#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qsq s ASN 2 N 0.00 0.40 0.28 6.12 2.20 -1.26 -5.04 114.94 117.64 1qsq s ASN 2 Ca 0.00 -1.25 0.02 0.00 -0.94 0.00 0.00 52.86 50.69 1qsq s ASN 2 Cb 0.00 0.60 0.58 0.00 -2.00 0.00 0.00 41.25 40.44 1qsq s ASN 2 CO 0.00 -1.19 1.82 -0.29 -2.94 0.00 0.00 177.10 174.50 1qsq h ILE 3 N 2.23 0.87 -0.31 0.54 6.09 -1.97 -1.18 117.51 123.77 1qsq h ILE 3 Ca -0.28 -0.32 -0.05 0.00 -1.37 0.00 0.00 64.86 62.84 1qsq h ILE 3 Cb 1.25 -0.14 -0.01 0.00 0.47 0.00 0.00 36.82 38.38 1qsq h ILE 3 CO 0.39 0.17 0.00 -0.26 -3.07 0.00 0.00 178.15 175.38 1qsq h PHE 4 N 0.93 0.59 -0.09 2.19 -1.00 -1.99 -0.77 116.94 116.80 1qsq h PHE 4 Ca 0.51 -0.10 -0.11 0.00 2.81 0.00 0.00 57.97 61.07 1qsq h PHE 4 Cb 0.57 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 39.97 1qsq h PHE 4 CO -0.01 0.67 -0.45 0.93 -1.61 0.00 0.00 178.31 177.84 1qsq h GLU 5 N 0.34 0.21 -0.10 1.51 5.08 -1.90 -1.68 114.58 118.04 1qsq h GLU 5 Ca 0.09 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1qsq h GLU 5 Cb 0.44 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 1qsq h GLU 5 CO 0.02 0.63 0.01 1.98 -1.00 0.00 0.00 179.01 180.64 1qsq h MET 6 N 0.17 0.17 -0.16 2.33 4.05 -1.00 -2.35 114.93 118.14 1qsq h MET 6 Ca 0.01 -0.05 -0.10 0.00 -0.28 0.00 0.00 59.70 59.28 1qsq h MET 6 Cb 0.87 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.64 1qsq h MET 6 CO 0.07 0.39 -0.36 -0.07 0.23 0.00 0.00 176.91 177.17 1qsq h LEU 7 N -0.08 0.35 -1.58 3.39 3.38 -1.13 -1.91 115.31 117.73 1qsq h LEU 7 Ca 0.03 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.81 1qsq h LEU 7 Cb 0.31 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1qsq h LEU 7 CO 0.00 0.69 -0.22 -0.09 0.09 0.00 0.00 178.44 178.91 1qsq h ARG 8 N 0.29 0.00 -0.00 1.13 9.65 -1.15 0.94 114.38 125.23 1qsq h ARG 8 Ca 0.03 0.00 -0.03 0.00 -1.10 0.00 0.00 59.98 58.88 1qsq h ARG 8 Cb 0.77 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.35 1qsq h ARG 8 CO 0.06 0.22 -0.12 0.82 2.80 0.00 0.00 179.97 183.76 1qsq h ILE 9 N 0.00 1.57 0.00 1.20 2.04 -1.00 -2.27 117.51 119.05 1qsq h ILE 9 Ca -0.00 -1.84 -0.10 0.00 1.00 0.00 0.00 64.86 63.91 1qsq h ILE 9 Cb 0.45 2.77 -0.01 0.00 -0.74 0.00 0.00 36.82 39.29 1qsq h ILE 9 CO 0.03 0.49 -0.49 0.44 0.00 0.00 0.00 178.15 178.62 1qsq h ASP 10 N -0.63 0.00 0.00 1.72 3.32 -1.03 -3.34 116.42 116.46 1qsq h ASP 10 Ca -0.01 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.91 1qsq h ASP 10 Cb 0.87 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.39 1qsq h ASP 10 CO 0.02 0.49 -1.96 -0.62 -1.72 0.00 0.00 179.24 175.45 1qsq n GLU 11 N -3.94 0.85 -0.11 3.56 -0.58 0.29 -5.09 120.64 115.63 1qsq n GLU 11 Ca -0.01 -0.10 0.02 0.00 -0.42 0.00 0.00 57.16 56.64 1qsq n GLU 11 Cb 0.51 -1.43 -0.00 0.00 -0.57 0.00 0.00 31.44 29.95 1qsq n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1qsq n GLY 12 N 1.69 -1.99 2.74 0.62 0.00 -0.86 -4.43 105.19 102.96 1qsq n GLY 12 Ca -0.13 -1.39 -0.24 0.00 0.00 0.00 0.00 46.02 44.26 1qsq n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1qsq s LEU 13 N 0.00 0.65 -0.08 0.99 2.96 -1.26 -4.29 118.68 117.65 1qsq s LEU 13 Ca 0.00 -0.25 0.01 0.00 -0.22 0.00 0.00 54.13 53.67 1qsq s LEU 13 Cb 0.00 -0.43 0.02 0.00 0.50 0.00 0.00 46.19 46.28 1qsq s LEU 13 CO 0.00 -0.23 -0.09 -0.13 -1.32 0.00 0.00 176.35 174.58 1qsq s ARG 14 N 1.98 1.52 0.00 1.98 0.52 -0.67 -5.00 118.95 119.28 1qsq s ARG 14 Ca 0.04 -0.31 0.25 0.00 -0.52 0.00 0.00 55.73 55.19 1qsq s ARG 14 Cb -0.13 -1.41 1.07 0.00 0.52 0.00 0.00 34.95 34.99 1qsq s ARG 14 CO -0.06 -0.11 1.74 1.28 0.02 0.00 0.00 175.30 178.18 1qsq n LEU 15 N 4.31 1.23 -4.17 2.53 4.77 -1.26 -0.40 117.00 124.00 1qsq n LEU 15 Ca -0.19 -0.46 -0.19 0.00 -0.03 0.00 0.00 56.01 55.15 1qsq n LEU 15 Cb 0.51 -0.03 -0.12 0.00 -2.33 0.00 0.00 43.42 41.44 1qsq n LEU 15 CO 0.21 0.23 -0.46 -0.75 -1.33 0.00 0.00 177.39 175.29 1qsq s LYS 16 N -1.93 0.85 0.42 3.23 2.20 -1.26 -1.72 119.74 121.52 1qsq s LYS 16 Ca 0.37 -0.94 -0.23 0.00 -0.36 0.00 0.00 55.97 54.80 1qsq s LYS 16 Cb 0.19 -0.87 -0.11 0.00 -1.51 0.00 0.00 37.83 35.53 1qsq s LYS 16 CO 0.31 0.20 0.81 -0.89 -0.36 0.00 0.00 175.35 175.41 1qsq n ILE 17 N 1.34 2.22 -3.89 5.43 5.41 -0.86 -4.76 119.36 124.26 1qsq n ILE 17 Ca -0.21 -0.50 -0.08 0.00 1.00 0.00 0.00 62.75 62.96 1qsq n ILE 17 Cb 0.54 -0.88 -0.02 0.00 -0.71 0.00 0.00 39.64 38.58 1qsq n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 1qsq s TYR 18 N -1.35 0.09 -0.09 1.39 -0.85 -0.09 -4.97 117.35 111.48 1qsq s TYR 18 Ca 0.64 -0.58 -0.02 0.00 -0.52 0.00 0.00 57.07 56.59 1qsq s TYR 18 Cb -0.58 0.59 -0.03 0.00 0.38 0.00 0.00 41.96 42.32 1qsq s TYR 18 CO 0.57 -1.28 0.00 0.15 -1.52 0.00 0.00 175.55 173.47 1qsq s LYS 19 N -3.42 3.02 0.12 -3.49 1.02 -1.26 -0.09 119.74 115.65 1qsq s LYS 19 Ca 0.16 -0.40 -0.02 0.00 0.02 0.00 0.00 55.97 55.72 1qsq s LYS 19 Cb -0.04 -2.81 0.03 0.00 -0.52 0.00 0.00 37.83 34.48 1qsq s LYS 19 CO 0.10 0.69 0.17 -0.40 -0.92 0.00 0.00 175.35 174.98 1qsq n ASP 20 N 2.19 0.01 0.19 2.83 5.68 0.61 -4.83 116.55 123.22 1qsq n ASP 20 Ca -0.19 -1.06 0.14 0.00 -0.50 0.00 0.00 54.79 53.18 1qsq n ASP 20 Cb 0.54 -0.13 0.61 0.00 -1.14 0.00 0.00 41.12 41.00 1qsq n ASP 20 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 1qsq h THR 21 N -1.10 0.00 -0.01 2.12 1.35 -1.99 -1.64 112.91 111.64 1qsq h THR 21 Ca -0.05 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 1qsq h THR 21 Cb 0.15 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.58 1qsq h THR 21 CO 0.04 0.00 -0.60 -0.62 -0.25 0.00 0.00 175.52 174.09 1qsq n GLU 22 N -2.51 0.65 -0.29 4.72 -0.58 -1.26 -4.95 120.64 116.42 1qsq n GLU 22 Ca 0.01 -0.50 0.00 0.00 -0.42 0.00 0.00 57.16 56.24 1qsq n GLU 22 Cb 0.20 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.58 1qsq n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1qsq n GLY 23 N 1.44 0.84 3.94 0.62 0.00 -0.62 -5.08 105.19 106.33 1qsq n GLY 23 Ca 0.08 -0.20 -0.27 0.00 0.00 0.00 0.00 46.02 45.63 1qsq n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1qsq s TYR 24 N -2.00 3.48 -0.01 1.61 4.12 -1.26 -4.67 117.35 118.62 1qsq s TYR 24 Ca 0.00 0.25 -0.30 0.00 0.02 0.00 0.00 57.07 57.04 1qsq s TYR 24 Cb 0.00 -1.78 -0.06 0.00 -1.52 0.00 0.00 41.96 38.60 1qsq s TYR 24 CO 0.00 0.42 1.64 0.71 0.02 0.00 0.00 175.55 178.34 1qsq s TYR 25 N -1.84 2.17 0.15 2.71 4.12 -1.14 -0.28 117.35 123.24 1qsq s TYR 25 Ca 0.37 0.27 -0.00 0.00 0.02 0.00 0.00 57.07 57.73 1qsq s TYR 25 Cb -0.11 -3.91 -0.04 0.00 -1.52 0.00 0.00 41.96 36.38 1qsq s TYR 25 CO 0.29 -3.76 0.06 0.99 0.02 0.00 0.00 175.55 173.15 1qsq s THR 26 N 3.50 0.22 0.25 -0.71 2.01 0.87 0.06 115.64 121.84 1qsq s THR 26 Ca 0.73 -1.94 -0.15 0.00 0.31 0.00 0.00 61.69 60.64 1qsq s THR 26 Cb -0.35 -2.15 0.00 0.00 0.01 0.00 0.00 72.50 70.01 1qsq s THR 26 CO 0.30 -0.38 0.54 -0.51 -0.69 0.00 0.00 174.62 173.88 1qsq s ILE 27 N -3.97 0.00 0.00 1.82 2.07 -0.87 -0.91 121.20 119.34 1qsq s ILE 27 Ca 0.27 -1.26 0.00 0.00 -1.41 0.00 0.00 60.65 58.25 1qsq s ILE 27 Cb 0.07 -2.10 0.00 0.00 0.13 0.00 0.00 42.46 40.56 1qsq s ILE 27 CO 0.04 -0.01 0.00 0.61 -1.91 0.00 0.00 174.94 173.67 1qsq n GLY 28 N -0.40 3.49 3.12 1.50 0.00 0.46 -1.40 105.19 111.97 1qsq n GLY 28 Ca -0.03 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 1qsq n GLY 28 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1qsq n ILE 29 N 0.00 4.42 -1.28 -0.61 5.41 -1.26 -1.66 119.36 124.38 1qsq n ILE 29 Ca 0.00 -5.52 -0.07 0.00 1.00 0.00 0.00 62.75 58.16 1qsq n ILE 29 Cb 0.00 -2.34 -0.03 0.00 -0.71 0.00 0.00 39.64 36.56 1qsq n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1qsq n GLY 30 N 2.02 0.84 3.51 7.39 0.00 -1.23 -4.92 105.19 112.79 1qsq n GLY 30 Ca 0.25 -0.73 -0.42 0.00 0.00 0.00 0.00 46.02 45.11 1qsq n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1qsq s HIS 31 N -2.26 2.61 0.18 1.61 5.04 -0.49 -4.92 115.29 117.05 1qsq s HIS 31 Ca 0.00 -0.17 -0.32 0.00 -1.54 0.00 0.00 55.06 53.03 1qsq s HIS 31 Cb 0.00 -4.33 -0.11 0.00 0.04 0.00 0.00 32.58 28.18 1qsq s HIS 31 CO 0.00 -1.66 1.66 -1.17 -2.34 0.00 0.00 174.74 171.23 1qsq s LEU 32 N 4.53 4.37 -0.22 8.88 2.96 -1.26 -2.06 118.68 135.88 1qsq s LEU 32 Ca 0.30 2.74 -0.18 0.00 -0.22 0.00 0.00 54.13 56.76 1qsq s LEU 32 Cb -0.12 -3.59 -0.15 0.00 0.50 0.00 0.00 46.19 42.82 1qsq s LEU 32 CO 0.16 -0.91 -0.01 0.18 -1.32 0.00 0.00 176.35 174.45 1qsq n LEU 33 N 4.13 1.89 -3.50 -0.68 4.77 0.11 -4.95 117.00 118.76 1qsq n LEU 33 Ca 0.15 0.41 -0.12 0.00 -0.03 0.00 0.00 56.01 56.43 1qsq n LEU 33 Cb 0.37 -0.91 -0.03 0.00 -2.33 0.00 0.00 43.42 40.52 1qsq n LEU 33 CO 0.63 0.27 0.32 0.28 -1.33 0.00 0.00 177.39 177.55 1qsq s THR 34 N -2.42 0.02 -2.47 -5.08 -1.32 -1.17 -4.94 115.64 98.27 1qsq s THR 34 Ca -0.30 -0.20 0.23 0.00 -1.21 0.00 0.00 61.69 60.21 1qsq s THR 34 Cb 0.08 -1.05 0.08 0.00 -1.51 0.00 0.00 72.50 70.10 1qsq s THR 34 CO 0.52 -0.11 1.16 0.29 -2.21 0.00 0.00 174.62 174.27 1qsq n LYS 35 N -0.23 1.73 -2.48 7.08 5.02 -1.26 -2.86 118.16 125.16 1qsq n LYS 35 Ca -0.17 -1.43 -0.34 0.00 -2.02 0.00 0.00 58.31 54.35 1qsq n LYS 35 Cb 0.64 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 34.16 1qsq n LYS 35 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1qsq s SER 36 N -2.24 6.26 0.12 4.39 0.15 -1.26 -4.95 113.70 116.17 1qsq s SER 36 Ca 0.23 1.93 0.23 0.00 0.70 0.00 0.00 55.95 59.04 1qsq s SER 36 Cb 0.19 -2.56 0.91 0.00 -1.71 0.00 0.00 66.02 62.85 1qsq s SER 36 CO 0.44 -0.84 1.71 -2.65 1.20 0.00 0.00 173.24 173.10 1qsq n PRO 37 N -1.08 0.12 -2.93 5.44 -0.02 -1.26 -4.71 135.00 130.55 1qsq n PRO 37 Ca 0.09 0.23 -0.41 0.00 -2.02 0.00 0.00 63.50 61.39 1qsq n PRO 37 Cb 0.52 -1.67 -0.04 0.00 -0.02 0.00 0.00 33.50 32.28 1qsq n PRO 37 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1qsq s SER 38 N -3.70 6.86 0.44 2.55 0.15 -1.26 -4.90 113.70 113.83 1qsq s SER 38 Ca 0.09 1.06 0.13 0.00 0.70 0.00 0.00 55.95 57.92 1qsq s SER 38 Cb 0.12 -2.43 0.97 0.00 -1.71 0.00 0.00 66.02 62.98 1qsq s SER 38 CO 0.44 -0.41 2.00 0.25 1.20 0.00 0.00 173.24 176.72 1qsq h LEU 39 N 8.56 0.11 -0.28 3.45 5.85 -1.99 -0.78 115.31 130.22 1qsq h LEU 39 Ca -0.28 -0.02 -0.18 0.00 0.84 0.00 0.00 57.88 58.24 1qsq h LEU 39 Cb 1.12 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.12 1qsq h LEU 39 CO 0.83 0.22 -0.54 0.78 -0.34 0.00 0.00 178.44 179.40 1qsq h ASN 40 N 0.12 0.96 0.13 1.25 2.35 -1.98 0.27 115.58 118.68 1qsq h ASN 40 Ca 0.03 -0.53 -0.03 0.00 -0.55 0.00 0.00 56.30 55.22 1qsq h ASN 40 Cb 0.25 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.34 1qsq h ASN 40 CO 0.01 1.32 -0.12 0.00 -1.65 0.00 0.00 177.43 176.99 1qsq h ALA 41 N 0.67 1.76 -0.14 -0.83 0.00 -1.58 -0.61 119.26 118.53 1qsq h ALA 41 Ca 0.01 -0.11 -0.20 0.00 0.00 0.00 0.00 54.91 54.61 1qsq h ALA 41 Cb 1.15 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.93 1qsq h ALA 41 CO 0.12 0.15 -0.70 0.00 0.00 0.00 0.00 179.25 178.82 1qsq h ALA 42 N 1.88 0.27 -0.68 0.00 0.00 -0.68 -1.99 119.26 118.07 1qsq h ALA 42 Ca -0.00 -0.57 -0.06 0.00 0.00 0.00 0.00 54.91 54.28 1qsq h ALA 42 Cb 0.22 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1qsq h ALA 42 CO 0.02 0.60 0.21 0.87 0.00 0.00 0.00 179.25 180.94 1qsq h LYS 43 N 0.43 1.05 -0.19 0.00 1.57 0.27 -1.05 116.57 118.65 1qsq h LYS 43 Ca -0.05 -0.23 -0.00 0.00 -1.87 0.00 0.00 60.65 58.50 1qsq h LYS 43 Cb 1.34 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 1qsq h LYS 43 CO 0.15 0.92 0.11 1.03 -0.57 0.00 0.00 179.45 181.08 1qsq h SER 44 N 0.99 0.24 -1.01 0.86 0.87 -1.08 -1.57 113.55 112.85 1qsq h SER 44 Ca 0.22 -0.07 0.02 0.00 -1.23 0.00 0.00 61.79 60.73 1qsq h SER 44 Cb 0.31 -0.06 -0.05 0.00 -0.44 0.00 0.00 62.40 62.15 1qsq h SER 44 CO -0.01 0.24 0.66 -0.33 -0.53 0.00 0.00 176.83 176.86 1qsq h GLU 45 N 0.22 1.29 -0.10 2.24 4.39 -1.21 -1.45 114.58 119.96 1qsq h GLU 45 Ca 0.07 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 1qsq h GLU 45 Cb 0.05 -0.29 -0.00 0.00 -0.10 0.00 0.00 28.75 28.40 1qsq h GLU 45 CO -0.01 0.85 0.04 1.25 -1.16 0.00 0.00 179.01 179.98 1qsq h LEU 46 N 1.33 0.13 -0.78 1.33 5.85 -0.81 0.03 115.31 122.39 1qsq h LEU 46 Ca 0.38 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.99 1qsq h LEU 46 Cb -0.09 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 40.86 1qsq h LEU 46 CO -0.10 0.23 0.51 0.44 -0.34 0.00 0.00 178.44 179.18 1qsq h ASP 47 N 0.01 0.85 -0.67 1.25 3.32 -1.06 -0.24 116.42 119.88 1qsq h ASP 47 Ca 0.03 -0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.01 1qsq h ASP 47 Cb 0.14 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 1qsq h ASP 47 CO -0.00 0.59 0.16 0.50 -1.72 0.00 0.00 179.24 178.77 1qsq h LYS 48 N 1.00 1.08 -0.29 3.56 3.64 -1.00 0.80 116.57 125.36 1qsq h LYS 48 Ca 0.30 -0.25 -0.13 0.00 -1.27 0.00 0.00 60.65 59.30 1qsq h LYS 48 Cb -0.03 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 1qsq h LYS 48 CO -0.10 0.96 -0.35 0.00 -2.27 0.00 0.00 179.45 177.69 1qsq h ALA 49 N 1.14 0.83 0.00 5.00 0.00 -0.33 -3.27 119.26 122.64 1qsq h ALA 49 Ca 0.21 -0.42 -0.25 0.00 0.00 0.00 0.00 54.91 54.46 1qsq h ALA 49 Cb 0.36 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1qsq h ALA 49 CO 0.00 0.64 -1.41 0.82 0.00 0.00 0.00 179.25 179.31 1qsq h ILE 50 N 0.55 1.10 0.00 0.00 1.08 -0.83 -3.49 117.51 115.92 1qsq h ILE 50 Ca 0.06 -2.86 0.00 0.00 -0.39 0.00 0.00 64.86 61.67 1qsq h ILE 50 Cb 0.86 2.52 0.00 0.00 -3.07 0.00 0.00 36.82 37.14 1qsq h ILE 50 CO 0.07 0.62 0.00 0.61 -0.69 0.00 0.00 178.15 178.77 1qsq n GLY 51 N 1.46 0.88 3.66 5.37 0.00 0.28 -5.05 105.19 111.79 1qsq n GLY 51 Ca -0.10 -0.56 -0.07 0.00 0.00 0.00 0.00 46.02 45.29 1qsq n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1qsq s ARG 52 N -2.01 1.28 -0.65 1.61 1.70 -1.03 -5.04 118.95 114.81 1qsq s ARG 52 Ca 0.00 -0.63 -0.28 0.00 -0.47 0.00 0.00 55.73 54.36 1qsq s ARG 52 Cb 0.00 0.49 0.03 0.00 -0.57 0.00 0.00 34.95 34.89 1qsq s ARG 52 CO 0.00 -0.58 1.28 1.21 -1.08 0.00 0.00 175.30 176.13 1qsq s ASN 53 N -2.80 6.25 -0.16 -2.89 2.47 -1.26 -4.38 114.94 112.17 1qsq s ASN 53 Ca 0.08 -0.10 0.03 0.00 0.42 0.00 0.00 52.86 53.28 1qsq s ASN 53 Cb -0.02 -2.55 -0.23 0.00 -1.45 0.00 0.00 41.25 36.99 1qsq s ASN 53 CO -0.02 -1.69 0.21 0.35 -3.72 0.00 0.00 177.10 172.23 1qsq n THR 54 N 6.59 1.62 -2.17 -5.21 -2.24 -1.26 -4.99 114.28 106.61 1qsq n THR 54 Ca 0.07 -0.68 -0.03 0.00 -2.27 0.00 0.00 64.05 61.14 1qsq n THR 54 Cb 0.49 -1.35 0.00 0.00 -2.10 0.00 0.00 70.33 67.37 1qsq n THR 54 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1qsq n ASN 55 N -3.24 -1.83 0.00 3.42 5.15 -1.26 -3.76 115.26 113.74 1qsq n ASN 55 Ca -0.33 -0.02 0.00 0.00 -0.60 0.00 0.00 54.58 53.63 1qsq n ASN 55 Cb 1.05 -1.09 0.00 0.00 -0.53 0.00 0.00 39.78 39.21 1qsq n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1qsq n GLY 56 N -0.94 0.65 3.12 8.20 0.00 -1.26 -5.01 105.19 109.94 1qsq n GLY 56 Ca -0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 1qsq n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qsq s VAL 57 N -2.76 1.35 0.24 1.61 1.01 -1.25 -2.02 120.40 118.58 1qsq s VAL 57 Ca 0.00 -0.67 0.04 0.00 0.00 0.00 0.00 61.98 61.34 1qsq s VAL 57 Cb 0.00 -1.17 -0.05 0.00 0.00 0.00 0.00 36.38 35.16 1qsq s VAL 57 CO 0.00 0.39 0.00 0.27 0.00 0.00 0.00 175.10 175.77 1qsq s ILE 58 N 0.07 1.04 0.62 2.22 -4.36 -0.70 -4.85 121.20 115.24 1qsq s ILE 58 Ca -0.04 -2.03 -0.05 0.00 -0.26 0.00 0.00 60.65 58.27 1qsq s ILE 58 Cb -0.11 -2.39 0.03 0.00 1.25 0.00 0.00 42.46 41.24 1qsq s ILE 58 CO 0.02 -0.29 0.92 0.42 0.24 0.00 0.00 174.94 176.25 1qsq s THR 59 N -3.41 3.07 0.20 8.37 -4.23 -1.26 -4.77 115.64 113.61 1qsq s THR 59 Ca 0.29 -0.18 -0.11 0.00 -1.18 0.00 0.00 61.69 60.51 1qsq s THR 59 Cb 0.06 -3.25 0.14 0.00 1.34 0.00 0.00 72.50 70.79 1qsq s THR 59 CO 0.09 -0.24 1.84 0.50 -0.54 0.00 0.00 174.62 176.27 1qsq h LYS 60 N -0.28 0.97 -0.89 3.99 1.63 -1.99 -1.22 116.57 118.78 1qsq h LYS 60 Ca -0.45 -0.09 0.04 0.00 -0.85 0.00 0.00 60.65 59.30 1qsq h LYS 60 Cb 1.28 -0.20 -0.05 0.00 -0.60 0.00 0.00 32.23 32.65 1qsq h LYS 60 CO 0.60 0.69 0.57 -0.44 -3.45 0.00 0.00 179.45 177.41 1qsq h ASP 61 N 0.98 0.94 -0.62 4.20 3.32 -1.99 -0.80 116.42 122.44 1qsq h ASP 61 Ca 0.26 -0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.24 1qsq h ASP 61 Cb -0.03 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.29 1qsq h ASP 61 CO -0.05 0.64 0.13 -0.33 -1.72 0.00 0.00 179.24 177.91 1qsq h GLU 62 N 1.09 1.01 -0.81 3.56 5.08 -1.63 -1.61 114.58 121.27 1qsq h GLU 62 Ca 0.36 -0.25 -0.04 0.00 -1.00 0.00 0.00 59.36 58.43 1qsq h GLU 62 Cb 0.03 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.12 1qsq h GLU 62 CO -0.13 0.93 0.36 0.00 -1.00 0.00 0.00 179.01 179.17 1qsq h ALA 63 N 1.04 1.05 0.00 3.43 0.00 -0.94 -1.72 119.26 122.12 1qsq h ALA 63 Ca 0.19 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 1qsq h ALA 63 Cb 0.39 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1qsq h ALA 63 CO 0.01 0.65 -0.50 0.93 0.00 0.00 0.00 179.25 180.34 1qsq h GLU 64 N 1.17 0.00 -0.18 0.00 5.08 -0.85 -1.32 114.58 118.48 1qsq h GLU 64 Ca 0.28 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.55 1qsq h GLU 64 Cb 0.17 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 1qsq h GLU 64 CO -0.03 0.50 -0.23 -0.22 -1.00 0.00 0.00 179.01 178.03 1qsq h LYS 65 N 0.00 0.47 -0.81 2.33 3.64 -0.92 -0.18 116.57 121.10 1qsq h LYS 65 Ca -0.00 -0.27 0.01 0.00 -1.27 0.00 0.00 60.65 59.12 1qsq h LYS 65 Cb 0.99 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.79 1qsq h LYS 65 CO 0.06 0.85 0.53 -0.07 -2.27 0.00 0.00 179.45 178.55 1qsq h LEU 66 N 0.12 0.93 -0.21 5.20 3.38 -1.14 -2.23 115.31 121.36 1qsq h LEU 66 Ca 0.02 -0.03 0.03 0.00 0.09 0.00 0.00 57.88 57.99 1qsq h LEU 66 Cb 0.79 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 1qsq h LEU 66 CO 0.05 0.68 0.05 0.15 0.09 0.00 0.00 178.44 179.46 1qsq h PHE 67 N 1.09 0.09 -0.75 1.13 3.57 -1.02 -0.10 116.94 120.94 1qsq h PHE 67 Ca 0.29 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.83 1qsq h PHE 67 Cb -0.12 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.57 1qsq h PHE 67 CO -0.01 0.03 0.48 -0.91 -2.23 0.00 0.00 178.31 175.67 1qsq h ASN 68 N 0.14 0.80 -0.65 0.41 2.35 -0.81 -0.41 115.58 117.41 1qsq h ASN 68 Ca 0.10 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.81 1qsq h ASN 68 Cb 0.09 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.25 1qsq h ASN 68 CO -0.12 0.56 0.27 1.56 -1.65 0.00 0.00 177.43 178.04 1qsq h GLN 69 N 0.94 0.96 -0.08 0.81 4.20 -0.97 -1.57 115.11 119.41 1qsq h GLN 69 Ca 0.30 -0.17 -0.15 0.00 0.06 0.00 0.00 58.65 58.69 1qsq h GLN 69 Cb -0.00 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 1qsq h GLN 69 CO -0.10 0.80 -0.60 -0.44 -0.67 0.00 0.00 178.83 177.81 1qsq h ASP 70 N 0.91 0.31 -0.24 1.46 3.45 -0.44 -0.69 116.42 121.17 1qsq h ASP 70 Ca 0.22 -0.18 -0.09 0.00 0.43 0.00 0.00 57.03 57.41 1qsq h ASP 70 Cb 0.19 -0.09 -0.00 0.00 -0.56 0.00 0.00 39.33 38.86 1qsq h ASP 70 CO -0.02 0.84 -0.21 0.58 -1.57 0.00 0.00 179.24 178.86 1qsq h VAL 71 N 0.20 1.31 -0.33 -1.35 2.07 -0.98 -1.55 116.25 115.63 1qsq h VAL 71 Ca -0.01 -1.35 0.05 0.00 0.82 0.00 0.00 66.70 66.21 1qsq h VAL 71 Cb 1.11 1.65 -0.05 0.00 -1.52 0.00 0.00 31.29 32.48 1qsq h VAL 71 CO 0.10 0.42 0.04 -0.78 0.02 0.00 0.00 177.57 177.37 1qsq h ASP 72 N 0.28 -0.03 -0.78 0.57 3.58 -1.18 -1.17 116.42 117.68 1qsq h ASP 72 Ca 0.04 0.06 -0.00 0.00 0.42 0.00 0.00 57.03 57.55 1qsq h ASP 72 Cb 0.75 0.09 -0.04 0.00 1.72 0.00 0.00 39.33 41.85 1qsq h ASP 72 CO 0.05 0.02 0.47 0.00 -2.88 0.00 0.00 179.24 176.90 1qsq h ALA 73 N 1.26 0.99 0.28 -0.78 0.00 -1.06 -1.91 119.26 118.03 1qsq h ALA 73 Ca 0.16 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1qsq h ALA 73 Cb 0.19 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1qsq h ALA 73 CO -0.22 0.45 -0.21 0.00 0.00 0.00 0.00 179.25 179.27 1qsq h ALA 74 N 1.25 -0.47 -0.35 0.00 0.00 -0.64 0.66 119.26 119.71 1qsq h ALA 74 Ca 0.28 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.17 1qsq h ALA 74 Cb -0.05 0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 1qsq h ALA 74 CO -0.05 -0.78 0.02 0.28 0.00 0.00 0.00 179.25 178.72 1qsq h VAL 75 N -0.49 0.77 -0.86 0.00 2.07 -0.96 -1.56 116.25 115.21 1qsq h VAL 75 Ca -0.02 -0.04 -0.03 0.00 0.82 0.00 0.00 66.70 67.43 1qsq h VAL 75 Cb 0.42 0.63 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 1qsq h VAL 75 CO -0.00 0.02 0.44 0.03 0.02 0.00 0.00 177.57 178.08 1qsq h ARG 76 N 0.13 1.23 -0.59 1.57 3.08 -1.26 -1.05 114.38 117.48 1qsq h ARG 76 Ca 0.17 -0.17 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 1qsq h ARG 76 Cb 0.22 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 1qsq h ARG 76 CO -0.27 0.92 0.27 0.78 -1.07 0.00 0.00 179.97 180.60 1qsq h GLY 77 N 1.23 0.90 0.95 0.04 0.00 -0.35 -1.17 103.07 104.66 1qsq h GLY 77 Ca 0.30 -0.43 -0.04 0.00 0.00 0.00 0.00 47.33 47.15 1qsq h GLY 77 CO -0.04 0.41 0.11 -2.22 0.00 0.00 0.00 176.54 174.80 1qsq h ILE 78 N 0.84 1.23 0.00 2.60 2.04 -0.27 -2.21 117.51 121.74 1qsq h ILE 78 Ca 0.20 -0.79 -0.02 0.00 1.00 0.00 0.00 64.86 65.25 1qsq h ILE 78 Cb 0.12 0.92 -0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1qsq h ILE 78 CO -0.02 0.28 -0.11 -0.07 0.00 0.00 0.00 178.15 178.22 1qsq h LEU 79 N 0.56 0.00 -0.08 1.44 3.38 -0.63 -2.54 115.31 117.44 1qsq h LEU 79 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1qsq h LEU 79 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1qsq h LEU 79 CO 0.00 0.11 -0.51 0.54 0.09 0.00 0.00 178.44 178.67 1qsq n ARG 80 N -3.24 0.12 -3.30 1.13 1.74 -0.50 -4.69 116.66 107.92 1qsq n ARG 80 Ca 0.01 -0.08 -0.38 0.00 -0.77 0.00 0.00 57.85 56.63 1qsq n ARG 80 Cb 0.38 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.26 1qsq n ARG 80 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1qsq s ASN 81 N -2.93 6.61 0.41 0.55 3.84 -0.85 -4.95 114.94 117.62 1qsq s ASN 81 Ca 0.13 0.73 0.13 0.00 0.21 0.00 0.00 52.86 54.06 1qsq s ASN 81 Cb 0.18 -2.28 0.86 0.00 -0.55 0.00 0.00 41.25 39.45 1qsq s ASN 81 CO 0.69 -0.07 1.91 0.00 -2.79 0.00 0.00 177.10 176.83 1qsq h ALA 82 N 7.06 1.54 0.01 1.71 0.00 -1.88 0.09 119.26 127.79 1qsq h ALA 82 Ca -0.38 -0.25 -0.26 0.00 0.00 0.00 0.00 54.91 54.02 1qsq h ALA 82 Cb 1.17 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.87 1qsq h ALA 82 CO 0.75 0.35 -1.43 0.87 0.00 0.00 0.00 179.25 179.79 1qsq h LYS 83 N 0.00 0.03 0.17 0.00 6.56 -1.92 -3.40 116.57 118.01 1qsq h LYS 83 Ca -0.00 -0.05 -0.34 0.00 -1.06 0.00 0.00 60.65 59.20 1qsq h LYS 83 Cb 0.49 0.02 0.01 0.00 -0.57 0.00 0.00 32.23 32.18 1qsq h LYS 83 CO 0.04 0.76 -1.70 -0.07 -2.06 0.00 0.00 179.45 176.42 1qsq h LEU 84 N 0.01 0.56 -0.91 2.94 3.38 -1.69 -3.38 115.31 116.21 1qsq h LEU 84 Ca -0.18 -0.92 0.16 0.00 0.09 0.00 0.00 57.88 57.03 1qsq h LEU 84 Cb 1.92 -0.18 -0.10 0.00 0.09 0.00 0.00 40.66 42.39 1qsq h LEU 84 CO 0.11 1.76 0.51 0.50 0.09 0.00 0.00 178.44 181.40 1qsq h LYS 85 N 0.02 0.67 -0.44 1.13 3.64 -0.61 -2.08 116.57 118.89 1qsq h LYS 85 Ca -0.34 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 58.94 1qsq h LYS 85 Cb 2.03 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 33.68 1qsq h LYS 85 CO 0.15 0.44 0.05 -1.35 -2.27 0.00 0.00 179.45 176.47 1qsq h PRO 86 N 0.69 0.75 -0.21 1.90 0.10 -1.78 -0.64 132.00 132.80 1qsq h PRO 86 Ca 0.51 -0.21 -0.00 0.00 0.10 0.00 0.00 66.00 66.39 1qsq h PRO 86 Cb 0.73 -0.08 -0.01 0.00 0.10 0.00 0.00 31.00 31.74 1qsq h PRO 86 CO -0.37 0.79 0.13 0.28 0.10 0.00 0.00 178.00 178.93 1qsq h VAL 87 N 0.60 1.09 -0.35 3.15 2.07 -1.57 -2.34 116.25 118.91 1qsq h VAL 87 Ca 0.13 -0.24 0.05 0.00 0.82 0.00 0.00 66.70 67.47 1qsq h VAL 87 Cb 0.42 0.86 -0.05 0.00 -1.52 0.00 0.00 31.29 31.01 1qsq h VAL 87 CO 0.01 0.09 0.07 0.22 0.02 0.00 0.00 177.57 177.98 1qsq h TYR 88 N 0.25 0.11 -0.02 1.57 3.20 -1.37 -1.52 116.97 119.20 1qsq h TYR 88 Ca 0.08 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.92 1qsq h TYR 88 Cb 0.04 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 1qsq h TYR 88 CO -0.04 0.02 -0.21 -0.44 -1.64 0.00 0.00 178.16 175.84 1qsq h ASP 89 N 0.19 0.03 1.02 -2.11 3.32 -0.97 -2.57 116.42 115.33 1qsq h ASP 89 Ca 0.16 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.17 1qsq h ASP 89 Cb 0.18 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.72 1qsq h ASP 89 CO -0.22 0.24 -0.16 0.77 -1.72 0.00 0.00 179.24 178.15 1qsq h SER 90 N 0.03 0.00 -3.56 6.45 4.64 -0.73 -3.47 113.55 116.91 1qsq h SER 90 Ca 0.00 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.83 1qsq h SER 90 Cb 0.39 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.49 1qsq h SER 90 CO 0.03 0.16 0.07 -0.76 -0.87 0.00 0.00 176.83 175.46 1qsq s LEU 91 N -6.59 3.82 1.06 5.97 1.43 -0.97 -5.07 118.68 118.32 1qsq s LEU 91 Ca 0.01 0.99 -0.17 0.00 -1.03 0.00 0.00 54.13 53.94 1qsq s LEU 91 Cb 0.10 -3.88 0.23 0.00 0.03 0.00 0.00 46.19 42.66 1qsq s LEU 91 CO 0.62 -0.41 1.18 1.51 0.23 0.00 0.00 176.35 179.48 1qsq s ASP 92 N -3.44 2.20 0.31 2.29 1.47 -1.26 -4.80 116.67 113.44 1qsq s ASP 92 Ca 0.49 0.59 0.03 0.00 1.18 0.00 0.00 52.55 54.84 1qsq s ASP 92 Cb -0.10 -0.85 0.51 0.00 -0.34 0.00 0.00 42.92 42.14 1qsq s ASP 92 CO 0.35 -3.33 1.81 0.00 0.68 0.00 0.00 175.17 174.68 1qsq h ALA 93 N -2.04 1.25 0.09 2.11 0.00 -1.98 -2.31 119.26 116.38 1qsq h ALA 93 Ca -0.46 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.18 1qsq h ALA 93 Cb 1.28 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1qsq h ALA 93 CO 0.42 0.49 -0.05 0.28 0.00 0.00 0.00 179.25 180.39 1qsq h VAL 94 N 0.49 1.14 -0.46 0.00 2.07 -1.94 -2.76 116.25 114.79 1qsq h VAL 94 Ca 0.09 -1.20 0.10 0.00 0.82 0.00 0.00 66.70 66.51 1qsq h VAL 94 Cb 0.47 1.87 -0.02 0.00 -1.52 0.00 0.00 31.29 32.09 1qsq h VAL 94 CO 0.03 0.28 0.32 0.03 0.02 0.00 0.00 177.57 178.24 1qsq h ARG 95 N -0.71 0.18 -0.61 1.57 3.08 -1.83 0.88 114.38 116.94 1qsq h ARG 95 Ca -0.01 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 59.93 1qsq h ARG 95 Cb 0.55 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 1qsq h ARG 95 CO 0.02 0.12 -0.00 0.00 -1.07 0.00 0.00 179.97 179.04 1qsq h ARG 96 N 0.18 1.07 -0.92 0.04 3.08 -1.35 -1.74 114.38 114.73 1qsq h ARG 96 Ca 0.22 -0.34 0.01 0.00 0.07 0.00 0.00 59.98 59.94 1qsq h ARG 96 Cb 0.61 -0.10 -0.05 0.00 0.08 0.00 0.00 29.97 30.52 1qsq h ARG 96 CO -0.03 1.04 0.61 0.00 -1.07 0.00 0.00 179.97 180.52 1qsq h ALA 97 N 1.01 1.33 -0.58 0.04 0.00 -0.54 -1.02 119.26 119.50 1qsq h ALA 97 Ca 0.17 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1qsq h ALA 97 Cb 0.56 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1qsq h ALA 97 CO 0.03 0.62 0.22 0.00 0.00 0.00 0.00 179.25 180.11 1qsq h ALA 98 N 1.42 1.29 -0.39 0.00 0.00 -0.78 -0.56 119.26 120.25 1qsq h ALA 98 Ca 0.34 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 1qsq h ALA 98 Cb -0.14 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 1qsq h ALA 98 CO -0.07 0.52 0.02 1.25 0.00 0.00 0.00 179.25 180.97 1qsq h LEU 99 N 0.83 0.65 -0.67 0.00 5.85 -0.78 -1.41 115.31 119.79 1qsq h LEU 99 Ca 0.20 -0.29 -0.03 0.00 0.84 0.00 0.00 57.88 58.59 1qsq h LEU 99 Cb 0.19 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 1qsq h LEU 99 CO -0.02 0.78 0.28 0.40 -0.34 0.00 0.00 178.44 179.55 1qsq h ILE 100 N 0.50 1.24 0.20 4.05 2.04 -0.81 -1.17 117.51 123.55 1qsq h ILE 100 Ca 0.11 -0.71 -0.00 0.00 1.00 0.00 0.00 64.86 65.26 1qsq h ILE 100 Cb 0.43 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1qsq h ILE 100 CO 0.02 0.29 -0.16 -1.13 0.00 0.00 0.00 178.15 177.17 1qsq h ASN 101 N 0.94 -0.40 -0.86 1.72 -0.73 -0.79 0.17 115.58 115.63 1qsq h ASN 101 Ca 0.22 0.03 0.12 0.00 1.87 0.00 0.00 56.30 58.54 1qsq h ASN 101 Cb 0.18 0.13 -0.08 0.00 0.27 0.00 0.00 38.32 38.82 1qsq h ASN 101 CO -0.02 -0.24 0.49 0.24 -0.37 0.00 0.00 177.43 177.52 1qsq h MET 102 N -0.37 0.74 -0.45 6.67 2.86 -1.05 -2.36 114.93 120.98 1qsq h MET 102 Ca -0.01 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 1qsq h MET 102 Cb 0.33 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.80 1qsq h MET 102 CO -0.01 0.49 0.12 0.28 1.06 0.00 0.00 176.91 178.85 1qsq h VAL 103 N 0.77 1.23 -0.73 -2.22 2.07 -0.22 -0.24 116.25 116.90 1qsq h VAL 103 Ca 0.44 -0.78 0.01 0.00 0.82 0.00 0.00 66.70 67.18 1qsq h VAL 103 Cb 0.48 0.88 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 1qsq h VAL 103 CO -0.29 0.28 0.48 0.15 0.02 0.00 0.00 177.57 178.22 1qsq h PHE 104 N 0.60 0.91 0.03 1.57 3.57 -0.21 -0.61 116.94 122.79 1qsq h PHE 104 Ca 0.14 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.61 1qsq h PHE 104 Cb 0.30 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.73 1qsq h PHE 104 CO 0.02 0.56 -0.27 0.37 -2.23 0.00 0.00 178.31 176.76 1qsq h GLN 105 N 0.97 0.05 -0.62 1.11 4.15 -1.16 -3.40 115.11 116.22 1qsq h GLN 105 Ca 0.27 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 59.60 1qsq h GLN 105 Cb -0.08 0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.64 1qsq h GLN 105 CO -0.06 1.04 0.00 0.00 -1.93 0.00 0.00 178.83 177.88 1qsq n ALA 106 N -2.70 2.34 -1.29 3.38 0.00 -0.13 -5.08 120.51 117.04 1qsq n ALA 106 Ca -0.13 -1.27 0.02 0.00 0.00 0.00 0.00 53.44 52.06 1qsq n ALA 106 Cb 0.56 -0.79 -0.01 0.00 0.00 0.00 0.00 19.45 19.21 1qsq n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qsq n GLY 107 N 1.31 -3.77 0.37 0.00 0.00 -0.24 -3.40 105.19 99.45 1qsq n GLY 107 Ca 0.21 -0.96 -0.02 0.00 0.00 0.00 0.00 46.02 45.26 1qsq n GLY 107 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1qsq h GLU 108 N -0.07 1.21 -0.56 1.61 4.81 -1.92 -0.57 114.58 119.09 1qsq h GLU 108 Ca -0.03 -0.09 -0.09 0.00 -0.13 0.00 0.00 59.36 59.02 1qsq h GLU 108 Cb 0.86 -0.27 -0.02 0.00 0.63 0.00 0.00 28.75 29.95 1qsq h GLU 108 CO 0.01 0.82 -0.01 1.15 -0.73 0.00 0.00 179.01 180.25 1qsq h THR 109 N 1.24 1.27 0.18 0.32 2.02 -1.96 0.40 112.91 116.38 1qsq h THR 109 Ca 0.33 -1.15 -0.00 0.00 0.77 0.00 0.00 66.41 66.36 1qsq h THR 109 Cb -0.11 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 1qsq h THR 109 CO -0.07 0.41 -0.27 1.23 0.37 0.00 0.00 175.52 177.20 1qsq h GLY 110 N 0.89 -1.07 0.88 2.16 0.00 -1.34 -1.74 103.07 102.85 1qsq h GLY 110 Ca 0.16 0.51 0.02 0.00 0.00 0.00 0.00 47.33 48.02 1qsq h GLY 110 CO 0.03 -0.34 0.31 -2.08 0.00 0.00 0.00 176.54 174.47 1qsq h VAL 111 N -0.47 1.06 -0.00 4.60 2.07 -1.07 0.13 116.25 122.56 1qsq h VAL 111 Ca -0.02 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.28 1qsq h VAL 111 Cb 0.43 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 30.57 1qsq h VAL 111 CO -0.08 0.11 0.37 0.00 0.02 0.00 0.00 177.57 177.99 1qsq h ALA 112 N 1.23 1.37 -0.00 1.67 0.00 0.00 0.16 119.26 123.70 1qsq h ALA 112 Ca 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1qsq h ALA 112 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1qsq h ALA 112 CO -0.09 -0.37 -0.10 0.41 0.00 0.00 0.00 179.25 179.10 1qsq n GLY 113 N -1.23 -1.41 2.26 0.00 0.00 0.03 -4.23 105.19 100.61 1qsq n GLY 113 Ca -0.02 -0.16 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 1qsq n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1qsq n PHE 114 N -1.46 1.48 -0.15 1.61 3.01 0.57 -4.76 117.46 117.77 1qsq n PHE 114 Ca 0.08 -2.31 -0.12 0.00 1.01 0.00 0.00 57.45 56.10 1qsq n PHE 114 Cb 0.33 -1.90 -0.08 0.00 -0.01 0.00 0.00 39.48 37.83 1qsq n PHE 114 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1qsq h THR 115 N 2.42 0.04 -0.43 4.37 2.02 -1.81 -0.27 112.91 119.24 1qsq h THR 115 Ca 0.53 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.71 1qsq h THR 115 Cb 0.78 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.21 1qsq h THR 115 CO 1.05 0.00 0.24 0.78 0.37 0.00 0.00 175.52 177.97 1qsq h ASN 116 N -0.36 0.51 -0.07 4.18 2.35 -1.96 -1.97 115.58 118.26 1qsq h ASN 116 Ca 0.10 -0.03 -0.24 0.00 -0.55 0.00 0.00 56.30 55.58 1qsq h ASN 116 Cb 0.59 -0.13 0.01 0.00 0.05 0.00 0.00 38.32 38.85 1qsq h ASN 116 CO -0.61 0.41 -0.90 0.28 -1.65 0.00 0.00 177.43 174.97 1qsq h SER 117 N 0.59 0.92 -0.96 5.81 0.02 -1.72 -2.35 113.55 115.87 1qsq h SER 117 Ca 0.15 -0.66 -0.00 0.00 -0.84 0.00 0.00 61.79 60.44 1qsq h SER 117 Cb 0.00 -0.28 -0.05 0.00 0.14 0.00 0.00 62.40 62.22 1qsq h SER 117 CO -0.03 1.47 0.59 -0.07 -1.14 0.00 0.00 176.83 177.65 1qsq h LEU 118 N 0.47 1.14 -0.68 5.07 3.38 -0.79 0.13 115.31 124.04 1qsq h LEU 118 Ca -0.09 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.76 1qsq h LEU 118 Cb 1.54 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 41.97 1qsq h LEU 118 CO 0.18 0.86 0.15 -0.09 0.09 0.00 0.00 178.44 179.63 1qsq h ARG 119 N 1.31 1.09 -0.25 1.13 2.43 -1.35 0.64 114.38 119.39 1qsq h ARG 119 Ca 0.35 -0.27 -0.10 0.00 -0.81 0.00 0.00 59.98 59.14 1qsq h ARG 119 Cb -0.08 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.31 1qsq h ARG 119 CO -0.07 0.98 -0.29 0.52 -1.51 0.00 0.00 179.97 179.60 1qsq h MET 120 N 1.02 0.50 -0.29 0.20 2.86 -0.82 -1.09 114.93 117.31 1qsq h MET 120 Ca 0.21 -0.20 -0.10 0.00 -2.06 0.00 0.00 59.70 57.55 1qsq h MET 120 Cb 0.39 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 1qsq h MET 120 CO 0.00 0.74 -0.22 -0.07 1.06 0.00 0.00 176.91 178.42 1qsq h LEU 121 N 0.43 0.70 -1.43 1.22 3.38 -0.18 -1.93 115.31 117.50 1qsq h LEU 121 Ca 0.06 -0.44 -0.01 0.00 0.09 0.00 0.00 57.88 57.57 1qsq h LEU 121 Cb 0.73 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 1qsq h LEU 121 CO 0.06 1.00 0.21 -0.61 0.09 0.00 0.00 178.44 179.18 1qsq h GLN 122 N 0.41 0.60 -0.00 1.13 4.15 -0.60 -0.60 115.11 120.19 1qsq h GLN 122 Ca 0.06 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1qsq h GLN 122 Cb 0.77 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.34 1qsq h GLN 122 CO 0.06 0.47 -0.01 1.04 -1.93 0.00 0.00 178.83 178.46 1qsq n GLN 123 N -4.40 0.61 -2.18 1.69 6.02 -0.44 -4.89 117.38 113.79 1qsq n GLN 123 Ca 0.03 -0.02 -0.14 0.00 -0.01 0.00 0.00 57.00 56.87 1qsq n GLN 123 Cb 0.12 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 29.86 1qsq n GLN 123 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1qsq n LYS 124 N -1.18 -1.09 -3.10 -1.09 5.02 -0.23 -4.94 118.16 111.55 1qsq n LYS 124 Ca 0.17 0.70 -0.44 0.00 -2.02 0.00 0.00 58.31 56.72 1qsq n LYS 124 Cb 0.21 -4.95 0.00 0.00 -0.02 0.00 0.00 35.03 30.27 1qsq n LYS 124 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1qsq n ARG 125 N -2.35 3.44 -0.01 1.97 1.74 -0.78 -4.88 116.66 115.80 1qsq n ARG 125 Ca -0.16 -4.09 -0.09 0.00 -0.77 0.00 0.00 57.85 52.73 1qsq n ARG 125 Cb 0.61 -2.85 -0.03 0.00 -1.02 0.00 0.00 32.46 29.17 1qsq n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 1qsq h TRP 126 N 6.93 -0.60 -0.70 -1.55 4.06 -1.89 -1.73 115.95 120.47 1qsq h TRP 126 Ca 0.26 0.03 -0.05 0.00 2.06 0.00 0.00 58.89 61.19 1qsq h TRP 126 Cb 0.87 0.29 -0.03 0.00 -1.00 0.00 0.00 29.16 29.29 1qsq h TRP 126 CO 0.96 -0.31 0.23 -0.44 -3.56 0.00 0.00 178.44 175.33 1qsq h ASP 127 N -0.28 1.00 0.18 -3.49 5.19 -1.90 -2.04 116.42 115.08 1qsq h ASP 127 Ca 0.11 -0.20 -0.12 0.00 -0.62 0.00 0.00 57.03 56.20 1qsq h ASP 127 Cb 0.44 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 39.67 1qsq h ASP 127 CO -0.31 0.93 -0.43 -0.33 -3.12 0.00 0.00 179.24 175.98 1qsq h GLU 128 N 1.02 0.32 -0.37 3.56 5.08 -1.93 -2.50 114.58 119.76 1qsq h GLU 128 Ca 0.23 -0.16 -0.11 0.00 -1.00 0.00 0.00 59.36 58.31 1qsq h GLU 128 Cb 0.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1qsq h GLU 128 CO -0.01 0.70 -0.22 0.00 -1.00 0.00 0.00 179.01 178.47 1qsq h ALA 129 N 1.28 0.91 -0.11 3.43 0.00 -1.12 -1.38 119.26 122.27 1qsq h ALA 129 Ca 0.02 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 1qsq h ALA 129 Cb 0.87 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1qsq h ALA 129 CO 0.07 0.62 0.07 0.00 0.00 0.00 0.00 179.25 180.01 1qsq h ALA 130 N 1.11 0.14 0.09 0.00 0.00 -1.04 0.68 119.26 120.25 1qsq h ALA 130 Ca 0.09 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1qsq h ALA 130 Cb 0.72 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1qsq h ALA 130 CO 0.06 -0.34 -0.05 0.28 0.00 0.00 0.00 179.25 179.19 1qsq h VAL 131 N 0.11 0.89 -0.71 0.00 2.07 -1.37 -1.94 116.25 115.31 1qsq h VAL 131 Ca 0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 1qsq h VAL 131 Cb 0.03 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 1qsq h VAL 131 CO -0.01 0.00 0.44 -1.13 0.02 0.00 0.00 177.57 176.90 1qsq h ASN 132 N -0.13 0.83 0.59 0.57 -0.73 -0.89 -1.29 115.58 114.54 1qsq h ASN 132 Ca -0.01 -0.03 -0.03 0.00 1.87 0.00 0.00 56.30 58.10 1qsq h ASN 132 Cb 0.11 -0.21 -0.00 0.00 0.27 0.00 0.00 38.32 38.48 1qsq h ASN 132 CO 0.01 0.62 -0.15 -0.07 -0.37 0.00 0.00 177.43 177.47 1qsq h LEU 133 N 0.97 0.00 -0.70 0.34 3.38 0.97 -2.67 115.31 117.60 1qsq h LEU 133 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1qsq h LEU 133 Cb -0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1qsq h LEU 133 CO -0.05 0.15 0.00 0.00 0.09 0.00 0.00 178.44 178.63 1qsq h ALA 134 N 1.85 1.00 -0.86 1.53 0.00 -0.49 -3.35 119.26 118.94 1qsq h ALA 134 Ca -0.00 0.00 -0.75 0.00 0.00 0.00 0.00 54.91 54.15 1qsq h ALA 134 Cb 0.49 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.13 1qsq h ALA 134 CO 0.02 0.00 2.10 1.63 0.00 0.00 0.00 179.25 183.00 1qsq n LYS 135 N -2.80 3.77 -3.70 0.00 5.02 -1.01 -4.71 118.16 114.74 1qsq n LYS 135 Ca 0.03 -3.51 -0.12 0.00 -2.02 0.00 0.00 58.31 52.69 1qsq n LYS 135 Cb 0.37 -2.88 -0.06 0.00 -0.02 0.00 0.00 35.03 32.44 1qsq n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1qsq s SER 136 N 0.77 -0.19 0.23 4.39 1.04 -1.26 -5.01 113.70 113.67 1qsq s SER 136 Ca 0.42 -0.18 -0.07 0.00 0.48 0.00 0.00 55.95 56.60 1qsq s SER 136 Cb 0.11 0.41 0.25 0.00 0.10 0.00 0.00 66.02 66.89 1qsq s SER 136 CO -0.01 -0.69 1.89 -0.09 0.98 0.00 0.00 173.24 175.32 1qsq h ARG 137 N 2.92 1.12 -0.81 4.02 2.43 -1.93 -2.26 114.38 119.86 1qsq h ARG 137 Ca -0.32 -0.07 0.19 0.00 -0.81 0.00 0.00 59.98 58.97 1qsq h ARG 137 Cb 1.21 -0.25 -0.12 0.00 -0.42 0.00 0.00 29.97 30.39 1qsq h ARG 137 CO 0.46 0.74 0.24 2.35 -1.51 0.00 0.00 179.97 182.25 1qsq h TRP 138 N 1.15 0.38 -0.18 2.20 7.01 -1.95 0.63 115.95 125.20 1qsq h TRP 138 Ca 0.34 0.04 -0.11 0.00 2.11 0.00 0.00 58.89 61.27 1qsq h TRP 138 Cb -0.06 -0.04 0.00 0.00 -2.10 0.00 0.00 29.16 26.96 1qsq h TRP 138 CO -0.01 -0.10 -0.32 -0.92 -2.79 0.00 0.00 178.44 174.29 1qsq h TYR 139 N 0.29 0.67 -0.52 2.65 3.20 -1.75 -2.69 116.97 118.82 1qsq h TYR 139 Ca 0.48 -0.24 -0.03 0.00 3.14 0.00 0.00 58.73 62.08 1qsq h TYR 139 Cb 0.88 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.99 1qsq h TYR 139 CO -0.23 0.96 0.19 -0.91 -1.64 0.00 0.00 178.16 176.53 1qsq h ASN 140 N 0.18 0.69 0.21 -2.11 4.21 -0.73 -0.38 115.58 117.65 1qsq h ASN 140 Ca 0.01 -0.09 -0.31 0.00 1.21 0.00 0.00 56.30 57.12 1qsq h ASN 140 Cb 0.92 -0.18 0.04 0.00 -1.12 0.00 0.00 38.32 37.97 1qsq h ASN 140 CO 0.07 0.63 -1.35 1.56 -1.29 0.00 0.00 177.43 177.05 1qsq h GLN 141 N 0.74 0.54 -2.11 0.81 1.08 -0.98 -3.38 115.11 111.81 1qsq h GLN 141 Ca 0.18 -0.87 -0.57 0.00 -1.45 0.00 0.00 58.65 55.94 1qsq h GLN 141 Cb 0.17 0.31 -0.41 0.00 -0.05 0.00 0.00 27.48 27.51 1qsq h GLN 141 CO -0.01 1.41 -0.87 0.25 -0.95 0.00 0.00 178.83 178.66 1qsq n THR 142 N -3.79 1.02 -0.31 -0.54 -2.24 -1.02 -4.99 114.28 102.42 1qsq n THR 142 Ca -0.16 -4.75 0.00 0.00 -2.27 0.00 0.00 64.05 56.87 1qsq n THR 142 Cb 1.05 -1.70 0.13 0.00 -2.10 0.00 0.00 70.33 67.71 1qsq n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1qsq h PRO 143 N 3.78 0.96 -0.26 -0.78 0.13 -1.25 -0.68 132.00 133.90 1qsq h PRO 143 Ca 0.13 -0.06 -0.13 0.00 -0.87 0.00 0.00 66.00 65.07 1qsq h PRO 143 Cb 0.76 -0.22 -0.01 0.00 0.13 0.00 0.00 31.00 31.66 1qsq h PRO 143 CO 0.65 0.64 -0.40 -0.91 -0.23 0.00 0.00 178.00 177.76 1qsq h ASN 144 N 0.99 0.64 0.12 1.44 2.35 -1.94 0.09 115.58 119.28 1qsq h ASN 144 Ca 0.36 -0.28 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 1qsq h ASN 144 Cb 0.13 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.32 1qsq h ASN 144 CO -0.16 0.96 -0.06 -0.09 -1.65 0.00 0.00 177.43 176.44 1qsq h ARG 145 N 0.50 -0.16 -0.77 0.81 2.43 -1.90 -2.61 114.38 112.68 1qsq h ARG 145 Ca 0.04 0.01 0.17 0.00 -0.81 0.00 0.00 59.98 59.39 1qsq h ARG 145 Cb 0.90 0.04 -0.11 0.00 -0.42 0.00 0.00 29.97 30.38 1qsq h ARG 145 CO 0.08 0.24 0.24 0.00 -1.51 0.00 0.00 179.97 179.02 1qsq h ALA 146 N 0.16 1.06 -0.99 2.80 0.00 -1.07 0.84 119.26 122.05 1qsq h ALA 146 Ca -0.02 0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.13 1qsq h ALA 146 Cb 0.48 0.19 -0.07 0.00 0.00 0.00 0.00 17.79 18.39 1qsq h ALA 146 CO 0.03 -0.31 0.63 -0.22 0.00 0.00 0.00 179.25 179.37 1qsq h LYS 147 N 0.33 1.07 -0.47 0.00 3.64 -0.92 0.19 116.57 120.41 1qsq h LYS 147 Ca 0.44 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.69 1qsq h LYS 147 Cb 0.76 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.32 1qsq h LYS 147 CO -0.49 0.71 0.01 0.00 -2.27 0.00 0.00 179.45 177.40 1qsq h ARG 148 N 1.10 0.82 -0.28 1.90 3.08 -0.46 -1.88 114.38 118.65 1qsq h ARG 148 Ca 0.45 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 60.22 1qsq h ARG 148 Cb 0.27 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1qsq h ARG 148 CO -0.20 0.86 0.10 0.28 -1.07 0.00 0.00 179.97 179.94 1qsq h VAL 149 N 0.67 1.19 -0.72 2.04 2.07 -0.47 -2.37 116.25 118.66 1qsq h VAL 149 Ca 0.13 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 67.07 1qsq h VAL 149 Cb 0.49 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 1qsq h VAL 149 CO 0.02 0.20 0.44 0.40 0.02 0.00 0.00 177.57 178.65 1qsq h ILE 150 N 0.29 1.20 -0.43 4.57 2.04 -1.02 -1.82 117.51 122.36 1qsq h ILE 150 Ca 0.09 -0.43 -0.05 0.00 1.00 0.00 0.00 64.86 65.47 1qsq h ILE 150 Cb 0.21 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 1qsq h ILE 150 CO -0.01 0.21 0.06 0.74 0.00 0.00 0.00 178.15 179.15 1qsq h THR 151 N 0.98 1.21 -0.68 -0.27 2.02 -1.24 0.12 112.91 115.04 1qsq h THR 151 Ca 0.26 -0.78 -0.07 0.00 0.77 0.00 0.00 66.41 66.58 1qsq h THR 151 Cb -0.05 0.82 -0.03 0.00 -1.74 0.00 0.00 68.15 67.16 1qsq h THR 151 CO -0.05 0.28 0.15 0.74 0.37 0.00 0.00 175.52 177.01 1qsq h THR 152 N 0.63 1.26 -0.19 3.16 2.02 -0.91 0.78 112.91 119.66 1qsq h THR 152 Ca 0.14 -0.98 -0.20 0.00 0.77 0.00 0.00 66.41 66.13 1qsq h THR 152 Cb 0.31 0.59 0.00 0.00 -1.74 0.00 0.00 68.15 67.31 1qsq h THR 152 CO 0.00 0.37 -0.68 -0.26 0.37 0.00 0.00 175.52 175.33 1qsq h PHE 153 N 1.03 1.00 -0.40 3.16 0.05 -0.78 -0.28 116.94 120.73 1qsq h PHE 153 Ca 0.21 -0.41 -0.03 0.00 3.82 0.00 0.00 57.97 61.57 1qsq h PHE 153 Cb 0.39 -0.17 -0.02 0.00 2.00 0.00 0.00 35.95 38.16 1qsq h PHE 153 CO 0.03 1.23 0.15 -0.09 -0.18 0.00 0.00 178.31 179.44 1qsq h ARG 154 N 0.55 0.61 0.00 1.51 2.43 -0.52 -3.37 114.38 115.59 1qsq h ARG 154 Ca -0.02 -0.12 -0.37 0.00 -0.81 0.00 0.00 59.98 58.66 1qsq h ARG 154 Cb 1.29 -0.09 -0.07 0.00 -0.42 0.00 0.00 29.97 30.68 1qsq h ARG 154 CO 0.14 0.58 -2.37 0.25 -1.51 0.00 0.00 179.97 177.06 1qsq n THR 155 N -4.63 1.42 -1.02 0.20 -2.24 0.25 -4.75 114.28 103.50 1qsq n THR 155 Ca -0.00 -0.81 -0.01 0.00 -2.27 0.00 0.00 64.05 60.96 1qsq n THR 155 Cb 0.16 -0.64 -0.00 0.00 -2.10 0.00 0.00 70.33 67.74 1qsq n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qsq n GLY 156 N 1.82 0.46 3.61 3.38 0.00 -0.12 -5.03 105.19 109.32 1qsq n GLY 156 Ca -0.34 -0.67 -0.28 0.00 0.00 0.00 0.00 46.02 44.73 1qsq n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qsq s THR 157 N -2.01 1.31 -0.53 2.61 -4.23 -1.26 -4.80 115.64 106.74 1qsq s THR 157 Ca 0.00 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.64 1qsq s THR 157 Cb 0.00 -2.57 0.69 0.00 1.34 0.00 0.00 72.50 71.96 1qsq s THR 157 CO 0.00 0.00 1.56 0.79 -0.54 0.00 0.00 174.62 176.43 1qsq n TRP 158 N -1.00 1.70 -0.34 3.99 7.02 -1.26 -4.63 117.44 122.92 1qsq n TRP 158 Ca -0.09 -0.60 0.17 0.00 -1.02 0.00 0.00 57.50 55.96 1qsq n TRP 158 Cb 0.67 -0.41 0.40 0.00 -2.42 0.00 0.00 31.31 29.54 1qsq n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1qsq h ASP 159 N 3.48 0.65 0.89 -0.99 3.32 -1.95 -0.26 116.42 121.56 1qsq h ASP 159 Ca 0.00 0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1qsq h ASP 159 Cb 1.68 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 41.22 1qsq h ASP 159 CO 0.38 0.17 0.00 0.00 -1.72 0.00 0.00 179.24 178.07 1qsq h ALA 160 N 1.67 1.00 -0.02 3.45 0.00 -1.89 -2.17 119.26 121.29 1qsq h ALA 160 Ca 0.60 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.51 1qsq h ALA 160 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1qsq h ALA 160 CO -0.38 0.00 -0.01 0.66 0.00 0.00 0.00 179.25 179.52 1qsq n TYR 161 N -2.68 0.00 0.94 0.00 4.02 -0.14 -5.00 117.16 114.30 1qsq n TYR 161 Ca 0.01 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 58.02 1qsq n TYR 161 Cb 0.27 0.00 0.09 0.00 -0.02 0.00 0.00 39.34 39.69 1qsq n TYR 161 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02