#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1psq s THR 3 N 0.00 2.29 -0.18 2.52 -4.23 -0.11 0.72 115.64 116.65 1psq s THR 3 Ca 0.00 -1.97 -0.06 0.00 -1.18 0.00 0.00 61.69 58.49 1psq s THR 3 Cb 0.00 -2.07 0.09 0.00 1.34 0.00 0.00 72.50 71.85 1psq s THR 3 CO 0.00 -0.09 0.36 0.12 -0.54 0.00 0.00 174.62 174.47 1psq s PHE 4 N -1.58 -0.67 -0.78 3.99 5.36 0.24 -2.03 117.98 122.51 1psq s PHE 4 Ca 0.19 1.22 -0.05 0.00 -0.96 0.00 0.00 56.93 57.33 1psq s PHE 4 Cb -0.08 0.14 0.01 0.00 -0.34 0.00 0.00 43.02 42.74 1psq s PHE 4 CO 0.09 -0.48 0.67 1.28 -1.46 0.00 0.00 175.22 175.32 1psq n LEU 5 N 5.37 -2.80 0.00 6.12 4.77 -1.26 -3.07 117.00 126.14 1psq n LEU 5 Ca -0.07 -0.31 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 1psq n LEU 5 Cb 0.50 -1.95 0.00 0.00 -2.33 0.00 0.00 43.42 39.64 1psq n LEU 5 CO 0.02 0.37 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 1psq n GLY 6 N -1.36 2.76 3.70 -0.72 0.00 -1.26 -5.00 105.19 103.31 1psq n GLY 6 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1psq n GLY 6 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1psq s ASN 7 N -0.97 5.07 0.61 1.61 0.01 -1.18 -5.03 114.94 115.07 1psq s ASN 7 Ca 0.00 -0.16 -0.19 0.00 -0.71 0.00 0.00 52.86 51.80 1psq s ASN 7 Cb 0.00 -1.22 -0.02 0.00 0.41 0.00 0.00 41.25 40.41 1psq s ASN 7 CO 0.00 0.18 1.30 -0.81 -1.51 0.00 0.00 177.10 176.26 1psq n PRO 8 N 0.56 1.30 -4.04 -0.60 -0.04 -1.26 -0.59 135.00 130.32 1psq n PRO 8 Ca -0.11 0.50 -0.09 0.00 -0.04 0.00 0.00 63.50 63.76 1psq n PRO 8 Cb 0.52 -2.53 -0.11 0.00 -0.04 0.00 0.00 33.50 31.34 1psq n PRO 8 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1psq s VAL 9 N -1.36 0.22 0.39 0.52 1.01 0.22 -4.79 120.40 116.62 1psq s VAL 9 Ca 0.79 -1.35 0.04 0.00 0.00 0.00 0.00 61.98 61.46 1psq s VAL 9 Cb -0.39 -0.88 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 1psq s VAL 9 CO 0.43 -0.72 0.06 -0.94 0.00 0.00 0.00 175.10 173.94 1psq s SER 10 N -2.16 2.98 0.30 3.32 1.04 -1.26 -4.18 113.70 113.74 1psq s SER 10 Ca -0.05 -1.52 0.03 0.00 0.48 0.00 0.00 55.95 54.90 1psq s SER 10 Cb -0.02 0.16 -0.04 0.00 0.10 0.00 0.00 66.02 66.22 1psq s SER 10 CO -0.05 -0.73 0.15 -0.36 0.98 0.00 0.00 173.24 173.24 1psq s PHE 11 N -3.13 1.58 -0.15 5.02 0.40 -1.26 -1.89 117.98 118.55 1psq s PHE 11 Ca 0.27 -1.35 0.01 0.00 -0.60 0.00 0.00 56.93 55.26 1psq s PHE 11 Cb 0.06 -0.85 0.00 0.00 0.51 0.00 0.00 43.02 42.74 1psq s PHE 11 CO 0.13 -0.51 -0.18 0.99 0.70 0.00 0.00 175.22 176.35 1psq s THR 12 N -3.64 2.38 0.00 0.64 2.01 -1.26 -4.93 115.64 110.83 1psq s THR 12 Ca 0.36 -0.87 0.00 0.00 0.31 0.00 0.00 61.69 61.49 1psq s THR 12 Cb 0.05 -1.98 0.00 0.00 0.01 0.00 0.00 72.50 70.58 1psq s THR 12 CO 0.17 0.53 0.00 0.61 -0.69 0.00 0.00 174.62 175.24 1psq n GLY 13 N 4.11 -1.72 3.59 4.40 0.00 -1.26 -4.56 105.19 109.75 1psq n GLY 13 Ca -0.20 -1.99 -0.34 0.00 0.00 0.00 0.00 46.02 43.49 1psq n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1psq s LYS 14 N 0.00 3.20 0.39 1.61 1.02 -1.26 -4.98 119.74 119.71 1psq s LYS 14 Ca 0.00 -0.48 -0.20 0.00 0.02 0.00 0.00 55.97 55.31 1psq s LYS 14 Cb 0.00 -2.80 -0.10 0.00 -0.52 0.00 0.00 37.83 34.41 1psq s LYS 14 CO 0.00 0.52 0.89 -0.65 -0.92 0.00 0.00 175.35 175.19 1psq s GLN 15 N -0.40 4.20 0.51 1.68 -0.21 -1.26 -4.57 119.66 119.62 1psq s GLN 15 Ca 0.07 1.02 -0.21 0.00 0.02 0.00 0.00 55.36 56.26 1psq s GLN 15 Cb -0.12 -2.31 -0.06 0.00 1.00 0.00 0.00 33.01 31.51 1psq s GLN 15 CO 0.02 0.05 1.18 -0.51 -2.12 0.00 0.00 175.29 173.91 1psq s LEU 16 N -3.00 3.87 0.19 2.90 1.43 -1.26 -5.05 118.68 117.75 1psq s LEU 16 Ca 0.59 2.33 0.09 0.00 -1.03 0.00 0.00 54.13 56.10 1psq s LEU 16 Cb -0.10 -4.39 -0.04 0.00 0.03 0.00 0.00 46.19 41.68 1psq s LEU 16 CO 0.15 -1.16 -0.19 0.00 0.23 0.00 0.00 176.35 175.38 1psq s GLN 17 N -2.97 1.38 0.19 1.70 -2.07 -1.26 -5.05 119.66 111.57 1psq s GLN 17 Ca 0.69 -1.51 -0.31 0.00 -1.82 0.00 0.00 55.36 52.42 1psq s GLN 17 Cb -0.29 -1.43 -0.16 0.00 -1.09 0.00 0.00 33.01 30.04 1psq s GLN 17 CO 0.33 0.28 0.87 0.28 -1.32 0.00 0.00 175.29 175.73 1psq n VAL 18 N 0.04 1.50 0.00 3.63 0.31 -1.26 -0.68 118.33 121.87 1psq n VAL 18 Ca -0.11 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 63.84 1psq n VAL 18 Cb 0.58 -0.47 0.00 0.00 -0.91 0.00 0.00 33.84 33.04 1psq n VAL 18 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1psq n GLY 19 N 1.75 3.11 3.84 2.92 0.00 0.21 -4.99 105.19 112.02 1psq n GLY 19 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 1psq n GLY 19 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1psq s ASP 20 N 0.24 5.51 -0.04 1.61 1.01 0.14 -4.69 116.67 120.45 1psq s ASP 20 Ca 0.00 1.48 -0.18 0.00 0.71 0.00 0.00 52.55 54.56 1psq s ASP 20 Cb 0.00 -2.38 -0.05 0.00 1.01 0.00 0.00 42.92 41.50 1psq s ASP 20 CO 0.00 -1.34 0.49 -0.75 0.21 0.00 0.00 175.17 173.78 1psq s LYS 21 N -5.13 4.20 0.16 8.23 2.47 -1.26 -0.72 119.74 127.70 1psq s LYS 21 Ca 0.58 0.52 -0.31 0.00 -1.56 0.00 0.00 55.97 55.19 1psq s LYS 21 Cb -0.13 -3.34 -0.09 0.00 -1.46 0.00 0.00 37.83 32.81 1psq s LYS 21 CO 0.54 0.40 1.48 0.00 0.16 0.00 0.00 175.35 177.93 1psq s ALA 22 N -0.19 3.69 0.50 3.13 0.00 -0.35 -4.93 121.76 123.61 1psq s ALA 22 Ca 0.26 1.27 -0.21 0.00 0.00 0.00 0.00 51.96 53.28 1psq s ALA 22 Cb -0.17 -3.58 -0.07 0.00 0.00 0.00 0.00 23.12 19.30 1psq s ALA 22 CO 0.13 -0.71 1.10 -0.51 0.00 0.00 0.00 175.76 175.77 1psq s LEU 23 N 0.93 3.85 1.20 0.00 1.43 -1.26 -5.02 118.68 119.81 1psq s LEU 23 Ca 0.66 2.10 -0.19 0.00 -1.03 0.00 0.00 54.13 55.67 1psq s LEU 23 Cb -0.41 -4.50 0.29 0.00 0.03 0.00 0.00 46.19 41.60 1psq s LEU 23 CO 0.32 -0.97 1.11 -0.62 0.23 0.00 0.00 176.35 176.43 1psq s ASP 24 N -1.77 0.94 -0.09 2.29 -1.08 -1.26 -4.95 116.67 110.75 1psq s ASP 24 Ca 0.68 0.62 -0.32 0.00 -0.52 0.00 0.00 52.55 53.01 1psq s ASP 24 Cb -0.22 -0.85 0.12 0.00 -1.46 0.00 0.00 42.92 40.51 1psq s ASP 24 CO 0.25 -4.11 1.09 0.72 0.52 0.00 0.00 175.17 173.65 1psq s PHE 25 N -3.02 -0.19 -0.37 -5.34 -0.12 -1.26 -4.96 117.98 102.71 1psq s PHE 25 Ca 0.71 0.09 0.00 0.00 -0.05 0.00 0.00 56.93 57.69 1psq s PHE 25 Cb -0.09 0.53 0.12 0.00 -0.63 0.00 0.00 43.02 42.95 1psq s PHE 25 CO 0.56 -0.37 0.18 -1.54 -0.05 0.00 0.00 175.22 174.00 1psq s SER 26 N -2.42 3.65 0.16 1.98 1.04 -1.25 -3.91 113.70 112.96 1psq s SER 26 Ca 0.09 -2.15 0.05 0.00 0.48 0.00 0.00 55.95 54.41 1psq s SER 26 Cb -0.00 -0.83 -0.04 0.00 0.10 0.00 0.00 66.02 65.25 1psq s SER 26 CO -0.06 -0.33 0.15 -0.76 0.98 0.00 0.00 173.24 173.22 1psq s LEU 27 N 0.99 3.84 -0.18 2.42 1.43 -0.53 -4.87 118.68 121.79 1psq s LEU 27 Ca 0.15 -0.11 -0.19 0.00 -1.03 0.00 0.00 54.13 52.95 1psq s LEU 27 Cb -0.21 -2.45 -0.03 0.00 0.03 0.00 0.00 46.19 43.53 1psq s LEU 27 CO -0.10 0.07 0.54 -0.89 0.23 0.00 0.00 176.35 176.20 1psq s THR 28 N -1.75 5.10 0.85 5.49 2.01 -1.01 -0.39 115.64 125.95 1psq s THR 28 Ca 0.31 1.02 -0.07 0.00 0.31 0.00 0.00 61.69 63.26 1psq s THR 28 Cb -0.10 -3.87 0.18 0.00 0.01 0.00 0.00 72.50 68.72 1psq s THR 28 CO 0.24 0.20 1.16 0.28 -0.69 0.00 0.00 174.62 175.80 1psq s THR 29 N 1.45 2.02 0.37 -0.82 -1.32 0.76 -0.93 115.64 117.18 1psq s THR 29 Ca 0.26 -0.35 0.38 0.00 -1.21 0.00 0.00 61.69 60.77 1psq s THR 29 Cb -0.16 -2.67 0.39 0.00 -1.51 0.00 0.00 72.50 68.56 1psq s THR 29 CO 0.10 0.00 2.16 0.71 -2.21 0.00 0.00 174.62 175.39 1psq h THR 30 N -1.08 0.00 -0.63 5.08 1.35 -1.88 -0.31 112.91 115.45 1psq h THR 30 Ca -0.39 -0.11 0.00 0.00 -0.55 0.00 0.00 66.41 65.37 1psq h THR 30 Cb 1.24 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 1psq h THR 30 CO 0.36 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 174.73 1psq n ASP 31 N -2.91 3.37 0.00 5.36 5.68 -1.26 -4.86 116.55 121.93 1psq n ASP 31 Ca -0.02 -2.00 0.00 0.00 -0.50 0.00 0.00 54.79 52.27 1psq n ASP 31 Cb 0.12 -0.42 0.00 0.00 -1.14 0.00 0.00 41.12 39.68 1psq n ASP 31 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1psq n LEU 32 N 1.35 0.18 -4.95 -2.12 4.77 -0.13 -5.03 117.00 111.07 1psq n LEU 32 Ca 0.21 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.92 1psq n LEU 32 Cb 0.53 -0.43 0.13 0.00 -2.33 0.00 0.00 43.42 41.32 1psq n LEU 32 CO 0.14 -0.11 0.73 -0.94 -1.33 0.00 0.00 177.39 175.88 1psq s SER 33 N -2.59 3.89 -0.09 -1.43 1.04 -1.26 -4.71 113.70 108.56 1psq s SER 33 Ca 0.00 0.16 0.01 0.00 0.48 0.00 0.00 55.95 56.61 1psq s SER 33 Cb 0.00 -0.45 -0.02 0.00 0.10 0.00 0.00 66.02 65.65 1psq s SER 33 CO 0.00 -2.21 -0.12 -0.54 0.98 0.00 0.00 173.24 171.35 1psq s LYS 34 N -5.53 2.93 0.15 4.02 1.02 -1.26 -0.17 119.74 120.90 1psq s LYS 34 Ca 0.68 -0.66 0.11 0.00 0.02 0.00 0.00 55.97 56.12 1psq s LYS 34 Cb -0.06 -2.53 -0.04 0.00 -0.52 0.00 0.00 37.83 34.67 1psq s LYS 34 CO 0.49 0.46 -0.26 0.15 -0.92 0.00 0.00 175.35 175.27 1psq s LYS 35 N -0.28 1.45 0.36 1.68 -0.14 0.48 -4.93 119.74 118.35 1psq s LYS 35 Ca 0.03 -1.40 0.06 0.00 -1.36 0.00 0.00 55.97 53.29 1psq s LYS 35 Cb -0.13 -1.89 -0.03 0.00 -1.68 0.00 0.00 37.83 34.10 1psq s LYS 35 CO 0.03 0.44 0.21 -1.54 -0.76 0.00 0.00 175.35 173.73 1psq s SER 36 N -2.25 2.11 0.23 2.83 1.04 -1.25 -1.45 113.70 114.96 1psq s SER 36 Ca 0.16 -1.72 -0.06 0.00 0.48 0.00 0.00 55.95 54.81 1psq s SER 36 Cb -0.09 0.55 0.34 0.00 0.10 0.00 0.00 66.02 66.91 1psq s SER 36 CO 0.07 -1.01 1.82 0.25 0.98 0.00 0.00 173.24 175.35 1psq h LEU 37 N 2.00 0.69 -1.97 2.42 5.85 -1.93 -0.84 115.31 121.53 1psq h LEU 37 Ca -0.29 0.03 0.24 0.00 0.84 0.00 0.00 57.88 58.70 1psq h LEU 37 Cb 1.25 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 42.14 1psq h LEU 37 CO 0.45 0.42 0.60 0.00 -0.34 0.00 0.00 178.44 179.56 1psq h ALA 38 N 1.41 2.75 0.00 1.25 0.00 -1.96 -1.19 119.26 121.52 1psq h ALA 38 Ca 0.36 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1psq h ALA 38 Cb 0.26 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1psq h ALA 38 CO -0.21 -0.99 0.00 -0.25 0.00 0.00 0.00 179.25 177.80 1psq n ASP 39 N -4.30 0.00 -1.51 0.00 8.00 -0.32 -2.73 116.55 115.68 1psq n ASP 39 Ca 0.17 0.23 -0.02 0.00 0.71 0.00 0.00 54.79 55.88 1psq n ASP 39 Cb 0.88 -0.38 0.09 0.00 -0.02 0.00 0.00 41.12 41.70 1psq n ASP 39 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1psq n PHE 40 N -1.38 0.83 -1.74 1.24 3.01 -0.45 -5.01 117.46 113.97 1psq n PHE 40 Ca 0.07 -1.51 -0.42 0.00 1.01 0.00 0.00 57.45 56.59 1psq n PHE 40 Cb 0.17 -0.24 -0.01 0.00 -0.01 0.00 0.00 39.48 39.39 1psq n PHE 40 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1psq n ASP 41 N -0.53 3.53 -0.69 4.37 2.03 -1.11 -2.92 116.55 121.22 1psq n ASP 41 Ca 0.19 1.18 -0.08 0.00 0.52 0.00 0.00 54.79 56.60 1psq n ASP 41 Cb 0.89 -1.56 -0.03 0.00 -0.72 0.00 0.00 41.12 39.70 1psq n ASP 41 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1psq n GLY 42 N 1.51 0.79 3.26 0.27 0.00 -1.26 -5.02 105.19 104.73 1psq n GLY 42 Ca 0.06 -0.65 -0.15 0.00 0.00 0.00 0.00 46.02 45.29 1psq n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1psq s LYS 43 N -3.08 1.12 0.32 1.61 1.02 -1.15 -5.01 119.74 114.57 1psq s LYS 43 Ca 0.00 -1.50 -0.17 0.00 0.02 0.00 0.00 55.97 54.32 1psq s LYS 43 Cb 0.00 -0.56 -0.09 0.00 -0.52 0.00 0.00 37.83 36.65 1psq s LYS 43 CO 0.00 0.01 0.77 0.15 -0.92 0.00 0.00 175.35 175.36 1psq s LYS 44 N -3.80 4.09 -0.01 1.68 3.01 0.16 -4.29 119.74 120.59 1psq s LYS 44 Ca 0.20 0.79 0.02 0.00 -1.01 0.00 0.00 55.97 55.97 1psq s LYS 44 Cb 0.04 -2.47 -0.00 0.00 -1.01 0.00 0.00 37.83 34.38 1psq s LYS 44 CO 0.02 0.17 -0.07 0.15 0.51 0.00 0.00 175.35 176.13 1psq s LYS 45 N -2.83 0.62 -0.53 1.68 1.02 -1.16 -0.07 119.74 118.46 1psq s LYS 45 Ca 0.53 -0.25 -0.03 0.00 0.02 0.00 0.00 55.97 56.24 1psq s LYS 45 Cb -0.11 -0.60 0.14 0.00 -0.52 0.00 0.00 37.83 36.74 1psq s LYS 45 CO 0.17 0.14 0.34 0.08 -0.92 0.00 0.00 175.35 175.17 1psq s VAL 46 N -0.10 3.54 -0.49 3.17 1.01 0.13 -0.76 120.40 126.90 1psq s VAL 46 Ca 0.02 -2.56 -0.28 0.00 0.00 0.00 0.00 61.98 59.15 1psq s VAL 46 Cb -0.04 -3.36 0.02 0.00 0.00 0.00 0.00 36.38 33.00 1psq s VAL 46 CO -0.00 -0.80 1.34 -0.76 0.00 0.00 0.00 175.10 174.88 1psq s LEU 47 N 0.46 3.52 -0.28 3.92 1.43 0.30 -1.81 118.68 126.23 1psq s LEU 47 Ca 0.13 0.53 -0.03 0.00 -1.03 0.00 0.00 54.13 53.73 1psq s LEU 47 Cb -0.21 -3.36 0.03 0.00 0.03 0.00 0.00 46.19 42.68 1psq s LEU 47 CO -0.04 -1.49 -0.00 -0.94 0.23 0.00 0.00 176.35 174.10 1psq s SER 48 N 3.75 4.71 -0.17 2.29 1.04 -0.83 0.86 113.70 125.36 1psq s SER 48 Ca 0.54 -0.98 -0.08 0.00 0.48 0.00 0.00 55.95 55.91 1psq s SER 48 Cb -0.11 -1.73 -0.04 0.00 0.10 0.00 0.00 66.02 64.23 1psq s SER 48 CO 0.30 -0.19 0.11 -0.69 0.98 0.00 0.00 173.24 173.74 1psq s VAL 49 N 1.34 5.26 0.10 5.02 1.01 -0.33 -1.60 120.40 131.19 1psq s VAL 49 Ca -0.01 0.13 0.03 0.00 0.00 0.00 0.00 61.98 62.13 1psq s VAL 49 Cb -0.18 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.81 1psq s VAL 49 CO -0.02 0.50 -0.10 0.68 0.00 0.00 0.00 175.10 176.17 1psq s VAL 50 N -0.04 0.92 0.10 2.92 -7.23 -0.53 -2.25 120.40 114.29 1psq s VAL 50 Ca 0.09 -1.70 -0.20 0.00 -1.81 0.00 0.00 61.98 58.36 1psq s VAL 50 Cb -0.12 -1.43 -0.08 0.00 0.56 0.00 0.00 36.38 35.32 1psq s VAL 50 CO 0.00 -0.61 1.69 -0.65 -0.31 0.00 0.00 175.10 175.21 1psq h PRO 51 N 3.44 0.28 -0.70 4.82 0.11 -1.71 -3.39 132.00 134.85 1psq h PRO 51 Ca -0.37 -0.04 0.21 0.00 0.11 0.00 0.00 66.00 65.91 1psq h PRO 51 Cb 1.19 -0.05 -0.28 0.00 0.11 0.00 0.00 31.00 31.97 1psq h PRO 51 CO 0.55 0.29 0.48 0.45 -0.21 0.00 0.00 178.00 179.56 1psq s SER 52 N -5.51 -0.25 0.16 -2.05 0.15 -1.26 -4.42 113.70 100.52 1psq s SER 52 Ca -0.13 0.36 0.12 0.00 0.70 0.00 0.00 55.95 56.99 1psq s SER 52 Cb 0.08 1.23 0.62 0.00 -1.71 0.00 0.00 66.02 66.24 1psq s SER 52 CO 0.70 -0.05 1.36 2.30 1.20 0.00 0.00 173.24 178.75 1psq n ILE 53 N 4.27 1.46 0.42 6.45 -6.64 -1.26 -1.47 119.36 122.59 1psq n ILE 53 Ca -0.11 0.59 -0.02 0.00 -1.77 0.00 0.00 62.75 61.45 1psq n ILE 53 Cb 0.55 -1.58 0.09 0.00 -1.44 0.00 0.00 39.64 37.26 1psq n ILE 53 CO 0.00 0.00 0.00 0.47 -1.77 0.00 0.00 176.55 175.25 1psq n ASP 54 N -1.89 2.72 -4.18 7.28 8.00 -1.26 -4.23 116.55 123.00 1psq n ASP 54 Ca -0.00 -2.35 -0.17 0.00 0.71 0.00 0.00 54.79 52.98 1psq n ASP 54 Cb 0.03 -0.57 -0.12 0.00 -0.02 0.00 0.00 41.12 40.44 1psq n ASP 54 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1psq s THR 55 N -1.27 1.09 0.01 -3.53 -4.23 -0.54 -5.07 115.64 102.10 1psq s THR 55 Ca 0.16 -1.44 -0.03 0.00 -1.18 0.00 0.00 61.69 59.20 1psq s THR 55 Cb 0.13 -1.19 -0.01 0.00 1.34 0.00 0.00 72.50 72.77 1psq s THR 55 CO 0.04 -0.34 1.05 1.23 -0.54 0.00 0.00 174.62 176.06 1psq h GLY 56 N 4.01 -2.26 0.58 3.99 0.00 -1.87 -1.51 103.07 106.01 1psq h GLY 56 Ca -0.40 1.00 0.05 0.00 0.00 0.00 0.00 47.33 47.99 1psq h GLY 56 CO 0.45 -0.83 0.06 -2.22 0.00 0.00 0.00 176.54 173.99 1psq h ILE 57 N -0.02 0.82 -0.83 2.60 2.04 -1.97 -1.92 117.51 118.24 1psq h ILE 57 Ca 0.01 -0.06 0.09 0.00 1.00 0.00 0.00 64.86 65.90 1psq h ILE 57 Cb 0.04 0.63 -0.07 0.00 -0.74 0.00 0.00 36.82 36.69 1psq h ILE 57 CO -0.07 0.03 0.49 0.00 0.00 0.00 0.00 178.15 178.60 1psq h SER 59 N 0.84 -0.34 -0.62 0.00 0.87 -0.77 -1.80 113.55 111.74 1psq h SER 59 Ca 0.39 -0.05 0.08 0.00 -1.23 0.00 0.00 61.79 60.98 1psq h SER 59 Cb 0.31 0.09 -0.06 0.00 -0.44 0.00 0.00 62.40 62.29 1psq h SER 59 CO -0.23 -0.17 0.28 0.74 -0.53 0.00 0.00 176.83 176.93 1psq h THR 60 N -0.49 0.85 -0.37 2.23 2.02 -0.88 -0.78 112.91 115.50 1psq h THR 60 Ca -0.04 -0.17 0.01 0.00 0.77 0.00 0.00 66.41 66.97 1psq h THR 60 Cb 0.37 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 67.06 1psq h THR 60 CO 0.07 0.09 0.24 -0.61 0.37 0.00 0.00 175.52 175.68 1psq h GLN 61 N 0.51 0.48 -0.25 6.66 4.15 -0.73 0.25 115.11 126.17 1psq h GLN 61 Ca 0.30 -0.03 -0.09 0.00 0.77 0.00 0.00 58.65 59.60 1psq h GLN 61 Cb 0.30 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.87 1psq h GLN 61 CO -0.25 0.32 -0.25 1.15 -1.93 0.00 0.00 178.83 177.87 1psq h THR 62 N 0.49 1.26 -0.08 2.39 2.02 -0.96 -2.39 112.91 115.64 1psq h THR 62 Ca 0.14 -1.26 -0.18 0.00 0.77 0.00 0.00 66.41 65.89 1psq h THR 62 Cb -0.04 1.34 0.01 0.00 -1.74 0.00 0.00 68.15 67.72 1psq h THR 62 CO -0.04 0.40 -0.65 -0.09 0.37 0.00 0.00 175.52 175.51 1psq h ARG 63 N 0.43 0.59 0.93 6.66 2.43 -0.81 -3.06 114.38 121.55 1psq h ARG 63 Ca 0.06 -0.52 -0.05 0.00 -0.81 0.00 0.00 59.98 58.67 1psq h ARG 63 Cb 0.66 0.12 0.01 0.00 -0.42 0.00 0.00 29.97 30.34 1psq h ARG 63 CO 0.05 1.14 -0.45 -0.09 -1.51 0.00 0.00 179.97 179.11 1psq h ARG 64 N 0.21 -1.21 -0.82 0.20 9.65 -0.33 -1.98 114.38 120.10 1psq h ARG 64 Ca -0.06 0.08 0.11 0.00 -1.10 0.00 0.00 59.98 59.01 1psq h ARG 64 Cb 1.30 0.27 -0.08 0.00 -1.39 0.00 0.00 29.97 30.08 1psq h ARG 64 CO 0.13 -0.81 0.45 0.74 2.80 0.00 0.00 179.97 183.28 1psq h PHE 65 N -1.29 0.80 -0.47 2.20 0.04 -1.58 0.11 116.94 116.75 1psq h PHE 65 Ca -0.13 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.67 1psq h PHE 65 Cb 0.96 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 38.85 1psq h PHE 65 CO 0.01 0.29 0.28 -0.91 -0.60 0.00 0.00 178.31 177.38 1psq h ASN 66 N 0.72 0.57 0.32 2.17 2.35 -1.48 -0.84 115.58 119.39 1psq h ASN 66 Ca 0.41 -0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 56.08 1psq h ASN 66 Cb 0.45 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.68 1psq h ASN 66 CO -0.28 0.47 -0.15 -0.33 -1.65 0.00 0.00 177.43 175.48 1psq h GLU 67 N 0.63 -0.41 0.18 0.81 5.08 -0.66 -2.86 114.58 117.36 1psq h GLU 67 Ca 0.17 0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.57 1psq h GLU 67 Cb 0.01 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.31 1psq h GLU 67 CO -0.03 -0.09 -0.45 0.93 -1.00 0.00 0.00 179.01 178.37 1psq h GLU 68 N -0.95 -0.70 -0.95 2.33 4.39 -0.84 -1.83 114.58 116.03 1psq h GLU 68 Ca -0.04 0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1psq h GLU 68 Cb 0.51 0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.31 1psq h GLU 68 CO 0.07 -0.47 0.01 1.28 -1.16 0.00 0.00 179.01 178.75 1psq n LEU 69 N -5.48 1.91 -4.77 1.33 4.77 -0.32 -4.87 117.00 109.56 1psq n LEU 69 Ca -0.08 -0.96 -0.39 0.00 -0.03 0.00 0.00 56.01 54.55 1psq n LEU 69 Cb 0.40 -0.53 -0.05 0.00 -2.33 0.00 0.00 43.42 40.90 1psq n LEU 69 CO 0.20 0.34 0.69 0.00 -1.33 0.00 0.00 177.39 177.29 1psq s ALA 70 N -1.12 3.27 0.00 -1.18 0.00 -0.69 -3.38 121.76 118.66 1psq s ALA 70 Ca 0.07 0.66 0.00 0.00 0.00 0.00 0.00 51.96 52.69 1psq s ALA 70 Cb 0.06 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.94 1psq s ALA 70 CO 0.02 0.06 0.00 0.41 0.00 0.00 0.00 175.76 176.25 1psq n GLY 71 N 0.95 2.56 3.35 0.00 0.00 -1.26 -4.95 105.19 105.84 1psq n GLY 71 Ca 0.01 -0.01 -0.58 0.00 0.00 0.00 0.00 46.02 45.43 1psq n GLY 71 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1psq n LEU 72 N 0.00 1.16 -4.70 0.99 4.77 -1.22 -4.77 117.00 113.23 1psq n LEU 72 Ca 0.00 0.67 -0.43 0.00 -0.03 0.00 0.00 56.01 56.22 1psq n LEU 72 Cb 0.00 -0.99 -0.01 0.00 -2.33 0.00 0.00 43.42 40.09 1psq n LEU 72 CO 0.00 -0.75 0.99 -0.67 -1.33 0.00 0.00 177.39 175.62 1psq n ASP 73 N 7.73 2.95 -3.92 -1.43 -0.08 -1.26 -2.56 116.55 117.97 1psq n ASP 73 Ca 0.49 1.18 -0.30 0.00 -1.51 0.00 0.00 54.79 54.65 1psq n ASP 73 Cb 0.03 -1.49 0.02 0.00 2.34 0.00 0.00 41.12 42.02 1psq n ASP 73 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1psq n ASN 74 N 1.29 -4.68 -3.74 1.67 4.05 -1.26 -4.90 115.26 107.69 1psq n ASN 74 Ca 0.07 -0.79 -0.15 0.00 0.45 0.00 0.00 54.58 54.16 1psq n ASN 74 Cb 0.35 -3.85 -0.16 0.00 1.23 0.00 0.00 39.78 37.35 1psq n ASN 74 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 1psq s THR 75 N -3.31 -0.08 -0.04 -0.44 2.01 -1.06 0.37 115.64 113.09 1psq s THR 75 Ca 0.65 0.24 0.06 0.00 0.31 0.00 0.00 61.69 62.96 1psq s THR 75 Cb -0.33 -0.16 -0.01 0.00 0.01 0.00 0.00 72.50 72.01 1psq s THR 75 CO 0.83 0.10 -0.22 0.68 -0.69 0.00 0.00 174.62 175.33 1psq s VAL 76 N 1.36 1.76 -0.47 3.82 -7.23 0.90 -4.82 120.40 115.73 1psq s VAL 76 Ca -0.06 -0.93 -0.13 0.00 -1.81 0.00 0.00 61.98 59.05 1psq s VAL 76 Cb -0.12 -1.48 0.08 0.00 0.56 0.00 0.00 36.38 35.42 1psq s VAL 76 CO -0.04 0.50 0.37 0.54 -0.31 0.00 0.00 175.10 176.15 1psq s VAL 77 N -0.28 4.89 -0.35 1.32 0.11 -1.26 0.19 120.40 125.02 1psq s VAL 77 Ca 0.02 -1.25 -0.19 0.00 -2.93 0.00 0.00 61.98 57.63 1psq s VAL 77 Cb -0.11 -3.99 -0.00 0.00 -1.53 0.00 0.00 36.38 30.76 1psq s VAL 77 CO 0.01 -0.61 0.57 -0.76 -3.33 0.00 0.00 175.10 170.98 1psq s LEU 78 N 1.56 4.32 -0.17 2.54 1.43 -0.75 -4.35 118.68 123.25 1psq s LEU 78 Ca 0.04 0.03 -0.17 0.00 -1.03 0.00 0.00 54.13 53.00 1psq s LEU 78 Cb -0.25 -2.67 -0.04 0.00 0.03 0.00 0.00 46.19 43.27 1psq s LEU 78 CO 0.04 -0.53 0.44 -0.89 0.23 0.00 0.00 176.35 175.64 1psq s THR 79 N 2.53 5.18 -0.12 5.49 2.01 -0.66 -1.96 115.64 128.12 1psq s THR 79 Ca 0.21 0.82 0.03 0.00 0.31 0.00 0.00 61.69 63.06 1psq s THR 79 Cb -0.15 -3.77 0.01 0.00 0.01 0.00 0.00 72.50 68.59 1psq s THR 79 CO 0.14 0.27 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.43 1psq s VAL 80 N 1.11 1.95 0.00 3.82 1.01 -0.63 -0.05 120.40 127.61 1psq s VAL 80 Ca 0.22 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.27 1psq s VAL 80 Cb -0.15 -1.72 0.00 0.00 0.00 0.00 0.00 36.38 34.52 1psq s VAL 80 CO 0.09 0.53 0.00 -1.54 0.00 0.00 0.00 175.10 174.18 1psq n SER 81 N 3.86 0.00 -1.04 3.32 3.41 -0.88 -1.45 113.62 120.84 1psq n SER 81 Ca -0.20 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 1psq n SER 81 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 1psq n SER 81 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1psq n ASP 83 N 0.00 -5.89 -4.73 4.04 9.92 -1.26 -0.92 116.55 117.71 1psq n ASP 83 Ca 0.00 0.92 -0.33 0.00 -0.53 0.00 0.00 54.79 54.85 1psq n ASP 83 Cb 0.00 -2.86 0.09 0.00 -0.64 0.00 0.00 41.12 37.71 1psq n ASP 83 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1psq s LEU 84 N -3.36 3.22 0.29 0.64 1.43 -1.26 -4.56 118.68 115.08 1psq s LEU 84 Ca 0.00 2.17 0.01 0.00 -1.03 0.00 0.00 54.13 55.28 1psq s LEU 84 Cb 0.00 -4.57 0.55 0.00 0.03 0.00 0.00 46.19 42.20 1psq s LEU 84 CO 0.00 -2.22 1.87 -0.65 0.23 0.00 0.00 176.35 175.58 1psq h PRO 85 N -0.59 0.98 -0.94 1.29 0.11 -1.88 -1.22 132.00 129.75 1psq h PRO 85 Ca -0.46 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 65.60 1psq h PRO 85 Cb 1.27 -0.22 -0.05 0.00 0.11 0.00 0.00 31.00 32.11 1psq h PRO 85 CO 0.50 0.65 0.62 0.74 -0.21 0.00 0.00 178.00 180.29 1psq h PHE 86 N 1.01 1.17 -0.32 0.65 0.04 -1.90 0.26 116.94 117.86 1psq h PHE 86 Ca 0.45 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 61.20 1psq h PHE 86 Cb 0.37 -0.40 -0.01 0.00 2.20 0.00 0.00 35.95 38.11 1psq h PHE 86 CO -0.00 0.74 0.01 0.00 -0.60 0.00 0.00 178.31 178.46 1psq h ALA 87 N 1.42 0.42 -0.58 2.45 0.00 -1.59 -0.58 119.26 120.80 1psq h ALA 87 Ca 0.35 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1psq h ALA 87 Cb -0.14 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1psq h ALA 87 CO -0.08 0.16 0.17 1.96 0.00 0.00 0.00 179.25 181.47 1psq h GLN 88 N 0.35 0.91 -0.39 0.00 4.20 -0.77 -1.03 115.11 118.39 1psq h GLN 88 Ca 0.09 -0.20 -0.05 0.00 0.06 0.00 0.00 58.65 58.55 1psq h GLN 88 Cb 0.42 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 1psq h GLN 88 CO 0.01 0.82 0.04 -0.22 -0.67 0.00 0.00 178.83 178.81 1psq h LYS 89 N 0.82 0.66 -0.33 1.46 3.64 -0.37 -1.33 116.57 121.13 1psq h LYS 89 Ca 0.19 -0.19 0.02 0.00 -1.27 0.00 0.00 60.65 59.39 1psq h LYS 89 Cb 0.30 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 1psq h LYS 89 CO -0.00 0.73 0.18 -0.09 -2.27 0.00 0.00 179.45 177.99 1psq h ARG 90 N 0.49 0.35 -0.48 1.90 2.43 -0.98 -2.13 114.38 115.96 1psq h ARG 90 Ca 0.11 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.29 1psq h ARG 90 Cb 0.41 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 29.84 1psq h ARG 90 CO 0.01 0.23 0.27 2.35 -1.51 0.00 0.00 179.97 181.32 1psq h TRP 91 N 0.36 0.49 -0.73 2.20 7.01 -1.00 -1.93 115.95 122.36 1psq h TRP 91 Ca 0.13 0.02 0.09 0.00 2.11 0.00 0.00 58.89 61.24 1psq h TRP 91 Cb 0.03 -0.15 -0.07 0.00 -2.10 0.00 0.00 29.16 26.86 1psq h TRP 91 CO -0.09 0.27 0.37 0.00 -2.79 0.00 0.00 178.44 176.20 1psq h GLY 93 N 0.63 0.65 2.00 0.00 0.00 -1.02 0.91 103.07 106.24 1psq h GLY 93 Ca 0.36 -0.65 -0.10 0.00 0.00 0.00 0.00 47.33 46.93 1psq h GLY 93 CO -0.26 0.59 -0.50 0.00 0.00 0.00 0.00 176.54 176.37 1psq h ALA 94 N 1.07 1.04 -0.01 3.60 0.00 -0.75 -3.10 119.26 121.11 1psq h ALA 94 Ca 0.04 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1psq h ALA 94 Cb 0.92 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1psq h ALA 94 CO 0.08 0.62 -0.56 0.39 0.00 0.00 0.00 179.25 179.78 1psq n GLU 95 N -3.74 0.49 -2.42 0.00 -0.58 -0.41 -4.96 120.64 109.00 1psq n GLU 95 Ca -0.01 -0.35 -0.07 0.00 -0.42 0.00 0.00 57.16 56.31 1psq n GLU 95 Cb 0.55 -1.49 0.01 0.00 -0.57 0.00 0.00 31.44 29.93 1psq n GLU 95 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1psq n GLY 96 N 1.44 0.27 2.69 0.62 0.00 -0.60 -4.96 105.19 104.65 1psq n GLY 96 Ca 0.08 -0.52 -0.25 0.00 0.00 0.00 0.00 46.02 45.33 1psq n GLY 96 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1psq n LEU 97 N -1.34 3.89 0.23 0.99 4.77 0.21 -4.90 117.00 120.87 1psq n LEU 97 Ca -0.04 -5.33 0.08 0.00 -0.03 0.00 0.00 56.01 50.68 1psq n LEU 97 Cb 0.54 -0.30 0.57 0.00 -2.33 0.00 0.00 43.42 41.90 1psq n LEU 97 CO 0.14 2.26 0.90 0.44 -1.33 0.00 0.00 177.39 179.80 1psq h ASP 98 N 2.87 0.00 0.31 -1.43 3.32 -1.93 -2.48 116.42 117.07 1psq h ASP 98 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1psq h ASP 98 Cb 0.73 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.28 1psq h ASP 98 CO 0.77 0.19 -0.24 0.59 -1.72 0.00 0.00 179.24 178.82 1psq n ASN 99 N -3.99 0.83 -4.77 6.45 3.02 -1.26 -4.93 115.26 110.61 1psq n ASN 99 Ca -0.02 -0.73 -0.40 0.00 -0.03 0.00 0.00 54.58 53.40 1psq n ASN 99 Cb 0.27 0.09 0.01 0.00 -0.61 0.00 0.00 39.78 39.54 1psq n ASN 99 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1psq s ALA 100 N -2.56 3.39 0.42 5.41 0.00 -0.93 -5.16 121.76 122.33 1psq s ALA 100 Ca 0.24 1.50 -0.01 0.00 0.00 0.00 0.00 51.96 53.68 1psq s ALA 100 Cb 0.19 -3.59 -0.02 0.00 0.00 0.00 0.00 23.12 19.70 1psq s ALA 100 CO 0.53 -1.10 0.66 0.42 0.00 0.00 0.00 175.76 176.27 1psq s ILE 101 N -1.17 4.68 0.00 0.00 1.01 -1.26 -5.03 121.20 119.43 1psq s ILE 101 Ca 0.57 -0.28 0.00 0.00 0.00 0.00 0.00 60.65 60.94 1psq s ILE 101 Cb -0.45 -3.74 0.00 0.00 0.01 0.00 0.00 42.46 38.29 1psq s ILE 101 CO 0.59 -0.57 0.00 0.18 0.00 0.00 0.00 174.94 175.14 1psq n LEU 103 N -2.03 0.00 -4.73 2.97 4.77 0.92 -1.65 117.00 117.25 1psq n LEU 103 Ca -0.01 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.65 1psq n LEU 103 Cb 0.56 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.58 1psq n LEU 103 CO 0.50 0.00 -0.29 -0.55 -1.33 0.00 0.00 177.39 175.72 1psq s SER 104 N 0.00 5.36 -0.03 -1.43 0.15 -0.10 -2.08 113.70 115.57 1psq s SER 104 Ca 0.00 0.01 0.09 0.00 0.70 0.00 0.00 55.95 56.75 1psq s SER 104 Cb 0.00 -1.43 0.25 0.00 -1.71 0.00 0.00 66.02 63.12 1psq s SER 104 CO 0.00 0.24 1.20 -0.67 1.20 0.00 0.00 173.24 175.20 1psq n ASP 105 N 1.01 2.75 -0.28 5.45 2.03 -0.10 -2.39 116.55 125.01 1psq n ASP 105 Ca -0.12 -2.21 0.13 0.00 0.52 0.00 0.00 54.79 53.11 1psq n ASP 105 Cb 0.52 -0.22 0.39 0.00 -0.72 0.00 0.00 41.12 41.09 1psq n ASP 105 CO 0.00 0.00 0.00 0.10 -1.92 0.00 0.00 177.20 175.38 1psq h TYR 106 N 1.27 0.82 0.72 -0.67 -0.00 -1.83 -1.23 116.97 116.05 1psq h TYR 106 Ca 0.00 0.02 -0.03 0.00 0.00 0.00 0.00 58.73 58.72 1psq h TYR 106 Cb 0.78 -0.26 0.01 0.00 0.00 0.00 0.00 36.73 37.26 1psq h TYR 106 CO 0.18 0.28 -0.37 0.35 -0.00 0.00 0.00 178.16 178.60 1psq h PHE 107 N 0.67 -0.96 0.00 0.10 3.57 -1.97 -3.40 116.94 114.96 1psq h PHE 107 Ca 0.47 -0.02 -0.21 0.00 3.53 0.00 0.00 57.97 61.74 1psq h PHE 107 Cb 0.80 0.32 -0.04 0.00 2.79 0.00 0.00 35.95 39.82 1psq h PHE 107 CO -0.00 -0.58 -1.97 -0.25 -2.23 0.00 0.00 178.31 173.28 1psq n ASP 108 N -4.73 1.29 0.00 0.41 8.00 -1.22 -4.95 116.55 115.34 1psq n ASP 108 Ca -0.12 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.38 1psq n ASP 108 Cb 0.40 1.07 0.00 0.00 -0.02 0.00 0.00 41.12 42.56 1psq n ASP 108 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1psq n HIS 109 N -2.45 0.00 -0.13 1.24 8.25 -0.47 -4.87 115.22 116.80 1psq n HIS 109 Ca -0.20 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.19 1psq n HIS 109 Cb 0.86 -1.07 0.01 0.00 1.12 0.00 0.00 29.99 30.91 1psq n HIS 109 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1psq h SER 110 N 0.00 0.41 0.48 0.41 4.64 -1.93 -1.91 113.55 115.66 1psq h SER 110 Ca 0.00 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1psq h SER 110 Cb 0.53 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.51 1psq h SER 110 CO 0.00 0.30 -0.40 0.15 -0.87 0.00 0.00 176.83 176.01 1psq h PHE 111 N 0.51 -1.08 -0.49 4.77 3.57 -1.90 0.76 116.94 123.08 1psq h PHE 111 Ca 0.16 0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.76 1psq h PHE 111 Cb -0.01 0.41 -0.09 0.00 2.79 0.00 0.00 35.95 39.04 1psq h PHE 111 CO -0.06 -0.57 -0.13 0.78 -2.23 0.00 0.00 178.31 176.10 1psq h GLY 112 N -0.87 0.35 2.00 2.40 0.00 -1.91 0.19 103.07 105.23 1psq h GLY 112 Ca -0.05 0.17 -0.10 0.00 0.00 0.00 0.00 47.33 47.35 1psq h GLY 112 CO -0.02 -0.19 -0.48 0.07 0.00 0.00 0.00 176.54 175.93 1psq h ARG 113 N -0.00 0.00 -0.08 4.80 0.11 -1.22 0.42 114.38 118.41 1psq h ARG 113 Ca 0.24 0.00 -0.21 0.00 0.10 0.00 0.00 59.98 60.10 1psq h ARG 113 Cb 0.36 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.45 1psq h ARG 113 CO -0.51 0.48 -0.82 -0.44 0.10 0.00 0.00 179.97 178.78 1psq h ASP 114 N 0.00 0.69 -0.07 0.08 3.32 0.27 -3.07 116.42 117.64 1psq h ASP 114 Ca -0.00 -0.48 0.00 0.00 0.02 0.00 0.00 57.03 56.56 1psq h ASP 114 Cb 1.04 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.38 1psq h ASP 114 CO 0.06 1.26 0.00 -1.22 -1.72 0.00 0.00 179.24 177.62 1psq n TYR 115 N -3.85 0.07 -3.26 4.55 4.01 0.57 -4.93 117.16 114.31 1psq n TYR 115 Ca -0.06 -0.04 -0.24 0.00 -0.16 0.00 0.00 57.90 57.40 1psq n TYR 115 Cb 0.76 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.83 1psq n TYR 115 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1psq n ALA 116 N 0.41 -1.08 0.65 -0.72 0.00 0.11 -4.40 120.51 115.48 1psq n ALA 116 Ca 0.18 0.26 0.07 0.00 0.00 0.00 0.00 53.44 53.95 1psq n ALA 116 Cb 0.39 -4.02 -0.00 0.00 0.00 0.00 0.00 19.45 15.82 1psq n ALA 116 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1psq n LEU 117 N -4.20 1.54 -4.59 0.00 4.77 0.13 -4.69 117.00 109.95 1psq n LEU 117 Ca -0.06 -0.77 -0.43 0.00 -0.03 0.00 0.00 56.01 54.72 1psq n LEU 117 Cb 0.59 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.65 1psq n LEU 117 CO 0.54 0.30 1.19 -0.22 -1.33 0.00 0.00 177.39 177.87 1psq s LEU 118 N -1.91 3.53 -0.00 2.23 2.96 -0.81 -1.67 118.68 123.00 1psq s LEU 118 Ca 0.12 0.55 -0.30 0.00 -0.22 0.00 0.00 54.13 54.28 1psq s LEU 118 Cb 0.12 -3.38 -0.08 0.00 0.50 0.00 0.00 46.19 43.35 1psq s LEU 118 CO 0.36 -1.49 1.97 -0.63 -1.32 0.00 0.00 176.35 175.25 1psq s ILE 119 N 5.41 3.07 0.33 6.68 1.01 -0.22 -4.50 121.20 132.98 1psq s ILE 119 Ca 0.55 0.08 0.04 0.00 0.00 0.00 0.00 60.65 61.32 1psq s ILE 119 Cb -0.11 -3.06 0.29 0.00 0.01 0.00 0.00 42.46 39.59 1psq s ILE 119 CO 0.30 -0.01 1.91 0.78 0.00 0.00 0.00 174.94 177.92 1psq h ASN 120 N 11.03 0.80 0.98 3.58 2.35 -1.72 0.83 115.58 133.42 1psq h ASN 120 Ca -0.48 0.01 -0.17 0.00 -0.55 0.00 0.00 56.30 55.12 1psq h ASN 120 Cb 1.23 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 39.43 1psq h ASN 120 CO 0.94 0.49 -0.81 -0.33 -1.65 0.00 0.00 177.43 176.07 1psq h GLU 121 N 0.89 0.00 0.00 0.81 3.07 -1.90 -3.39 114.58 114.06 1psq h GLU 121 Ca 0.39 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.25 1psq h GLU 121 Cb 0.33 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.24 1psq h GLU 121 CO -0.15 0.81 -0.61 0.91 -1.40 0.00 0.00 179.01 178.56 1psq n TRP 122 N -3.44 0.00 -3.29 4.33 7.02 -0.98 -5.02 117.44 116.07 1psq n TRP 122 Ca 0.00 0.00 -0.24 0.00 -1.02 0.00 0.00 57.50 56.24 1psq n TRP 122 Cb 0.81 -0.02 0.04 0.00 -2.42 0.00 0.00 31.31 29.73 1psq n TRP 122 CO 0.00 0.00 0.00 0.72 -2.02 0.00 0.00 177.69 176.39 1psq n HIS 123 N -1.32 -2.25 -4.60 -5.99 8.25 0.29 -4.97 115.22 104.63 1psq n HIS 123 Ca -0.00 0.69 -0.27 0.00 -0.26 0.00 0.00 57.72 57.88 1psq n HIS 123 Cb 0.04 -4.49 -0.11 0.00 1.12 0.00 0.00 29.99 26.55 1psq n HIS 123 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1psq s LEU 124 N -6.91 2.80 -0.17 2.41 1.43 -1.26 -4.87 118.68 112.12 1psq s LEU 124 Ca 0.42 -1.36 -0.16 0.00 -1.03 0.00 0.00 54.13 52.00 1psq s LEU 124 Cb -0.19 -0.85 -0.04 0.00 0.03 0.00 0.00 46.19 45.13 1psq s LEU 124 CO 0.52 -0.45 0.39 -0.76 0.23 0.00 0.00 176.35 176.28 1psq s LEU 125 N -3.68 4.21 0.67 1.79 1.43 -1.26 -1.05 118.68 120.79 1psq s LEU 125 Ca 0.35 0.60 -0.16 0.00 -1.03 0.00 0.00 54.13 53.89 1psq s LEU 125 Cb 0.09 -2.53 0.01 0.00 0.03 0.00 0.00 46.19 43.80 1psq s LEU 125 CO 0.18 -0.01 1.16 0.00 0.23 0.00 0.00 176.35 177.91 1psq s ALA 126 N 0.89 2.36 -0.08 4.21 0.00 -0.67 -2.21 121.76 126.27 1psq s ALA 126 Ca 0.20 0.74 -0.30 0.00 0.00 0.00 0.00 51.96 52.61 1psq s ALA 126 Cb -0.14 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.56 1psq s ALA 126 CO 0.07 -1.45 1.19 0.50 0.00 0.00 0.00 175.76 176.08 1psq s ARG 127 N -3.88 4.34 0.10 0.00 3.52 -1.26 -4.31 118.95 117.45 1psq s ARG 127 Ca 0.71 1.65 -0.15 0.00 -0.13 0.00 0.00 55.73 57.81 1psq s ARG 127 Cb -0.25 -3.59 0.03 0.00 -1.56 0.00 0.00 34.95 29.58 1psq s ARG 127 CO 0.41 -0.48 0.35 0.00 -0.81 0.00 0.00 175.30 174.76 1psq s ALA 128 N 2.42 -0.77 -0.05 6.12 0.00 -0.95 -2.09 121.76 126.44 1psq s ALA 128 Ca 0.55 -0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.39 1psq s ALA 128 Cb -0.24 0.57 0.02 0.00 0.00 0.00 0.00 23.12 23.48 1psq s ALA 128 CO 0.20 -0.57 -0.02 0.08 0.00 0.00 0.00 175.76 175.45 1psq s VAL 129 N -3.53 0.41 0.12 0.00 1.01 0.59 -1.19 120.40 117.81 1psq s VAL 129 Ca 0.02 -0.00 0.11 0.00 0.00 0.00 0.00 61.98 62.10 1psq s VAL 129 Cb 0.02 -0.49 -0.04 0.00 0.00 0.00 0.00 36.38 35.87 1psq s VAL 129 CO -0.10 0.22 -0.26 -0.36 0.00 0.00 0.00 175.10 174.60 1psq s PHE 130 N 1.28 2.32 -0.27 5.22 0.40 0.25 -0.92 117.98 126.26 1psq s PHE 130 Ca -0.06 -0.38 0.00 0.00 -0.60 0.00 0.00 56.93 55.90 1psq s PHE 130 Cb -0.13 -1.27 0.08 0.00 0.51 0.00 0.00 43.02 42.21 1psq s PHE 130 CO -0.02 0.33 0.04 0.08 0.70 0.00 0.00 175.22 176.34 1psq s VAL 131 N -1.04 1.21 0.13 -0.44 1.01 -0.26 -0.54 120.40 120.47 1psq s VAL 131 Ca 0.14 -1.34 -0.06 0.00 0.00 0.00 0.00 61.98 60.71 1psq s VAL 131 Cb -0.10 -1.75 -0.06 0.00 0.00 0.00 0.00 36.38 34.48 1psq s VAL 131 CO 0.06 -0.42 0.39 -0.76 0.00 0.00 0.00 175.10 174.37 1psq s LEU 132 N 1.49 4.28 0.89 3.92 1.43 0.06 -1.38 118.68 129.38 1psq s LEU 132 Ca 0.04 0.66 -0.13 0.00 -1.03 0.00 0.00 54.13 53.66 1psq s LEU 132 Cb -0.18 -3.22 0.14 0.00 0.03 0.00 0.00 46.19 42.95 1psq s LEU 132 CO -0.14 0.08 1.20 -0.62 0.23 0.00 0.00 176.35 177.10 1psq s ASP 133 N -2.23 3.71 0.50 2.29 2.15 0.25 -3.00 116.67 120.34 1psq s ASP 133 Ca 0.39 0.69 0.27 0.00 0.43 0.00 0.00 52.55 54.33 1psq s ASP 133 Cb -0.13 -1.08 1.33 0.00 -0.30 0.00 0.00 42.92 42.74 1psq s ASP 133 CO 0.22 -2.40 2.01 0.74 -0.17 0.00 0.00 175.17 175.57 1psq h THR 134 N -1.40 0.53 -0.31 1.71 2.02 -1.89 0.91 112.91 114.48 1psq h THR 134 Ca -0.47 -0.69 0.00 0.00 0.77 0.00 0.00 66.41 66.03 1psq h THR 134 Cb 1.30 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 69.18 1psq h THR 134 CO 0.56 0.14 0.00 0.47 0.37 0.00 0.00 175.52 177.06 1psq n ASP 135 N -3.53 2.02 -1.33 4.18 8.00 -1.26 -4.37 116.55 120.25 1psq n ASP 135 Ca -0.01 -1.88 -0.11 0.00 0.71 0.00 0.00 54.79 53.49 1psq n ASP 135 Cb 0.29 -0.20 -0.00 0.00 -0.02 0.00 0.00 41.12 41.19 1psq n ASP 135 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1psq n ASN 136 N 0.57 -3.70 -4.80 -2.24 3.02 0.31 -4.93 115.26 103.49 1psq n ASN 136 Ca 0.15 -0.02 -0.38 0.00 -0.03 0.00 0.00 54.58 54.29 1psq n ASN 136 Cb 0.35 -2.91 -0.06 0.00 -0.61 0.00 0.00 39.78 36.55 1psq n ASN 136 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1psq s THR 137 N -2.59 4.86 -0.47 3.41 2.01 -1.26 -1.20 115.64 120.40 1psq s THR 137 Ca 0.01 1.11 -0.29 0.00 0.31 0.00 0.00 61.69 62.83 1psq s THR 137 Cb -0.01 -3.85 0.02 0.00 0.01 0.00 0.00 72.50 68.68 1psq s THR 137 CO 0.02 0.53 1.27 -0.63 -0.69 0.00 0.00 174.62 175.12 1psq s ILE 138 N -0.87 4.03 -0.51 1.82 1.01 0.11 0.86 121.20 127.64 1psq s ILE 138 Ca 0.28 1.02 0.23 0.00 0.00 0.00 0.00 60.65 62.18 1psq s ILE 138 Cb -0.18 -4.46 -0.12 0.00 0.01 0.00 0.00 42.46 37.72 1psq s ILE 138 CO 0.17 -0.97 0.99 0.54 0.00 0.00 0.00 174.94 175.66 1psq n ARG 139 N 8.08 0.36 -3.63 2.79 5.12 -0.48 0.66 116.66 129.57 1psq n ARG 139 Ca 0.13 -0.00 -0.12 0.00 -1.93 0.00 0.00 57.85 55.93 1psq n ARG 139 Cb 0.49 -1.62 -0.07 0.00 -1.16 0.00 0.00 32.46 30.10 1psq n ARG 139 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 1psq s TYR 140 N -3.25 -0.76 -0.17 -1.55 5.04 -1.16 -4.90 117.35 110.59 1psq s TYR 140 Ca 0.02 1.80 -0.15 0.00 -2.44 0.00 0.00 57.07 56.29 1psq s TYR 140 Cb 0.14 0.33 0.05 0.00 0.35 0.00 0.00 41.96 42.82 1psq s TYR 140 CO 0.81 -0.37 0.46 0.54 -1.34 0.00 0.00 175.55 175.65 1psq s VAL 141 N 0.52 -0.00 -0.05 3.14 0.11 -1.26 -1.10 120.40 121.76 1psq s VAL 141 Ca -0.01 0.01 0.01 0.00 -2.93 0.00 0.00 61.98 59.06 1psq s VAL 141 Cb -0.05 -0.64 0.02 0.00 -1.53 0.00 0.00 36.38 34.18 1psq s VAL 141 CO -0.03 0.00 -0.05 -0.70 -3.33 0.00 0.00 175.10 171.00 1psq s GLU 142 N 0.37 0.88 -0.36 1.54 2.12 -0.10 -4.96 118.70 118.18 1psq s GLU 142 Ca -0.01 -0.11 -0.04 0.00 0.36 0.00 0.00 54.97 55.18 1psq s GLU 142 Cb -0.04 -0.91 0.07 0.00 0.26 0.00 0.00 34.13 33.52 1psq s GLU 142 CO -0.01 -0.10 0.13 0.71 -0.54 0.00 0.00 175.26 175.44 1psq s TYR 143 N 1.04 3.39 -0.10 5.30 1.51 -1.26 -0.30 117.35 126.93 1psq s TYR 143 Ca -0.09 -1.94 -0.29 0.00 -1.01 0.00 0.00 57.07 53.74 1psq s TYR 143 Cb -0.14 -2.65 -0.06 0.00 -0.11 0.00 0.00 41.96 38.99 1psq s TYR 143 CO -0.01 -0.86 1.98 0.08 -1.11 0.00 0.00 175.55 175.63 1psq s VAL 144 N 1.26 3.16 0.24 0.71 1.01 -0.89 -4.86 120.40 121.03 1psq s VAL 144 Ca 0.01 0.18 -0.06 0.00 0.00 0.00 0.00 61.98 62.12 1psq s VAL 144 Cb -0.21 -3.15 0.22 0.00 0.00 0.00 0.00 36.38 33.23 1psq s VAL 144 CO -0.01 -0.06 1.87 0.44 0.00 0.00 0.00 175.10 177.34 1psq h ASP 145 N 12.06 0.90 -3.62 3.32 3.32 -1.95 -3.26 116.42 127.19 1psq h ASP 145 Ca -0.44 0.00 -0.75 0.00 0.02 0.00 0.00 57.03 55.87 1psq h ASP 145 Cb 1.22 -0.19 -0.28 0.00 0.22 0.00 0.00 39.33 40.30 1psq h ASP 145 CO 0.96 0.60 -0.16 0.21 -1.72 0.00 0.00 179.24 179.13 1psq s ASN 146 N -5.84 6.13 0.55 6.45 2.47 -1.26 -0.93 114.94 122.51 1psq s ASN 146 Ca -0.13 -2.37 0.30 0.00 0.42 0.00 0.00 52.86 51.09 1psq s ASN 146 Cb 0.18 -2.10 1.47 0.00 -1.45 0.00 0.00 41.25 39.35 1psq s ASN 146 CO 0.79 -0.62 1.89 0.40 -3.72 0.00 0.00 177.10 175.85 1psq h ILE 147 N 5.40 0.50 -0.24 -5.21 2.04 -1.45 0.15 117.51 118.71 1psq h ILE 147 Ca -0.07 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.69 1psq h ILE 147 Cb 1.04 0.58 -0.06 0.00 -0.74 0.00 0.00 36.82 37.64 1psq h ILE 147 CO 0.83 0.00 0.13 0.59 0.00 0.00 0.00 178.15 179.69 1psq n ASN 148 N -4.10 2.95 -4.17 1.72 3.02 -1.26 -4.78 115.26 108.64 1psq n ASN 148 Ca 0.15 -2.38 -0.10 0.00 -0.03 0.00 0.00 54.58 52.21 1psq n ASN 148 Cb 0.86 -0.58 -0.10 0.00 -0.61 0.00 0.00 39.78 39.35 1psq n ASN 148 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1psq s SER 149 N 0.22 0.87 0.50 6.41 1.04 0.54 -5.05 113.70 118.23 1psq s SER 149 Ca 0.15 -1.09 -0.17 0.00 0.48 0.00 0.00 55.95 55.32 1psq s SER 149 Cb 0.12 0.16 -0.08 0.00 0.10 0.00 0.00 66.02 66.32 1psq s SER 149 CO 0.03 -0.57 0.98 -1.83 0.98 0.00 0.00 173.24 172.83 1psq s GLU 150 N -3.91 3.98 0.85 4.02 -1.05 -1.26 -4.95 118.70 116.37 1psq s GLU 150 Ca 0.17 0.96 -0.13 0.00 -0.15 0.00 0.00 54.97 55.82 1psq s GLU 150 Cb 0.06 -2.15 0.19 0.00 -0.44 0.00 0.00 34.13 31.80 1psq s GLU 150 CO -0.02 -0.24 1.16 -0.35 0.95 0.00 0.00 175.26 176.76 1psq n PRO 151 N -1.46 -1.01 -2.85 -4.83 -0.04 -1.26 -4.97 135.00 118.57 1psq n PRO 151 Ca 0.06 -1.94 -0.43 0.00 -0.04 0.00 0.00 63.50 61.15 1psq n PRO 151 Cb 0.54 -1.14 -0.02 0.00 -0.04 0.00 0.00 33.50 32.84 1psq n PRO 151 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1psq s ASN 152 N -5.28 6.69 0.14 3.54 3.84 -1.26 -4.85 114.94 117.76 1psq s ASN 152 Ca 0.67 -2.13 -0.18 0.00 0.21 0.00 0.00 52.86 51.43 1psq s ASN 152 Cb -0.02 -2.44 0.00 0.00 -0.55 0.00 0.00 41.25 38.25 1psq s ASN 152 CO 0.47 -1.09 1.75 -0.26 -2.79 0.00 0.00 177.10 175.17 1psq h PHE 153 N 8.65 0.14 -0.13 0.43 -1.00 -1.99 -2.06 116.94 120.98 1psq h PHE 153 Ca 0.21 0.01 0.05 0.00 2.81 0.00 0.00 57.97 61.05 1psq h PHE 153 Cb 0.99 -0.03 -0.06 0.00 3.61 0.00 0.00 35.95 40.46 1psq h PHE 153 CO 1.19 0.06 -0.27 1.05 -1.61 0.00 0.00 178.31 178.73 1psq h GLU 154 N 0.20 -0.33 -0.20 1.51 9.09 -1.98 0.36 114.58 123.22 1psq h GLU 154 Ca 0.12 0.02 0.01 0.00 0.05 0.00 0.00 59.36 59.57 1psq h GLU 154 Cb 0.10 0.07 -0.02 0.00 -1.65 0.00 0.00 28.75 27.25 1psq h GLU 154 CO -0.13 -0.22 0.09 0.00 0.05 0.00 0.00 179.01 178.80 1psq h ALA 155 N 0.57 0.24 0.04 1.06 0.00 -1.93 0.29 119.26 119.53 1psq h ALA 155 Ca 0.10 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1psq h ALA 155 Cb 0.49 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1psq h ALA 155 CO -0.32 -0.33 -0.02 0.00 0.00 0.00 0.00 179.25 178.58 1psq h ALA 156 N 1.11 -0.06 -0.71 0.00 0.00 -1.05 -2.44 119.26 116.10 1psq h ALA 156 Ca 0.08 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 54.99 1psq h ALA 156 Cb 0.03 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.77 1psq h ALA 156 CO -0.07 -0.45 0.36 0.82 0.00 0.00 0.00 179.25 179.91 1psq h ILE 157 N -0.23 0.85 -0.69 0.00 2.04 -0.13 -2.06 117.51 117.29 1psq h ILE 157 Ca -0.01 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.62 1psq h ILE 157 Cb 0.21 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.44 1psq h ILE 157 CO 0.01 0.11 0.35 0.00 0.00 0.00 0.00 178.15 178.63 1psq h ALA 158 N 1.43 0.89 0.18 1.87 0.00 -0.83 -2.37 119.26 120.44 1psq h ALA 158 Ca 0.35 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1psq h ALA 158 Cb 0.36 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1psq h ALA 158 CO -0.27 0.44 -0.13 0.00 0.00 0.00 0.00 179.25 179.29 1psq h ALA 159 N 1.17 -0.30 -0.42 0.00 0.00 -0.89 -0.67 119.26 118.15 1psq h ALA 159 Ca 0.24 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.17 1psq h ALA 159 Cb 0.08 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.98 1psq h ALA 159 CO -0.03 -0.68 0.05 0.00 0.00 0.00 0.00 179.25 178.59 1psq h ALA 160 N 0.49 0.43 -0.35 0.00 0.00 -1.30 0.17 119.26 118.70 1psq h ALA 160 Ca -0.01 0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 1psq h ALA 160 Cb 0.28 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1psq h ALA 160 CO 0.00 -0.35 -0.06 0.87 0.00 0.00 0.00 179.25 179.72 1psq h LYS 161 N 0.17 0.58 0.00 0.00 1.57 -1.32 -2.68 116.57 114.89 1psq h LYS 161 Ca 0.21 -0.15 -0.14 0.00 -1.87 0.00 0.00 60.65 58.70 1psq h LYS 161 Cb 0.27 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 1psq h LYS 161 CO -0.30 0.64 -0.66 0.00 -0.57 0.00 0.00 179.45 178.57 1psq h ALA 162 N 1.40 0.87 0.00 3.86 0.00 -0.11 -3.52 119.26 121.76 1psq h ALA 162 Ca 0.11 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1psq h ALA 162 Cb 0.43 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1psq h ALA 162 CO 0.02 0.82 0.00 1.28 0.00 0.00 0.00 179.25 181.37