#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cux n THR 18 N 0.00 0.01 -4.22 5.15 -2.24 -1.26 -4.62 114.28 107.10 1cux n THR 18 Ca 0.00 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.50 1cux n THR 18 Cb 0.00 -0.51 -0.17 0.00 -2.10 0.00 0.00 70.33 67.55 1cux n THR 18 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1cux s THR 19 N -2.74 1.37 -0.03 4.28 2.01 -1.26 -0.67 115.64 118.59 1cux s THR 19 Ca 0.23 -0.54 -0.01 0.00 0.31 0.00 0.00 61.69 61.68 1cux s THR 19 Cb 0.20 -1.29 0.03 0.00 0.01 0.00 0.00 72.50 71.45 1cux s THR 19 CO 0.48 0.42 0.03 -0.13 -0.69 0.00 0.00 174.62 174.74 1cux s ARG 20 N 1.26 0.01 -0.34 4.92 1.81 -1.26 -4.98 118.95 120.36 1cux s ARG 20 Ca -0.02 0.23 0.14 0.00 -1.72 0.00 0.00 55.73 54.36 1cux s ARG 20 Cb -0.14 -0.38 0.46 0.00 -0.45 0.00 0.00 34.95 34.44 1cux s ARG 20 CO -0.05 -0.22 1.05 -0.25 -0.68 0.00 0.00 175.30 175.15 1cux n ASP 21 N 4.54 2.79 -0.27 0.23 8.00 -1.25 -1.83 116.55 128.75 1cux n ASP 21 Ca -0.20 -3.01 0.03 0.00 0.71 0.00 0.00 54.79 52.32 1cux n ASP 21 Cb 0.50 -0.48 0.24 0.00 -0.02 0.00 0.00 41.12 41.36 1cux n ASP 21 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1cux h ASP 22 N 2.73 0.89 -0.08 -2.24 3.32 -1.67 -0.06 116.42 119.31 1cux h ASP 22 Ca 0.06 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.08 1cux h ASP 22 Cb 1.15 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 40.50 1cux h ASP 22 CO 0.58 0.60 -0.05 0.25 -1.72 0.00 0.00 179.24 178.90 1cux h LEU 23 N 1.03 0.18 -0.80 1.55 5.85 -1.90 0.29 115.31 121.51 1cux h LEU 23 Ca 0.35 -0.45 -0.05 0.00 0.84 0.00 0.00 57.88 58.57 1cux h LEU 23 Cb 0.09 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1cux h LEU 23 CO -0.11 0.59 0.28 0.40 -0.34 0.00 0.00 178.44 179.26 1cux h ILE 24 N -0.23 1.26 0.00 4.05 2.04 -1.88 -3.04 117.51 119.71 1cux h ILE 24 Ca 0.01 -0.87 -0.12 0.00 1.00 0.00 0.00 64.86 64.88 1cux h ILE 24 Cb 0.53 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 1cux h ILE 24 CO 0.01 0.35 -0.69 0.78 0.00 0.00 0.00 178.15 178.61 1cux h ASN 25 N 1.14 0.00 -3.87 1.72 2.35 -1.02 -3.48 115.58 112.41 1cux h ASN 25 Ca 0.25 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 55.44 1cux h ASN 25 Cb 0.26 0.00 0.14 0.00 0.05 0.00 0.00 38.32 38.77 1cux h ASN 25 CO -0.02 0.56 0.49 0.61 -1.65 0.00 0.00 177.43 177.43 1cux n GLY 26 N 1.26 0.52 3.66 2.83 0.00 0.10 -4.99 105.19 108.57 1cux n GLY 26 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1cux n GLY 26 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1cux s ASN 27 N -0.96 6.77 0.56 1.61 -0.87 -1.26 -4.94 114.94 115.84 1cux s ASN 27 Ca 0.72 0.94 0.24 0.00 -1.57 0.00 0.00 52.86 53.19 1cux s ASN 27 Cb -0.43 -2.39 1.58 0.00 -0.02 0.00 0.00 41.25 39.99 1cux s ASN 27 CO 0.49 -0.34 2.18 -1.28 -2.57 0.00 0.00 177.10 175.58 1cux h SER 28 N 7.48 0.00 0.85 -1.22 0.87 -1.94 -0.58 113.55 119.01 1cux h SER 28 Ca -0.30 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.24 1cux h SER 28 Cb 1.13 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.09 1cux h SER 28 CO 0.80 0.00 -0.09 0.00 -0.53 0.00 0.00 176.83 177.01 1cux h ALA 29 N 1.94 1.04 -2.08 6.23 0.00 -1.92 -3.28 119.26 121.19 1cux h ALA 29 Ca 0.03 -0.08 -0.55 0.00 0.00 0.00 0.00 54.91 54.31 1cux h ALA 29 Cb 0.15 -0.01 -0.40 0.00 0.00 0.00 0.00 17.79 17.52 1cux h ALA 29 CO -0.00 0.11 -0.97 -1.13 0.00 0.00 0.00 179.25 177.26 1cux n SER 30 N -3.25 1.69 -4.77 0.00 3.41 -0.23 -5.11 113.62 105.36 1cux n SER 30 Ca -0.00 -3.07 -0.39 0.00 -0.26 0.00 0.00 58.87 55.14 1cux n SER 30 Cb 0.32 -0.63 -0.00 0.00 -0.26 0.00 0.00 64.21 63.64 1cux n SER 30 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1cux s ALA 32 N -1.29 2.50 0.01 0.00 0.00 -1.26 -4.97 121.76 116.74 1cux s ALA 32 Ca 0.58 -0.09 0.10 0.00 0.00 0.00 0.00 51.96 52.55 1cux s ALA 32 Cb -0.37 -3.13 -0.11 0.00 0.00 0.00 0.00 23.12 19.52 1cux s ALA 32 CO 0.47 -1.45 1.32 -0.44 0.00 0.00 0.00 175.76 175.66 1cux h ASP 33 N -0.88 0.00 -3.71 0.00 3.32 -1.69 -3.43 116.42 110.03 1cux h ASP 33 Ca -0.45 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.05 1cux h ASP 33 Cb 1.24 0.00 -0.32 0.00 0.22 0.00 0.00 39.33 40.47 1cux h ASP 33 CO 0.59 0.80 -0.83 -0.69 -1.72 0.00 0.00 179.24 177.39 1cux s VAL 34 N -2.81 1.33 -0.14 -1.35 1.01 -0.85 -0.68 120.40 116.91 1cux s VAL 34 Ca 0.02 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.37 1cux s VAL 34 Cb 0.09 -1.17 0.02 0.00 0.00 0.00 0.00 36.38 35.32 1cux s VAL 34 CO 0.79 0.39 -0.16 -0.63 0.00 0.00 0.00 175.10 175.49 1cux s ILE 35 N 0.26 1.69 -0.22 2.22 1.01 -0.56 -0.71 121.20 124.87 1cux s ILE 35 Ca -0.08 -0.73 -0.05 0.00 0.00 0.00 0.00 60.65 59.79 1cux s ILE 35 Cb -0.13 -1.54 -0.02 0.00 0.01 0.00 0.00 42.46 40.78 1cux s ILE 35 CO 0.03 0.48 0.01 0.12 0.00 0.00 0.00 174.94 175.57 1cux s PHE 36 N 1.19 3.02 -0.18 3.97 5.36 0.08 -1.41 117.98 130.02 1cux s PHE 36 Ca -0.01 -0.63 -0.02 0.00 -0.96 0.00 0.00 56.93 55.32 1cux s PHE 36 Cb -0.14 -2.14 -0.01 0.00 -0.34 0.00 0.00 43.02 40.39 1cux s PHE 36 CO -0.07 -0.40 -0.09 0.42 -1.46 0.00 0.00 175.22 173.63 1cux s ILE 37 N 1.39 3.13 -0.02 3.12 1.01 -0.67 -0.43 121.20 128.73 1cux s ILE 37 Ca 0.05 -0.60 0.03 0.00 0.00 0.00 0.00 60.65 60.13 1cux s ILE 37 Cb -0.15 -2.37 -0.00 0.00 0.01 0.00 0.00 42.46 39.95 1cux s ILE 37 CO 0.01 0.47 -0.12 -0.47 0.00 0.00 0.00 174.94 174.83 1cux s TYR 38 N 1.03 1.09 -0.17 3.97 5.04 -0.44 -1.98 117.35 125.90 1cux s TYR 38 Ca -0.00 -0.24 -0.03 0.00 -2.44 0.00 0.00 57.07 54.36 1cux s TYR 38 Cb -0.15 -0.73 -0.02 0.00 0.35 0.00 0.00 41.96 41.42 1cux s TYR 38 CO -0.01 -0.06 -0.06 0.00 -1.34 0.00 0.00 175.55 174.08 1cux s ALA 39 N -0.10 2.83 0.95 3.97 0.00 -0.42 -1.18 121.76 127.80 1cux s ALA 39 Ca 0.01 -0.97 -0.14 0.00 0.00 0.00 0.00 51.96 50.87 1cux s ALA 39 Cb -0.06 -1.52 0.16 0.00 0.00 0.00 0.00 23.12 21.70 1cux s ALA 39 CO 0.00 -0.02 1.17 -0.98 0.00 0.00 0.00 175.76 175.93 1cux s ARG 40 N 0.78 0.80 0.83 0.00 1.70 -1.26 -2.14 118.95 119.65 1cux s ARG 40 Ca -0.02 0.12 -0.08 0.00 -0.47 0.00 0.00 55.73 55.27 1cux s ARG 40 Cb -0.15 -1.82 0.15 0.00 -0.57 0.00 0.00 34.95 32.57 1cux s ARG 40 CO 0.02 -2.40 1.15 0.20 -1.08 0.00 0.00 175.30 173.19 1cux s GLY 41 N -4.19 1.76 0.33 3.88 0.00 -1.20 -2.39 107.32 105.51 1cux s GLY 41 Ca 0.66 -1.37 -0.29 0.00 0.00 0.00 0.00 44.72 43.72 1cux s GLY 41 CO 0.53 -0.74 1.49 -0.56 0.00 0.00 0.00 173.10 173.83 1cux s SER 42 N -4.77 6.44 0.00 1.64 0.01 -1.26 -2.64 113.70 113.12 1cux s SER 42 Ca 0.69 2.94 0.00 0.00 1.31 0.00 0.00 55.95 60.88 1cux s SER 42 Cb -0.05 -2.65 0.00 0.00 0.21 0.00 0.00 66.02 63.52 1cux s SER 42 CO 0.48 -0.83 0.00 0.41 0.41 0.00 0.00 173.24 173.72 1cux n THR 43 N 1.23 0.00 -1.94 1.44 -1.04 0.12 -4.96 114.28 109.13 1cux n THR 43 Ca 0.04 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.73 1cux n THR 43 Cb 0.39 -0.76 0.01 0.00 -1.82 0.00 0.00 70.33 68.15 1cux n THR 43 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1cux s GLU 44 N -1.51 3.57 0.56 -2.82 2.02 -1.08 -5.06 118.70 114.37 1cux s GLU 44 Ca 0.00 0.83 -0.02 0.00 0.02 0.00 0.00 54.97 55.80 1cux s GLU 44 Cb 0.00 -2.08 0.02 0.00 0.10 0.00 0.00 34.13 32.17 1cux s GLU 44 CO 0.00 -0.59 0.81 0.95 0.02 0.00 0.00 175.26 176.45 1cux s THR 45 N -3.03 3.20 0.00 3.63 -4.23 -1.26 -4.87 115.64 109.07 1cux s THR 45 Ca 0.56 -0.40 0.00 0.00 -1.18 0.00 0.00 61.69 60.67 1cux s THR 45 Cb -0.11 -3.24 0.00 0.00 1.34 0.00 0.00 72.50 70.49 1cux s THR 45 CO 0.49 -0.20 0.00 0.61 -0.54 0.00 0.00 174.62 174.99 1cux n GLY 46 N -2.42 1.69 0.00 3.99 0.00 -1.26 -1.62 105.19 105.57 1cux n GLY 46 Ca 0.05 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1cux n GLY 46 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1cux n ASN 47 N -1.70 1.46 -0.01 1.61 2.04 0.15 -4.70 115.26 114.11 1cux n ASN 47 Ca 0.00 -1.47 0.02 0.00 -0.44 0.00 0.00 54.58 52.69 1cux n ASN 47 Cb 0.00 0.00 -0.04 0.00 -2.53 0.00 0.00 39.78 37.21 1cux n ASN 47 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 1cux n LEU 48 N -0.23 0.00 0.00 -4.53 4.77 0.15 -3.53 117.00 113.63 1cux n LEU 48 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1cux n LEU 48 Cb 0.12 0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1cux n LEU 48 CO 0.00 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.69 1cux n GLY 49 N 2.28 1.15 0.07 -0.72 0.00 -0.64 -2.19 105.19 105.14 1cux n GLY 49 Ca -0.02 -0.64 -0.08 0.00 0.00 0.00 0.00 46.02 45.28 1cux n GLY 49 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1cux h THR 50 N 0.00 1.53 0.02 2.61 1.35 -1.98 -3.39 112.91 113.05 1cux h THR 50 Ca 0.00 -3.26 -0.35 0.00 -0.55 0.00 0.00 66.41 62.25 1cux h THR 50 Cb 0.00 2.76 -0.06 0.00 -1.73 0.00 0.00 68.15 69.13 1cux h THR 50 CO 0.00 0.87 -2.19 0.18 -0.25 0.00 0.00 175.52 174.14 1cux n LEU 51 N -3.30 1.26 -0.17 3.87 4.77 -1.26 -4.63 117.00 117.54 1cux n LEU 51 Ca -0.04 0.10 -0.03 0.00 -0.03 0.00 0.00 56.01 56.01 1cux n LEU 51 Cb 0.97 -0.13 0.03 0.00 -2.33 0.00 0.00 43.42 41.96 1cux n LEU 51 CO 0.47 0.62 0.72 1.23 -1.33 0.00 0.00 177.39 179.10 1cux h GLY 52 N 3.02 0.23 0.52 -0.72 0.00 -1.63 -2.63 103.07 101.86 1cux h GLY 52 Ca -0.47 0.26 0.11 0.00 0.00 0.00 0.00 47.33 47.22 1cux h GLY 52 CO 0.02 -0.22 0.63 -2.55 0.00 0.00 0.00 176.54 174.43 1cux h PRO 53 N -0.07 1.00 -0.66 4.80 0.11 -1.79 -0.49 132.00 134.90 1cux h PRO 53 Ca 0.25 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 66.24 1cux h PRO 53 Cb 0.46 -0.23 -0.03 0.00 0.11 0.00 0.00 31.00 31.31 1cux h PRO 53 CO -0.58 0.66 0.19 0.77 -0.21 0.00 0.00 178.00 178.83 1cux h SER 54 N 1.03 0.98 -0.16 -2.05 0.02 -1.75 -1.07 113.55 110.55 1cux h SER 54 Ca 0.48 -0.22 -0.03 0.00 -0.84 0.00 0.00 61.79 61.18 1cux h SER 54 Cb 0.42 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 1cux h SER 54 CO -0.25 0.94 -0.02 0.40 -1.14 0.00 0.00 176.83 176.76 1cux h ILE 55 N 0.97 1.28 -0.23 3.27 2.04 -1.21 -3.08 117.51 120.54 1cux h ILE 55 Ca 0.21 -0.94 0.06 0.00 1.00 0.00 0.00 64.86 65.19 1cux h ILE 55 Cb 0.32 1.58 -0.06 0.00 -0.74 0.00 0.00 36.82 37.92 1cux h ILE 55 CO -0.00 0.28 -0.14 0.00 0.00 0.00 0.00 178.15 178.28 1cux h ALA 56 N 0.73 0.04 -0.81 1.87 0.00 -0.86 -1.14 119.26 119.09 1cux h ALA 56 Ca 0.04 0.09 0.10 0.00 0.00 0.00 0.00 54.91 55.14 1cux h ALA 56 Cb 0.43 0.32 -0.08 0.00 0.00 0.00 0.00 17.79 18.47 1cux h ALA 56 CO 0.01 -0.56 0.45 0.77 0.00 0.00 0.00 179.25 179.92 1cux h SER 57 N -0.12 0.62 0.17 0.00 0.02 -1.22 -0.27 113.55 112.74 1cux h SER 57 Ca 0.13 0.06 -0.13 0.00 -0.84 0.00 0.00 61.79 61.00 1cux h SER 57 Cb 0.32 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.79 1cux h SER 57 CO -0.31 0.34 -0.49 0.78 -1.14 0.00 0.00 176.83 176.01 1cux h ASN 58 N 0.74 0.41 -0.43 3.07 2.35 -1.30 -1.86 115.58 118.56 1cux h ASN 58 Ca 0.40 -0.20 -0.08 0.00 -0.55 0.00 0.00 56.30 55.87 1cux h ASN 58 Cb 0.41 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 1cux h ASN 58 CO -0.27 0.84 -0.04 -0.07 -1.65 0.00 0.00 177.43 176.23 1cux h LEU 59 N 0.30 0.78 -1.17 1.61 3.38 -0.14 -2.39 115.31 117.68 1cux h LEU 59 Ca 0.01 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.64 1cux h LEU 59 Cb 0.98 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 1cux h LEU 59 CO 0.08 0.93 0.35 -0.33 0.09 0.00 0.00 178.44 179.56 1cux h GLU 60 N 0.62 0.93 -0.72 1.13 5.08 -0.89 -0.40 114.58 120.31 1cux h GLU 60 Ca 0.12 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 1cux h GLU 60 Cb 0.55 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 1cux h GLU 60 CO 0.03 0.69 0.19 0.77 -1.00 0.00 0.00 179.01 179.70 1cux h SER 61 N 0.93 1.08 -0.09 1.42 0.02 -1.08 0.62 113.55 116.46 1cux h SER 61 Ca 0.24 -0.22 -0.14 0.00 -0.84 0.00 0.00 61.79 60.82 1cux h SER 61 Cb 0.05 -0.28 0.01 0.00 0.14 0.00 0.00 62.40 62.31 1cux h SER 61 CO -0.04 1.02 -0.50 0.00 -1.14 0.00 0.00 176.83 176.18 1cux h ALA 62 N 1.11 0.17 -0.00 3.77 0.00 -0.87 -3.36 119.26 120.08 1cux h ALA 62 Ca 0.23 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1cux h ALA 62 Cb 0.35 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1cux h ALA 62 CO -0.00 0.36 -0.58 1.19 0.00 0.00 0.00 179.25 180.22 1cux n PHE 63 N -4.25 0.00 0.00 0.00 3.72 -0.23 -5.10 117.46 111.60 1cux n PHE 63 Ca -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 1cux n PHE 63 Cb 0.60 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.14 1cux n PHE 63 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1cux n GLY 64 N 1.28 -1.36 0.25 1.37 0.00 0.22 -3.56 105.19 103.39 1cux n GLY 64 Ca 0.04 -1.42 0.03 0.00 0.00 0.00 0.00 46.02 44.68 1cux n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1cux h LYS 65 N 0.00 0.23 0.00 1.61 1.79 -1.90 0.27 116.57 118.57 1cux h LYS 65 Ca 0.00 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1cux h LYS 65 Cb 0.00 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.60 1cux h LYS 65 CO 0.00 0.15 0.00 -0.25 -1.08 0.00 0.00 179.45 178.27 1cux n ASP 66 N -5.18 0.51 0.12 0.86 9.92 -1.26 -3.61 116.55 117.90 1cux n ASP 66 Ca 0.11 0.56 0.12 0.00 -0.53 0.00 0.00 54.79 55.06 1cux n ASP 66 Cb 0.40 -0.69 0.20 0.00 -0.64 0.00 0.00 41.12 40.38 1cux n ASP 66 CO 0.00 0.00 0.00 1.23 0.13 0.00 0.00 177.20 178.56 1cux h GLY 67 N 4.26 0.00 -5.69 0.44 0.00 -0.99 -3.42 103.07 97.68 1cux h GLY 67 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.05 1cux h GLY 67 CO 0.00 0.00 -0.74 0.54 0.00 0.00 0.00 176.54 176.34 1cux s VAL 68 N -3.20 0.16 -0.17 4.60 0.11 -1.14 -2.01 120.40 118.76 1cux s VAL 68 Ca 0.06 -0.05 -0.06 0.00 -2.93 0.00 0.00 61.98 59.01 1cux s VAL 68 Cb 0.10 -0.17 -0.03 0.00 -1.53 0.00 0.00 36.38 34.75 1cux s VAL 68 CO 0.69 0.07 0.02 0.26 -3.33 0.00 0.00 175.10 172.81 1cux s TRP 69 N 0.19 3.15 -0.22 1.54 0.51 0.11 -4.89 118.94 119.33 1cux s TRP 69 Ca -0.02 -0.11 -0.09 0.00 -2.12 0.00 0.00 56.10 53.77 1cux s TRP 69 Cb -0.04 -2.03 -0.04 0.00 -0.81 0.00 0.00 33.47 30.55 1cux s TRP 69 CO -0.01 0.05 0.10 0.42 -0.51 0.00 0.00 176.95 177.01 1cux s ILE 70 N 0.42 4.86 -0.14 2.03 -1.09 -1.26 -0.74 121.20 125.28 1cux s ILE 70 Ca 0.00 0.00 -0.02 0.00 -2.23 0.00 0.00 60.65 58.40 1cux s ILE 70 Cb -0.13 -3.24 0.04 0.00 -1.58 0.00 0.00 42.46 37.55 1cux s ILE 70 CO 0.01 0.38 0.01 -1.58 -1.23 0.00 0.00 174.94 172.54 1cux s GLN 71 N 1.00 0.69 0.46 2.79 2.00 0.43 -1.57 119.66 125.46 1cux s GLN 71 Ca 0.05 -0.18 -0.05 0.00 -2.00 0.00 0.00 55.36 53.18 1cux s GLN 71 Cb -0.14 -1.58 -0.04 0.00 0.80 0.00 0.00 33.01 32.05 1cux s GLN 71 CO 0.03 -0.47 0.76 0.20 -0.50 0.00 0.00 175.29 175.31 1cux s GLY 72 N 1.90 1.53 -0.47 2.59 0.00 -0.76 -1.32 107.32 110.78 1cux s GLY 72 Ca 0.02 -0.52 -0.20 0.00 0.00 0.00 0.00 44.72 44.02 1cux s GLY 72 CO -0.07 -0.36 0.63 0.14 0.00 0.00 0.00 173.10 173.45 1cux s VAL 73 N -2.65 4.84 0.00 1.40 1.01 -0.33 -4.84 120.40 119.83 1cux s VAL 73 Ca 0.47 -0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.27 1cux s VAL 73 Cb -0.10 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 32.03 1cux s VAL 73 CO 0.43 -0.70 0.00 0.61 0.00 0.00 0.00 175.10 175.43 1cux n GLY 74 N 5.11 1.43 7.00 4.51 0.00 -1.26 -4.75 105.19 117.22 1cux n GLY 74 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1cux n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cux n GLY 75 N 5.00 3.46 0.08 -0.02 0.00 -1.26 -1.06 105.19 111.39 1cux n GLY 75 Ca 0.00 0.23 0.11 0.00 0.00 0.00 0.00 46.02 46.36 1cux n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cux n ALA 76 N 11.76 1.80 -2.61 4.61 0.00 -1.26 -4.57 120.51 130.25 1cux n ALA 76 Ca 0.00 0.02 -0.41 0.00 0.00 0.00 0.00 53.44 53.05 1cux n ALA 76 Cb 0.00 -1.37 -0.03 0.00 0.00 0.00 0.00 19.45 18.05 1cux n ALA 76 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1cux s TYR 77 N -3.18 2.37 -1.04 0.00 5.04 -0.22 -4.50 117.35 115.83 1cux s TYR 77 Ca 0.07 -0.19 0.26 0.00 -2.44 0.00 0.00 57.07 54.76 1cux s TYR 77 Cb 0.11 -4.56 0.73 0.00 0.35 0.00 0.00 41.96 38.58 1cux s TYR 77 CO 0.40 -1.99 1.57 0.54 -1.34 0.00 0.00 175.55 174.74 1cux n ARG 78 N 9.01 0.04 -3.70 4.97 5.12 -1.26 -4.73 116.66 126.11 1cux n ARG 78 Ca 0.03 -0.02 -0.23 0.00 -1.93 0.00 0.00 57.85 55.70 1cux n ARG 78 Cb 0.48 -1.50 0.05 0.00 -1.16 0.00 0.00 32.46 30.33 1cux n ARG 78 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1cux n ALA 79 N -1.46 -1.74 -2.54 7.54 0.00 -1.26 -4.70 120.51 116.34 1cux n ALA 79 Ca 0.06 0.02 -0.43 0.00 0.00 0.00 0.00 53.44 53.09 1cux n ALA 79 Cb 0.34 -3.13 -0.02 0.00 0.00 0.00 0.00 19.45 16.63 1cux n ALA 79 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1cux s THR 80 N -3.48 4.46 0.23 0.00 2.01 -1.26 -0.70 115.64 116.90 1cux s THR 80 Ca 0.25 1.76 -0.07 0.00 0.31 0.00 0.00 61.69 63.94 1cux s THR 80 Cb -0.12 -4.14 0.23 0.00 0.01 0.00 0.00 72.50 68.48 1cux s THR 80 CO 0.79 -0.06 1.67 0.25 -0.69 0.00 0.00 174.62 176.58 1cux h LEU 81 N 8.69 -0.16 -2.09 4.42 5.85 -1.93 -1.31 115.31 128.78 1cux h LEU 81 Ca -0.29 0.16 0.07 0.00 0.84 0.00 0.00 57.88 58.65 1cux h LEU 81 Cb 1.13 0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.40 1cux h LEU 81 CO 0.91 -0.09 0.18 1.23 -0.34 0.00 0.00 178.44 180.33 1cux h GLY 82 N 0.18 0.00 2.00 3.75 0.00 -2.02 -2.04 103.07 104.94 1cux h GLY 82 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 1cux h GLY 82 CO -0.55 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.21 1cux n ASP 83 N -4.25 0.12 0.27 0.19 8.00 -0.49 -2.06 116.55 118.32 1cux n ASP 83 Ca 0.02 0.54 0.13 0.00 0.71 0.00 0.00 54.79 56.19 1cux n ASP 83 Cb 0.33 -0.56 0.77 0.00 -0.02 0.00 0.00 41.12 41.63 1cux n ASP 83 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 1cux h ASN 84 N 0.00 0.00 0.96 -2.24 2.35 -1.52 -2.11 115.58 113.02 1cux h ASN 84 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1cux h ASN 84 Cb 0.16 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.53 1cux h ASN 84 CO 0.00 0.08 -0.09 0.00 -1.65 0.00 0.00 177.43 175.77 1cux n ALA 85 N -2.32 2.53 -1.47 -0.83 0.00 -0.88 -4.29 120.51 113.26 1cux n ALA 85 Ca -0.02 -0.14 -0.33 0.00 0.00 0.00 0.00 53.44 52.96 1cux n ALA 85 Cb 0.18 -1.41 0.05 0.00 0.00 0.00 0.00 19.45 18.28 1cux n ALA 85 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1cux s LEU 86 N -3.16 3.32 0.24 0.00 1.43 -0.81 -4.89 118.68 114.80 1cux s LEU 86 Ca 0.13 1.95 -0.10 0.00 -1.03 0.00 0.00 54.13 55.08 1cux s LEU 86 Cb 0.18 -4.54 0.36 0.00 0.03 0.00 0.00 46.19 42.22 1cux s LEU 86 CO 0.57 -1.69 1.40 -2.65 0.23 0.00 0.00 176.35 174.21 1cux n PRO 87 N -2.64 -0.12 -0.18 1.29 -0.02 -1.26 -0.47 135.00 131.60 1cux n PRO 87 Ca 0.10 1.40 0.09 0.00 -2.02 0.00 0.00 63.50 63.07 1cux n PRO 87 Cb 0.52 -2.09 0.26 0.00 -0.02 0.00 0.00 33.50 32.17 1cux n PRO 87 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1cux n ARG 88 N -5.43 2.04 -0.72 -0.52 1.74 -1.26 -4.91 116.66 107.60 1cux n ARG 88 Ca 0.13 -1.60 0.00 0.00 -0.77 0.00 0.00 57.85 55.61 1cux n ARG 88 Cb 0.43 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 30.47 1cux n ARG 88 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1cux n GLY 89 N 1.25 0.73 3.85 -0.13 0.00 0.38 -4.71 105.19 106.56 1cux n GLY 89 Ca 0.16 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.14 1cux n GLY 89 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1cux s THR 90 N -2.58 0.00 0.46 2.61 -1.32 -1.08 -4.13 115.64 109.61 1cux s THR 90 Ca 0.00 -0.66 -0.09 0.00 -1.21 0.00 0.00 61.69 59.73 1cux s THR 90 Cb 0.00 -2.75 -0.05 0.00 -1.51 0.00 0.00 72.50 68.19 1cux s THR 90 CO 0.00 0.00 0.81 -0.94 -2.21 0.00 0.00 174.62 172.28 1cux s SER 91 N -3.29 6.39 0.24 8.08 1.04 -1.26 -4.74 113.70 120.16 1cux s SER 91 Ca 0.19 1.10 -0.05 0.00 0.48 0.00 0.00 55.95 57.67 1cux s SER 91 Cb -0.03 -2.32 0.25 0.00 0.10 0.00 0.00 66.02 64.03 1cux s SER 91 CO 0.06 -0.53 1.81 0.28 0.98 0.00 0.00 173.24 175.84 1cux h SER 92 N 0.65 1.00 -0.95 7.02 0.02 -2.00 -2.28 113.55 117.01 1cux h SER 92 Ca -0.47 -0.15 -0.00 0.00 -0.84 0.00 0.00 61.79 60.33 1cux h SER 92 Cb 1.19 -0.26 -0.05 0.00 0.14 0.00 0.00 62.40 63.43 1cux h SER 92 CO 0.63 0.89 0.58 0.00 -1.14 0.00 0.00 176.83 177.79 1cux h ALA 93 N 1.25 1.23 -0.44 3.77 0.00 -1.94 -1.20 119.26 121.94 1cux h ALA 93 Ca 0.24 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1cux h ALA 93 Cb 0.21 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1cux h ALA 93 CO -0.02 0.66 0.06 0.00 0.00 0.00 0.00 179.25 179.96 1cux h ALA 94 N 1.33 0.59 -0.83 0.00 0.00 -1.65 -1.60 119.26 117.09 1cux h ALA 94 Ca 0.34 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1cux h ALA 94 Cb -0.07 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 1cux h ALA 94 CO -0.07 0.32 0.50 0.82 0.00 0.00 0.00 179.25 180.82 1cux h ILE 95 N 0.59 1.23 -0.72 0.00 2.04 -1.03 -1.51 117.51 118.12 1cux h ILE 95 Ca 0.13 -0.52 -0.03 0.00 1.00 0.00 0.00 64.86 65.44 1cux h ILE 95 Cb 0.39 0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 1cux h ILE 95 CO 0.01 0.25 0.31 -0.09 0.00 0.00 0.00 178.15 178.63 1cux h ARG 96 N 1.14 1.04 -0.10 2.37 2.43 -0.97 -0.27 114.38 120.03 1cux h ARG 96 Ca 0.30 -0.16 -0.01 0.00 -0.81 0.00 0.00 59.98 59.30 1cux h ARG 96 Cb -0.04 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.32 1cux h ARG 96 CO -0.06 0.83 0.04 1.49 -1.51 0.00 0.00 179.97 180.76 1cux h GLU 97 N 1.03 0.15 -0.52 0.20 4.57 -0.37 -1.19 114.58 118.44 1cux h GLU 97 Ca 0.24 -0.03 -0.11 0.00 -1.18 0.00 0.00 59.36 58.28 1cux h GLU 97 Cb 0.15 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 1cux h GLU 97 CO -0.03 0.27 -0.12 1.98 -1.18 0.00 0.00 179.01 179.94 1cux h MET 98 N -0.01 0.98 -0.71 1.92 4.05 -1.08 -2.22 114.93 117.87 1cux h MET 98 Ca 0.03 -0.36 0.02 0.00 -0.28 0.00 0.00 59.70 59.11 1cux h MET 98 Cb 0.18 -0.06 -0.04 0.00 -0.80 0.00 0.00 31.60 30.88 1cux h MET 98 CO -0.00 1.03 0.46 -0.07 0.23 0.00 0.00 176.91 178.56 1cux h LEU 99 N 0.87 0.78 -1.60 3.39 3.38 -0.98 -1.59 115.31 119.56 1cux h LEU 99 Ca 0.14 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1cux h LEU 99 Cb 0.67 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1cux h LEU 99 CO 0.05 0.56 0.21 1.23 0.09 0.00 0.00 178.44 180.57 1cux h GLY 100 N 0.92 0.51 1.03 0.83 0.00 -0.85 -0.48 103.07 105.03 1cux h GLY 100 Ca 0.27 -0.20 -0.15 0.00 0.00 0.00 0.00 47.33 47.25 1cux h GLY 100 CO -0.07 0.20 -0.40 1.41 0.00 0.00 0.00 176.54 177.67 1cux h LEU 101 N 0.49 0.83 -0.80 3.11 3.38 -0.71 0.08 115.31 121.68 1cux h LEU 101 Ca 0.13 -0.51 -0.06 0.00 0.09 0.00 0.00 57.88 57.53 1cux h LEU 101 Cb -0.01 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 1cux h LEU 101 CO -0.02 1.18 0.24 -0.26 0.09 0.00 0.00 178.44 179.66 1cux h PHE 102 N 0.50 1.17 -0.53 1.13 0.04 -0.81 -0.06 116.94 118.38 1cux h PHE 102 Ca 0.03 -0.11 -0.08 0.00 2.80 0.00 0.00 57.97 60.61 1cux h PHE 102 Cb 0.99 -0.34 -0.02 0.00 2.20 0.00 0.00 35.95 38.78 1cux h PHE 102 CO 0.08 0.92 0.01 1.96 -0.60 0.00 0.00 178.31 180.68 1cux h GLN 103 N 1.09 0.88 -0.61 1.51 4.20 -0.98 -1.18 115.11 120.03 1cux h GLN 103 Ca 0.24 -0.25 -0.06 0.00 0.06 0.00 0.00 58.65 58.64 1cux h GLN 103 Cb 0.29 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.95 1cux h GLN 103 CO -0.01 0.87 0.13 1.96 -0.67 0.00 0.00 178.83 181.11 1cux h GLN 104 N 0.82 0.99 -0.56 1.46 4.20 -0.39 -1.49 115.11 120.14 1cux h GLN 104 Ca 0.16 -0.25 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 1cux h GLN 104 Cb 0.47 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.10 1cux h GLN 104 CO 0.02 0.91 0.31 0.00 -0.67 0.00 0.00 178.83 179.41 1cux h ALA 105 N 1.03 0.72 -0.56 3.87 0.00 -0.63 0.11 119.26 123.79 1cux h ALA 105 Ca 0.19 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1cux h ALA 105 Cb 0.38 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1cux h ALA 105 CO 0.01 0.23 0.15 -0.97 0.00 0.00 0.00 179.25 178.67 1cux h ASN 106 N 0.75 0.79 0.01 0.00 -1.24 -0.98 0.16 115.58 115.07 1cux h ASN 106 Ca 0.20 -0.13 -0.07 0.00 0.71 0.00 0.00 56.30 57.00 1cux h ASN 106 Cb 0.04 -0.21 0.01 0.00 0.73 0.00 0.00 38.32 38.89 1cux h ASN 106 CO -0.03 0.76 -0.28 0.74 -1.29 0.00 0.00 177.43 177.33 1cux h THR 107 N 0.83 1.57 -0.13 -3.57 2.02 -0.88 -3.11 112.91 109.63 1cux h THR 107 Ca 0.18 -2.04 -0.07 0.00 0.77 0.00 0.00 66.41 65.25 1cux h THR 107 Cb 0.27 2.87 -0.00 0.00 -1.74 0.00 0.00 68.15 69.55 1cux h THR 107 CO -0.00 0.56 -0.17 0.11 0.37 0.00 0.00 175.52 176.38 1cux h LYS 108 N -0.53 0.35 -2.44 6.66 1.57 -0.77 -3.40 116.57 118.01 1cux h LYS 108 Ca -0.04 -0.20 -0.59 0.00 -1.87 0.00 0.00 60.65 57.95 1cux h LYS 108 Cb 1.07 0.01 -0.39 0.00 0.08 0.00 0.00 32.23 33.00 1cux h LYS 108 CO 0.05 0.77 -0.88 0.00 -0.57 0.00 0.00 179.45 178.83 1cux h PRO 110 N 5.13 0.00 -0.02 0.00 0.13 -1.66 -2.74 132.00 132.83 1cux h PRO 110 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 1cux h PRO 110 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 1cux h PRO 110 CO 0.51 0.02 -0.14 -0.25 -0.23 0.00 0.00 178.00 177.90 1cux n ASP 111 N -3.21 2.09 -4.86 1.44 8.00 -1.26 -4.95 116.55 113.80 1cux n ASP 111 Ca -0.02 -1.59 -0.31 0.00 0.71 0.00 0.00 54.79 53.58 1cux n ASP 111 Cb 0.15 0.12 -0.00 0.00 -0.02 0.00 0.00 41.12 41.37 1cux n ASP 111 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1cux s ALA 112 N -2.18 3.08 -0.14 2.24 0.00 -1.03 -5.03 121.76 118.69 1cux s ALA 112 Ca 0.28 0.01 -0.12 0.00 0.00 0.00 0.00 51.96 52.13 1cux s ALA 112 Cb 0.20 -3.10 -0.05 0.00 0.00 0.00 0.00 23.12 20.17 1cux s ALA 112 CO 0.40 -0.56 0.25 0.99 0.00 0.00 0.00 175.76 176.85 1cux s THR 113 N -2.99 5.33 0.14 0.00 2.01 0.14 -4.96 115.64 115.31 1cux s THR 113 Ca 0.56 0.46 0.03 0.00 0.31 0.00 0.00 61.69 63.06 1cux s THR 113 Cb -0.11 -3.57 -0.04 0.00 0.01 0.00 0.00 72.50 68.79 1cux s THR 113 CO 0.46 0.47 0.18 -0.31 -0.69 0.00 0.00 174.62 174.73 1cux s TYR 114 N -0.03 3.29 0.02 4.92 2.02 -0.86 -1.50 117.35 125.20 1cux s TYR 114 Ca 0.16 0.06 -0.06 0.00 -0.37 0.00 0.00 57.07 56.86 1cux s TYR 114 Cb -0.13 -1.60 -0.00 0.00 -0.40 0.00 0.00 41.96 39.83 1cux s TYR 114 CO 0.04 0.53 0.11 0.96 -1.57 0.00 0.00 175.55 175.62 1cux s ILE 115 N -1.67 0.10 0.18 2.71 -4.36 -0.50 -0.55 121.20 117.11 1cux s ILE 115 Ca 0.32 -0.84 -0.02 0.00 -0.26 0.00 0.00 60.65 59.85 1cux s ILE 115 Cb -0.11 -0.58 -0.04 0.00 1.25 0.00 0.00 42.46 42.99 1cux s ILE 115 CO 0.25 -0.46 0.13 0.00 0.24 0.00 0.00 174.94 175.10 1cux s ALA 116 N -1.81 0.93 0.03 2.27 0.00 -0.79 -1.66 121.76 120.72 1cux s ALA 116 Ca -0.12 -1.54 -0.28 0.00 0.00 0.00 0.00 51.96 50.03 1cux s ALA 116 Cb -0.06 1.16 0.09 0.00 0.00 0.00 0.00 23.12 24.32 1cux s ALA 116 CO -0.01 -0.57 0.93 0.20 0.00 0.00 0.00 175.76 176.31 1cux s GLY 117 N -3.10 -0.40 -0.02 0.00 0.00 -0.84 -1.53 107.32 101.43 1cux s GLY 117 Ca 0.32 0.80 -0.29 0.00 0.00 0.00 0.00 44.72 45.55 1cux s GLY 117 CO 0.08 0.25 0.77 -0.32 0.00 0.00 0.00 173.10 173.88 1cux s GLY 118 N -2.60 -0.50 -0.06 0.20 0.00 -0.72 -1.30 107.32 102.33 1cux s GLY 118 Ca 0.07 1.25 0.03 0.00 0.00 0.00 0.00 44.72 46.08 1cux s GLY 118 CO -0.06 0.70 -0.16 -0.47 0.00 0.00 0.00 173.10 173.11 1cux s TYR 119 N -2.04 1.75 0.00 1.90 5.04 -0.91 -1.04 117.35 122.05 1cux s TYR 119 Ca -0.04 -0.62 0.00 0.00 -2.44 0.00 0.00 57.07 53.98 1cux s TYR 119 Cb -0.00 -1.22 0.00 0.00 0.35 0.00 0.00 41.96 41.09 1cux s TYR 119 CO 0.00 -0.26 0.00 0.45 -1.34 0.00 0.00 175.55 174.40 1cux n SER 120 N 3.52 0.00 -0.19 4.32 2.88 -0.06 -0.17 113.62 123.93 1cux n SER 120 Ca -0.20 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.45 1cux n SER 120 Cb 0.52 0.00 0.42 0.00 -0.75 0.00 0.00 64.21 64.41 1cux n SER 120 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 1cux h GLN 121 N 0.00 0.57 0.00 -1.46 4.15 -1.85 0.22 115.11 116.74 1cux h GLN 121 Ca 0.00 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.36 1cux h GLN 121 Cb 0.00 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 27.56 1cux h GLN 121 CO 0.00 0.38 -0.11 0.78 -1.93 0.00 0.00 178.83 177.95 1cux h GLY 122 N 0.59 0.00 1.10 2.39 0.00 -0.19 0.49 103.07 107.45 1cux h GLY 122 Ca 0.36 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.51 1cux h GLY 122 CO -0.13 0.00 -0.54 0.00 0.00 0.00 0.00 176.54 175.87 1cux h ALA 123 N 1.89 0.41 -0.59 3.60 0.00 -0.52 0.07 119.26 124.12 1cux h ALA 123 Ca -0.00 -0.51 -0.08 0.00 0.00 0.00 0.00 54.91 54.31 1cux h ALA 123 Cb 0.20 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1cux h ALA 123 CO 0.01 0.62 0.04 0.00 0.00 0.00 0.00 179.25 179.92 1cux h ALA 124 N 0.64 0.79 -0.26 0.00 0.00 -1.02 -1.31 119.26 118.09 1cux h ALA 124 Ca 0.00 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 1cux h ALA 124 Cb 1.15 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1cux h ALA 124 CO 0.12 0.59 0.16 1.25 0.00 0.00 0.00 179.25 181.37 1cux h LEU 125 N 0.91 0.32 -0.45 0.00 5.85 -0.82 0.36 115.31 121.47 1cux h LEU 125 Ca 0.17 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.85 1cux h LEU 125 Cb 0.50 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 1cux h LEU 125 CO 0.02 0.28 0.28 0.00 -0.34 0.00 0.00 178.44 178.69 1cux h ALA 126 N 1.05 0.57 -0.43 1.25 0.00 -0.78 -0.18 119.26 120.74 1cux h ALA 126 Ca 0.09 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1cux h ALA 126 Cb 0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1cux h ALA 126 CO -0.02 -0.01 0.21 0.00 0.00 0.00 0.00 179.25 179.43 1cux h ALA 127 N 1.18 0.56 -0.43 0.00 0.00 -0.97 -0.96 119.26 118.64 1cux h ALA 127 Ca 0.17 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1cux h ALA 127 Cb -0.03 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1cux h ALA 127 CO -0.06 0.11 0.11 0.00 0.00 0.00 0.00 179.25 179.41 1cux h ALA 128 N 1.06 0.57 -0.15 0.00 0.00 -0.66 -1.19 119.26 118.88 1cux h ALA 128 Ca 0.15 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1cux h ALA 128 Cb 0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1cux h ALA 128 CO -0.02 0.25 0.07 0.77 0.00 0.00 0.00 179.25 180.32 1cux h SER 129 N 0.56 0.20 -0.90 0.00 0.02 -0.86 -1.99 113.55 110.59 1cux h SER 129 Ca 0.14 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1cux h SER 129 Cb 0.32 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 62.76 1cux h SER 129 CO 0.00 0.29 0.51 0.40 -1.14 0.00 0.00 176.83 176.89 1cux h ILE 130 N 0.11 1.26 -0.89 3.27 2.04 -1.11 0.48 117.51 122.67 1cux h ILE 130 Ca 0.05 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.29 1cux h ILE 130 Cb 0.14 0.02 -0.04 0.00 -0.74 0.00 0.00 36.82 36.19 1cux h ILE 130 CO -0.01 0.28 0.52 -0.08 0.00 0.00 0.00 178.15 178.87 1cux h GLU 131 N 1.26 1.22 0.00 2.37 4.81 -0.98 -2.83 114.58 120.42 1cux h GLU 131 Ca 0.32 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 1cux h GLU 131 Cb 0.00 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.13 1cux h GLU 131 CO -0.05 0.86 -0.26 -0.44 -0.73 0.00 0.00 179.01 178.39 1cux h ASP 132 N 1.23 0.00 -3.80 1.04 5.19 -0.61 -3.48 116.42 115.99 1cux h ASP 132 Ca 0.32 -0.03 -0.56 0.00 -0.62 0.00 0.00 57.03 56.14 1cux h ASP 132 Cb -0.03 0.00 0.15 0.00 0.18 0.00 0.00 39.33 39.63 1cux h ASP 132 CO -0.06 0.01 0.43 0.18 -3.12 0.00 0.00 179.24 176.69 1cux n LEU 133 N -2.71 4.78 -4.74 1.55 4.77 0.09 -4.93 117.00 115.81 1cux n LEU 133 Ca 0.04 0.94 -0.42 0.00 -0.03 0.00 0.00 56.01 56.54 1cux n LEU 133 Cb 0.50 -1.51 -0.02 0.00 -2.33 0.00 0.00 43.42 40.06 1cux n LEU 133 CO 0.35 -1.00 1.23 -0.62 -1.33 0.00 0.00 177.39 176.01 1cux s ASP 134 N -0.99 6.46 0.30 -1.43 2.15 -1.26 -4.77 116.67 117.14 1cux s ASP 134 Ca 0.72 2.84 0.07 0.00 0.43 0.00 0.00 52.55 56.60 1cux s ASP 134 Cb -0.43 -2.62 0.80 0.00 -0.30 0.00 0.00 42.92 40.37 1cux s ASP 134 CO 0.49 -0.86 1.71 0.77 -0.17 0.00 0.00 175.17 177.12 1cux h SER 135 N 5.35 0.51 -0.28 -0.34 4.64 -1.95 -0.47 113.55 121.01 1cux h SER 135 Ca -0.46 0.14 -0.01 0.00 -0.47 0.00 0.00 61.79 61.00 1cux h SER 135 Cb 1.22 0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 63.37 1cux h SER 135 CO 0.82 0.06 0.16 0.00 -0.87 0.00 0.00 176.83 177.00 1cux h ALA 136 N 1.72 1.70 0.13 5.18 0.00 -1.99 -0.03 119.26 125.97 1cux h ALA 136 Ca 0.60 -0.06 -0.27 0.00 0.00 0.00 0.00 54.91 55.19 1cux h ALA 136 Cb 1.13 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1cux h ALA 136 CO -0.50 0.25 -1.33 0.82 0.00 0.00 0.00 179.25 178.50 1cux h ILE 137 N 0.43 1.12 -0.88 0.00 2.04 -1.52 -3.35 117.51 115.35 1cux h ILE 137 Ca 0.11 -2.44 0.11 0.00 1.00 0.00 0.00 64.86 63.64 1cux h ILE 137 Cb 0.03 2.81 -0.08 0.00 -0.74 0.00 0.00 36.82 38.84 1cux h ILE 137 CO -0.02 0.72 0.52 -0.09 0.00 0.00 0.00 178.15 179.27 1cux h ARG 138 N -0.28 0.81 0.00 2.37 2.43 -0.89 -0.09 114.38 118.73 1cux h ARG 138 Ca -0.28 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.84 1cux h ARG 138 Cb 1.77 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 31.14 1cux h ARG 138 CO 0.09 0.54 0.00 -0.25 -1.51 0.00 0.00 179.97 178.83 1cux n ASP 139 N -4.72 0.27 -0.06 -3.80 8.00 -0.05 -1.37 116.55 114.82 1cux n ASP 139 Ca 0.15 0.59 0.13 0.00 0.71 0.00 0.00 54.79 56.38 1cux n ASP 139 Cb 0.32 -0.64 0.36 0.00 -0.02 0.00 0.00 41.12 41.14 1cux n ASP 139 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1cux n LYS 140 N -1.83 0.24 -2.75 -1.24 5.02 -0.05 -4.73 118.16 112.83 1cux n LYS 140 Ca 0.01 -0.12 -0.42 0.00 -2.02 0.00 0.00 58.31 55.75 1cux n LYS 140 Cb 0.11 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.59 1cux n LYS 140 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1cux s ILE 141 N -2.84 4.16 0.33 -0.18 1.01 -0.47 -2.03 121.20 121.17 1cux s ILE 141 Ca 0.16 0.12 0.31 0.00 0.00 0.00 0.00 60.65 61.24 1cux s ILE 141 Cb 0.18 -4.71 0.33 0.00 0.01 0.00 0.00 42.46 38.28 1cux s ILE 141 CO 0.62 -1.45 2.05 0.00 0.00 0.00 0.00 174.94 176.16 1cux h ALA 142 N 9.61 1.13 -1.51 9.38 0.00 -1.11 -3.46 119.26 133.30 1cux h ALA 142 Ca -0.27 -0.08 0.10 0.00 0.00 0.00 0.00 54.91 54.65 1cux h ALA 142 Cb 1.06 -0.01 -0.24 0.00 0.00 0.00 0.00 17.79 18.61 1cux h ALA 142 CO 1.18 0.11 0.59 0.20 0.00 0.00 0.00 179.25 181.33 1cux s GLY 143 N -4.20 -0.23 -0.01 0.00 0.00 -1.26 -4.78 107.32 96.84 1cux s GLY 143 Ca -0.02 2.13 0.01 0.00 0.00 0.00 0.00 44.72 46.84 1cux s GLY 143 CO 0.56 1.06 -0.02 -1.59 0.00 0.00 0.00 173.10 173.11 1cux s THR 144 N -1.06 0.20 -0.09 0.90 2.01 -0.02 -1.89 115.64 115.70 1cux s THR 144 Ca -0.01 -0.03 0.03 0.00 0.31 0.00 0.00 61.69 61.99 1cux s THR 144 Cb -0.01 -0.23 -0.02 0.00 0.01 0.00 0.00 72.50 72.26 1cux s THR 144 CO 0.00 0.10 -0.17 0.68 -0.69 0.00 0.00 174.62 174.54 1cux s VAL 145 N 0.40 2.76 -0.09 3.82 -7.23 -0.58 -1.68 120.40 117.80 1cux s VAL 145 Ca -0.04 -0.80 0.03 0.00 -1.81 0.00 0.00 61.98 59.36 1cux s VAL 145 Cb -0.07 -2.10 0.01 0.00 0.56 0.00 0.00 36.38 34.79 1cux s VAL 145 CO -0.01 0.56 -0.17 -0.76 -0.31 0.00 0.00 175.10 174.41 1cux s LEU 146 N -0.12 1.82 -0.09 1.32 1.43 -0.56 -1.76 118.68 120.71 1cux s LEU 146 Ca -0.03 -0.43 0.00 0.00 -1.03 0.00 0.00 54.13 52.65 1cux s LEU 146 Cb -0.14 -1.11 -0.03 0.00 0.03 0.00 0.00 46.19 44.95 1cux s LEU 146 CO 0.04 0.06 -0.08 -0.36 0.23 0.00 0.00 176.35 176.24 1cux s PHE 147 N 0.69 2.90 -1.38 0.29 0.40 -0.21 -0.41 117.98 120.27 1cux s PHE 147 Ca -0.13 -0.18 -0.01 0.00 -0.60 0.00 0.00 56.93 56.00 1cux s PHE 147 Cb -0.16 -1.78 -0.00 0.00 0.51 0.00 0.00 43.02 41.59 1cux s PHE 147 CO 0.03 0.14 0.47 0.41 0.70 0.00 0.00 175.22 176.98 1cux n GLY 148 N 2.74 -0.28 3.57 4.36 0.00 -0.11 -0.88 105.19 114.60 1cux n GLY 148 Ca -0.18 0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 1cux n GLY 148 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1cux s TYR 149 N -3.89 1.18 0.53 1.61 5.04 -1.26 -3.33 117.35 117.22 1cux s TYR 149 Ca 0.03 1.04 0.41 0.00 -2.44 0.00 0.00 57.07 56.12 1cux s TYR 149 Cb -0.01 -3.78 2.15 0.00 0.35 0.00 0.00 41.96 40.67 1cux s TYR 149 CO 0.88 -3.21 2.27 1.79 -1.34 0.00 0.00 175.55 175.94 1cux h THR 150 N 7.38 0.03 -0.34 4.34 1.35 -1.75 -1.61 112.91 122.31 1cux h THR 150 Ca -0.32 -0.14 -0.09 0.00 -0.55 0.00 0.00 66.41 65.31 1cux h THR 150 Cb 1.25 1.13 -0.05 0.00 -1.73 0.00 0.00 68.15 68.74 1cux h THR 150 CO 1.07 0.00 0.01 0.29 -0.25 0.00 0.00 175.52 176.64 1cux n LYS 151 N -3.12 2.53 -0.04 4.72 4.76 -1.26 -4.76 118.16 120.99 1cux n LYS 151 Ca -0.02 -2.98 -0.08 0.00 -2.87 0.00 0.00 58.31 52.36 1cux n LYS 151 Cb 0.13 -1.86 -0.02 0.00 -1.84 0.00 0.00 35.03 31.44 1cux n LYS 151 CO 0.00 0.00 0.00 -0.97 -1.37 0.00 0.00 177.40 175.06 1cux h ASN 152 N 1.50 -0.06 -0.09 4.39 -0.73 -1.52 0.21 115.58 119.28 1cux h ASN 152 Ca 0.11 0.04 -0.04 0.00 1.87 0.00 0.00 56.30 58.28 1cux h ASN 152 Cb 1.61 0.07 -0.00 0.00 0.27 0.00 0.00 38.32 40.27 1cux h ASN 152 CO 0.33 -0.00 -0.11 0.25 -0.37 0.00 0.00 177.43 177.52 1cux h LEU 153 N 0.08 0.25 -1.09 0.34 5.85 -1.84 0.19 115.31 119.10 1cux h LEU 153 Ca 0.10 -0.51 0.05 0.00 0.84 0.00 0.00 57.88 58.35 1cux h LEU 153 Cb 0.12 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.02 1cux h LEU 153 CO -0.16 0.72 0.62 1.56 -0.34 0.00 0.00 178.44 180.84 1cux h GLN 154 N -0.20 1.11 -0.53 1.25 7.50 -1.87 -2.12 115.11 120.24 1cux h GLN 154 Ca 0.01 -0.07 0.00 0.00 0.50 0.00 0.00 58.65 59.09 1cux h GLN 154 Cb 0.66 -0.25 0.00 0.00 0.05 0.00 0.00 27.48 27.94 1cux h GLN 154 CO 0.03 0.73 0.00 0.09 -1.50 0.00 0.00 178.83 178.18 1cux n ASN 155 N -4.46 3.41 -3.53 1.46 3.02 0.05 -4.96 115.26 110.24 1cux n ASN 155 Ca 0.13 -1.98 -0.25 0.00 -0.03 0.00 0.00 54.58 52.45 1cux n ASN 155 Cb 0.14 -0.35 0.05 0.00 -0.61 0.00 0.00 39.78 39.00 1cux n ASN 155 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1cux n ARG 156 N 1.40 -6.11 -1.23 3.52 5.12 -0.57 -1.98 116.66 116.81 1cux n ARG 156 Ca 0.21 0.75 -0.08 0.00 -1.93 0.00 0.00 57.85 56.80 1cux n ARG 156 Cb 0.56 -5.68 -0.03 0.00 -1.16 0.00 0.00 32.46 26.15 1cux n ARG 156 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1cux n GLY 157 N -1.73 0.98 3.52 -0.13 0.00 0.58 -5.01 105.19 103.40 1cux n GLY 157 Ca -0.01 -0.47 -0.24 0.00 0.00 0.00 0.00 46.02 45.29 1cux n GLY 157 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1cux s ARG 158 N -2.48 1.77 -0.21 1.61 1.81 -0.84 -4.90 118.95 115.71 1cux s ARG 158 Ca 0.00 -1.96 -0.04 0.00 -1.72 0.00 0.00 55.73 52.01 1cux s ARG 158 Cb 0.00 -1.31 -0.01 0.00 -0.45 0.00 0.00 34.95 33.18 1cux s ARG 158 CO 0.00 -0.05 -0.03 0.42 -0.68 0.00 0.00 175.30 174.96 1cux s ILE 159 N -2.94 3.52 0.18 1.52 1.01 -1.26 -4.80 121.20 118.43 1cux s ILE 159 Ca 0.34 -0.45 -0.33 0.00 0.00 0.00 0.00 60.65 60.21 1cux s ILE 159 Cb 0.07 -2.60 -0.15 0.00 0.01 0.00 0.00 42.46 39.80 1cux s ILE 159 CO 0.16 0.42 1.32 -2.65 0.00 0.00 0.00 174.94 174.20 1cux n PRO 160 N 4.64 1.59 -1.14 2.79 -0.02 -1.26 -1.79 135.00 139.81 1cux n PRO 160 Ca -0.18 0.57 -0.05 0.00 -2.02 0.00 0.00 63.50 61.82 1cux n PRO 160 Cb 0.51 -2.18 -0.02 0.00 -0.02 0.00 0.00 33.50 31.79 1cux n PRO 160 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1cux n ASN 161 N 2.30 -4.55 -4.10 2.55 3.02 -1.26 -4.17 115.26 109.05 1cux n ASN 161 Ca 0.14 0.12 -0.25 0.00 -0.03 0.00 0.00 54.58 54.56 1cux n ASN 161 Cb 0.27 -2.49 -0.16 0.00 -0.61 0.00 0.00 39.78 36.79 1cux n ASN 161 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1cux s TYR 162 N -1.87 1.60 0.36 3.10 5.04 -0.74 -5.02 117.35 119.81 1cux s TYR 162 Ca 0.00 -0.49 -0.28 0.00 -2.44 0.00 0.00 57.07 53.85 1cux s TYR 162 Cb 0.00 -1.10 -0.11 0.00 0.35 0.00 0.00 41.96 41.10 1cux s TYR 162 CO 0.00 -0.19 1.44 -0.35 -1.34 0.00 0.00 175.55 175.11 1cux n PRO 163 N 3.33 2.52 -0.09 4.97 -0.04 -1.26 -4.53 135.00 139.90 1cux n PRO 163 Ca -0.19 0.88 -0.00 0.00 -0.04 0.00 0.00 63.50 64.15 1cux n PRO 163 Cb 0.53 -2.58 0.28 0.00 -0.04 0.00 0.00 33.50 31.68 1cux n PRO 163 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1cux h ALA 164 N 3.04 1.41 0.00 0.55 0.00 -1.93 -2.39 119.26 119.93 1cux h ALA 164 Ca -0.49 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1cux h ALA 164 Cb 1.25 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1cux h ALA 164 CO 0.65 0.45 0.00 0.38 0.00 0.00 0.00 179.25 180.73 1cux h ASP 165 N 0.72 0.00 -0.38 0.00 2.03 -2.01 -1.70 116.42 115.08 1cux h ASP 165 Ca 0.18 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.48 1cux h ASP 165 Cb 0.14 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.64 1cux h ASP 165 CO -0.02 0.00 0.00 0.54 -1.03 0.00 0.00 179.24 178.73 1cux n ARG 166 N -3.00 2.51 -4.88 4.15 1.74 -0.90 -4.93 116.66 111.35 1cux n ARG 166 Ca -0.01 -2.28 -0.33 0.00 -0.77 0.00 0.00 57.85 54.47 1cux n ARG 166 Cb 0.20 -1.52 -0.13 0.00 -1.02 0.00 0.00 32.46 29.99 1cux n ARG 166 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1cux s THR 167 N -1.52 3.04 -0.07 0.55 2.01 -0.64 -0.84 115.64 118.17 1cux s THR 167 Ca 0.39 -0.72 -0.01 0.00 0.31 0.00 0.00 61.69 61.66 1cux s THR 167 Cb 0.23 -2.20 0.03 0.00 0.01 0.00 0.00 72.50 70.56 1cux s THR 167 CO 0.32 0.58 -0.01 -0.75 -0.69 0.00 0.00 174.62 174.07 1cux s LYS 168 N -0.52 0.70 -0.13 4.92 2.20 -0.68 -4.96 119.74 121.27 1cux s LYS 168 Ca 0.07 0.05 -0.02 0.00 -0.36 0.00 0.00 55.97 55.70 1cux s LYS 168 Cb -0.12 -0.98 -0.03 0.00 -1.51 0.00 0.00 37.83 35.20 1cux s LYS 168 CO 0.01 -0.26 -0.04 0.08 -0.36 0.00 0.00 175.35 174.78 1cux s VAL 169 N 1.75 3.88 -0.35 4.02 1.01 -1.26 -1.50 120.40 127.94 1cux s VAL 169 Ca 0.02 -0.38 -0.04 0.00 0.00 0.00 0.00 61.98 61.58 1cux s VAL 169 Cb -0.13 -2.67 0.07 0.00 0.00 0.00 0.00 36.38 33.65 1cux s VAL 169 CO -0.04 0.53 0.10 -0.36 0.00 0.00 0.00 175.10 175.32 1cux s PHE 170 N -0.00 3.36 -0.21 5.22 0.08 0.45 -4.97 117.98 121.90 1cux s PHE 170 Ca 0.01 -1.89 -0.01 0.00 0.12 0.00 0.00 56.93 55.16 1cux s PHE 170 Cb -0.13 -2.53 0.06 0.00 -0.57 0.00 0.00 43.02 39.85 1cux s PHE 170 CO 0.03 -0.84 -0.02 0.00 -0.10 0.00 0.00 175.22 174.30 1cux s ASN 172 N 1.61 5.96 0.12 0.00 0.01 -1.26 -4.98 114.94 116.41 1cux s ASN 172 Ca -0.03 2.10 -0.31 0.00 -0.71 0.00 0.00 52.86 53.91 1cux s ASN 172 Cb -0.18 -2.58 -0.08 0.00 0.41 0.00 0.00 41.25 38.82 1cux s ASN 172 CO -0.07 -1.05 1.43 -0.89 -1.51 0.00 0.00 177.10 175.01 1cux s THR 173 N -1.82 3.17 0.00 1.60 2.01 -1.26 -1.65 115.64 117.69 1cux s THR 173 Ca 0.70 0.83 0.00 0.00 0.31 0.00 0.00 61.69 63.54 1cux s THR 173 Cb -0.22 -3.53 0.00 0.00 0.01 0.00 0.00 72.50 68.76 1cux s THR 173 CO 0.25 0.06 0.00 0.61 -0.69 0.00 0.00 174.62 174.85 1cux n GLY 174 N 3.56 0.84 3.53 4.40 0.00 -1.26 -4.86 105.19 111.40 1cux n GLY 174 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1cux n GLY 174 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1cux s ASP 175 N -2.72 6.21 0.59 1.61 -1.08 -0.66 -4.65 116.67 115.96 1cux s ASP 175 Ca 0.00 -0.72 0.28 0.00 -0.52 0.00 0.00 52.55 51.59 1cux s ASP 175 Cb 0.00 -2.53 1.54 0.00 -1.46 0.00 0.00 42.92 40.48 1cux s ASP 175 CO 0.00 -1.70 1.99 -0.07 0.52 0.00 0.00 175.17 175.91 1cux h LEU 176 N 12.58 0.00 -1.53 -1.34 3.38 -1.88 -1.55 115.31 124.97 1cux h LEU 176 Ca -0.22 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1cux h LEU 176 Cb 1.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 1cux h LEU 176 CO 1.27 0.00 -0.05 -0.37 0.09 0.00 0.00 178.44 179.38 1cux h VAL 177 N 0.00 0.15 0.00 1.22 -1.51 -1.70 -1.47 116.25 112.94 1cux h VAL 177 Ca 0.16 -0.60 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 1cux h VAL 177 Cb 0.88 1.51 0.00 0.00 -2.13 0.00 0.00 31.29 31.55 1cux h VAL 177 CO -0.00 0.05 -0.17 0.00 -1.23 0.00 0.00 177.57 176.22 1cux n THR 179 N -1.51 2.28 -0.35 0.00 -1.04 -0.59 -3.50 114.28 109.57 1cux n THR 179 Ca 0.06 -1.93 0.00 0.00 -2.04 0.00 0.00 64.05 60.14 1cux n THR 179 Cb 0.34 -0.26 0.00 0.00 -1.82 0.00 0.00 70.33 68.59 1cux n THR 179 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1cux n GLY 180 N -0.59 0.76 3.76 3.41 0.00 -1.21 -4.97 105.19 106.36 1cux n GLY 180 Ca 0.21 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.00 1cux n GLY 180 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1cux s SER 181 N -2.46 4.55 -0.04 1.61 0.15 -0.96 -5.04 113.70 111.50 1cux s SER 181 Ca 0.00 -1.00 0.10 0.00 0.70 0.00 0.00 55.95 55.75 1cux s SER 181 Cb 0.00 -0.51 0.28 0.00 -1.71 0.00 0.00 66.02 64.08 1cux s SER 181 CO 0.00 -0.54 1.22 0.18 1.20 0.00 0.00 173.24 175.30 1cux n LEU 182 N -1.28 2.86 -4.73 3.45 4.77 -1.26 -3.79 117.00 117.01 1cux n LEU 182 Ca -0.00 -2.28 -0.41 0.00 -0.03 0.00 0.00 56.01 53.28 1cux n LEU 182 Cb 0.64 -0.25 -0.04 0.00 -2.33 0.00 0.00 43.42 41.43 1cux n LEU 182 CO 0.45 0.67 0.75 -0.63 -1.33 0.00 0.00 177.39 177.30 1cux s ILE 183 N -1.50 4.18 -0.37 -0.08 -1.09 -1.26 -4.97 121.20 116.11 1cux s ILE 183 Ca 0.22 1.78 -0.15 0.00 -2.23 0.00 0.00 60.65 60.28 1cux s ILE 183 Cb 0.15 -4.14 -0.00 0.00 -1.58 0.00 0.00 42.46 36.89 1cux s ILE 183 CO 0.10 0.26 0.34 -0.69 -1.23 0.00 0.00 174.94 173.72 1cux s VAL 184 N 0.11 5.19 0.41 2.92 1.01 -1.26 -4.06 120.40 124.72 1cux s VAL 184 Ca 0.50 -0.20 0.07 0.00 0.00 0.00 0.00 61.98 62.35 1cux s VAL 184 Cb -0.27 -3.86 -0.06 0.00 0.00 0.00 0.00 36.38 32.19 1cux s VAL 184 CO 0.32 -0.18 0.14 0.00 0.00 0.00 0.00 175.10 175.38 1cux s ALA 185 N 1.93 3.49 0.25 5.51 0.00 -1.26 -5.04 121.76 126.64 1cux s ALA 185 Ca 0.10 -2.16 -0.03 0.00 0.00 0.00 0.00 51.96 49.86 1cux s ALA 185 Cb -0.17 -0.25 0.50 0.00 0.00 0.00 0.00 23.12 23.20 1cux s ALA 185 CO 0.12 -0.16 1.70 0.00 0.00 0.00 0.00 175.76 177.42 1cux h ALA 186 N 1.51 1.06 -0.01 0.00 0.00 -1.97 -1.03 119.26 118.81 1cux h ALA 186 Ca -0.43 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1cux h ALA 186 Cb 1.25 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 1cux h ALA 186 CO 0.73 -0.30 0.05 -1.35 0.00 0.00 0.00 179.25 178.37 1cux h PRO 187 N 0.34 0.00 0.00 0.00 0.11 -1.89 -0.68 132.00 129.88 1cux h PRO 187 Ca 0.44 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.53 1cux h PRO 187 Cb 0.74 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.85 1cux h PRO 187 CO -0.48 0.00 -0.07 1.25 -0.21 0.00 0.00 178.00 178.49 1cux h HIS 188 N 0.00 0.00 -0.57 0.65 2.76 -1.49 -2.68 115.15 113.82 1cux h HIS 188 Ca 0.01 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.18 1cux h HIS 188 Cb 0.10 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.06 1cux h HIS 188 CO 0.00 0.07 0.00 1.28 -1.30 0.00 0.00 177.93 177.98 1cux n LEU 189 N -3.24 4.47 -2.19 0.26 4.32 -0.26 -4.59 117.00 115.77 1cux n LEU 189 Ca -0.00 -2.46 -0.28 0.00 -0.02 0.00 0.00 56.01 53.25 1cux n LEU 189 Cb 0.31 -0.54 0.04 0.00 -1.62 0.00 0.00 43.42 41.61 1cux n LEU 189 CO 0.28 0.79 0.64 0.00 -1.22 0.00 0.00 177.39 177.89 1cux n ALA 190 N 0.88 5.51 0.61 -1.18 0.00 -1.01 -4.66 120.51 120.65 1cux n ALA 190 Ca 0.24 -3.74 0.12 0.00 0.00 0.00 0.00 53.44 50.05 1cux n ALA 190 Cb 0.84 -0.86 0.22 0.00 0.00 0.00 0.00 19.45 19.65 1cux n ALA 190 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1cux n TYR 191 N -0.75 0.35 -0.11 0.00 4.01 -1.26 -4.61 117.16 114.78 1cux n TYR 191 Ca 0.50 -0.17 -0.10 0.00 -0.16 0.00 0.00 57.90 57.97 1cux n TYR 191 Cb 0.82 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.80 1cux n TYR 191 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1cux h GLY 192 N 4.65 -0.56 0.47 2.72 0.00 -1.97 -1.75 103.07 106.63 1cux h GLY 192 Ca 0.00 0.54 0.11 0.00 0.00 0.00 0.00 47.33 47.98 1cux h GLY 192 CO 0.00 -0.19 0.52 -2.55 0.00 0.00 0.00 176.54 174.32 1cux h PRO 193 N -0.34 0.81 -0.56 4.80 0.11 -2.00 -2.02 132.00 132.80 1cux h PRO 193 Ca 0.13 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.16 1cux h PRO 193 Cb 0.59 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.49 1cux h PRO 193 CO -0.55 0.54 0.21 -0.44 -0.21 0.00 0.00 178.00 177.55 1cux h ASP 194 N 0.83 0.78 0.60 -2.05 3.32 -1.68 -1.88 116.42 116.35 1cux h ASP 194 Ca 0.44 -0.18 -0.03 0.00 0.02 0.00 0.00 57.03 57.28 1cux h ASP 194 Cb 0.43 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.78 1cux h ASP 194 CO -0.27 0.75 -0.15 0.00 -1.72 0.00 0.00 179.24 177.86 1cux h ALA 195 N 1.06 1.15 0.00 3.45 0.00 -0.73 -1.02 119.26 123.18 1cux h ALA 195 Ca 0.19 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 1cux h ALA 195 Cb 0.22 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1cux h ALA 195 CO -0.01 0.19 -0.95 0.00 0.00 0.00 0.00 179.25 178.47 1cux h ARG 196 N 0.00 0.00 0.00 0.00 3.08 -0.94 -3.30 114.38 113.21 1cux h ARG 196 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1cux h ARG 196 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1cux h ARG 196 CO 0.02 0.38 0.00 0.41 -1.07 0.00 0.00 179.97 179.71 1cux n GLY 197 N 1.30 0.24 0.37 0.04 0.00 -0.75 -4.86 105.19 101.53 1cux n GLY 197 Ca -0.03 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.11 1cux n GLY 197 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1cux h PRO 198 N 0.00 0.48 0.59 1.61 0.13 -1.76 -0.85 132.00 132.20 1cux h PRO 198 Ca 0.00 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 65.07 1cux h PRO 198 Cb 0.00 -0.11 0.01 0.00 0.13 0.00 0.00 31.00 31.03 1cux h PRO 198 CO 0.00 0.32 -0.28 0.00 -0.23 0.00 0.00 178.00 177.81 1cux h ALA 199 N 1.65 -0.79 -0.06 -0.56 0.00 -1.49 -0.09 119.26 117.91 1cux h ALA 199 Ca 0.34 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1cux h ALA 199 Cb 0.66 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1cux h ALA 199 CO -0.12 -0.84 -0.22 -1.00 0.00 0.00 0.00 179.25 177.08 1cux h PRO 200 N -1.00 0.11 -0.36 0.00 0.13 -1.75 -1.92 132.00 127.21 1cux h PRO 200 Ca -0.08 -0.03 0.03 0.00 -0.87 0.00 0.00 66.00 65.05 1cux h PRO 200 Cb 0.66 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.75 1cux h PRO 200 CO 0.13 0.32 0.17 1.49 -0.23 0.00 0.00 178.00 179.89 1cux h GLU 201 N 0.10 0.35 -0.13 0.86 4.81 -0.95 0.29 114.58 119.90 1cux h GLU 201 Ca 0.02 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1cux h GLU 201 Cb 0.44 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 1cux h GLU 201 CO 0.03 0.23 0.08 0.35 -0.73 0.00 0.00 179.01 178.97 1cux h PHE 202 N 0.36 0.18 -0.62 0.92 3.57 -0.56 -1.48 116.94 119.31 1cux h PHE 202 Ca 0.15 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.65 1cux h PHE 202 Cb 0.07 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 1cux h PHE 202 CO -0.10 0.17 0.40 -0.07 -2.23 0.00 0.00 178.31 176.48 1cux h LEU 203 N 0.13 0.72 -0.46 0.59 3.38 -1.01 -0.72 115.31 117.93 1cux h LEU 203 Ca 0.05 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1cux h LEU 203 Cb 0.05 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1cux h LEU 203 CO -0.01 0.53 0.21 0.40 0.09 0.00 0.00 178.44 179.66 1cux h ILE 204 N 0.84 1.19 -0.53 1.22 2.04 -0.84 -1.44 117.51 119.99 1cux h ILE 204 Ca 0.23 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.51 1cux h ILE 204 Cb -0.08 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 36.69 1cux h ILE 204 CO -0.05 0.22 0.34 -0.08 0.00 0.00 0.00 178.15 178.58 1cux h GLU 205 N 0.60 0.72 -0.26 2.37 4.81 -0.92 -0.66 114.58 121.24 1cux h GLU 205 Ca 0.16 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.25 1cux h GLU 205 Cb 0.15 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 1cux h GLU 205 CO -0.02 0.50 -0.20 0.87 -0.73 0.00 0.00 179.01 179.44 1cux h LYS 206 N 0.72 0.46 -0.13 1.92 1.79 -0.89 -0.56 116.57 119.89 1cux h LYS 206 Ca 0.19 -0.15 -0.06 0.00 -2.18 0.00 0.00 60.65 58.45 1cux h LYS 206 Cb -0.04 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 30.57 1cux h LYS 206 CO -0.04 0.64 -0.16 0.28 -1.08 0.00 0.00 179.45 179.09 1cux h VAL 207 N 0.42 1.36 0.00 0.50 2.07 -0.86 -3.16 116.25 116.58 1cux h VAL 207 Ca 0.07 -1.37 -0.06 0.00 0.82 0.00 0.00 66.70 66.16 1cux h VAL 207 Cb 0.59 1.97 -0.01 0.00 -1.52 0.00 0.00 31.29 32.32 1cux h VAL 207 CO 0.04 0.40 -0.26 0.03 0.02 0.00 0.00 177.57 177.79 1cux h ARG 208 N -0.07 0.00 -0.85 1.57 3.08 -0.96 0.28 114.38 117.43 1cux h ARG 208 Ca 0.02 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.09 1cux h ARG 208 Cb 0.71 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.72 1cux h ARG 208 CO 0.04 0.26 0.56 0.00 -1.07 0.00 0.00 179.97 179.76 1cux h ALA 209 N 1.74 1.44 0.00 0.04 0.00 -1.07 0.45 119.26 121.86 1cux h ALA 209 Ca -0.00 -0.05 -0.24 0.00 0.00 0.00 0.00 54.91 54.62 1cux h ALA 209 Cb 0.49 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1cux h ALA 209 CO 0.03 0.49 -2.14 1.33 0.00 0.00 0.00 179.25 178.96 1cux n VAL 210 N -4.43 0.98 0.19 0.00 0.24 -0.99 -4.47 118.33 109.83 1cux n VAL 210 Ca 0.11 -0.73 0.11 0.00 -2.04 0.00 0.00 64.34 61.78 1cux n VAL 210 Cb 0.08 -0.38 -0.10 0.00 -1.47 0.00 0.00 33.84 31.96 1cux n VAL 210 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1cux n ARG 211 N -2.64 0.54 0.00 7.34 1.74 0.05 -5.06 116.66 118.63 1cux n ARG 211 Ca -0.21 -0.09 0.00 0.00 -0.77 0.00 0.00 57.85 56.78 1cux n ARG 211 Cb 0.95 -1.59 0.00 0.00 -1.02 0.00 0.00 32.46 30.79 1cux n ARG 211 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1cux n GLY 212 N 1.28 1.41 0.00 -0.13 0.00 0.16 -5.02 105.19 102.89 1cux n GLY 212 Ca -0.02 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1cux n GLY 212 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06