00 1qxh s ASN 10 CO 0.00 0.27 1.14 -2.16 0.02 0.00 0.00 177.10 176.37 1qxh s PRO 11 N -0.53 2.47 -0.02 -0.60 0.04 -1.26 -0.63 135.00 134.48 1qxh s PRO 11 Ca 0.09 1.48 0.02 0.00 0.04 0.00 0.00 61.00 62.63 1qxh s PRO 11 Cb -0.09 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.56 1qxh s PRO 11 CO -0.01 -1.52 -0.05 0.08 0.04 0.00 0.00 177.00 175.54 1qxh s VAL 12 N -2.30 0.48 -0.01 -0.36 1.01 0.19 -4.80 120.40 114.61 1qxh s VAL 12 Ca 0.69 -0.21 -0.19 0.00 0.00 0.00 0.00 61.98 62.27 1qxh s VAL 12 Cb -0.23 -0.44 -0.05 0.00 0.00 0.00 0.00 36.38 35.65 1qxh s VAL 12 CO 0.45 0.16 0.53 -0.89 0.00 0.00 0.00 175.10 175.35 1qxh s THR 13 N 0.21 4.94 -0.15 3.92 2.01 -1.26 -0.41 115.64 124.90 1qxh s THR 13 Ca -0.02 1.11 0.00 0.00 0.31 0.00 0.00 61.69 63.09 1qxh s THR 13 Cb -0.06 -3.86 0.03 0.00 0.01 0.00 0.00 72.50 68.61 1qxh s THR 13 CO -0.00 0.46 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.58 1qxh s VAL 14 N -0.42 1.47 0.48 3.82 1.01 0.88 -0.84 120.40 126.80 1qxh s VAL 14 Ca 0.28 -0.61 -0.23 0.00 0.00 0.00 0.00 61.98 61.42 1qxh s VAL 14 Cb -0.18 -1.42 -0.08 0.00 0.00 0.00 0.00 36.38 34.70 1qxh s VAL 14 CO 0.16 0.40 1.19 0.00 0.00 0.00 0.00 175.10 176.84 1qxh n ALA 15 N 4.80 0.96 -0.56 5.51 0.00 -0.76 -1.51 120.51 128.94 1qxh n ALA 15 Ca -0.16 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1qxh n ALA 15 Cb 0.50 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.72 1qxh n ALA 15 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1qxh n ASN 16 N -0.16 0.00 -3.91 0.00 3.02 -1.26 -4.26 115.26 108.69 1qxh n ASN 16 Ca 0.09 0.00 -0.12 0.00 -0.03 0.00 0.00 54.58 54.52 1qxh n ASN 16 Cb 0.42 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.45 1qxh n ASN 16 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1qxh s SER 17 N -4.00 0.17 0.44 6.41 0.15 -1.26 -3.67 113.70 111.94 1qxh s SER 17 Ca 0.00 -0.10 -0.24 0.00 0.70 0.00 0.00 55.95 56.31 1qxh s SER 17 Cb 0.00 0.00 -0.08 0.00 -1.71 0.00 0.00 66.02 64.23 1qxh s SER 17 CO 0.00 -0.03 1.19 -0.51 1.20 0.00 0.00 173.24 175.08 1qxh s ILE 18 N -0.26 3.02 0.57 6.45 2.07 -1.26 -4.03 121.20 127.77 1qxh s ILE 18 Ca -0.02 0.81 -0.18 0.00 -1.41 0.00 0.00 60.65 59.85 1qxh s ILE 18 Cb -0.02 -3.43 -0.09 0.00 0.13 0.00 0.00 42.46 39.05 1qxh s ILE 18 CO -0.00 0.03 0.47 -2.65 -1.91 0.00 0.00 174.94 170.88 1qxh n PRO 19 N -0.27 0.46 -4.61 3.50 -0.02 -1.26 -5.00 135.00 127.81 1qxh n PRO 19 Ca 0.06 0.18 -0.31 0.00 -2.02 0.00 0.00 63.50 61.41 1qxh n PRO 19 Cb 0.47 -1.65 -0.12 0.00 -0.02 0.00 0.00 33.50 32.18 1qxh n PRO 19 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1qxh s GLN 20 N -2.02 2.15 0.24 -0.52 -1.52 -1.26 -4.70 119.66 112.04 1qxh s GLN 20 Ca 0.68 -0.94 -0.29 0.00 -1.95 0.00 0.00 55.36 52.85 1qxh s GLN 20 Cb -0.45 -2.24 -0.15 0.00 -0.22 0.00 0.00 33.01 29.95 1qxh s GLN 20 CO 0.55 0.55 1.00 0.00 -0.25 0.00 0.00 175.29 177.14 1qxh n ALA 21 N 1.51 -0.71 0.00 6.09 0.00 -1.26 -1.61 120.51 124.54 1qxh n ALA 21 Ca -0.16 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1qxh n ALA 21 Cb 0.52 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 18.00 1qxh n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qxh n GLY 22 N 1.54 2.97 3.83 0.00 0.00 0.31 -4.97 105.19 108.86 1qxh n GLY 22 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 1qxh n GLY 22 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qxh s SER 23 N -1.25 6.81 0.01 1.61 0.01 -0.63 -4.76 113.70 115.51 1qxh s SER 23 Ca 0.00 1.66 -0.30 0.00 1.31 0.00 0.00 55.95 58.62 1qxh s SER 23 Cb 0.00 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.66 1qxh s SER 23 CO 0.00 -0.45 1.11 -0.75 0.41 0.00 0.00 173.24 173.56 1qxh s LYS 24 N -3.47 4.46 0.29 12.44 2.47 -1.26 -0.31 119.74 134.36 1qxh s LYS 24 Ca 0.61 1.61 -0.29 0.00 -1.56 0.00 0.00 55.97 56.34 1qxh s LYS 24 Cb -0.10 -3.43 -0.10 0.00 -1.46 0.00 0.00 37.83 32.74 1qxh s LYS 24 CO 0.19 -0.22 1.39 0.00 0.16 0.00 0.00 175.35 176.87 1qxh s ALA 25 N 1.28 3.57 0.31 3.13 0.00 0.55 -4.87 121.76 125.73 1qxh s ALA 25 Ca 0.55 1.32 -0.25 0.00 0.00 0.00 0.00 51.96 53.58 1qxh s ALA 25 Cb -0.25 -3.53 -0.10 0.00 0.00 0.00 0.00 23.12 19.24 1qxh s ALA 25 CO 0.27 -0.72 0.91 -0.65 0.00 0.00 0.00 175.76 175.57 1qxh s GLN 26 N -1.02 4.52 0.87 0.00 -0.21 -1.26 -4.99 119.66 117.56 1qxh s GLN 26 Ca 0.55 1.25 -0.12 0.00 0.02 0.00 0.00 55.36 57.06 1qxh s GLN 26 Cb -0.41 -2.78 0.11 0.00 1.00 0.00 0.00 33.01 30.93 1qxh s GLN 26 CO 0.48 0.28 1.10 -0.08 -2.12 0.00 0.00 175.29 174.96 1qxh s THR 27 N -1.63 2.67 0.14 -0.19 -1.32 -1.26 -4.98 115.64 109.07 1qxh s THR 27 Ca 0.50 0.22 -0.24 0.00 -1.21 0.00 0.00 61.69 60.95 1qxh s THR 27 Cb -0.18 -2.85 0.07 0.00 -1.51 0.00 0.00 72.50 68.03 1qxh s THR 27 CO 0.23 -0.28 0.75 0.72 -2.21 0.00 0.00 174.62 173.82 1qxh s PHE 28 N -3.08 -0.36 -0.05 9.09 -0.12 -1.26 -4.99 117.98 117.21 1qxh s PHE 28 Ca 0.63 0.11 0.02 0.00 -0.05 0.00 0.00 56.93 57.63 1qxh s PHE 28 Cb -0.16 0.59 0.02 0.00 -0.63 0.00 0.00 43.02 42.84 1qxh s PHE 28 CO 0.55 -0.84 -0.08 0.99 -0.05 0.00 0.00 175.22 175.79 1qxh s THR 29 N -3.55 0.81 0.19 -4.49 2.01 -1.26 -2.81 115.64 106.54 1qxh s THR 29 Ca 0.06 -0.30 0.00 0.00 0.31 0.00 0.00 61.69 61.76 1qxh s THR 29 Cb -0.02 -0.77 -0.04 0.00 0.01 0.00 0.00 72.50 71.68 1qxh s THR 29 CO -0.06 0.28 0.07 -0.76 -0.69 0.00 0.00 174.62 173.46 1qxh s LEU 30 N 0.70 1.68 -0.11 4.42 1.43 0.26 -4.76 118.68 122.29 1qxh s LEU 30 Ca -0.12 -1.29 -0.04 0.00 -1.03 0.00 0.00 54.13 51.65 1qxh s LEU 30 Cb -0.14 0.15 -0.04 0.00 0.03 0.00 0.00 46.19 46.19 1qxh s LEU 30 CO 0.02 -0.71 0.03 -0.69 0.23 0.00 0.00 176.35 175.23 1qxh s VAL 31 N -3.89 4.58 0.71 -1.59 1.01 -0.73 -0.11 120.40 120.38 1qxh s VAL 31 Ca 0.31 -0.14 -0.01 0.00 0.00 0.00 0.00 61.98 62.14 1qxh s VAL 31 Cb 0.07 -2.97 0.12 0.00 0.00 0.00 0.00 36.38 33.60 1qxh s VAL 31 CO 0.08 0.58 0.99 0.00 0.00 0.00 0.00 175.10 176.75 1qxh s ALA 32 N -0.62 3.64 0.27 5.51 0.00 -0.67 -0.27 121.76 129.62 1qxh s ALA 32 Ca 0.11 -1.64 0.34 0.00 0.00 0.00 0.00 51.96 50.77 1qxh s ALA 32 Cb -0.12 -2.07 1.86 0.00 0.00 0.00 0.00 23.12 22.80 1qxh s ALA 32 CO 0.02 -1.43 2.05 1.57 0.00 0.00 0.00 175.76 177.98 1qxh h LYS 33 N -0.52 0.00 -0.53 0.00 2.10 -1.89 -0.82 116.57 114.91 1qxh h LYS 33 Ca -0.37 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.28 1qxh h LYS 33 Cb 1.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 1qxh h LYS 33 CO 0.42 0.00 0.00 -0.40 -2.00 0.00 0.00 179.45 177.47 1qxh n ASP 34 N -2.72 4.45 0.00 7.07 5.75 -1.26 -4.85 116.55 124.99 1qxh n ASP 34 Ca -0.02 -2.53 0.00 0.00 -0.01 0.00 0.00 54.79 52.23 1qxh n ASP 34 Cb 0.06 -0.53 0.00 0.00 -1.03 0.00 0.00 41.12 39.62 1qxh n ASP 34 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1qxh n LEU 35 N 0.70 0.55 -4.90 -2.12 4.77 -0.31 -5.00 117.00 110.69 1qxh n LEU 35 Ca 0.23 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.93 1qxh n LEU 35 Cb 0.86 -1.39 0.02 0.00 -2.33 0.00 0.00 43.42 40.57 1qxh n LEU 35 CO 0.21 -0.48 0.60 -0.94 -1.33 0.00 0.00 177.39 175.45 1qxh s SER 36 N -2.12 5.90 0.24 -1.43 1.04 -1.26 -4.78 113.70 111.28 1qxh s SER 36 Ca 0.00 1.03 -0.12 0.00 0.48 0.00 0.00 55.95 57.33 1qxh s SER 36 Cb 0.00 -2.08 -0.08 0.00 0.10 0.00 0.00 66.02 63.96 1qxh s SER 36 CO 0.00 -0.94 0.61 -1.81 0.98 0.00 0.00 173.24 172.07 1qxh s ASP 37 N -4.23 6.71 -0.03 7.02 1.01 -1.26 -1.67 116.67 124.22 1qxh s ASP 37 Ca 0.53 1.06 0.00 0.00 0.71 0.00 0.00 52.55 54.86 1qxh s ASP 37 Cb -0.11 -2.28 0.03 0.00 1.01 0.00 0.00 42.92 41.57 1qxh s ASP 37 CO 0.49 -0.08 0.01 -0.69 0.21 0.00 0.00 175.17 175.11 1qxh s VAL 38 N -1.80 0.11 0.41 -1.27 1.01 0.84 -4.91 120.40 114.78 1qxh s VAL 38 Ca 0.48 0.15 0.08 0.00 0.00 0.00 0.00 61.98 62.68 1qxh s VAL 38 Cb -0.12 -0.23 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 1qxh s VAL 38 CO 0.20 0.14 0.26 0.42 0.00 0.00 0.00 175.10 176.12 1qxh s THR 39 N 1.19 2.55 0.18 3.92 -4.23 -1.26 -0.58 115.64 117.41 1qxh s THR 39 Ca -0.08 -1.54 -0.11 0.00 -1.18 0.00 0.00 61.69 58.78 1qxh s THR 39 Cb -0.13 -3.00 0.09 0.00 1.34 0.00 0.00 72.50 70.79 1qxh s THR 39 CO -0.02 -0.02 1.72 0.25 -0.54 0.00 0.00 174.62 176.01 1qxh h LEU 40 N 1.27 0.90 -2.74 4.79 5.85 -1.90 -2.81 115.31 120.66 1qxh h LEU 40 Ca -0.42 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.10 1qxh h LEU 40 Cb 1.26 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 42.05 1qxh h LEU 40 CO 0.64 0.85 0.09 1.23 -0.34 0.00 0.00 178.44 180.91 1qxh h GLY 41 N 0.90 0.00 1.44 3.75 0.00 -1.96 0.53 103.07 107.73 1qxh h GLY 41 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.54 1qxh h GLY 41 CO -0.01 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.47 1qxh n GLN 42 N -3.04 0.35 -0.27 4.80 6.02 -1.06 -2.09 117.38 122.09 1qxh n GLN 42 Ca -0.03 0.08 0.08 0.00 -0.01 0.00 0.00 57.00 57.13 1qxh n GLN 42 Cb 0.15 -1.50 0.16 0.00 1.02 0.00 0.00 30.24 30.07 1qxh n GLN 42 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1qxh n PHE 43 N -1.22 0.00 -1.73 1.08 3.72 0.18 -5.06 117.46 114.42 1qxh n PHE 43 Ca 0.10 -1.16 -0.42 0.00 -0.05 0.00 0.00 57.45 55.92 1qxh n PHE 43 Cb 0.13 -0.18 -0.01 0.00 -0.94 0.00 0.00 39.48 38.48 1qxh n PHE 43 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1qxh n ALA 44 N -1.30 1.89 -0.99 4.37 0.00 -0.89 -2.13 120.51 121.47 1qxh n ALA 44 Ca 0.17 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.97 1qxh n ALA 44 Cb 0.66 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.76 1qxh n ALA 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qxh n GLY 45 N 0.95 0.50 3.35 0.00 0.00 -1.20 -5.03 105.19 103.76 1qxh n GLY 45 Ca 0.04 -0.02 -0.19 0.00 0.00 0.00 0.00 46.02 45.86 1qxh n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qxh s LYS 46 N -0.04 1.34 -0.05 1.61 1.02 -0.91 -4.84 119.74 117.88 1qxh s LYS 46 Ca 0.00 -1.60 -0.24 0.00 0.02 0.00 0.00 55.97 54.16 1qxh s LYS 46 Cb 0.00 -1.13 -0.04 0.00 -0.52 0.00 0.00 37.83 36.14 1qxh s LYS 46 CO 0.00 0.18 0.71 0.50 -0.92 0.00 0.00 175.35 175.82 1qxh s ARG 47 N -3.64 4.44 -0.15 1.68 3.52 0.03 -3.53 118.95 121.29 1qxh s ARG 47 Ca 0.23 0.90 -0.01 0.00 -0.13 0.00 0.00 55.73 56.72 1qxh s ARG 47 Cb -0.01 -3.43 -0.01 0.00 -1.56 0.00 0.00 34.95 29.94 1qxh s ARG 47 CO 0.07 0.11 -0.11 0.15 -0.81 0.00 0.00 175.30 174.71 1qxh s LYS 48 N 0.63 3.37 -0.30 5.12 3.01 0.19 -1.08 119.74 130.68 1qxh s LYS 48 Ca 0.37 -0.67 -0.02 0.00 -1.01 0.00 0.00 55.97 54.64 1qxh s LYS 48 Cb -0.18 -2.72 0.05 0.00 -1.01 0.00 0.00 37.83 33.96 1qxh s LYS 48 CO 0.19 0.09 0.01 0.08 0.51 0.00 0.00 175.35 176.23 1qxh s VAL 49 N 0.67 3.05 -0.43 3.17 1.01 -0.62 0.09 120.40 127.34 1qxh s VAL 49 Ca -0.06 -1.38 -0.22 0.00 0.00 0.00 0.00 61.98 60.32 1qxh s VAL 49 Cb -0.15 -2.76 0.02 0.00 0.00 0.00 0.00 36.38 33.49 1qxh s VAL 49 CO 0.02 -0.12 0.75 -0.76 0.00 0.00 0.00 175.10 174.99 1qxh s LEU 50 N 1.26 4.27 -0.50 3.92 1.43 0.57 -0.71 118.68 128.93 1qxh s LEU 50 Ca -0.05 -0.05 -0.14 0.00 -1.03 0.00 0.00 54.13 52.86 1qxh s LEU 50 Cb -0.20 -2.92 0.11 0.00 0.03 0.00 0.00 46.19 43.21 1qxh s LEU 50 CO -0.01 -0.84 0.42 0.21 0.23 0.00 0.00 176.35 176.37 1qxh s ASN 51 N 2.04 6.03 -0.22 2.29 3.84 0.12 -1.88 114.94 127.17 1qxh s ASN 51 Ca 0.28 -1.67 -0.11 0.00 0.21 0.00 0.00 52.86 51.57 1qxh s ASN 51 Cb -0.13 -2.14 -0.05 0.00 -0.55 0.00 0.00 41.25 38.38 1qxh s ASN 51 CO 0.20 -0.74 0.20 -0.63 -2.79 0.00 0.00 177.10 173.34 1qxh s ILE 52 N 1.54 5.34 0.15 -5.21 1.01 0.36 -0.07 121.20 124.33 1qxh s ILE 52 Ca 0.04 0.30 0.07 0.00 0.00 0.00 0.00 60.65 61.06 1qxh s ILE 52 Cb -0.27 -3.54 -0.04 0.00 0.01 0.00 0.00 42.46 38.62 1qxh s ILE 52 CO 0.03 0.36 -0.17 -0.36 0.00 0.00 0.00 174.94 174.81 1qxh s PHE 53 N 0.85 1.65 0.26 3.97 0.40 0.39 -1.51 117.98 123.99 1qxh s PHE 53 Ca 0.10 -0.50 0.04 0.00 -0.60 0.00 0.00 56.93 55.97 1qxh s PHE 53 Cb -0.13 -0.84 0.33 0.00 0.51 0.00 0.00 43.02 42.89 1qxh s PHE 53 CO 0.03 0.25 1.62 -1.35 0.70 0.00 0.00 175.22 176.48 1qxh h PRO 54 N 3.37 0.30 -1.62 0.24 0.11 -1.70 -3.39 132.00 129.31 1qxh h PRO 54 Ca -0.41 -0.17 0.06 0.00 0.11 0.00 0.00 66.00 65.59 1qxh h PRO 54 Cb 1.20 0.01 -0.26 0.00 0.11 0.00 0.00 31.00 32.06 1qxh h PRO 54 CO 0.51 0.72 0.42 0.45 -0.21 0.00 0.00 178.00 179.89 1qxh s SER 55 N -6.88 -0.49 -0.29 -2.05 0.15 -1.26 -4.36 113.70 98.52 1qxh s SER 55 Ca -0.05 0.90 0.09 0.00 0.70 0.00 0.00 55.95 57.59 1qxh s SER 55 Cb 0.13 0.97 0.49 0.00 -1.71 0.00 0.00 66.02 65.90 1qxh s SER 55 CO 0.79 -0.15 1.44 2.30 1.20 0.00 0.00 173.24 178.82 1qxh n ILE 56 N 2.54 2.54 -2.54 6.45 -5.35 -1.26 -4.59 119.36 117.16 1qxh n ILE 56 Ca -0.14 -2.90 -0.15 0.00 -0.27 0.00 0.00 62.75 59.30 1qxh n ILE 56 Cb 0.56 -0.37 0.02 0.00 -1.74 0.00 0.00 39.64 38.12 1qxh n ILE 56 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 1qxh n ASP 57 N -1.11 2.96 0.22 7.28 2.03 -1.26 -4.05 116.55 122.63 1qxh n ASP 57 Ca 0.33 -3.01 0.12 0.00 0.52 0.00 0.00 54.79 52.74 1qxh n ASP 57 Cb 0.99 -0.47 0.17 0.00 -0.72 0.00 0.00 41.12 41.09 1qxh n ASP 57 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1qxh h THR 58 N 3.31 0.03 0.00 5.18 1.03 -1.95 -3.47 112.91 117.04 1qxh h THR 58 Ca 0.08 -1.03 0.00 0.00 -0.01 0.00 0.00 66.41 65.45 1qxh h THR 58 Cb 1.19 2.01 0.00 0.00 -1.07 0.00 0.00 68.15 70.28 1qxh h THR 58 CO 0.57 0.01 0.00 0.61 -0.01 0.00 0.00 175.52 176.70 1qxh n GLY 59 N 1.09 0.59 3.16 2.99 0.00 -1.26 -5.03 105.19 106.72 1qxh n GLY 59 Ca 0.04 -0.04 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1qxh n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qxh s VAL 60 N -2.00 1.58 -0.89 1.61 1.01 -1.26 -5.08 120.40 115.36 1qxh s VAL 60 Ca 0.00 -0.79 -0.03 0.00 0.00 0.00 0.00 61.98 61.17 1qxh s VAL 60 Cb 0.00 -1.36 0.22 0.00 0.00 0.00 0.00 36.38 35.24 1qxh s VAL 60 CO 0.00 0.45 0.79 0.00 0.00 0.00 0.00 175.10 176.34 1qxh s ALA 62 N -1.23 3.49 0.41 0.00 0.00 -1.26 -4.91 121.76 118.25 1qxh s ALA 62 Ca 0.27 1.14 0.14 0.00 0.00 0.00 0.00 51.96 53.50 1qxh s ALA 62 Cb -0.08 -3.44 0.87 0.00 0.00 0.00 0.00 23.12 20.46 1qxh s ALA 62 CO -0.11 -0.50 1.91 0.00 0.00 0.00 0.00 175.76 177.05 1qxh h ALA 63 N 4.03 1.52 -0.47 0.00 0.00 -1.98 -2.89 119.26 119.48 1qxh h ALA 63 Ca -0.47 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.14 1qxh h ALA 63 Cb 1.22 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1qxh h ALA 63 CO 0.69 0.35 0.11 0.66 0.00 0.00 0.00 179.25 181.06 1qxh h SER 64 N 0.00 0.71 -0.40 0.00 4.64 -1.99 -1.53 113.55 114.98 1qxh h SER 64 Ca -0.00 -0.23 -0.02 0.00 -0.47 0.00 0.00 61.79 61.06 1qxh h SER 64 Cb 0.50 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.38 1qxh h SER 64 CO 0.04 0.75 0.16 0.58 -0.87 0.00 0.00 176.83 177.49 1qxh h VAL 65 N 0.63 1.19 -0.57 0.95 2.07 -1.90 -2.28 116.25 116.34 1qxh h VAL 65 Ca 0.15 -0.59 -0.04 0.00 0.82 0.00 0.00 66.70 67.03 1qxh h VAL 65 Cb 0.32 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1qxh h VAL 65 CO 0.00 0.22 0.20 -0.09 0.02 0.00 0.00 177.57 177.91 1qxh h ARG 66 N 0.49 0.87 -0.57 1.57 2.43 -1.48 -2.82 114.38 114.87 1qxh h ARG 66 Ca 0.13 -0.18 0.06 0.00 -0.81 0.00 0.00 59.98 59.18 1qxh h ARG 66 Cb 0.18 -0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 29.55 1qxh h ARG 66 CO -0.01 0.78 0.28 -0.22 -1.51 0.00 0.00 179.97 179.29 1qxh h LYS 67 N 0.79 0.52 -0.04 0.20 3.64 -1.13 0.74 116.57 121.30 1qxh h LYS 67 Ca 0.19 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.54 1qxh h LYS 67 Cb 0.25 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 1qxh h LYS 67 CO -0.01 0.35 -0.01 0.35 -2.27 0.00 0.00 179.45 177.86 1qxh h PHE 68 N 0.54 -0.02 -0.61 1.91 3.04 -1.24 0.84 116.94 121.39 1qxh h PHE 68 Ca 0.26 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 62.20 1qxh h PHE 68 Cb 0.19 0.02 -0.03 0.00 2.56 0.00 0.00 35.95 38.69 1qxh h PHE 68 CO -0.11 -0.02 0.32 -0.91 -2.02 0.00 0.00 178.31 175.58 1qxh h ASN 69 N -0.00 0.77 -0.67 0.41 2.35 -1.24 -0.67 115.58 116.52 1qxh h ASN 69 Ca 0.02 -0.10 0.02 0.00 -0.55 0.00 0.00 56.30 55.69 1qxh h ASN 69 Cb 0.03 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.17 1qxh h ASN 69 CO -0.04 0.65 0.43 1.56 -1.65 0.00 0.00 177.43 178.38 1qxh h GLN 70 N 0.82 0.84 -0.30 0.81 4.20 -0.52 -1.87 115.11 119.09 1qxh h GLN 70 Ca 0.21 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.84 1qxh h GLN 70 Cb 0.06 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.64 1qxh h GLN 70 CO -0.03 0.55 0.05 -0.07 -0.67 0.00 0.00 178.83 178.66 1qxh h LEU 71 N 0.86 0.48 -0.96 1.46 3.38 -0.43 -3.02 115.31 117.08 1qxh h LEU 71 Ca 0.26 -0.26 0.04 0.00 0.09 0.00 0.00 57.88 58.01 1qxh h LEU 71 Cb -0.03 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.53 1qxh h LEU 71 CO -0.08 0.61 0.62 0.00 0.09 0.00 0.00 178.44 179.68 1qxh h ALA 72 N 0.88 1.27 0.00 1.53 0.00 -0.84 -2.18 119.26 119.92 1qxh h ALA 72 Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1qxh h ALA 72 Cb 0.34 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1qxh h ALA 72 CO 0.01 0.49 0.00 1.79 0.00 0.00 0.00 179.25 181.53 1qxh h THR 73 N 1.19 0.00 0.00 0.00 1.35 -1.31 -3.16 112.91 110.98 1qxh h THR 73 Ca 0.38 -0.50 0.00 0.00 -0.55 0.00 0.00 66.41 65.75 1qxh h THR 73 Cb 0.02 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 67.85 1qxh h THR 73 CO -0.13 0.00 0.00 -0.33 -0.25 0.00 0.00 175.52 174.81 1qxh h GLU 74 N 0.00 0.00 -6.85 4.72 5.08 -1.26 -3.44 114.58 112.83 1qxh h GLU 74 Ca 0.00 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.87 1qxh h GLU 74 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1qxh h GLU 74 CO 0.00 0.00 0.41 0.42 -1.00 0.00 0.00 179.01 178.84 1qxh s ILE 75 N -3.37 3.82 0.43 3.13 -1.09 -1.20 -4.97 121.20 117.95 1qxh s ILE 75 Ca 0.05 1.65 -0.23 0.00 -2.23 0.00 0.00 60.65 59.89 1qxh s ILE 75 Cb 0.09 -3.98 -0.11 0.00 -1.58 0.00 0.00 42.46 36.87 1qxh s ILE 75 CO 0.55 0.26 0.83 0.47 -1.23 0.00 0.00 174.94 175.82 1qxh n ASP 76 N 0.83 0.42 -4.23 3.58 8.00 -1.26 -3.28 116.55 120.61 1qxh n ASP 76 Ca 0.01 0.97 -0.33 0.00 0.71 0.00 0.00 54.79 56.15 1qxh n ASP 76 Cb 0.47 -1.26 -0.07 0.00 -0.02 0.00 0.00 41.12 40.24 1qxh n ASP 76 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1qxh n ASN 77 N 0.70 -0.07 -4.54 -2.24 5.15 -1.26 -4.72 115.26 108.27 1qxh n ASN 77 Ca 0.11 -1.25 -0.28 0.00 -0.60 0.00 0.00 54.58 52.56 1qxh n ASN 77 Cb 0.40 -1.82 -0.10 0.00 -0.53 0.00 0.00 39.78 37.73 1qxh n ASN 77 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1qxh s THR 78 N -4.19 3.08 -0.04 -0.44 2.01 -1.21 -0.79 115.64 114.06 1qxh s THR 78 Ca 0.08 -1.59 0.01 0.00 0.31 0.00 0.00 61.69 60.50 1qxh s THR 78 Cb -0.04 -2.48 0.02 0.00 0.01 0.00 0.00 72.50 70.01 1qxh s THR 78 CO 0.98 -0.03 -0.02 0.54 -0.69 0.00 0.00 174.62 175.40 1qxh s VAL 79 N -1.49 0.37 -0.22 3.82 0.11 -0.24 -4.88 120.40 117.87 1qxh s VAL 79 Ca 0.22 -0.02 -0.07 0.00 -2.93 0.00 0.00 61.98 59.19 1qxh s VAL 79 Cb -0.09 -0.44 -0.03 0.00 -1.53 0.00 0.00 36.38 34.29 1qxh s VAL 79 CO 0.13 0.19 0.05 -0.69 -3.33 0.00 0.00 175.10 171.46 1qxh s VAL 80 N 1.02 4.33 -0.35 2.04 1.01 0.87 -1.60 120.40 127.73 1qxh s VAL 80 Ca -0.10 -0.18 -0.08 0.00 0.00 0.00 0.00 61.98 61.62 1qxh s VAL 80 Cb -0.14 -2.99 0.03 0.00 0.00 0.00 0.00 36.38 33.29 1qxh s VAL 80 CO -0.01 0.39 0.15 -0.76 0.00 0.00 0.00 175.10 174.87 1qxh s LEU 81 N 1.14 4.47 -0.47 3.92 1.43 0.11 0.53 118.68 129.81 1qxh s LEU 81 Ca 0.04 -1.07 -0.21 0.00 -1.03 0.00 0.00 54.13 51.85 1qxh s LEU 81 Cb -0.14 -1.93 0.03 0.00 0.03 0.00 0.00 46.19 44.18 1qxh s LEU 81 CO 0.03 -0.35 0.71 0.00 0.23 0.00 0.00 176.35 176.97 1qxh s ILE 83 N 3.05 4.50 0.27 0.00 1.01 0.90 -1.57 121.20 129.36 1qxh s ILE 83 Ca 0.24 -0.20 -0.15 0.00 0.00 0.00 0.00 60.65 60.54 1qxh s ILE 83 Cb -0.14 -2.92 0.06 0.00 0.01 0.00 0.00 42.46 39.47 1qxh s ILE 83 CO 0.19 0.59 0.74 -1.54 0.00 0.00 0.00 174.94 174.91 1qxh n SER 84 N 2.04 -1.79 -0.56 3.58 3.41 -1.07 -0.46 113.62 118.76 1qxh n SER 84 Ca -0.18 -2.15 0.12 0.00 -0.26 0.00 0.00 58.87 56.40 1qxh n SER 84 Cb 0.54 2.96 0.16 0.00 -0.26 0.00 0.00 64.21 67.60 1qxh n SER 84 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1qxh n ALA 85 N -1.00 3.08 -1.37 7.33 0.00 -1.26 -1.37 120.51 125.93 1qxh n ALA 85 Ca -0.13 -0.59 -0.35 0.00 0.00 0.00 0.00 53.44 52.37 1qxh n ALA 85 Cb 0.50 -0.91 0.10 0.00 0.00 0.00 0.00 19.45 19.14 1qxh n ALA 85 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1qxh n ASP 86 N 0.22 1.35 -4.83 0.00 8.00 -1.26 -4.43 116.55 115.60 1qxh n ASP 86 Ca 0.12 0.69 -0.32 0.00 0.71 0.00 0.00 54.79 55.99 1qxh n ASP 86 Cb 0.47 -1.51 0.00 0.00 -0.02 0.00 0.00 41.12 40.06 1qxh n ASP 86 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1qxh s LEU 87 N -4.83 3.42 0.42 0.64 1.43 -1.26 -4.52 118.68 113.99 1qxh s LEU 87 Ca 0.77 1.65 0.19 0.00 -1.03 0.00 0.00 54.13 55.70 1qxh s LEU 87 Cb -0.33 -4.51 1.11 0.00 0.03 0.00 0.00 46.19 42.49 1qxh s LEU 87 CO 0.47 -1.00 1.83 -0.65 0.23 0.00 0.00 176.35 177.22 1qxh h PRO 88 N 0.24 0.37 -0.47 1.29 0.11 -1.90 -0.72 132.00 130.92 1qxh h PRO 88 Ca -0.46 -0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.71 1qxh h PRO 88 Cb 1.20 -0.08 -0.07 0.00 0.11 0.00 0.00 31.00 32.16 1qxh h PRO 88 CO 0.59 0.24 0.09 0.74 -0.21 0.00 0.00 178.00 179.45 1qxh h PHE 89 N 0.38 0.14 -0.06 0.65 -1.00 -1.90 -2.60 116.94 112.55 1qxh h PHE 89 Ca 0.51 0.03 -0.19 0.00 2.81 0.00 0.00 57.97 61.13 1qxh h PHE 89 Cb 1.31 0.01 -0.01 0.00 3.61 0.00 0.00 35.95 40.88 1qxh h PHE 89 CO -0.00 -0.01 -0.76 0.00 -1.61 0.00 0.00 178.31 175.93 1qxh h ALA 90 N 1.37 0.58 0.00 2.45 0.00 -1.51 -3.27 119.26 118.88 1qxh h ALA 90 Ca 0.23 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1qxh h ALA 90 Cb 0.31 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1qxh h ALA 90 CO -0.31 0.79 0.09 1.96 0.00 0.00 0.00 179.25 181.78 1qxh h GLN 91 N 0.24 0.00 0.00 0.00 4.20 -1.02 -1.45 115.11 117.07 1qxh h GLN 91 Ca -0.04 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 1qxh h GLN 91 Cb 1.35 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.13 1qxh h GLN 91 CO 0.13 0.00 -0.07 0.66 -0.67 0.00 0.00 178.83 178.88 1qxh h SER 92 N 0.00 0.00 0.28 1.46 4.64 -1.61 -2.34 113.55 115.99 1qxh h SER 92 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1qxh h SER 92 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1qxh h SER 92 CO 0.00 0.07 0.00 0.54 -0.87 0.00 0.00 176.83 176.57 1qxh n ARG 93 N -3.23 0.70 -1.83 4.77 1.74 -0.55 -4.84 116.66 113.42 1qxh n ARG 93 Ca -0.00 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.66 1qxh n ARG 93 Cb 0.29 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.20 1qxh n ARG 93 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 1qxh s PHE 94 N -2.29 2.47 -0.17 -1.55 5.99 -0.88 -4.89 117.98 116.66 1qxh s PHE 94 Ca 0.38 0.24 0.17 0.00 0.00 0.00 0.00 56.93 57.72 1qxh s PHE 94 Cb 0.21 -4.05 0.41 0.00 0.00 0.00 0.00 43.02 39.59 1qxh s PHE 94 CO 0.41 -4.21 1.29 0.00 -0.00 0.00 0.00 175.22 172.72 1qxh n GLY 96 N -0.89 1.12 1.77 0.00 0.00 -1.26 -4.30 105.19 101.63 1qxh n GLY 96 Ca 0.18 -0.58 -0.00 0.00 0.00 0.00 0.00 46.02 45.62 1qxh n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qxh n ALA 97 N 0.95 2.85 -1.74 4.61 0.00 -1.26 -3.89 120.51 122.02 1qxh n ALA 97 Ca 0.18 -1.82 -0.42 0.00 0.00 0.00 0.00 53.44 51.38 1qxh n ALA 97 Cb 0.46 -0.67 -0.03 0.00 0.00 0.00 0.00 19.45 19.21 1qxh n ALA 97 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1qxh s GLU 98 N -0.72 4.13 -0.25 0.00 2.02 -1.26 -2.39 118.70 120.23 1qxh s GLU 98 Ca 0.20 2.59 0.00 0.00 0.02 0.00 0.00 54.97 57.78 1qxh s GLU 98 Cb 0.28 -3.16 0.00 0.00 0.10 0.00 0.00 34.13 31.35 1qxh s GLU 98 CO -0.09 -0.76 0.00 0.41 0.02 0.00 0.00 175.26 174.84 1qxh n GLY 99 N 4.00 0.54 3.20 -1.39 0.00 -1.26 -4.98 105.19 105.30 1qxh n GLY 99 Ca 0.16 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 1qxh n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qxh s LEU 100 N -0.54 5.69 0.59 0.99 1.43 -1.01 -4.97 118.68 120.87 1qxh s LEU 100 Ca 0.00 -2.00 0.29 0.00 -1.03 0.00 0.00 54.13 51.40 1qxh s LEU 100 Cb 0.00 -2.00 1.77 0.00 0.03 0.00 0.00 46.19 45.99 1qxh s LEU 100 CO 0.00 -0.67 2.20 0.78 0.23 0.00 0.00 176.35 178.90 1qxh h ASN 101 N 8.33 0.00 -0.81 2.29 2.35 -1.94 -2.68 115.58 123.13 1qxh h ASN 101 Ca -0.19 0.00 -0.35 0.00 -0.55 0.00 0.00 56.30 55.21 1qxh h ASN 101 Cb 1.06 0.00 -0.21 0.00 0.05 0.00 0.00 38.32 39.22 1qxh h ASN 101 CO 0.84 0.00 0.41 0.59 -1.65 0.00 0.00 177.43 177.62 1qxh n ASN 102 N -3.82 4.01 -4.28 5.81 3.02 -1.26 -4.86 115.26 113.88 1qxh n ASN 102 Ca -0.01 -3.47 -0.34 0.00 -0.03 0.00 0.00 54.58 50.72 1qxh n ASN 102 Cb 0.16 -0.77 -0.14 0.00 -0.61 0.00 0.00 39.78 38.42 1qxh n ASN 102 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1qxh s VAL 103 N -3.17 3.05 -0.04 2.41 1.01 -1.01 -0.09 120.40 122.56 1qxh s VAL 103 Ca 0.55 -0.61 0.07 0.00 0.00 0.00 0.00 61.98 61.98 1qxh s VAL 103 Cb 0.45 -2.36 -0.01 0.00 0.00 0.00 0.00 36.38 34.46 1qxh s VAL 103 CO 0.11 0.46 -0.24 -0.63 0.00 0.00 0.00 175.10 174.80 1qxh s ILE 104 N 1.28 1.93 -0.09 2.22 -1.09 0.19 -4.96 121.20 120.68 1qxh s ILE 104 Ca 0.03 -1.02 -0.16 0.00 -2.23 0.00 0.00 60.65 57.26 1qxh s ILE 104 Cb -0.14 -1.62 -0.05 0.00 -1.58 0.00 0.00 42.46 39.07 1qxh s ILE 104 CO -0.04 0.54 0.43 0.42 -1.23 0.00 0.00 174.94 175.06 1qxh s THR 105 N -0.36 5.16 -0.02 2.92 -4.23 -1.26 -0.51 115.64 117.34 1qxh s THR 105 Ca 0.03 0.85 0.03 0.00 -1.18 0.00 0.00 61.69 61.43 1qxh s THR 105 Cb -0.11 -3.76 -0.00 0.00 1.34 0.00 0.00 72.50 69.97 1qxh s THR 105 CO 0.01 0.41 -0.11 -0.76 -0.54 0.00 0.00 174.62 173.63 1qxh s LEU 106 N 0.10 1.92 0.13 4.79 1.43 -0.61 -4.22 118.68 122.22 1qxh s LEU 106 Ca 0.24 -0.22 0.03 0.00 -1.03 0.00 0.00 54.13 53.14 1qxh s LEU 106 Cb -0.15 -0.63 -0.04 0.00 0.03 0.00 0.00 46.19 45.40 1qxh s LEU 106 CO 0.10 0.12 0.22 -0.55 0.23 0.00 0.00 176.35 176.47 1qxh s SER 107 N -0.07 6.11 0.00 2.29 0.15 0.62 -2.61 113.70 120.20 1qxh s SER 107 Ca 0.01 0.11 0.08 0.00 0.70 0.00 0.00 55.95 56.85 1qxh s SER 107 Cb -0.07 -1.79 0.18 0.00 -1.71 0.00 0.00 66.02 62.63 1qxh s SER 107 CO 0.00 0.09 1.07 1.07 1.20 0.00 0.00 173.24 176.67 1qxh n THR 108 N -0.28 0.74 -0.13 6.45 5.66 -0.47 -1.76 114.28 124.49 1qxh n THR 108 Ca -0.07 -0.87 0.28 0.00 -3.05 0.00 0.00 64.05 60.34 1qxh n THR 108 Cb 0.53 0.67 0.71 0.00 -1.55 0.00 0.00 70.33 70.70 1qxh n THR 108 CO 0.00 0.00 0.00 2.19 -3.05 0.00 0.00 175.07 174.21 1qxh h PHE 109 N 1.46 0.00 0.00 1.09 -5.15 -1.80 -1.22 116.94 111.32 1qxh h PHE 109 Ca 0.00 0.00 -0.02 0.00 -0.20 0.00 0.00 57.97 57.75 1qxh h PHE 109 Cb 0.58 0.00 -0.04 0.00 0.22 0.00 0.00 35.95 36.71 1qxh h PHE 109 CO 0.12 0.00 -0.33 2.89 -2.00 0.00 0.00 178.31 178.99 1qxh n ARG 110 N -3.95 0.92 -2.95 6.09 1.85 -1.26 -4.79 116.66 112.56 1qxh n ARG 110 Ca 0.17 -2.31 -0.14 0.00 -1.00 0.00 0.00 57.85 54.58 1qxh n ARG 110 Cb 0.98 -1.14 0.00 0.00 -1.05 0.00 0.00 32.46 31.26 1qxh n ARG 110 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1qxh n ASN 111 N -0.84 0.75 0.31 2.89 3.02 -0.46 -4.95 115.26 115.98 1qxh n ASN 111 Ca 0.12 -2.92 0.19 0.00 -0.03 0.00 0.00 54.58 51.94 1qxh n ASN 111 Cb 0.72 -0.37 1.04 0.00 -0.61 0.00 0.00 39.78 40.56 1qxh n ASN 111 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1qxh h ALA 112 N 2.96 1.31 0.00 5.41 0.00 -1.87 -1.41 119.26 125.66 1qxh h ALA 112 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1qxh h ALA 112 Cb 1.07 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1qxh h ALA 112 CO 0.45 -0.07 -0.06 1.05 0.00 0.00 0.00 179.25 180.62 1qxh h GLU 113 N 0.00 0.00 0.14 0.00 9.09 -1.92 -2.36 114.58 119.53 1qxh h GLU 113 Ca 0.01 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.42 1qxh h GLU 113 Cb 0.13 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.23 1qxh h GLU 113 CO -0.00 0.06 -0.09 0.35 0.05 0.00 0.00 179.01 179.38 1qxh h PHE 114 N 0.00 -0.24 -0.85 2.06 3.57 -1.60 -0.22 116.94 119.67 1qxh h PHE 114 Ca -0.00 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.55 1qxh h PHE 114 Cb 0.21 0.09 -0.05 0.00 2.79 0.00 0.00 35.95 38.98 1qxh h PHE 114 CO 0.00 -0.15 0.55 -0.07 -2.23 0.00 0.00 178.31 176.42 1qxh h LEU 115 N -0.23 0.85 0.14 0.59 3.38 -1.60 0.13 115.31 118.56 1qxh h LEU 115 Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1qxh h LEU 115 Cb 0.20 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1qxh h LEU 115 CO 0.01 0.56 -0.07 1.56 0.09 0.00 0.00 178.44 180.59 1qxh h GLN 116 N 0.97 -0.18 -0.92 1.13 1.08 -1.40 -1.08 115.11 114.72 1qxh h GLN 116 Ca 0.36 0.01 0.05 0.00 -1.45 0.00 0.00 58.65 57.61 1qxh h GLN 116 Cb 0.16 0.04 -0.06 0.00 -0.05 0.00 0.00 27.48 27.58 1qxh h GLN 116 CO -0.12 0.22 0.60 0.00 -0.95 0.00 0.00 178.83 178.58 1qxh h ALA 117 N 0.13 1.44 -0.10 3.87 0.00 -0.73 -2.27 119.26 121.59 1qxh h ALA 117 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1qxh h ALA 117 Cb 0.48 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1qxh h ALA 117 CO 0.03 0.45 0.00 0.66 0.00 0.00 0.00 179.25 180.40 1qxh n TYR 118 N -4.46 0.12 -3.39 0.00 4.01 0.00 -4.81 117.16 108.63 1qxh n TYR 118 Ca 0.13 -0.06 -0.17 0.00 -0.16 0.00 0.00 57.90 57.64 1qxh n TYR 118 Cb 0.13 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.24 1qxh n TYR 118 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1qxh n GLY 119 N 1.21 -0.59 0.01 2.72 0.00 -0.58 -4.14 105.19 103.82 1qxh n GLY 119 Ca 0.17 0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.44 1qxh n GLY 119 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1qxh n VAL 120 N -3.88 0.11 -2.60 1.61 0.24 -0.51 -4.06 118.33 109.23 1qxh n VAL 120 Ca -0.23 -0.11 -0.43 0.00 -2.04 0.00 0.00 64.34 61.53 1qxh n VAL 120 Cb 0.66 0.94 -0.02 0.00 -1.47 0.00 0.00 33.84 33.94 1qxh n VAL 120 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1qxh s ALA 121 N -0.11 3.34 0.06 2.33 0.00 -1.17 0.67 121.76 126.88 1qxh s ALA 121 Ca 0.00 -0.21 -0.31 0.00 0.00 0.00 0.00 51.96 51.44 1qxh s ALA 121 Cb 0.00 -3.78 -0.08 0.00 0.00 0.00 0.00 23.12 19.26 1qxh s ALA 121 CO 0.00 -1.83 1.66 0.42 0.00 0.00 0.00 175.76 176.01 1qxh s ILE 122 N 4.06 3.07 -2.04 0.00 -1.09 -0.63 -1.83 121.20 122.75 1qxh s ILE 122 Ca 0.47 0.49 0.23 0.00 -2.23 0.00 0.00 60.65 59.61 1qxh s ILE 122 Cb -0.10 -3.31 -0.01 0.00 -1.58 0.00 0.00 42.46 37.45 1qxh s ILE 122 CO 0.23 -0.01 1.09 0.00 -1.23 0.00 0.00 174.94 175.02 1qxh n ALA 123 N 5.75 3.57 -3.61 9.38 0.00 -0.02 -2.76 120.51 132.81 1qxh n ALA 123 Ca 0.16 -0.64 -0.01 0.00 0.00 0.00 0.00 53.44 52.94 1qxh n ALA 123 Cb 0.41 -0.79 0.02 0.00 0.00 0.00 0.00 19.45 19.08 1qxh n ALA 123 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1qxh n ASP 124 N -0.03 -1.73 -0.14 0.00 3.85 -1.26 -4.95 116.55 112.29 1qxh n ASP 124 Ca 0.09 -2.23 0.01 0.00 -0.71 0.00 0.00 54.79 51.96 1qxh n ASP 124 Cb 0.47 2.89 -0.00 0.00 -1.35 0.00 0.00 41.12 43.13 1qxh n ASP 124 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1qxh n GLY 125 N -0.41 -2.12 0.29 6.12 0.00 -1.26 -3.29 105.19 104.53 1qxh n GLY 125 Ca -0.06 -1.45 0.19 0.00 0.00 0.00 0.00 46.02 44.70 1qxh n GLY 125 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qxh h PRO 126 N 0.00 0.00 -0.59 1.61 0.13 -2.01 -2.82 132.00 128.33 1qxh h PRO 126 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1qxh h PRO 126 Cb 0.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.22 1qxh h PRO 126 CO 0.00 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.05 1qxh n LEU 127 N -3.09 3.26 -4.71 1.56 4.32 -1.26 -4.97 117.00 112.12 1qxh n LEU 127 Ca -0.00 -1.64 -0.43 0.00 -0.02 0.00 0.00 56.01 53.93 1qxh n LEU 127 Cb 0.25 -0.42 -0.01 0.00 -1.62 0.00 0.00 43.42 41.62 1qxh n LEU 127 CO 0.25 0.73 0.99 1.17 -1.22 0.00 0.00 177.39 179.31 1qxh n LYS 128 N 1.07 2.25 0.00 3.23 4.81 -1.07 -1.69 118.16 126.76 1qxh n LYS 128 Ca 0.19 0.79 0.00 0.00 -0.87 0.00 0.00 58.31 58.42 1qxh n LYS 128 Cb 0.55 -2.42 0.00 0.00 0.02 0.00 0.00 35.03 33.17 1qxh n LYS 128 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1qxh n GLY 129 N 1.08 2.24 3.99 3.14 0.00 -1.11 -5.01 105.19 109.51 1qxh n GLY 129 Ca 0.06 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.88 1qxh n GLY 129 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qxh s LEU 130 N 0.00 3.53 0.20 0.99 1.43 -0.68 -4.91 118.68 119.24 1qxh s LEU 130 Ca 0.00 -0.19 -0.07 0.00 -1.03 0.00 0.00 54.13 52.84 1qxh s LEU 130 Cb 0.00 -2.78 -0.06 0.00 0.03 0.00 0.00 46.19 43.37 1qxh s LEU 130 CO 0.00 -0.88 0.47 0.00 0.23 0.00 0.00 176.35 176.17 1qxh s ALA 131 N -2.51 3.67 0.77 4.21 0.00 -1.26 -1.60 121.76 125.04 1qxh s ALA 131 Ca 0.55 -0.44 -0.10 0.00 0.00 0.00 0.00 51.96 51.97 1qxh s ALA 131 Cb -0.10 -2.28 0.08 0.00 0.00 0.00 0.00 23.12 20.82 1qxh s ALA 131 CO 0.35 0.54 1.11 0.00 0.00 0.00 0.00 175.76 177.77 1qxh s ALA 132 N -1.79 2.86 -0.29 0.00 0.00 0.21 -2.78 121.76 119.98 1qxh s ALA 132 Ca 0.44 -0.80 -0.25 0.00 0.00 0.00 0.00 51.96 51.35 1qxh s ALA 132 Cb -0.11 -2.79 0.00 0.00 0.00 0.00 0.00 23.12 20.22 1qxh s ALA 132 CO 0.24 -1.55 0.85 0.50 0.00 0.00 0.00 175.76 175.80 1qxh s ARG 133 N -5.45 4.03 0.18 0.00 6.06 -1.26 -4.01 118.95 118.51 1qxh s ARG 133 Ca 0.62 0.75 -0.19 0.00 -2.50 0.00 0.00 55.73 54.40 1qxh s ARG 133 Cb -0.11 -3.71 0.04 0.00 0.06 0.00 0.00 34.95 31.23 1qxh s ARG 133 CO 0.47 -0.68 0.55 0.00 -2.50 0.00 0.00 175.30 173.14 1qxh s ALA 134 N 3.05 -1.17 -0.03 6.12 0.00 -0.57 -1.10 121.76 128.05 1qxh s ALA 134 Ca 0.35 0.01 0.03 0.00 0.00 0.00 0.00 51.96 52.35 1qxh s ALA 134 Cb -0.14 0.84 0.00 0.00 0.00 0.00 0.00 23.12 23.83 1qxh s ALA 134 CO 0.12 -0.80 -0.10 0.08 0.00 0.00 0.00 175.76 175.06 1qxh s VAL 135 N -3.83 0.90 -0.07 0.00 1.01 -0.15 -0.48 120.40 117.78 1qxh s VAL 135 Ca 0.06 -0.41 -0.00 0.00 0.00 0.00 0.00 61.98 61.62 1qxh s VAL 135 Cb -0.01 -0.80 0.03 0.00 0.00 0.00 0.00 36.38 35.59 1qxh s VAL 135 CO -0.06 0.28 -0.02 -0.69 0.00 0.00 0.00 175.10 174.61 1qxh s VAL 136 N 0.26 0.49 -0.17 2.92 1.01 -0.79 -0.33 120.40 123.79 1qxh s VAL 136 Ca -0.05 0.00 -0.05 0.00 0.00 0.00 0.00 61.98 61.89 1qxh s VAL 136 Cb -0.10 -0.59 -0.03 0.00 0.00 0.00 0.00 36.38 35.66 1qxh s VAL 136 CO 0.01 0.26 -0.00 -0.69 0.00 0.00 0.00 175.10 174.67 1qxh s VAL 137 N 1.59 4.17 -0.05 2.92 1.01 0.78 -0.31 120.40 130.50 1qxh s VAL 137 Ca -0.01 -0.26 0.05 0.00 0.00 0.00 0.00 61.98 61.77 1qxh s VAL 137 Cb -0.13 -2.85 -0.01 0.00 0.00 0.00 0.00 36.38 33.39 1qxh s VAL 137 CO -0.04 0.48 -0.21 -0.63 0.00 0.00 0.00 175.10 174.70 1qxh s ILE 138 N 0.44 1.73 0.71 2.22 1.01 0.11 -1.46 121.20 125.96 1qxh s ILE 138 Ca -0.01 -0.89 -0.07 0.00 0.00 0.00 0.00 60.65 59.68 1qxh s ILE 138 Cb -0.14 -1.48 0.15 0.00 0.01 0.00 0.00 42.46 41.01 1qxh s ILE 138 CO 0.02 0.49 0.97 -0.90 0.00 0.00 0.00 174.94 175.52 1qxh n ASP 139 N 3.04 0.62 0.16 3.58 3.85 0.66 0.57 116.55 129.03 1qxh n ASP 139 Ca -0.18 -1.68 0.19 0.00 -0.71 0.00 0.00 54.79 52.41 1qxh n ASP 139 Cb 0.52 -0.69 0.77 0.00 -1.35 0.00 0.00 41.12 40.37 1qxh n ASP 139 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 1qxh h GLU 140 N 0.00 0.00 -0.83 0.11 3.07 -1.88 -0.58 114.58 114.47 1qxh h GLU 140 Ca -0.32 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 57.98 1qxh h GLU 140 Cb 1.01 0.00 -0.32 0.00 -0.84 0.00 0.00 28.75 28.60 1qxh h GLU 140 CO 0.28 0.00 0.17 0.09 -1.40 0.00 0.00 179.01 178.15 1qxh n ASN 141 N -3.51 5.84 -3.22 1.42 5.03 -1.26 -3.27 115.26 116.28 1qxh n ASN 141 Ca 0.05 -3.77 -0.17 0.00 0.87 0.00 0.00 54.58 51.56 1qxh n ASN 141 Cb 0.54 -0.71 -0.02 0.00 -1.02 0.00 0.00 39.78 38.56 1qxh n ASN 141 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1qxh n ASP 142 N -0.89 -2.00 -4.85 6.41 8.00 -0.22 -4.92 116.55 118.08 1qxh n ASP 142 Ca 0.53 -0.17 -0.36 0.00 0.71 0.00 0.00 54.79 55.50 1qxh n ASP 142 Cb 0.88 -1.77 -0.06 0.00 -0.02 0.00 0.00 41.12 40.15 1qxh n ASP 142 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1qxh s ASN 143 N -2.49 6.15 -0.17 -2.24 0.01 -1.26 -0.33 114.94 114.61 1qxh s ASN 143 Ca 0.31 0.37 -0.25 0.00 -0.71 0.00 0.00 52.86 52.57 1qxh s ASN 143 Cb -0.17 -1.92 -0.01 0.00 0.41 0.00 0.00 41.25 39.55 1qxh s ASN 143 CO 0.38 0.36 0.84 -0.69 -1.51 0.00 0.00 177.10 176.48 1qxh s VAL 144 N -1.08 4.88 -0.75 1.60 1.01 0.58 -0.25 120.40 126.39 1qxh s VAL 144 Ca 0.18 1.65 0.10 0.00 0.00 0.00 0.00 61.98 63.91 1qxh s VAL 144 Cb -0.12 -4.14 -0.05 0.00 0.00 0.00 0.00 36.38 32.07 1qxh s VAL 144 CO 0.08 0.03 0.55 2.30 0.00 0.00 0.00 175.10 178.05 1qxh n ILE 145 N 4.72 0.00 -3.60 2.22 -0.00 -0.54 0.12 119.36 122.28 1qxh n ILE 145 Ca 0.05 -0.34 -0.11 0.00 -0.00 0.00 0.00 62.75 62.35 1qxh n ILE 145 Cb 0.49 1.07 -0.06 0.00 -0.00 0.00 0.00 39.64 41.14 1qxh n ILE 145 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 176.55 176.67 1qxh s PHE 146 N -1.61 -0.43 -0.04 4.28 2.19 -1.20 -4.81 117.98 116.36 1qxh s PHE 146 Ca 0.07 0.86 -0.24 0.00 0.33 0.00 0.00 56.93 57.95 1qxh s PHE 146 Cb 0.08 0.41 0.05 0.00 -1.31 0.00 0.00 43.02 42.25 1qxh s PHE 146 CO 0.32 -0.32 0.53 -1.54 1.83 0.00 0.00 175.22 176.04 1qxh s SER 147 N -0.62 -0.48 -0.26 6.13 1.04 -1.26 -0.15 113.70 118.11 1qxh s SER 147 Ca -0.01 0.48 -0.09 0.00 0.48 0.00 0.00 55.95 56.82 1qxh s SER 147 Cb -0.02 0.47 0.11 0.00 0.10 0.00 0.00 66.02 66.68 1qxh s SER 147 CO -0.01 -0.54 0.56 -1.58 0.98 0.00 0.00 173.24 172.66 1qxh s GLN 148 N -1.20 0.48 -0.36 4.02 0.74 0.55 -4.97 119.66 118.91 1qxh s GLN 148 Ca -0.12 1.28 -0.14 0.00 0.05 0.00 0.00 55.36 56.43 1qxh s GLN 148 Cb -0.02 0.63 -0.01 0.00 1.10 0.00 0.00 33.01 34.71 1qxh s GLN 148 CO 0.08 -0.22 0.28 -1.17 -0.55 0.00 0.00 175.29 173.71 1qxh s LEU 149 N 2.72 4.68 -0.07 3.68 2.96 -1.26 -0.97 118.68 130.42 1qxh s LEU 149 Ca -0.05 -0.54 -0.30 0.00 -0.22 0.00 0.00 54.13 53.03 1qxh s LEU 149 Cb -0.12 -2.18 -0.05 0.00 0.50 0.00 0.00 46.19 44.35 1qxh s LEU 149 CO -0.16 -0.32 1.59 -0.69 -1.32 0.00 0.00 176.35 175.45 1qxh s VAL 150 N 1.76 3.68 0.25 1.68 1.01 -0.26 -4.91 120.40 123.61 1qxh s VAL 150 Ca 0.07 0.83 -0.03 0.00 0.00 0.00 0.00 61.98 62.84 1qxh s VAL 150 Cb -0.18 -3.54 0.22 0.00 0.00 0.00 0.00 36.38 32.89 1qxh s VAL 150 CO 0.11 -0.07 1.77 -0.78 0.00 0.00 0.00 175.10 176.12 1qxh h ASP 151 N 9.29 0.49 -3.62 3.32 3.58 -1.93 -3.37 116.42 124.18 1qxh h ASP 151 Ca -0.37 0.08 -0.68 0.00 0.42 0.00 0.00 57.03 56.48 1qxh h ASP 151 Cb 1.17 0.00 -0.25 0.00 1.72 0.00 0.00 39.33 41.97 1qxh h ASP 151 CO 0.95 0.23 -0.60 -0.70 -2.88 0.00 0.00 179.24 176.24 1qxh s GLU 152 N -6.01 3.17 0.32 0.28 2.56 -1.26 -0.32 118.70 117.43 1qxh s GLU 152 Ca -0.12 -0.82 0.09 0.00 0.00 0.00 0.00 54.97 54.12 1qxh s GLU 152 Cb 0.20 -3.43 0.87 0.00 2.00 0.00 0.00 34.13 33.77 1qxh s GLU 152 CO 0.77 -0.44 1.74 0.82 -0.56 0.00 0.00 175.26 177.60 1qxh h ILE 153 N 5.80 0.58 -0.00 -3.70 2.04 -1.49 -0.32 117.51 120.42 1qxh h ILE 153 Ca -0.32 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.33 1qxh h ILE 153 Cb 1.13 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1qxh h ILE 153 CO 0.61 0.11 -0.02 0.35 0.00 0.00 0.00 178.15 179.20 1qxh n THR 154 N -4.83 0.00 -3.51 -0.27 -2.24 -1.26 -4.71 114.28 97.45 1qxh n THR 154 Ca 0.26 -0.02 -0.26 0.00 -2.27 0.00 0.00 64.05 61.76 1qxh n THR 154 Cb 0.71 -0.40 -0.03 0.00 -2.10 0.00 0.00 70.33 68.52 1qxh n THR 154 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1qxh s THR 155 N -2.34 5.13 0.21 4.28 2.01 -0.13 -5.11 115.64 119.68 1qxh s THR 155 Ca 0.36 -0.30 -0.01 0.00 0.31 0.00 0.00 61.69 62.04 1qxh s THR 155 Cb 0.21 -3.78 -0.04 0.00 0.01 0.00 0.00 72.50 68.90 1qxh s THR 155 CO 0.43 -0.34 0.40 -1.61 -0.69 0.00 0.00 174.62 172.82 1qxh s GLU 156 N -3.70 3.54 0.91 4.92 0.41 -1.26 -4.92 118.70 118.60 1qxh s GLU 156 Ca 0.40 -0.30 -0.12 0.00 -0.41 0.00 0.00 54.97 54.55 1qxh s GLU 156 Cb -0.10 -2.82 0.14 0.00 -1.78 0.00 0.00 34.13 29.56 1qxh s GLU 156 CO 0.31 0.39 1.12 -1.25 -0.49 0.00 0.00 175.26 175.34 1qxh s PRO 157 N -3.31 1.12 0.40 0.39 0.04 -1.26 -4.99 135.00 127.40 1qxh s PRO 157 Ca 0.39 0.41 -0.25 0.00 0.04 0.00 0.00 61.00 61.58 1qxh s PRO 157 Cb -0.11 -1.83 -0.08 0.00 0.04 0.00 0.00 34.50 32.52 1qxh s PRO 157 CO 0.29 -2.24 1.21 -0.51 0.04 0.00 0.00 177.00 175.79 1qxh s ASP 158 N -3.86 6.45 0.50 6.66 -0.00 -1.26 -4.91 116.67 120.24 1qxh s ASP 158 Ca 0.64 2.43 0.17 0.00 -0.00 0.00 0.00 52.55 55.79 1qxh s ASP 158 Cb -0.16 -2.62 1.21 0.00 -0.00 0.00 0.00 42.92 41.36 1qxh s ASP 158 CO 0.54 -0.73 2.07 1.88 -0.00 0.00 0.00 175.17 178.93 1qxh h TYR 159 N 2.63 0.13 -0.93 4.23 0.99 -1.99 -2.08 116.97 119.95 1qxh h TYR 159 Ca -0.49 0.00 0.17 0.00 2.00 0.00 0.00 58.73 60.42 1qxh h TYR 159 Cb 1.24 -0.04 -0.08 0.00 1.00 0.00 0.00 36.73 38.85 1qxh h TYR 159 CO 0.54 0.07 0.60 1.49 -0.00 0.00 0.00 178.16 180.86 1qxh h GLU 160 N 0.13 0.61 -0.55 4.88 4.81 -2.00 -1.34 114.58 121.13 1qxh h GLU 160 Ca 0.13 -0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.38 1qxh h GLU 160 Cb 0.35 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.54 1qxh h GLU 160 CO -0.02 0.41 0.27 0.00 -0.73 0.00 0.00 179.01 178.94 1qxh h ALA 161 N 1.61 0.72 -0.02 2.92 0.00 -1.76 -1.62 119.26 121.11 1qxh h ALA 161 Ca 0.49 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.44 1qxh h ALA 161 Cb 0.90 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1qxh h ALA 161 CO -0.24 -0.08 0.07 0.00 0.00 0.00 0.00 179.25 178.99 1qxh h ALA 162 N 1.31 1.19 -0.19 0.00 0.00 -1.39 -2.05 119.26 118.12 1qxh h ALA 162 Ca 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1qxh h ALA 162 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1qxh h ALA 162 CO -0.19 -0.07 0.00 1.28 0.00 0.00 0.00 179.25 180.27 1qxh n LEU 163 N -3.22 2.94 -4.40 0.00 4.77 -0.63 -3.85 117.00 112.62 1qxh n LEU 163 Ca -0.02 -1.28 -0.52 0.00 -0.03 0.00 0.00 56.01 54.15 1qxh n LEU 163 Cb 0.14 -0.12 -0.08 0.00 -2.33 0.00 0.00 43.42 41.03 1qxh n LEU 163 CO 0.21 0.59 1.81 0.00 -1.33 0.00 0.00 177.39 178.66 1qxh n ALA 164 N 1.17 0.84 -0.04 -1.18 0.00 -0.77 -5.08 120.51 115.45 1qxh n ALA 164 Ca 0.14 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1qxh n ALA 164 Cb 0.52 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.52 1qxh n ALA 164 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78