#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cuw n THR 18 N 0.00 1.92 -3.83 0.55 -2.24 -1.26 -4.36 114.28 105.06 1cuw n THR 18 Ca 0.00 0.49 -0.26 0.00 -2.27 0.00 0.00 64.05 62.01 1cuw n THR 18 Cb 0.00 -1.49 -0.17 0.00 -2.10 0.00 0.00 70.33 66.57 1cuw n THR 18 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1cuw s THR 19 N -2.96 0.78 -0.05 4.28 2.01 -1.26 -0.20 115.64 118.24 1cuw s THR 19 Ca 0.00 -0.34 0.01 0.00 0.31 0.00 0.00 61.69 61.67 1cuw s THR 19 Cb 0.00 -0.98 0.02 0.00 0.01 0.00 0.00 72.50 71.55 1cuw s THR 19 CO 0.00 0.15 -0.06 -0.13 -0.69 0.00 0.00 174.62 173.89 1cuw s ARG 20 N 1.78 1.01 -0.29 4.92 1.81 -1.26 -5.01 118.95 121.91 1cuw s ARG 20 Ca 0.02 -0.17 0.14 0.00 -1.72 0.00 0.00 55.73 54.01 1cuw s ARG 20 Cb -0.14 -0.97 0.48 0.00 -0.45 0.00 0.00 34.95 33.87 1cuw s ARG 20 CO -0.07 -0.07 1.13 -0.25 -0.68 0.00 0.00 175.30 175.36 1cuw n ASP 21 N 4.03 3.25 -0.35 0.23 8.00 -1.25 -1.64 116.55 128.84 1cuw n ASP 21 Ca -0.24 -2.96 0.07 0.00 0.71 0.00 0.00 54.79 52.37 1cuw n ASP 21 Cb 0.51 -0.42 0.25 0.00 -0.02 0.00 0.00 41.12 41.44 1cuw n ASP 21 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1cuw h ASP 22 N 2.46 0.90 0.47 -2.24 3.32 -1.72 -2.48 116.42 117.13 1cuw h ASP 22 Ca 0.12 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.19 1cuw h ASP 22 Cb 1.34 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1cuw h ASP 22 CO 0.51 0.49 -0.22 0.25 -1.72 0.00 0.00 179.24 178.55 1cuw h LEU 23 N 0.97 -0.53 -1.29 1.55 5.85 -1.91 -0.21 115.31 119.73 1cuw h LEU 23 Ca 0.48 0.02 0.47 0.00 0.84 0.00 0.00 57.88 59.68 1cuw h LEU 23 Cb 0.47 0.14 -0.15 0.00 0.37 0.00 0.00 40.66 41.49 1cuw h LEU 23 CO -0.24 -0.17 0.80 -0.38 -0.34 0.00 0.00 178.44 178.11 1cuw n ILE 24 N -4.84 -0.30 -0.03 4.05 5.41 -1.16 -1.00 119.36 121.49 1cuw n ILE 24 Ca -0.08 1.87 0.05 0.00 1.00 0.00 0.00 62.75 65.59 1cuw n ILE 24 Cb 0.25 -3.05 -0.16 0.00 -0.71 0.00 0.00 39.64 35.96 1cuw n ILE 24 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1cuw n ASN 25 N -4.86 0.05 -4.62 4.38 3.02 -0.94 -4.99 115.26 107.29 1cuw n ASN 25 Ca 0.40 0.02 -0.40 0.00 -0.03 0.00 0.00 54.58 54.57 1cuw n ASN 25 Cb 1.51 1.66 0.03 0.00 -0.61 0.00 0.00 39.78 42.36 1cuw n ASN 25 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1cuw n GLY 26 N 1.38 -0.24 3.80 7.41 0.00 -0.09 -4.99 105.19 112.47 1cuw n GLY 26 Ca -0.11 0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 1cuw n GLY 26 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1cuw s ASN 27 N -0.95 5.82 0.52 1.61 0.01 -1.26 -4.98 114.94 115.71 1cuw s ASN 27 Ca 0.68 0.24 0.26 0.00 -0.71 0.00 0.00 52.86 53.34 1cuw s ASN 27 Cb -0.48 -1.74 1.41 0.00 0.41 0.00 0.00 41.25 40.84 1cuw s ASN 27 CO 0.53 0.33 1.76 -1.28 -1.51 0.00 0.00 177.10 176.93 1cuw h SER 28 N 4.51 0.00 0.38 -1.22 0.87 -1.94 0.59 113.55 116.75 1cuw h SER 28 Ca -0.51 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 1cuw h SER 28 Cb 1.20 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 1cuw h SER 28 CO 0.60 0.00 -0.38 0.00 -0.53 0.00 0.00 176.83 176.52 1cuw n ALA 29 N -1.80 3.32 -3.17 6.23 0.00 -1.26 -4.30 120.51 119.53 1cuw n ALA 29 Ca -0.02 -0.37 -0.20 0.00 0.00 0.00 0.00 53.44 52.85 1cuw n ALA 29 Cb 0.27 -1.13 -0.04 0.00 0.00 0.00 0.00 19.45 18.55 1cuw n ALA 29 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1cuw n SER 30 N -1.11 1.18 -4.77 0.00 3.41 0.20 -5.12 113.62 107.41 1cuw n SER 30 Ca 0.09 -3.04 -0.39 0.00 -0.26 0.00 0.00 58.87 55.27 1cuw n SER 30 Cb 0.34 -0.62 -0.05 0.00 -0.26 0.00 0.00 64.21 63.62 1cuw n SER 30 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1cuw s ALA 32 N -1.36 2.61 -0.11 0.00 0.00 -1.26 -5.02 121.76 116.62 1cuw s ALA 32 Ca 0.48 -0.82 0.10 0.00 0.00 0.00 0.00 51.96 51.72 1cuw s ALA 32 Cb -0.26 -2.87 -0.24 0.00 0.00 0.00 0.00 23.12 19.76 1cuw s ALA 32 CO 0.32 -1.83 0.42 -0.25 0.00 0.00 0.00 175.76 174.43 1cuw n ASP 33 N -3.39 0.93 -4.08 0.00 8.00 -0.92 -4.61 116.55 112.47 1cuw n ASP 33 Ca 0.10 0.25 -0.22 0.00 0.71 0.00 0.00 54.79 55.63 1cuw n ASP 33 Cb 0.61 0.04 -0.15 0.00 -0.02 0.00 0.00 41.12 41.59 1cuw n ASP 33 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1cuw s VAL 34 N -2.56 1.07 -0.11 2.53 1.01 -1.16 -0.53 120.40 120.66 1cuw s VAL 34 Ca -0.11 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.33 1cuw s VAL 34 Cb 0.07 -0.91 0.02 0.00 0.00 0.00 0.00 36.38 35.56 1cuw s VAL 34 CO 0.80 0.31 -0.14 -0.63 0.00 0.00 0.00 175.10 175.44 1cuw s ILE 35 N -0.15 1.43 -0.22 2.22 1.01 -0.38 -1.36 121.20 123.75 1cuw s ILE 35 Ca 0.02 -0.60 -0.05 0.00 0.00 0.00 0.00 60.65 60.02 1cuw s ILE 35 Cb -0.07 -1.32 -0.02 0.00 0.01 0.00 0.00 42.46 41.06 1cuw s ILE 35 CO 0.00 0.43 0.00 0.12 0.00 0.00 0.00 174.94 175.49 1cuw s PHE 36 N 1.03 3.02 -0.16 3.97 5.36 -0.35 -1.52 117.98 129.33 1cuw s PHE 36 Ca -0.06 -0.60 0.00 0.00 -0.96 0.00 0.00 56.93 55.32 1cuw s PHE 36 Cb -0.15 -2.12 0.00 0.00 -0.34 0.00 0.00 43.02 40.41 1cuw s PHE 36 CO -0.02 -0.36 -0.16 0.42 -1.46 0.00 0.00 175.22 173.64 1cuw s ILE 37 N 1.28 2.53 0.04 3.12 1.01 -0.72 0.24 121.20 128.69 1cuw s ILE 37 Ca 0.04 -0.81 0.05 0.00 0.00 0.00 0.00 60.65 59.92 1cuw s ILE 37 Cb -0.15 -2.06 -0.02 0.00 0.01 0.00 0.00 42.46 40.24 1cuw s ILE 37 CO 0.01 0.52 -0.14 -0.47 0.00 0.00 0.00 174.94 174.86 1cuw s TYR 38 N 0.92 1.18 -0.13 3.97 5.04 -0.18 -2.28 117.35 125.87 1cuw s TYR 38 Ca -0.03 -0.37 0.02 0.00 -2.44 0.00 0.00 57.07 54.24 1cuw s TYR 38 Cb -0.15 -0.69 -0.00 0.00 0.35 0.00 0.00 41.96 41.46 1cuw s TYR 38 CO -0.02 0.03 -0.18 0.00 -1.34 0.00 0.00 175.55 174.04 1cuw s ALA 39 N -0.94 2.40 0.97 3.97 0.00 -0.92 -1.64 121.76 125.59 1cuw s ALA 39 Ca 0.00 -0.99 -0.15 0.00 0.00 0.00 0.00 51.96 50.82 1cuw s ALA 39 Cb -0.08 -1.07 0.18 0.00 0.00 0.00 0.00 23.12 22.15 1cuw s ALA 39 CO 0.01 0.12 1.21 -0.98 0.00 0.00 0.00 175.76 176.13 1cuw s ARG 40 N 0.57 0.63 0.78 0.00 1.70 -1.26 -2.20 118.95 119.18 1cuw s ARG 40 Ca -0.11 -0.07 -0.04 0.00 -0.47 0.00 0.00 55.73 55.04 1cuw s ARG 40 Cb -0.16 -1.81 0.15 0.00 -0.57 0.00 0.00 34.95 32.55 1cuw s ARG 40 CO 0.04 -2.47 1.08 0.20 -1.08 0.00 0.00 175.30 173.06 1cuw s GLY 41 N -4.42 1.76 0.18 3.88 0.00 -1.17 -2.29 107.32 105.26 1cuw s GLY 41 Ca 0.69 -1.65 -0.31 0.00 0.00 0.00 0.00 44.72 43.45 1cuw s GLY 41 CO 0.53 -1.02 1.48 -0.56 0.00 0.00 0.00 173.10 173.52 1cuw s SER 42 N -4.79 6.68 0.00 1.64 0.01 -1.26 -2.56 113.70 113.42 1cuw s SER 42 Ca 0.68 2.55 0.00 0.00 1.31 0.00 0.00 55.95 60.49 1cuw s SER 42 Cb -0.05 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.58 1cuw s SER 42 CO 0.46 -0.73 0.00 0.41 0.41 0.00 0.00 173.24 173.79 1cuw n THR 43 N 3.44 0.00 -2.01 1.44 -1.04 0.22 -4.97 114.28 111.37 1cuw n THR 43 Ca 0.11 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.77 1cuw n THR 43 Cb 0.40 -0.52 0.03 0.00 -1.82 0.00 0.00 70.33 68.42 1cuw n THR 43 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1cuw s GLU 44 N -1.03 3.04 0.62 -2.82 2.02 -1.06 -5.00 118.70 114.47 1cuw s GLU 44 Ca 0.00 1.57 -0.13 0.00 0.02 0.00 0.00 54.97 56.43 1cuw s GLU 44 Cb 0.00 -1.97 -0.03 0.00 0.10 0.00 0.00 34.13 32.23 1cuw s GLU 44 CO 0.00 -1.09 1.04 0.95 0.02 0.00 0.00 175.26 176.18 1cuw s THR 45 N -1.96 4.26 0.00 3.63 -4.23 -1.26 -4.86 115.64 111.22 1cuw s THR 45 Ca 0.71 0.87 0.00 0.00 -1.18 0.00 0.00 61.69 62.09 1cuw s THR 45 Cb -0.24 -3.58 0.00 0.00 1.34 0.00 0.00 72.50 70.02 1cuw s THR 45 CO 0.34 -0.83 0.00 0.61 -0.54 0.00 0.00 174.62 174.20 1cuw n GLY 46 N -1.89 2.54 0.00 3.99 0.00 -1.26 -2.04 105.19 106.52 1cuw n GLY 46 Ca 0.07 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1cuw n GLY 46 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1cuw n ASN 47 N 0.27 0.70 -0.00 1.61 2.04 -0.04 -4.71 115.26 115.14 1cuw n ASN 47 Ca 0.00 -0.87 0.02 0.00 -0.44 0.00 0.00 54.58 53.29 1cuw n ASN 47 Cb 0.00 0.23 -0.03 0.00 -2.53 0.00 0.00 39.78 37.45 1cuw n ASN 47 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 1cuw n LEU 48 N -0.23 0.21 0.00 -4.53 4.77 0.72 -3.73 117.00 114.21 1cuw n LEU 48 Ca 0.00 -0.46 0.00 0.00 -0.03 0.00 0.00 56.01 55.52 1cuw n LEU 48 Cb 0.01 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1cuw n LEU 48 CO 0.00 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.72 1cuw n GLY 49 N 1.19 0.93 0.15 -0.72 0.00 -0.87 -0.80 105.19 105.07 1cuw n GLY 49 Ca 0.01 -0.67 -0.11 0.00 0.00 0.00 0.00 46.02 45.24 1cuw n GLY 49 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1cuw h THR 50 N 0.00 0.79 0.00 2.61 1.35 -1.98 -3.33 112.91 112.35 1cuw h THR 50 Ca 0.00 -0.97 0.00 0.00 -0.55 0.00 0.00 66.41 64.89 1cuw h THR 50 Cb 0.00 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 67.69 1cuw h THR 50 CO 0.00 0.19 0.00 -0.07 -0.25 0.00 0.00 175.52 175.39 1cuw h LEU 51 N -0.84 0.00 0.47 3.87 3.38 -1.99 -3.38 115.31 116.82 1cuw h LEU 51 Ca -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1cuw h LEU 51 Cb 0.52 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1cuw h LEU 51 CO 0.05 0.00 -0.49 1.23 0.09 0.00 0.00 178.44 179.32 1cuw h GLY 52 N 3.38 -1.25 1.01 0.83 0.00 -1.08 -3.16 103.07 102.81 1cuw h GLY 52 Ca 0.00 0.58 0.08 0.00 0.00 0.00 0.00 47.33 47.99 1cuw h GLY 52 CO 0.00 -0.37 0.46 -2.55 0.00 0.00 0.00 176.54 174.09 1cuw h PRO 53 N -0.97 0.65 -0.16 4.80 0.11 -1.78 -2.64 132.00 132.02 1cuw h PRO 53 Ca -0.06 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.01 1cuw h PRO 53 Cb 0.84 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.80 1cuw h PRO 53 CO -0.07 0.43 0.10 0.77 -0.21 0.00 0.00 178.00 179.03 1cuw h SER 54 N 0.67 0.18 -0.32 -2.05 0.02 -1.77 -1.66 113.55 108.63 1cuw h SER 54 Ca 0.31 -0.02 -0.07 0.00 -0.84 0.00 0.00 61.79 61.17 1cuw h SER 54 Cb 0.35 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.84 1cuw h SER 54 CO -0.11 0.15 -0.08 0.40 -1.14 0.00 0.00 176.83 176.05 1cuw h ILE 55 N 0.20 1.28 -0.77 3.27 2.04 -1.49 -3.04 117.51 119.00 1cuw h ILE 55 Ca 0.06 -1.12 0.04 0.00 1.00 0.00 0.00 64.86 64.83 1cuw h ILE 55 Cb -0.01 1.36 -0.04 0.00 -0.74 0.00 0.00 36.82 37.39 1cuw h ILE 55 CO -0.01 0.36 0.51 0.00 0.00 0.00 0.00 178.15 179.01 1cuw h ALA 56 N 0.80 1.56 0.84 1.87 0.00 -1.37 -1.73 119.26 121.22 1cuw h ALA 56 Ca 0.08 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1cuw h ALA 56 Cb 0.57 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.11 1cuw h ALA 56 CO 0.03 0.36 -0.41 0.77 0.00 0.00 0.00 179.25 180.01 1cuw h SER 57 N 0.93 -0.96 -0.54 0.00 0.02 -1.20 -1.11 113.55 110.69 1cuw h SER 57 Ca 0.31 0.03 0.08 0.00 -0.84 0.00 0.00 61.79 61.37 1cuw h SER 57 Cb 0.07 0.25 -0.07 0.00 0.14 0.00 0.00 62.40 62.79 1cuw h SER 57 CO -0.09 -0.62 0.17 0.78 -1.14 0.00 0.00 176.83 175.92 1cuw h ASN 58 N -1.25 0.14 -0.43 3.07 2.35 -1.44 -1.03 115.58 116.98 1cuw h ASN 58 Ca -0.12 0.08 0.06 0.00 -0.55 0.00 0.00 56.30 55.78 1cuw h ASN 58 Cb 0.88 0.08 -0.06 0.00 0.05 0.00 0.00 38.32 39.27 1cuw h ASN 58 CO 0.19 0.10 0.10 -0.07 -1.65 0.00 0.00 177.43 176.10 1cuw h LEU 59 N 0.33 0.05 -1.31 1.61 3.38 -1.27 -1.12 115.31 116.98 1cuw h LEU 59 Ca 0.27 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.30 1cuw h LEU 59 Cb 0.33 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1cuw h LEU 59 CO -0.30 0.06 0.36 -0.33 0.09 0.00 0.00 178.44 178.33 1cuw h GLU 60 N 0.24 0.83 -0.46 1.13 5.08 -0.22 -1.87 114.58 119.32 1cuw h GLU 60 Ca 0.21 -0.07 0.05 0.00 -1.00 0.00 0.00 59.36 58.54 1cuw h GLU 60 Cb 0.24 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.27 1cuw h GLU 60 CO -0.25 0.59 0.21 0.77 -1.00 0.00 0.00 179.01 179.32 1cuw h SER 61 N 0.85 0.27 0.19 1.42 0.02 0.02 0.50 113.55 116.82 1cuw h SER 61 Ca 0.22 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.20 1cuw h SER 61 Cb -0.02 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.51 1cuw h SER 61 CO -0.04 0.19 -0.09 0.00 -1.14 0.00 0.00 176.83 175.75 1cuw h ALA 62 N 1.27 -0.26 -0.01 3.77 0.00 -0.87 -3.35 119.26 119.81 1cuw h ALA 62 Ca 0.21 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1cuw h ALA 62 Cb 0.16 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1cuw h ALA 62 CO -0.17 -0.36 -0.43 1.19 0.00 0.00 0.00 179.25 179.47 1cuw n PHE 63 N -4.97 0.00 -0.10 0.00 3.72 -0.77 -5.07 117.46 110.27 1cuw n PHE 63 Ca -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 1cuw n PHE 63 Cb 0.26 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 1cuw n PHE 63 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1cuw n GLY 64 N 1.40 -3.06 0.27 1.37 0.00 0.17 -3.61 105.19 101.74 1cuw n GLY 64 Ca 0.09 -1.15 -0.06 0.00 0.00 0.00 0.00 46.02 44.90 1cuw n GLY 64 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1cuw n LYS 65 N -1.05 -0.27 0.08 1.61 4.76 -1.25 -0.00 118.16 122.05 1cuw n LYS 65 Ca 0.00 0.99 0.12 0.00 -2.87 0.00 0.00 58.31 56.55 1cuw n LYS 65 Cb 0.00 -1.45 0.46 0.00 -1.84 0.00 0.00 35.03 32.20 1cuw n LYS 65 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1cuw n ASP 66 N -4.84 0.54 -0.15 4.39 9.92 -1.26 -3.17 116.55 121.99 1cuw n ASP 66 Ca 0.02 0.59 0.13 0.00 -0.53 0.00 0.00 54.79 55.00 1cuw n ASP 66 Cb 0.18 -0.72 0.44 0.00 -0.64 0.00 0.00 41.12 40.39 1cuw n ASP 66 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1cuw n GLY 67 N 0.73 -0.88 3.03 0.44 0.00 1.00 -4.64 105.19 104.86 1cuw n GLY 67 Ca 0.04 -0.33 -0.13 0.00 0.00 0.00 0.00 46.02 45.60 1cuw n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cuw s VAL 68 N -2.61 -0.02 -0.05 1.61 0.11 -1.13 -2.17 120.40 116.14 1cuw s VAL 68 Ca 0.23 0.08 -0.03 0.00 -2.93 0.00 0.00 61.98 59.32 1cuw s VAL 68 Cb 0.19 -0.28 -0.04 0.00 -1.53 0.00 0.00 36.38 34.72 1cuw s VAL 68 CO 0.54 0.03 0.13 0.26 -3.33 0.00 0.00 175.10 172.73 1cuw s TRP 69 N 0.61 3.47 -0.08 1.54 0.51 -0.46 -4.85 118.94 119.67 1cuw s TRP 69 Ca -0.04 0.36 0.05 0.00 -2.12 0.00 0.00 56.10 54.34 1cuw s TRP 69 Cb -0.06 -1.84 -0.00 0.00 -0.81 0.00 0.00 33.47 30.76 1cuw s TRP 69 CO -0.03 0.64 -0.24 0.42 -0.51 0.00 0.00 176.95 177.23 1cuw s ILE 70 N -1.17 2.00 -0.02 2.03 -1.09 -1.26 -1.21 121.20 120.48 1cuw s ILE 70 Ca 0.21 -1.01 0.00 0.00 -2.23 0.00 0.00 60.65 57.63 1cuw s ILE 70 Cb -0.12 -1.71 0.03 0.00 -1.58 0.00 0.00 42.46 39.07 1cuw s ILE 70 CO 0.12 0.55 0.03 -1.58 -1.23 0.00 0.00 174.94 172.83 1cuw s GLN 71 N 0.14 -0.02 0.37 2.79 2.00 0.14 -1.69 119.66 123.39 1cuw s GLN 71 Ca -0.12 0.17 0.03 0.00 -2.00 0.00 0.00 55.36 53.44 1cuw s GLN 71 Cb -0.16 -0.25 -0.01 0.00 0.80 0.00 0.00 33.01 33.39 1cuw s GLN 71 CO 0.06 -0.16 0.55 0.20 -0.50 0.00 0.00 175.29 175.45 1cuw s GLY 72 N 1.02 1.50 -0.34 2.59 0.00 -0.65 -1.01 107.32 110.43 1cuw s GLY 72 Ca -0.09 -1.18 -0.12 0.00 0.00 0.00 0.00 44.72 43.34 1cuw s GLY 72 CO -0.03 -1.07 0.21 0.14 0.00 0.00 0.00 173.10 172.34 1cuw s VAL 73 N -2.33 4.94 0.00 1.40 1.01 -0.65 -4.83 120.40 119.94 1cuw s VAL 73 Ca 0.44 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.03 1cuw s VAL 73 Cb -0.10 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.71 1cuw s VAL 73 CO 0.34 -0.03 0.00 0.61 0.00 0.00 0.00 175.10 176.03 1cuw n GLY 74 N 5.05 2.53 7.00 4.51 0.00 -1.26 -4.78 105.19 118.24 1cuw n GLY 74 Ca -0.13 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1cuw n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cuw n GLY 75 N 4.56 4.04 0.26 -0.02 0.00 -1.26 -1.41 105.19 111.36 1cuw n GLY 75 Ca 0.00 0.19 0.15 0.00 0.00 0.00 0.00 46.02 46.36 1cuw n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cuw h ALA 76 N -0.99 1.04 -1.73 4.61 0.00 -1.94 -3.42 119.26 116.83 1cuw h ALA 76 Ca 0.00 -0.07 -0.55 0.00 0.00 0.00 0.00 54.91 54.29 1cuw h ALA 76 Cb 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 1cuw h ALA 76 CO 0.00 0.09 1.25 -0.47 0.00 0.00 0.00 179.25 180.13 1cuw s TYR 77 N -3.75 1.90 -1.96 0.00 5.04 -0.50 -4.42 117.35 113.66 1cuw s TYR 77 Ca 0.00 0.67 0.17 0.00 -2.44 0.00 0.00 57.07 55.47 1cuw s TYR 77 Cb 0.10 -4.17 0.22 0.00 0.35 0.00 0.00 41.96 38.46 1cuw s TYR 77 CO 0.57 -2.54 1.13 0.54 -1.34 0.00 0.00 175.55 173.90 1cuw n ARG 78 N 8.59 1.72 -3.63 4.97 5.12 -1.26 -4.73 116.66 127.44 1cuw n ARG 78 Ca 0.20 -1.72 -0.27 0.00 -1.93 0.00 0.00 57.85 54.13 1cuw n ARG 78 Cb 0.49 -1.35 -0.01 0.00 -1.16 0.00 0.00 32.46 30.43 1cuw n ARG 78 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1cuw n ALA 79 N 0.99 -1.13 -1.34 7.54 0.00 -1.26 -4.75 120.51 120.56 1cuw n ALA 79 Ca 0.12 0.06 -0.34 0.00 0.00 0.00 0.00 53.44 53.28 1cuw n ALA 79 Cb 0.45 -3.03 0.09 0.00 0.00 0.00 0.00 19.45 16.96 1cuw n ALA 79 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1cuw s THR 80 N -3.03 2.50 0.15 0.00 2.01 -1.26 -0.61 115.64 115.40 1cuw s THR 80 Ca 0.51 0.24 0.05 0.00 0.31 0.00 0.00 61.69 62.80 1cuw s THR 80 Cb -0.27 -2.76 -0.18 0.00 0.01 0.00 0.00 72.50 69.30 1cuw s THR 80 CO 0.63 -0.14 1.33 -0.07 -0.69 0.00 0.00 174.62 175.68 1cuw h LEU 81 N -0.36 0.11 -0.63 4.42 -0.00 -1.96 -3.34 115.31 113.55 1cuw h LEU 81 Ca -0.47 -0.11 -0.11 0.00 -0.00 0.00 0.00 57.88 57.19 1cuw h LEU 81 Cb 1.28 -0.04 -0.02 0.00 -0.00 0.00 0.00 40.66 41.89 1cuw h LEU 81 CO 0.50 0.99 -0.13 0.00 -0.00 0.00 0.00 178.44 179.80 1cuw h ALA 82 N 1.00 0.83 0.00 1.53 0.00 -2.02 -3.24 119.26 117.35 1cuw h ALA 82 Ca -0.03 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1cuw h ALA 82 Cb 1.64 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.24 1cuw h ALA 82 CO 0.13 0.65 0.00 -0.25 0.00 0.00 0.00 179.25 179.79 1cuw n ASP 83 N -4.14 0.00 0.01 0.00 8.00 -1.25 -2.05 116.55 117.11 1cuw n ASP 83 Ca 0.01 0.30 0.10 0.00 0.71 0.00 0.00 54.79 55.91 1cuw n ASP 83 Cb 0.40 -0.37 0.45 0.00 -0.02 0.00 0.00 41.12 41.58 1cuw n ASP 83 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1cuw n ASN 84 N -1.37 0.09 -1.50 -2.24 3.02 -1.22 -2.46 115.26 109.57 1cuw n ASN 84 Ca 0.03 0.51 0.09 0.00 -0.03 0.00 0.00 54.58 55.19 1cuw n ASN 84 Cb 0.09 -0.54 0.34 0.00 -0.61 0.00 0.00 39.78 39.06 1cuw n ASN 84 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1cuw n PHE 85 N -1.59 1.47 -3.61 3.10 3.01 -0.87 -4.56 117.46 114.41 1cuw n PHE 85 Ca 0.05 -0.66 -0.29 0.00 1.01 0.00 0.00 57.45 57.56 1cuw n PHE 85 Cb 0.25 -0.29 -0.04 0.00 -0.01 0.00 0.00 39.48 39.40 1cuw n PHE 85 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1cuw s LEU 86 N -2.09 4.21 0.22 4.37 1.43 -1.15 -4.98 118.68 120.69 1cuw s LEU 86 Ca 0.49 0.54 0.09 0.00 -1.03 0.00 0.00 54.13 54.21 1cuw s LEU 86 Cb 0.33 -3.30 0.71 0.00 0.03 0.00 0.00 46.19 43.96 1cuw s LEU 86 CO 0.20 -0.04 1.01 -2.65 0.23 0.00 0.00 176.35 175.10 1cuw n PRO 87 N -0.44 -0.04 -0.65 1.29 -0.02 -1.26 -0.55 135.00 133.32 1cuw n PRO 87 Ca -0.03 0.91 0.08 0.00 -2.02 0.00 0.00 63.50 62.44 1cuw n PRO 87 Cb 0.53 -1.56 0.33 0.00 -0.02 0.00 0.00 33.50 32.78 1cuw n PRO 87 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1cuw n ARG 88 N -4.60 3.89 -1.16 -0.52 1.74 -1.26 -4.94 116.66 109.81 1cuw n ARG 88 Ca 0.21 -2.94 -0.05 0.00 -0.77 0.00 0.00 57.85 54.29 1cuw n ARG 88 Cb 0.69 -1.99 -0.02 0.00 -1.02 0.00 0.00 32.46 30.12 1cuw n ARG 88 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1cuw n GLY 89 N 0.33 0.75 3.60 -0.13 0.00 0.28 -4.73 105.19 105.29 1cuw n GLY 89 Ca 0.24 -0.32 0.01 0.00 0.00 0.00 0.00 46.02 45.95 1cuw n GLY 89 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1cuw s THR 90 N -1.99 0.00 0.85 2.61 -1.32 -1.03 -4.53 115.64 110.22 1cuw s THR 90 Ca 0.00 -0.04 -0.12 0.00 -1.21 0.00 0.00 61.69 60.32 1cuw s THR 90 Cb 0.00 -1.57 0.10 0.00 -1.51 0.00 0.00 72.50 69.52 1cuw s THR 90 CO 0.00 0.00 1.15 -0.94 -2.21 0.00 0.00 174.62 172.62 1cuw s SER 91 N -2.59 4.14 0.12 8.08 1.04 -1.26 -4.79 113.70 118.43 1cuw s SER 91 Ca 0.13 0.92 0.04 0.00 0.48 0.00 0.00 55.95 57.53 1cuw s SER 91 Cb 0.04 -1.49 -0.20 0.00 0.10 0.00 0.00 66.02 64.47 1cuw s SER 91 CO -0.05 -2.15 1.26 0.28 0.98 0.00 0.00 173.24 173.57 1cuw h SER 92 N -1.22 0.11 -0.37 7.02 0.02 -2.00 -3.16 113.55 113.96 1cuw h SER 92 Ca -0.48 -0.11 0.01 0.00 -0.84 0.00 0.00 61.79 60.37 1cuw h SER 92 Cb 1.32 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.80 1cuw h SER 92 CO 0.64 1.07 0.22 0.00 -1.14 0.00 0.00 176.83 177.62 1cuw h ALA 93 N 0.91 0.46 -0.17 3.77 0.00 -1.93 -0.68 119.26 121.62 1cuw h ALA 93 Ca -0.04 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1cuw h ALA 93 Cb 1.79 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.46 1cuw h ALA 93 CO 0.15 -0.12 -0.03 0.00 0.00 0.00 0.00 179.25 179.25 1cuw h ALA 94 N 1.16 1.64 0.05 0.00 0.00 -1.77 -1.72 119.26 118.63 1cuw h ALA 94 Ca 0.14 -0.13 -0.23 0.00 0.00 0.00 0.00 54.91 54.69 1cuw h ALA 94 Cb -0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1cuw h ALA 94 CO -0.06 0.27 -1.04 0.82 0.00 0.00 0.00 179.25 179.23 1cuw h ILE 95 N 0.25 1.51 0.00 0.00 2.04 -1.20 -0.89 117.51 119.22 1cuw h ILE 95 Ca 0.06 -2.86 -0.07 0.00 1.00 0.00 0.00 64.86 62.99 1cuw h ILE 95 Cb 0.21 2.69 -0.01 0.00 -0.74 0.00 0.00 36.82 38.97 1cuw h ILE 95 CO 0.01 0.84 -0.32 0.03 0.00 0.00 0.00 178.15 178.70 1cuw h ARG 96 N 0.10 0.00 0.42 2.37 3.08 -0.94 -2.69 114.38 116.73 1cuw h ARG 96 Ca -0.08 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 1cuw h ARG 96 Cb 1.72 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.78 1cuw h ARG 96 CO 0.16 0.32 -0.20 1.49 -1.07 0.00 0.00 179.97 180.67 1cuw h GLU 97 N 0.00 -0.55 -0.57 0.04 4.57 -1.05 -2.14 114.58 114.88 1cuw h GLU 97 Ca -0.00 0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.20 1cuw h GLU 97 Cb 0.92 0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 29.61 1cuw h GLU 97 CO 0.04 -0.24 0.28 1.98 -1.18 0.00 0.00 179.01 179.90 1cuw h MET 98 N -0.92 0.79 -0.69 1.92 4.05 -1.20 -2.54 114.93 116.35 1cuw h MET 98 Ca -0.06 -0.09 0.00 0.00 -0.28 0.00 0.00 59.70 59.27 1cuw h MET 98 Cb 0.56 -0.16 -0.03 0.00 -0.80 0.00 0.00 31.60 31.17 1cuw h MET 98 CO 0.10 0.61 0.43 -0.07 0.23 0.00 0.00 176.91 178.20 1cuw h LEU 99 N 0.80 0.81 -0.75 3.39 3.38 -1.47 -2.64 115.31 118.82 1cuw h LEU 99 Ca 0.20 -0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.20 1cuw h LEU 99 Cb 0.07 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.55 1cuw h LEU 99 CO -0.03 0.62 0.43 1.23 0.09 0.00 0.00 178.44 180.78 1cuw h GLY 100 N 0.93 1.13 0.98 0.83 0.00 -0.94 -2.32 103.07 103.68 1cuw h GLY 100 Ca 0.25 -0.30 -0.02 0.00 0.00 0.00 0.00 47.33 47.27 1cuw h GLY 100 CO -0.05 0.16 0.26 1.41 0.00 0.00 0.00 176.54 178.33 1cuw h LEU 101 N 0.76 0.67 -0.79 3.11 3.38 -1.41 0.12 115.31 121.15 1cuw h LEU 101 Ca 0.35 -0.12 0.05 0.00 0.09 0.00 0.00 57.88 58.26 1cuw h LEU 101 Cb 0.25 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.77 1cuw h LEU 101 CO -0.21 0.60 0.48 -0.26 0.09 0.00 0.00 178.44 179.14 1cuw h PHE 102 N 0.70 0.89 -0.20 1.13 0.04 -1.30 -0.55 116.94 117.65 1cuw h PHE 102 Ca 0.18 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.96 1cuw h PHE 102 Cb 0.09 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 37.95 1cuw h PHE 102 CO -0.01 0.46 0.07 1.96 -0.60 0.00 0.00 178.31 180.19 1cuw h GLN 103 N 0.89 0.31 -0.75 1.51 4.20 -0.87 -1.85 115.11 118.56 1cuw h GLN 103 Ca 0.34 -0.06 0.12 0.00 0.06 0.00 0.00 58.65 59.11 1cuw h GLN 103 Cb 0.14 -0.05 -0.08 0.00 0.30 0.00 0.00 27.48 27.79 1cuw h GLN 103 CO -0.16 0.40 0.35 0.37 -0.67 0.00 0.00 178.83 179.12 1cuw h GLN 104 N 0.16 0.53 -0.56 1.46 4.15 0.16 0.21 115.11 121.23 1cuw h GLN 104 Ca 0.07 -0.03 -0.08 0.00 0.77 0.00 0.00 58.65 59.38 1cuw h GLN 104 Cb 0.21 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.76 1cuw h GLN 104 CO -0.00 0.35 0.05 0.00 -1.93 0.00 0.00 178.83 177.30 1cuw h ALA 105 N 1.50 0.74 0.00 3.38 0.00 -0.98 -0.10 119.26 123.80 1cuw h ALA 105 Ca 0.39 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1cuw h ALA 105 Cb 0.51 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1cuw h ALA 105 CO -0.33 0.52 -0.24 -0.97 0.00 0.00 0.00 179.25 178.23 1cuw h ASN 106 N 0.84 0.00 0.14 0.00 -1.24 -0.25 0.68 115.58 115.75 1cuw h ASN 106 Ca 0.16 0.00 -0.21 0.00 0.71 0.00 0.00 56.30 56.96 1cuw h ASN 106 Cb 0.47 0.00 0.02 0.00 0.73 0.00 0.00 38.32 39.53 1cuw h ASN 106 CO 0.02 0.24 -0.98 0.74 -1.29 0.00 0.00 177.43 176.16 1cuw h THR 107 N 0.00 1.40 -0.06 -3.57 2.02 -0.25 -3.28 112.91 109.17 1cuw h THR 107 Ca -0.00 -2.52 -0.17 0.00 0.77 0.00 0.00 66.41 64.49 1cuw h THR 107 Cb 0.43 3.09 0.01 0.00 -1.74 0.00 0.00 68.15 69.94 1cuw h THR 107 CO 0.03 0.72 -0.62 0.11 0.37 0.00 0.00 175.52 176.13 1cuw h LYS 108 N -0.34 0.53 -2.60 6.66 1.57 -0.88 -3.41 116.57 118.11 1cuw h LYS 108 Ca -0.18 -0.49 -0.60 0.00 -1.87 0.00 0.00 60.65 57.51 1cuw h LYS 108 Cb 1.69 0.12 -0.39 0.00 0.08 0.00 0.00 32.23 33.73 1cuw h LYS 108 CO 0.14 1.12 -0.85 0.00 -0.57 0.00 0.00 179.45 179.29 1cuw h PRO 110 N 5.71 0.00 -0.00 0.00 0.13 -1.72 -2.28 132.00 133.84 1cuw h PRO 110 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 1cuw h PRO 110 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1cuw h PRO 110 CO 0.46 0.00 -0.51 -0.25 -0.23 0.00 0.00 178.00 177.47 1cuw n ASP 111 N -2.78 0.96 -4.84 1.44 8.00 -1.26 -4.96 116.55 113.11 1cuw n ASP 111 Ca -0.01 -0.76 -0.31 0.00 0.71 0.00 0.00 54.79 54.42 1cuw n ASP 111 Cb 0.14 0.38 0.03 0.00 -0.02 0.00 0.00 41.12 41.65 1cuw n ASP 111 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1cuw s ALA 112 N -2.77 2.89 -0.12 2.24 0.00 -0.86 -5.02 121.76 118.11 1cuw s ALA 112 Ca 0.16 -0.01 -0.05 0.00 0.00 0.00 0.00 51.96 52.06 1cuw s ALA 112 Cb 0.18 -3.13 -0.04 0.00 0.00 0.00 0.00 23.12 20.13 1cuw s ALA 112 CO 0.66 -0.96 0.06 0.99 0.00 0.00 0.00 175.76 176.50 1cuw s THR 113 N -3.11 4.80 0.20 0.00 2.01 0.31 -4.99 115.64 114.86 1cuw s THR 113 Ca 0.57 -0.05 0.05 0.00 0.31 0.00 0.00 61.69 62.57 1cuw s THR 113 Cb -0.13 -3.08 -0.04 0.00 0.01 0.00 0.00 72.50 69.27 1cuw s THR 113 CO 0.54 0.57 0.22 -0.76 -0.69 0.00 0.00 174.62 174.50 1cuw s LEU 114 N -0.59 3.98 -0.02 4.42 1.43 -1.00 -1.25 118.68 125.66 1cuw s LEU 114 Ca 0.11 -0.08 -0.15 0.00 -1.03 0.00 0.00 54.13 52.97 1cuw s LEU 114 Cb -0.12 -2.55 0.03 0.00 0.03 0.00 0.00 46.19 43.58 1cuw s LEU 114 CO 0.02 0.01 0.33 0.27 0.23 0.00 0.00 176.35 177.21 1cuw s ILE 115 N -1.90 0.05 0.23 -0.59 -4.36 -0.58 -0.07 121.20 113.99 1cuw s ILE 115 Ca 0.33 -0.43 -0.02 0.00 -0.26 0.00 0.00 60.65 60.26 1cuw s ILE 115 Cb -0.09 -0.63 -0.03 0.00 1.25 0.00 0.00 42.46 42.96 1cuw s ILE 115 CO 0.26 -0.24 0.24 0.00 0.24 0.00 0.00 174.94 175.43 1cuw s ALA 116 N -1.26 0.97 0.20 2.27 0.00 -0.95 -1.76 121.76 121.23 1cuw s ALA 116 Ca -0.13 -1.58 -0.23 0.00 0.00 0.00 0.00 51.96 50.01 1cuw s ALA 116 Cb -0.05 1.33 0.05 0.00 0.00 0.00 0.00 23.12 24.45 1cuw s ALA 116 CO 0.04 -0.66 0.91 0.20 0.00 0.00 0.00 175.76 176.25 1cuw s GLY 117 N -3.17 -0.13 -0.19 0.00 0.00 -0.96 -1.57 107.32 101.31 1cuw s GLY 117 Ca 0.36 -0.08 -0.29 0.00 0.00 0.00 0.00 44.72 44.71 1cuw s GLY 117 CO 0.14 0.20 1.02 -0.32 0.00 0.00 0.00 173.10 174.14 1cuw s GLY 118 N -2.99 -0.23 -0.03 0.20 0.00 -0.17 -2.17 107.32 101.93 1cuw s GLY 118 Ca 0.13 2.18 0.04 0.00 0.00 0.00 0.00 44.72 47.07 1cuw s GLY 118 CO 0.04 1.18 -0.14 -0.47 0.00 0.00 0.00 173.10 173.70 1cuw s TYR 119 N -0.87 1.43 0.00 1.90 5.04 -0.93 -0.16 117.35 123.75 1cuw s TYR 119 Ca -0.00 -0.38 0.00 0.00 -2.44 0.00 0.00 57.07 54.25 1cuw s TYR 119 Cb -0.01 -0.97 0.00 0.00 0.35 0.00 0.00 41.96 41.33 1cuw s TYR 119 CO -0.00 -0.12 0.00 0.45 -1.34 0.00 0.00 175.55 174.53 1cuw n SER 120 N 3.12 0.00 -0.06 4.32 2.88 -0.40 -0.72 113.62 122.77 1cuw n SER 120 Ca -0.18 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.50 1cuw n SER 120 Cb 0.54 0.00 0.55 0.00 -0.75 0.00 0.00 64.21 64.55 1cuw n SER 120 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 1cuw h GLN 121 N 0.00 0.29 0.00 -1.46 4.15 -1.87 0.11 115.11 116.33 1cuw h GLN 121 Ca 0.00 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 59.38 1cuw h GLN 121 Cb 0.00 -0.06 -0.00 0.00 0.21 0.00 0.00 27.48 27.62 1cuw h GLN 121 CO 0.00 0.19 -0.13 0.78 -1.93 0.00 0.00 178.83 177.74 1cuw h GLY 122 N 0.30 0.00 0.65 2.39 0.00 -0.49 -0.33 103.07 105.59 1cuw h GLY 122 Ca 0.27 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.55 1cuw h GLY 122 CO -0.06 0.00 -0.13 0.00 0.00 0.00 0.00 176.54 176.35 1cuw h ALA 123 N 1.87 0.14 -0.24 3.60 0.00 -1.01 -1.20 119.26 122.42 1cuw h ALA 123 Ca -0.00 -0.32 0.04 0.00 0.00 0.00 0.00 54.91 54.62 1cuw h ALA 123 Cb 0.29 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1cuw h ALA 123 CO 0.02 0.01 0.01 0.00 0.00 0.00 0.00 179.25 179.29 1cuw h ALA 124 N 0.54 0.22 -0.25 0.00 0.00 -1.40 -0.40 119.26 117.98 1cuw h ALA 124 Ca 0.01 0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.03 1cuw h ALA 124 Cb 0.67 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.51 1cuw h ALA 124 CO 0.03 -0.41 -0.09 1.25 0.00 0.00 0.00 179.25 180.03 1cuw h LEU 125 N 0.09 -0.32 -0.56 0.00 5.85 -1.04 -0.47 115.31 118.86 1cuw h LEU 125 Ca 0.11 0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.93 1cuw h LEU 125 Cb 0.14 0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 1cuw h LEU 125 CO -0.18 -0.12 0.36 0.00 -0.34 0.00 0.00 178.44 178.16 1cuw h ALA 126 N 1.19 0.72 0.04 1.25 0.00 -0.70 -1.05 119.26 120.72 1cuw h ALA 126 Ca 0.13 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1cuw h ALA 126 Cb 0.24 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1cuw h ALA 126 CO -0.29 0.12 -0.09 0.00 0.00 0.00 0.00 179.25 178.99 1cuw h ALA 127 N 1.22 -0.13 -0.57 0.00 0.00 -0.56 -0.17 119.26 119.04 1cuw h ALA 127 Ca 0.22 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.14 1cuw h ALA 127 Cb -0.04 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 1cuw h ALA 127 CO -0.07 -0.60 0.36 0.00 0.00 0.00 0.00 179.25 178.94 1cuw h ALA 128 N 0.76 0.74 -0.44 0.00 0.00 -0.86 0.68 119.26 120.14 1cuw h ALA 128 Ca 0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1cuw h ALA 128 Cb 0.20 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1cuw h ALA 128 CO -0.06 0.09 0.14 0.77 0.00 0.00 0.00 179.25 180.19 1cuw h SER 129 N 0.71 0.64 0.25 0.00 0.02 -0.95 -1.86 113.55 112.36 1cuw h SER 129 Ca 0.23 -0.20 -0.12 0.00 -0.84 0.00 0.00 61.79 60.86 1cuw h SER 129 Cb 0.00 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 1cuw h SER 129 CO -0.09 0.67 -0.46 0.40 -1.14 0.00 0.00 176.83 176.22 1cuw h ILE 130 N 0.57 1.33 -0.17 3.27 2.04 -0.78 -0.44 117.51 123.33 1cuw h ILE 130 Ca 0.14 -1.64 -0.11 0.00 1.00 0.00 0.00 64.86 64.25 1cuw h ILE 130 Cb 0.26 1.76 -0.01 0.00 -0.74 0.00 0.00 36.82 38.09 1cuw h ILE 130 CO -0.00 0.49 -0.37 -0.08 0.00 0.00 0.00 178.15 178.19 1cuw h GLU 131 N 0.21 0.36 0.01 2.37 4.81 -0.60 -3.23 114.58 118.52 1cuw h GLU 131 Ca 0.01 -0.16 -0.26 0.00 -0.13 0.00 0.00 59.36 58.82 1cuw h GLU 131 Cb 0.89 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.23 1cuw h GLU 131 CO 0.07 0.69 -1.39 -0.44 -0.73 0.00 0.00 179.01 177.21 1cuw h ASP 132 N 0.31 0.04 -2.79 1.04 3.32 -1.07 -3.45 116.42 113.81 1cuw h ASP 132 Ca 0.03 -0.06 -0.55 0.00 0.02 0.00 0.00 57.03 56.48 1cuw h ASP 132 Cb 0.80 -0.01 0.22 0.00 0.22 0.00 0.00 39.33 40.55 1cuw h ASP 132 CO 0.06 1.05 -1.03 0.18 -1.72 0.00 0.00 179.24 177.78 1cuw n LEU 133 N -3.22 -2.29 -4.76 1.55 4.77 -0.20 -4.94 117.00 107.92 1cuw n LEU 133 Ca -0.10 0.35 -0.39 0.00 -0.03 0.00 0.00 56.01 55.84 1cuw n LEU 133 Cb 1.00 -1.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.01 1cuw n LEU 133 CO 0.46 -4.46 0.31 1.51 -1.33 0.00 0.00 177.39 173.88 1cuw s ASP 134 N -1.50 7.00 0.27 -1.43 1.47 -1.26 -4.90 116.67 116.31 1cuw s ASP 134 Ca 0.53 1.19 -0.04 0.00 1.18 0.00 0.00 52.55 55.41 1cuw s ASP 134 Cb -0.24 -2.37 0.54 0.00 -0.34 0.00 0.00 42.92 40.50 1cuw s ASP 134 CO 0.71 0.10 1.44 -1.54 0.68 0.00 0.00 175.17 176.56 1cuw n SER 135 N 2.70 -0.24 -0.32 2.11 3.41 -1.26 -0.71 113.62 119.30 1cuw n SER 135 Ca -0.07 1.58 0.12 0.00 -0.26 0.00 0.00 58.87 60.24 1cuw n SER 135 Cb 0.51 -0.52 0.30 0.00 -0.26 0.00 0.00 64.21 64.24 1cuw n SER 135 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1cuw h ALA 136 N 1.85 1.52 0.07 7.33 0.00 -2.01 0.60 119.26 128.61 1cuw h ALA 136 Ca 0.49 0.11 -0.27 0.00 0.00 0.00 0.00 54.91 55.23 1cuw h ALA 136 Cb 0.87 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1cuw h ALA 136 CO -0.92 -0.16 -1.39 0.82 0.00 0.00 0.00 179.25 177.60 1cuw h ILE 137 N 0.61 1.29 0.00 0.00 2.04 -1.32 -3.32 117.51 116.81 1cuw h ILE 137 Ca 0.55 -2.98 -0.01 0.00 1.00 0.00 0.00 64.86 63.42 1cuw h ILE 137 Cb 0.92 2.75 -0.00 0.00 -0.74 0.00 0.00 36.82 39.74 1cuw h ILE 137 CO -0.43 0.82 -0.06 -0.09 0.00 0.00 0.00 178.15 178.39 1cuw h ARG 138 N 0.04 0.00 0.00 2.37 2.43 -0.13 -1.97 114.38 117.12 1cuw h ARG 138 Ca -0.18 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 58.93 1cuw h ARG 138 Cb 1.95 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.49 1cuw h ARG 138 CO 0.14 0.06 -0.29 -0.44 -1.51 0.00 0.00 179.97 177.93 1cuw h ASP 139 N 0.00 0.00 1.06 -3.80 3.32 -1.05 -2.82 116.42 113.13 1cuw h ASP 139 Ca -0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1cuw h ASP 139 Cb 0.49 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.04 1cuw h ASP 139 CO 0.01 0.29 -0.10 0.11 -1.72 0.00 0.00 179.24 177.83 1cuw h LYS 140 N 0.00 0.00 -6.27 3.56 1.57 -1.53 -3.42 116.57 110.48 1cuw h LYS 140 Ca -0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 1cuw h LYS 140 Cb 0.54 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.81 1cuw h LYS 140 CO 0.04 0.10 1.22 0.42 -0.57 0.00 0.00 179.45 180.66 1cuw s ILE 141 N -3.62 3.59 0.23 1.86 1.01 -1.07 -2.37 121.20 120.84 1cuw s ILE 141 Ca 0.01 0.52 -0.03 0.00 0.00 0.00 0.00 60.65 61.15 1cuw s ILE 141 Cb 0.09 -4.02 0.07 0.00 0.01 0.00 0.00 42.46 38.61 1cuw s ILE 141 CO 0.59 -0.80 1.69 0.00 0.00 0.00 0.00 174.94 176.42 1cuw h ALA 142 N 12.63 0.98 -2.88 9.38 0.00 -0.74 -3.47 119.26 135.15 1cuw h ALA 142 Ca -0.29 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1cuw h ALA 142 Cb 1.14 -0.17 -0.13 0.00 0.00 0.00 0.00 17.79 18.63 1cuw h ALA 142 CO 1.13 0.61 0.26 0.20 0.00 0.00 0.00 179.25 181.44 1cuw s GLY 143 N -3.78 -0.60 -0.04 0.00 0.00 -1.26 -4.78 107.32 96.87 1cuw s GLY 143 Ca -0.09 0.58 -0.02 0.00 0.00 0.00 0.00 44.72 45.18 1cuw s GLY 143 CO 0.83 0.19 0.09 -1.59 0.00 0.00 0.00 173.10 172.61 1cuw s THR 144 N -3.65 -0.02 -0.03 0.90 2.01 -0.24 -2.24 115.64 112.38 1cuw s THR 144 Ca 0.02 0.07 0.06 0.00 0.31 0.00 0.00 61.69 62.15 1cuw s THR 144 Cb -0.01 -0.14 -0.01 0.00 0.01 0.00 0.00 72.50 72.35 1cuw s THR 144 CO -0.12 0.03 -0.22 0.68 -0.69 0.00 0.00 174.62 174.30 1cuw s VAL 145 N 0.44 1.77 -0.00 3.82 -7.23 -0.61 -1.98 120.40 116.60 1cuw s VAL 145 Ca -0.03 -0.94 0.05 0.00 -1.81 0.00 0.00 61.98 59.25 1cuw s VAL 145 Cb -0.05 -1.48 -0.01 0.00 0.56 0.00 0.00 36.38 35.40 1cuw s VAL 145 CO -0.02 0.50 -0.15 -0.76 -0.31 0.00 0.00 175.10 174.36 1cuw s LEU 146 N -0.34 2.05 -0.09 1.32 1.43 -0.78 -0.99 118.68 121.27 1cuw s LEU 146 Ca 0.04 -0.30 0.03 0.00 -1.03 0.00 0.00 54.13 52.87 1cuw s LEU 146 Cb -0.10 -0.76 0.01 0.00 0.03 0.00 0.00 46.19 45.37 1cuw s LEU 146 CO 0.01 0.17 -0.18 -0.36 0.23 0.00 0.00 176.35 176.22 1cuw s PHE 147 N -0.41 2.05 -1.21 0.29 0.08 0.77 -0.27 117.98 119.28 1cuw s PHE 147 Ca 0.05 -0.85 -0.02 0.00 0.12 0.00 0.00 56.93 56.23 1cuw s PHE 147 Cb -0.06 -1.43 -0.01 0.00 -0.57 0.00 0.00 43.02 40.95 1cuw s PHE 147 CO -0.00 -0.39 0.89 0.41 -0.10 0.00 0.00 175.22 176.02 1cuw n GLY 148 N 3.79 -0.48 3.57 4.36 0.00 -0.65 -1.28 105.19 114.50 1cuw n GLY 148 Ca -0.20 0.19 -0.44 0.00 0.00 0.00 0.00 46.02 45.57 1cuw n GLY 148 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1cuw n TYR 149 N -4.04 1.87 -0.18 1.61 9.36 -1.26 -3.71 117.16 120.80 1cuw n TYR 149 Ca -0.25 -0.05 -0.04 0.00 3.32 0.00 0.00 57.90 60.87 1cuw n TYR 149 Cb 0.66 -2.69 0.14 0.00 -0.63 0.00 0.00 39.34 36.82 1cuw n TYR 149 CO 0.00 0.00 0.00 1.79 0.22 0.00 0.00 176.86 178.87 1cuw h THR 150 N 7.20 1.24 -0.96 2.97 1.35 -1.77 -2.71 112.91 120.23 1cuw h THR 150 Ca -0.38 -0.84 -0.53 0.00 -0.55 0.00 0.00 66.41 64.12 1cuw h THR 150 Cb 1.25 0.57 -0.30 0.00 -1.73 0.00 0.00 68.15 67.95 1cuw h THR 150 CO 0.98 0.32 0.64 0.29 -0.25 0.00 0.00 175.52 177.51 1cuw n LYS 151 N -4.27 2.30 -0.00 4.72 4.76 -1.26 -4.68 118.16 119.73 1cuw n LYS 151 Ca 0.05 -3.07 -0.10 0.00 -2.87 0.00 0.00 58.31 52.31 1cuw n LYS 151 Cb 0.22 -2.18 -0.05 0.00 -1.84 0.00 0.00 35.03 31.19 1cuw n LYS 151 CO 0.00 0.00 0.00 -0.97 -1.37 0.00 0.00 177.40 175.06 1cuw h ASN 152 N 1.16 -0.09 0.22 4.39 -0.73 -1.71 0.13 115.58 118.95 1cuw h ASN 152 Ca 0.61 0.03 -0.29 0.00 1.87 0.00 0.00 56.30 58.52 1cuw h ASN 152 Cb 2.48 0.06 0.02 0.00 0.27 0.00 0.00 38.32 41.16 1cuw h ASN 152 CO 1.14 -0.03 -1.21 0.25 -0.37 0.00 0.00 177.43 177.21 1cuw h LEU 153 N 0.01 0.78 -0.71 0.34 5.85 -1.83 0.57 115.31 120.30 1cuw h LEU 153 Ca 0.05 -0.72 0.01 0.00 0.84 0.00 0.00 57.88 58.06 1cuw h LEU 153 Cb 0.08 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.83 1cuw h LEU 153 CO -0.11 1.53 0.47 1.56 -0.34 0.00 0.00 178.44 181.55 1cuw h GLN 154 N 0.24 0.94 -0.65 1.25 7.50 -1.86 -2.39 115.11 120.15 1cuw h GLN 154 Ca -0.17 -0.06 0.00 0.00 0.50 0.00 0.00 58.65 58.92 1cuw h GLN 154 Cb 1.89 -0.21 0.00 0.00 0.05 0.00 0.00 27.48 29.20 1cuw h GLN 154 CO 0.23 0.63 0.00 0.09 -1.50 0.00 0.00 178.83 178.28 1cuw n ASN 155 N -4.58 4.22 -3.97 1.46 4.13 0.43 -4.95 115.26 112.00 1cuw n ASN 155 Ca 0.06 -2.34 -0.28 0.00 1.68 0.00 0.00 54.58 53.70 1cuw n ASN 155 Cb 0.02 -0.53 -0.00 0.00 -1.54 0.00 0.00 39.78 37.72 1cuw n ASN 155 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1cuw n ARG 156 N 1.06 -4.02 -2.29 3.52 5.12 -0.90 -1.90 116.66 117.24 1cuw n ARG 156 Ca 0.23 0.47 -0.18 0.00 -1.93 0.00 0.00 57.85 56.44 1cuw n ARG 156 Cb 0.78 -4.98 -0.01 0.00 -1.16 0.00 0.00 32.46 27.08 1cuw n ARG 156 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1cuw n GLY 157 N -1.72 -0.25 3.36 -0.13 0.00 0.19 -4.99 105.19 101.67 1cuw n GLY 157 Ca -0.14 -0.13 -0.21 0.00 0.00 0.00 0.00 46.02 45.55 1cuw n GLY 157 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1cuw s ARG 158 N -4.82 1.74 -0.20 1.61 1.81 -0.80 -4.94 118.95 113.36 1cuw s ARG 158 Ca 0.00 -2.02 0.01 0.00 -1.72 0.00 0.00 55.73 52.00 1cuw s ARG 158 Cb 0.00 -0.08 0.04 0.00 -0.45 0.00 0.00 34.95 34.46 1cuw s ARG 158 CO 0.00 -0.53 -0.14 0.42 -0.68 0.00 0.00 175.30 174.37 1cuw s ILE 159 N -3.45 1.86 0.07 1.52 1.01 -1.26 -4.83 121.20 116.11 1cuw s ILE 159 Ca 0.34 -1.05 -0.36 0.00 0.00 0.00 0.00 60.65 59.58 1cuw s ILE 159 Cb 0.03 -1.83 -0.16 0.00 0.01 0.00 0.00 42.46 40.51 1cuw s ILE 159 CO 0.20 0.29 1.42 -2.65 0.00 0.00 0.00 174.94 174.21 1cuw n PRO 160 N 4.63 1.35 -1.19 2.79 -0.02 -1.26 -1.31 135.00 140.00 1cuw n PRO 160 Ca -0.17 0.49 -0.06 0.00 -2.02 0.00 0.00 63.50 61.74 1cuw n PRO 160 Cb 0.47 -2.16 -0.03 0.00 -0.02 0.00 0.00 33.50 31.76 1cuw n PRO 160 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1cuw n ASN 161 N 2.97 -4.26 -4.02 2.55 3.02 -1.26 -3.86 115.26 110.40 1cuw n ASN 161 Ca 0.19 0.16 -0.25 0.00 -0.03 0.00 0.00 54.58 54.65 1cuw n ASN 161 Cb 0.21 -2.32 -0.17 0.00 -0.61 0.00 0.00 39.78 36.89 1cuw n ASN 161 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1cuw s TYR 162 N -2.07 1.46 0.17 3.10 5.04 -0.43 -4.98 117.35 119.64 1cuw s TYR 162 Ca 0.00 -0.55 -0.33 0.00 -2.44 0.00 0.00 57.07 53.75 1cuw s TYR 162 Cb 0.00 -1.08 -0.14 0.00 0.35 0.00 0.00 41.96 41.10 1cuw s TYR 162 CO 0.00 -0.29 1.58 -0.35 -1.34 0.00 0.00 175.55 175.15 1cuw n PRO 163 N 3.88 2.20 0.03 4.97 -0.04 -1.26 -4.55 135.00 140.23 1cuw n PRO 163 Ca -0.22 0.79 0.07 0.00 -0.04 0.00 0.00 63.50 64.10 1cuw n PRO 163 Cb 0.52 -2.56 0.49 0.00 -0.04 0.00 0.00 33.50 31.91 1cuw n PRO 163 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1cuw h ALA 164 N 5.85 1.85 0.00 0.55 0.00 -1.93 -1.74 119.26 123.84 1cuw h ALA 164 Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1cuw h ALA 164 Cb 1.25 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1cuw h ALA 164 CO 0.88 0.11 0.00 -0.40 0.00 0.00 0.00 179.25 179.84 1cuw n ASP 165 N -4.48 0.00 -0.10 0.00 5.75 -1.26 -1.64 116.55 114.82 1cuw n ASP 165 Ca 0.03 -1.61 0.01 0.00 -0.01 0.00 0.00 54.79 53.22 1cuw n ASP 165 Cb 0.14 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.24 1cuw n ASP 165 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1cuw n ARG 166 N -0.60 0.56 -4.27 0.11 1.74 -0.66 -5.02 116.66 108.51 1cuw n ARG 166 Ca 0.04 -0.56 -0.35 0.00 -0.77 0.00 0.00 57.85 56.21 1cuw n ARG 166 Cb 0.02 -0.98 -0.09 0.00 -1.02 0.00 0.00 32.46 30.39 1cuw n ARG 166 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1cuw s THR 167 N -0.42 4.55 -0.14 0.55 2.01 -0.65 -1.08 115.64 120.46 1cuw s THR 167 Ca 0.03 -0.17 -0.04 0.00 0.31 0.00 0.00 61.69 61.82 1cuw s THR 167 Cb 0.02 -2.93 0.06 0.00 0.01 0.00 0.00 72.50 69.66 1cuw s THR 167 CO 0.05 0.60 0.09 -0.75 -0.69 0.00 0.00 174.62 173.92 1cuw s LYS 168 N -0.94 0.04 -0.14 4.92 2.47 -0.84 -4.98 119.74 120.27 1cuw s LYS 168 Ca 0.14 0.05 -0.03 0.00 -1.56 0.00 0.00 55.97 54.56 1cuw s LYS 168 Cb -0.11 -1.49 -0.03 0.00 -1.46 0.00 0.00 37.83 34.74 1cuw s LYS 168 CO 0.03 -0.59 -0.04 0.08 0.16 0.00 0.00 175.35 174.99 1cuw s VAL 169 N 2.16 3.93 -0.41 4.02 1.01 -1.26 -1.87 120.40 127.99 1cuw s VAL 169 Ca 0.03 -0.35 -0.05 0.00 0.00 0.00 0.00 61.98 61.61 1cuw s VAL 169 Cb -0.15 -2.71 0.10 0.00 0.00 0.00 0.00 36.38 33.62 1cuw s VAL 169 CO -0.08 0.51 0.21 -0.36 0.00 0.00 0.00 175.10 175.39 1cuw s PHE 170 N 0.14 3.47 -0.14 5.22 0.08 0.63 -4.97 117.98 122.41 1cuw s PHE 170 Ca -0.01 -2.08 0.02 0.00 0.12 0.00 0.00 56.93 54.98 1cuw s PHE 170 Cb -0.14 -3.08 0.01 0.00 -0.57 0.00 0.00 43.02 39.25 1cuw s PHE 170 CO 0.03 -0.93 -0.19 0.00 -0.10 0.00 0.00 175.22 174.03 1cuw s ASN 172 N 1.05 6.93 0.32 0.00 0.01 -1.26 -5.03 114.94 116.95 1cuw s ASN 172 Ca -0.03 1.43 -0.29 0.00 -0.71 0.00 0.00 52.86 53.27 1cuw s ASN 172 Cb -0.14 -2.43 -0.10 0.00 0.41 0.00 0.00 41.25 38.98 1cuw s ASN 172 CO -0.05 -0.16 1.34 -0.89 -1.51 0.00 0.00 177.10 175.83 1cuw s THR 173 N -1.86 2.66 0.00 1.60 2.01 -1.26 -2.01 115.64 116.78 1cuw s THR 173 Ca 0.52 0.65 0.00 0.00 0.31 0.00 0.00 61.69 63.17 1cuw s THR 173 Cb -0.12 -3.41 0.00 0.00 0.01 0.00 0.00 72.50 68.97 1cuw s THR 173 CO 0.18 0.15 0.00 0.61 -0.69 0.00 0.00 174.62 174.87 1cuw n GLY 174 N 0.99 3.33 3.55 4.40 0.00 -1.26 -4.82 105.19 111.38 1cuw n GLY 174 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1cuw n GLY 174 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1cuw s ASP 175 N -0.84 6.32 0.59 1.61 2.15 -0.85 -4.78 116.67 120.86 1cuw s ASP 175 Ca 0.00 -0.92 0.31 0.00 0.43 0.00 0.00 52.55 52.37 1cuw s ASP 175 Cb 0.00 -2.56 1.69 0.00 -0.30 0.00 0.00 42.92 41.75 1cuw s ASP 175 CO 0.00 -1.67 1.94 -0.07 -0.17 0.00 0.00 175.17 175.20 1cuw h LEU 176 N 12.84 0.00 -0.28 -1.34 3.38 -1.88 -1.60 115.31 126.44 1cuw h LEU 176 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1cuw h LEU 176 Cb 1.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1cuw h LEU 176 CO 1.34 0.00 0.00 1.33 0.09 0.00 0.00 178.44 181.20 1cuw n VAL 177 N -2.76 0.71 1.07 1.22 0.24 -1.24 -1.13 118.33 116.44 1cuw n VAL 177 Ca -0.02 0.10 0.11 0.00 -2.04 0.00 0.00 64.34 62.49 1cuw n VAL 177 Cb 0.25 -0.91 0.11 0.00 -1.47 0.00 0.00 33.84 31.82 1cuw n VAL 177 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1cuw n THR 179 N -0.73 1.81 0.00 0.00 5.66 -0.91 -3.53 114.28 116.58 1cuw n THR 179 Ca 0.08 -3.90 0.00 0.00 -3.05 0.00 0.00 64.05 57.18 1cuw n THR 179 Cb 0.39 -0.24 0.00 0.00 -1.55 0.00 0.00 70.33 68.93 1cuw n THR 179 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1cuw n GLY 180 N -0.42 2.93 4.02 1.09 0.00 -1.22 -4.99 105.19 106.60 1cuw n GLY 180 Ca 0.26 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.07 1cuw n GLY 180 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1cuw s SER 181 N 0.05 4.96 -0.08 1.61 0.15 -0.28 -5.00 113.70 115.10 1cuw s SER 181 Ca 0.00 -0.60 0.13 0.00 0.70 0.00 0.00 55.95 56.18 1cuw s SER 181 Cb 0.00 0.01 0.24 0.00 -1.71 0.00 0.00 66.02 64.56 1cuw s SER 181 CO 0.00 -1.41 1.12 0.18 1.20 0.00 0.00 173.24 174.32 1cuw n LEU 182 N -2.38 1.48 -4.76 3.45 4.77 -1.26 -3.59 117.00 114.71 1cuw n LEU 182 Ca 0.14 -2.41 -0.39 0.00 -0.03 0.00 0.00 56.01 53.32 1cuw n LEU 182 Cb 0.61 -0.25 -0.05 0.00 -2.33 0.00 0.00 43.42 41.39 1cuw n LEU 182 CO 0.41 0.65 0.43 -0.63 -1.33 0.00 0.00 177.39 176.91 1cuw s ILE 183 N -1.64 4.65 -0.30 -0.08 -1.09 -1.26 -5.00 121.20 116.48 1cuw s ILE 183 Ca 0.23 1.56 -0.02 0.00 -2.23 0.00 0.00 60.65 60.19 1cuw s ILE 183 Cb 0.22 -4.08 0.04 0.00 -1.58 0.00 0.00 42.46 37.07 1cuw s ILE 183 CO -0.02 0.44 -0.00 -0.63 -1.23 0.00 0.00 174.94 173.49 1cuw s ILE 184 N -0.49 3.04 0.42 2.92 1.01 -1.26 -4.24 121.20 122.61 1cuw s ILE 184 Ca 0.36 -1.30 0.07 0.00 0.00 0.00 0.00 60.65 59.77 1cuw s ILE 184 Cb -0.21 -2.71 -0.05 0.00 0.01 0.00 0.00 42.46 39.50 1cuw s ILE 184 CO 0.23 -0.06 0.16 -0.76 0.00 0.00 0.00 174.94 174.50 1cuw s LEU 185 N 1.28 3.02 0.32 2.97 1.02 -1.26 -5.03 118.68 120.99 1cuw s LEU 185 Ca -0.04 -1.16 0.06 0.00 0.02 0.00 0.00 54.13 53.00 1cuw s LEU 185 Cb -0.19 -1.30 0.87 0.00 0.02 0.00 0.00 46.19 45.59 1cuw s LEU 185 CO -0.01 -0.57 1.58 0.00 0.02 0.00 0.00 176.35 177.36 1cuw h ALA 186 N 1.44 1.38 0.00 4.21 0.00 -1.98 -0.61 119.26 123.70 1cuw h ALA 186 Ca -0.43 0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1cuw h ALA 186 Cb 1.26 0.52 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1cuw h ALA 186 CO 0.71 -0.64 0.11 -1.35 0.00 0.00 0.00 179.25 178.08 1cuw h PRO 187 N 0.02 0.00 0.00 0.00 0.11 -1.88 0.16 132.00 130.41 1cuw h PRO 187 Ca 0.65 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.76 1cuw h PRO 187 Cb 1.44 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.55 1cuw h PRO 187 CO -0.87 0.00 0.00 1.58 -0.21 0.00 0.00 178.00 178.50 1cuw n HIS 188 N -2.60 0.47 0.11 0.65 -0.00 -0.24 -2.81 115.22 110.81 1cuw n HIS 188 Ca -0.02 0.16 0.07 0.00 0.46 0.00 0.00 57.72 58.39 1cuw n HIS 188 Cb 0.16 -0.76 0.14 0.00 -0.12 0.00 0.00 29.99 29.41 1cuw n HIS 188 CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 1cuw n PHE 189 N -1.90 0.36 -2.23 1.57 3.72 0.54 -4.73 117.46 114.78 1cuw n PHE 189 Ca 0.05 -0.29 -0.37 0.00 -0.05 0.00 0.00 57.45 56.78 1cuw n PHE 189 Cb 0.30 -0.01 0.02 0.00 -0.94 0.00 0.00 39.48 38.86 1cuw n PHE 189 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1cuw n ALA 190 N 0.82 6.07 0.40 4.37 0.00 -1.12 -4.57 120.51 126.48 1cuw n ALA 190 Ca 0.12 -4.30 0.05 0.00 0.00 0.00 0.00 53.44 49.31 1cuw n ALA 190 Cb 0.43 -1.71 0.00 0.00 0.00 0.00 0.00 19.45 18.17 1cuw n ALA 190 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1cuw n TYR 191 N -0.41 0.00 -0.14 0.00 4.01 -1.26 -4.73 117.16 114.63 1cuw n TYR 191 Ca 0.48 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 58.16 1cuw n TYR 191 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.35 1cuw n TYR 191 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1cuw h GLY 192 N 1.95 -0.08 0.06 2.72 0.00 -1.99 -1.47 103.07 104.27 1cuw h GLY 192 Ca 0.00 0.36 0.23 0.00 0.00 0.00 0.00 47.33 47.91 1cuw h GLY 192 CO 0.00 -0.21 0.63 -2.55 0.00 0.00 0.00 176.54 174.41 1cuw h PRO 193 N -0.19 0.50 -0.09 4.80 0.11 -1.98 -1.62 132.00 133.53 1cuw h PRO 193 Ca 0.20 -0.03 -0.24 0.00 0.11 0.00 0.00 66.00 66.04 1cuw h PRO 193 Cb 0.51 -0.11 0.01 0.00 0.11 0.00 0.00 31.00 31.52 1cuw h PRO 193 CO -0.55 0.33 -0.88 -0.44 -0.21 0.00 0.00 178.00 176.25 1cuw h ASP 194 N 0.52 0.91 0.13 -2.05 3.32 -1.62 -2.10 116.42 115.52 1cuw h ASP 194 Ca 0.56 -0.65 -0.09 0.00 0.02 0.00 0.00 57.03 56.87 1cuw h ASP 194 Cb 1.22 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.49 1cuw h ASP 194 CO -0.30 1.45 -0.30 0.00 -1.72 0.00 0.00 179.24 178.37 1cuw h ALA 195 N 0.52 1.22 0.00 3.45 0.00 -0.87 0.87 119.26 124.45 1cuw h ALA 195 Ca -0.08 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.36 1cuw h ALA 195 Cb 1.52 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 1cuw h ALA 195 CO 0.18 0.52 -0.62 0.00 0.00 0.00 0.00 179.25 179.33 1cuw h ARG 196 N 0.25 0.00 0.00 0.00 3.08 -1.32 -3.36 114.38 113.03 1cuw h ARG 196 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1cuw h ARG 196 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.72 1cuw h ARG 196 CO 0.05 0.62 0.00 0.41 -1.07 0.00 0.00 179.97 179.98 1cuw n GLY 197 N 1.25 0.88 0.53 0.04 0.00 -0.79 -4.89 105.19 102.21 1cuw n GLY 197 Ca 0.02 -0.03 0.41 0.00 0.00 0.00 0.00 46.02 46.42 1cuw n GLY 197 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1cuw h PRO 198 N 0.00 0.05 0.61 1.61 0.13 -1.75 -3.08 132.00 129.57 1cuw h PRO 198 Ca 0.00 -0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.10 1cuw h PRO 198 Cb 0.00 -0.01 0.01 0.00 0.13 0.00 0.00 31.00 31.12 1cuw h PRO 198 CO 0.00 0.03 -0.29 0.00 -0.23 0.00 0.00 178.00 177.51 1cuw h ALA 199 N 1.46 -0.96 0.00 -0.56 0.00 -1.08 -3.04 119.26 115.07 1cuw h ALA 199 Ca 0.84 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.55 1cuw h ALA 199 Cb 2.87 0.32 -0.00 0.00 0.00 0.00 0.00 17.79 20.98 1cuw h ALA 199 CO -0.31 -0.90 -0.11 -1.00 0.00 0.00 0.00 179.25 176.93 1cuw h PRO 200 N -1.04 0.00 -0.89 0.00 0.13 -1.73 -2.52 132.00 125.95 1cuw h PRO 200 Ca -0.08 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.05 1cuw h PRO 200 Cb 0.63 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.72 1cuw h PRO 200 CO 0.14 0.11 0.58 1.49 -0.23 0.00 0.00 178.00 180.08 1cuw h GLU 201 N 0.00 1.18 0.25 0.86 4.81 -1.57 -1.95 114.58 118.17 1cuw h GLU 201 Ca -0.00 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 1cuw h GLU 201 Cb 0.39 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.52 1cuw h GLU 201 CO 0.01 0.79 -0.12 0.35 -0.73 0.00 0.00 179.01 179.32 1cuw h PHE 202 N 1.21 -0.31 -0.63 0.92 3.57 -1.34 -3.02 116.94 117.34 1cuw h PHE 202 Ca 0.32 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.94 1cuw h PHE 202 Cb -0.12 0.10 -0.09 0.00 2.79 0.00 0.00 35.95 38.63 1cuw h PHE 202 CO 0.00 0.06 0.12 -0.07 -2.23 0.00 0.00 178.31 176.19 1cuw h LEU 203 N -0.80 -0.04 -1.30 0.59 3.38 -1.34 0.52 115.31 116.32 1cuw h LEU 203 Ca -0.03 0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 1cuw h LEU 203 Cb 0.51 0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 1cuw h LEU 203 CO 0.06 -0.02 0.40 0.40 0.09 0.00 0.00 178.44 179.36 1cuw h ILE 204 N 0.24 1.18 -0.45 1.22 2.04 -1.46 -1.82 117.51 118.47 1cuw h ILE 204 Ca 0.34 -0.39 -0.11 0.00 1.00 0.00 0.00 64.86 65.70 1cuw h ILE 204 Cb 0.53 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 1cuw h ILE 204 CO -0.45 0.19 -0.17 -0.08 0.00 0.00 0.00 178.15 177.64 1cuw h GLU 205 N 0.89 0.87 -0.04 2.37 4.81 -0.81 -2.55 114.58 120.12 1cuw h GLU 205 Ca 0.23 -0.33 -0.11 0.00 -0.13 0.00 0.00 59.36 59.03 1cuw h GLU 205 Cb -0.05 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 1cuw h GLU 205 CO -0.05 0.97 -0.47 0.87 -0.73 0.00 0.00 179.01 179.60 1cuw h LYS 206 N 0.76 0.10 -0.25 1.92 1.79 -0.41 -0.95 116.57 119.52 1cuw h LYS 206 Ca 0.11 -0.05 -0.11 0.00 -2.18 0.00 0.00 60.65 58.42 1cuw h LYS 206 Cb 0.69 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.34 1cuw h LYS 206 CO 0.05 0.55 -0.28 0.28 -1.08 0.00 0.00 179.45 178.98 1cuw h VAL 207 N 0.08 1.31 -0.12 0.50 2.07 -1.18 -2.51 116.25 116.40 1cuw h VAL 207 Ca 0.00 -1.45 -0.11 0.00 0.82 0.00 0.00 66.70 65.96 1cuw h VAL 207 Cb 0.87 1.67 -0.01 0.00 -1.52 0.00 0.00 31.29 32.29 1cuw h VAL 207 CO 0.07 0.46 -0.42 0.03 0.02 0.00 0.00 177.57 177.72 1cuw h ARG 208 N 0.35 0.28 0.25 1.57 3.08 -1.32 -2.65 114.38 115.94 1cuw h ARG 208 Ca 0.04 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 1cuw h ARG 208 Cb 0.84 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.89 1cuw h ARG 208 CO 0.07 0.66 -0.12 0.00 -1.07 0.00 0.00 179.97 179.51 1cuw h ALA 209 N 1.32 -0.33 0.00 0.04 0.00 -1.09 0.27 119.26 119.47 1cuw h ALA 209 Ca 0.02 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1cuw h ALA 209 Cb 0.85 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1cuw h ALA 209 CO 0.07 -0.57 0.00 -0.39 0.00 0.00 0.00 179.25 178.36 1cuw h VAL 210 N -0.56 0.00 0.00 0.00 -1.51 -1.49 -3.40 116.25 109.29 1cuw h VAL 210 Ca -0.03 -0.39 0.00 0.00 -1.23 0.00 0.00 66.70 65.05 1cuw h VAL 210 Cb 0.41 1.26 0.00 0.00 -2.13 0.00 0.00 31.29 30.83 1cuw h VAL 210 CO 0.06 0.00 0.00 0.54 -1.23 0.00 0.00 177.57 176.94 1cuw n ARG 211 N -2.61 0.00 0.00 5.19 1.74 -1.00 -5.12 116.66 114.86 1cuw n ARG 211 Ca 0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.10 1cuw n ARG 211 Cb 0.29 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.73 1cuw n ARG 211 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1cuw n GLY 212 N 4.11 0.94 0.00 -0.13 0.00 0.92 -5.03 105.19 106.01 1cuw n GLY 212 Ca 0.00 -2.17 0.00 0.00 0.00 0.00 0.00 46.02 43.85 1cuw n GLY 212 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06