#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pcz s ASP 3 N 0.00 6.28 0.00 -1.34 2.15 -1.26 -4.87 116.67 117.63 1pcz s ASP 3 Ca 0.00 -0.95 0.16 0.00 0.43 0.00 0.00 52.55 52.19 1pcz s ASP 3 Cb 0.00 -2.51 0.84 0.00 -0.30 0.00 0.00 42.92 40.95 1pcz s ASP 3 CO 0.00 -1.59 1.55 0.23 -0.17 0.00 0.00 175.17 175.19 1pcz n MET 4 N 8.56 1.18 0.20 4.34 2.81 -1.26 -3.86 117.12 129.09 1pcz n MET 4 Ca 0.09 -0.27 0.07 0.00 -1.81 0.00 0.00 57.70 55.79 1pcz n MET 4 Cb 0.48 -1.27 0.37 0.00 -0.71 0.00 0.00 33.22 32.10 1pcz n MET 4 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1pcz h SER 5 N 0.52 0.00 -0.20 7.83 4.64 -1.98 -2.92 113.55 121.44 1pcz h SER 5 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1pcz h SER 5 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1pcz h SER 5 CO 0.00 0.31 0.00 2.29 -0.87 0.00 0.00 176.83 178.56 1pcz n LYS 6 N -3.45 1.88 -2.87 4.77 2.85 -1.25 -4.89 118.16 115.20 1pcz n LYS 6 Ca 0.00 -1.81 -0.42 0.00 -1.05 0.00 0.00 58.31 55.03 1pcz n LYS 6 Cb 0.48 -1.36 -0.04 0.00 -0.65 0.00 0.00 35.03 33.46 1pcz n LYS 6 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1pcz s VAL 7 N -1.29 4.73 -0.12 0.58 1.01 -1.10 -3.73 120.40 120.48 1pcz s VAL 7 Ca 0.26 1.35 -0.01 0.00 0.00 0.00 0.00 61.98 63.57 1pcz s VAL 7 Cb 0.16 -4.21 -0.02 0.00 0.00 0.00 0.00 36.38 32.30 1pcz s VAL 7 CO 0.23 -0.29 -0.08 -0.54 0.00 0.00 0.00 175.10 174.42 1pcz s LYS 8 N 3.11 3.26 -0.05 2.72 -0.14 -0.31 -4.97 119.74 123.36 1pcz s LYS 8 Ca 0.36 -0.58 0.00 0.00 -1.36 0.00 0.00 55.97 54.39 1pcz s LYS 8 Cb -0.14 -2.71 0.02 0.00 -1.68 0.00 0.00 37.83 33.33 1pcz s LYS 8 CO 0.13 0.38 -0.03 -0.51 -0.76 0.00 0.00 175.35 174.56 1pcz s LEU 9 N -0.05 1.12 -0.04 3.17 1.43 -1.26 -1.21 118.68 121.84 1pcz s LEU 9 Ca -0.00 -0.11 0.03 0.00 -1.03 0.00 0.00 54.13 53.01 1pcz s LEU 9 Cb -0.13 -0.43 0.00 0.00 0.03 0.00 0.00 46.19 45.66 1pcz s LEU 9 CO 0.03 -0.10 -0.11 0.00 0.23 0.00 0.00 176.35 176.40 1pcz s ARG 10 N 1.22 1.25 0.27 1.70 1.70 0.05 -4.97 118.95 120.17 1pcz s ARG 10 Ca -0.06 -0.38 -0.30 0.00 -0.47 0.00 0.00 55.73 54.51 1pcz s ARG 10 Cb -0.14 -1.12 -0.11 0.00 -0.57 0.00 0.00 34.95 33.01 1pcz s ARG 10 CO -0.02 0.12 1.57 -1.50 -1.08 0.00 0.00 175.30 174.40 1pcz s ILE 11 N 0.26 2.20 -0.08 4.99 1.10 -1.26 -0.26 121.20 128.16 1pcz s ILE 11 Ca -0.05 0.16 0.06 0.00 -0.51 0.00 0.00 60.65 60.31 1pcz s ILE 11 Cb -0.11 -3.11 -0.09 0.00 0.15 0.00 0.00 42.46 39.31 1pcz s ILE 11 CO 0.01 0.02 0.01 -0.62 -2.11 0.00 0.00 174.94 172.26 1pcz n GLU 12 N 2.42 2.46 -3.59 3.50 -0.58 0.32 -4.79 120.64 120.37 1pcz n GLU 12 Ca 0.09 0.00 -0.12 0.00 -0.42 0.00 0.00 57.16 56.71 1pcz n GLU 12 Cb 0.38 -1.19 -0.06 0.00 -0.57 0.00 0.00 31.44 30.00 1pcz n GLU 12 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1pcz s ASN 13 N -4.05 -0.49 -0.06 1.62 3.84 -0.95 -4.71 114.94 110.14 1pcz s ASN 13 Ca -0.05 0.72 0.01 0.00 0.21 0.00 0.00 52.86 53.76 1pcz s ASN 13 Cb 0.02 0.66 0.02 0.00 -0.55 0.00 0.00 41.25 41.40 1pcz s ASN 13 CO 0.29 -0.32 -0.08 -0.63 -2.79 0.00 0.00 177.10 173.58 1pcz s ILE 14 N -0.53 0.81 -0.09 -5.21 1.01 0.14 -0.50 121.20 116.83 1pcz s ILE 14 Ca -0.02 -0.27 0.03 0.00 0.00 0.00 0.00 60.65 60.39 1pcz s ILE 14 Cb -0.02 -0.79 -0.01 0.00 0.01 0.00 0.00 42.46 41.64 1pcz s ILE 14 CO 0.01 0.29 -0.18 -0.69 0.00 0.00 0.00 174.94 174.36 1pcz s VAL 15 N 0.92 2.65 0.01 2.92 1.01 0.12 -3.25 120.40 124.78 1pcz s VAL 15 Ca -0.11 -0.84 0.06 0.00 0.00 0.00 0.00 61.98 61.10 1pcz s VAL 15 Cb -0.15 -2.05 -0.02 0.00 0.00 0.00 0.00 36.38 34.17 1pcz s VAL 15 CO 0.01 0.56 -0.20 0.00 0.00 0.00 0.00 175.10 175.47 1pcz s ALA 16 N -0.07 1.65 -0.08 5.51 0.00 -0.58 0.64 121.76 128.84 1pcz s ALA 16 Ca -0.04 -0.94 -0.14 0.00 0.00 0.00 0.00 51.96 50.84 1pcz s ALA 16 Cb -0.14 -0.37 -0.05 0.00 0.00 0.00 0.00 23.12 22.56 1pcz s ALA 16 CO 0.04 0.38 0.34 -1.54 0.00 0.00 0.00 175.76 174.99 1pcz s SER 17 N -0.82 6.62 -0.00 0.00 1.04 0.65 -0.17 113.70 121.02 1pcz s SER 17 Ca 0.07 0.73 0.03 0.00 0.48 0.00 0.00 55.95 57.26 1pcz s SER 17 Cb -0.08 -2.21 -0.01 0.00 0.10 0.00 0.00 66.02 63.82 1pcz s SER 17 CO 0.01 0.22 -0.10 -0.69 0.98 0.00 0.00 173.24 173.66 1pcz s VAL 18 N -0.36 0.75 -0.29 5.02 1.01 0.74 -0.05 120.40 127.21 1pcz s VAL 18 Ca 0.20 -0.47 0.03 0.00 0.00 0.00 0.00 61.98 61.75 1pcz s VAL 18 Cb -0.15 -0.64 0.08 0.00 0.00 0.00 0.00 36.38 35.67 1pcz s VAL 18 CO 0.09 0.17 -0.02 -0.62 0.00 0.00 0.00 175.10 174.71 1pcz s ASP 19 N -0.34 4.45 0.00 3.32 -1.08 -0.57 0.92 116.67 123.37 1pcz s ASP 19 Ca 0.03 -1.68 0.24 0.00 -0.52 0.00 0.00 52.55 50.61 1pcz s ASP 19 Cb -0.04 -1.48 1.39 0.00 -1.46 0.00 0.00 42.92 41.33 1pcz s ASP 19 CO -0.00 -0.29 1.78 0.18 0.52 0.00 0.00 175.17 177.36 1pcz n LEU 20 N 4.42 0.00 -1.25 -1.34 4.77 0.14 -1.31 117.00 122.43 1pcz n LEU 20 Ca -0.06 0.03 -0.10 0.00 -0.03 0.00 0.00 56.01 55.85 1pcz n LEU 20 Cb 0.42 -0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.44 1pcz n LEU 20 CO 0.20 -0.01 -0.10 0.49 -1.33 0.00 0.00 177.39 176.65 1pcz n PHE 21 N -1.03 -0.48 -3.96 -1.77 3.72 -1.26 -4.79 117.46 107.90 1pcz n PHE 21 Ca 0.17 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.36 1pcz n PHE 21 Cb 0.09 -2.21 -0.17 0.00 -0.94 0.00 0.00 39.48 36.25 1pcz n PHE 21 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1pcz s ALA 22 N -1.83 0.69 0.27 4.37 0.00 -1.26 -4.71 121.76 119.28 1pcz s ALA 22 Ca 0.00 -0.09 -0.30 0.00 0.00 0.00 0.00 51.96 51.57 1pcz s ALA 22 Cb 0.00 -0.58 -0.11 0.00 0.00 0.00 0.00 23.12 22.43 1pcz s ALA 22 CO 0.00 -0.23 1.61 -0.65 0.00 0.00 0.00 175.76 176.49 1pcz s GLN 23 N 1.42 4.13 -0.10 0.00 -1.52 -1.26 -3.33 119.66 119.00 1pcz s GLN 23 Ca -0.03 2.57 -0.00 0.00 -1.95 0.00 0.00 55.36 55.94 1pcz s GLN 23 Cb -0.13 -3.04 -0.03 0.00 -0.22 0.00 0.00 33.01 29.59 1pcz s GLN 23 CO -0.03 -0.64 -0.07 -0.51 -0.25 0.00 0.00 175.29 173.79 1pcz s LEU 24 N -0.19 3.13 -0.59 2.90 1.02 0.46 -4.85 118.68 120.56 1pcz s LEU 24 Ca 0.65 -0.08 -0.18 0.00 0.02 0.00 0.00 54.13 54.54 1pcz s LEU 24 Cb -0.48 -1.70 0.11 0.00 0.02 0.00 0.00 46.19 44.14 1pcz s LEU 24 CO 0.45 0.29 0.65 -0.62 0.02 0.00 0.00 176.35 177.15 1pcz s ASP 25 N -0.40 6.20 0.54 2.29 2.15 -1.26 -4.22 116.67 121.96 1pcz s ASP 25 Ca 0.06 -1.56 0.24 0.00 0.43 0.00 0.00 52.55 51.72 1pcz s ASP 25 Cb -0.12 -2.28 1.40 0.00 -0.30 0.00 0.00 42.92 41.62 1pcz s ASP 25 CO 0.02 -1.04 2.04 -0.07 -0.17 0.00 0.00 175.17 175.95 1pcz h LEU 26 N 9.65 0.00 -0.83 -1.34 4.07 -1.93 -0.25 115.31 124.69 1pcz h LEU 26 Ca -0.29 0.00 0.04 0.00 0.08 0.00 0.00 57.88 57.72 1pcz h LEU 26 Cb 1.09 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.78 1pcz h LEU 26 CO 1.08 0.00 0.52 -0.33 -1.08 0.00 0.00 178.44 178.63 1pcz h GLU 27 N 0.00 0.97 0.16 1.13 4.39 -2.01 0.13 114.58 119.35 1pcz h GLU 27 Ca 0.18 -0.06 -0.29 0.00 0.34 0.00 0.00 59.36 59.53 1pcz h GLU 27 Cb 0.75 -0.22 0.01 0.00 -0.10 0.00 0.00 28.75 29.20 1pcz h GLU 27 CO -0.00 0.64 -1.34 0.87 -1.16 0.00 0.00 179.01 178.02 1pcz h LYS 28 N 1.00 0.33 -0.89 2.33 1.79 -1.53 -3.30 116.57 116.29 1pcz h LYS 28 Ca 0.34 -0.57 0.00 0.00 -2.18 0.00 0.00 60.65 58.24 1pcz h LYS 28 Cb 0.06 0.21 -0.04 0.00 -1.58 0.00 0.00 32.23 30.88 1pcz h LYS 28 CO -0.13 1.26 0.56 0.28 -1.08 0.00 0.00 179.45 180.34 1pcz h VAL 29 N 0.09 1.24 -0.99 0.50 2.07 -0.54 -3.01 116.25 115.61 1pcz h VAL 29 Ca -0.18 -0.48 0.31 0.00 0.82 0.00 0.00 66.70 67.17 1pcz h VAL 29 Cb 2.03 -0.05 -0.15 0.00 -1.52 0.00 0.00 31.29 31.60 1pcz h VAL 29 CO 0.22 0.24 0.54 -0.07 0.02 0.00 0.00 177.57 178.51 1pcz h LEU 30 N 1.22 0.47 -1.23 2.57 3.38 -0.83 0.37 115.31 121.26 1pcz h LEU 30 Ca 0.32 0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.49 1pcz h LEU 30 Cb -0.09 0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1pcz h LEU 30 CO -0.07 -0.13 0.00 -0.78 0.09 0.00 0.00 178.44 177.55 1pcz h ASP 31 N 0.32 0.00 1.46 -0.43 3.58 -1.74 -2.13 116.42 117.48 1pcz h ASP 31 Ca 0.72 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 58.14 1pcz h ASP 31 Cb 1.61 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.66 1pcz h ASP 31 CO -0.61 0.00 -0.12 -0.07 -2.88 0.00 0.00 179.24 175.56 1pcz h LEU 32 N 0.00 0.00 -9.41 2.28 3.38 -0.42 -3.45 115.31 107.69 1pcz h LEU 32 Ca 0.00 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.42 1pcz h LEU 32 Cb 0.37 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.09 1pcz h LEU 32 CO 0.00 0.12 0.23 0.00 0.09 0.00 0.00 178.44 178.88 1pcz h PRO 34 N 6.64 0.12 -3.70 0.00 0.11 -1.86 -3.42 132.00 129.89 1pcz h PRO 34 Ca -0.41 -0.01 -0.18 0.00 0.11 0.00 0.00 66.00 65.51 1pcz h PRO 34 Cb 1.21 -0.03 -0.24 0.00 0.11 0.00 0.00 31.00 32.05 1pcz h PRO 34 CO 0.75 0.08 -0.63 -0.80 -0.21 0.00 0.00 178.00 177.19 1pcz s ASN 35 N -5.27 0.06 0.05 -2.05 -0.87 -1.11 -5.03 114.94 100.73 1pcz s ASN 35 Ca -0.13 -0.17 -0.12 0.00 -1.57 0.00 0.00 52.86 50.87 1pcz s ASN 35 Cb 0.12 0.14 0.01 0.00 -0.02 0.00 0.00 41.25 41.50 1pcz s ASN 35 CO 0.70 -0.20 0.27 -0.94 -2.57 0.00 0.00 177.10 174.36 1pcz s SER 36 N -0.80 -0.06 -0.15 -1.22 1.04 -1.25 0.40 113.70 111.66 1pcz s SER 36 Ca -0.09 -0.30 0.02 0.00 0.48 0.00 0.00 55.95 56.06 1pcz s SER 36 Cb -0.05 0.35 0.01 0.00 0.10 0.00 0.00 66.02 66.42 1pcz s SER 36 CO 0.00 -0.63 -0.22 -0.54 0.98 0.00 0.00 173.24 172.83 1pcz s LYS 37 N -2.81 3.00 -0.25 4.02 1.02 -0.53 -4.94 119.74 119.26 1pcz s LYS 37 Ca -0.03 -0.85 -0.04 0.00 0.02 0.00 0.00 55.97 55.08 1pcz s LYS 37 Cb 0.00 -2.45 0.08 0.00 -0.52 0.00 0.00 37.83 34.94 1pcz s LYS 37 CO -0.05 -0.05 0.10 -0.47 -0.92 0.00 0.00 175.35 173.95 1pcz s TYR 38 N 0.91 0.63 -0.51 3.18 5.04 -1.26 -0.92 117.35 124.42 1pcz s TYR 38 Ca -0.05 -0.87 0.05 0.00 -2.44 0.00 0.00 57.07 53.77 1pcz s TYR 38 Cb -0.15 -1.00 0.19 0.00 0.35 0.00 0.00 41.96 41.35 1pcz s TYR 38 CO -0.04 -0.72 0.45 0.09 -1.34 0.00 0.00 175.55 173.99 1pcz n ASN 39 N 5.16 1.00 -0.39 4.32 5.03 -1.26 -4.98 115.26 124.14 1pcz n ASN 39 Ca -0.06 -2.76 0.31 0.00 0.87 0.00 0.00 54.58 52.94 1pcz n ASN 39 Cb 0.45 -0.63 0.58 0.00 -1.02 0.00 0.00 39.78 39.15 1pcz n ASN 39 CO 0.00 0.00 0.00 -0.65 -1.83 0.00 0.00 177.26 174.78 1pcz h PRO 40 N 5.20 0.20 -0.73 3.52 0.11 -1.86 0.24 132.00 138.68 1pcz h PRO 40 Ca 0.20 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.28 1pcz h PRO 40 Cb 0.84 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 31.87 1pcz h PRO 40 CO 0.52 0.13 0.37 0.93 -0.21 0.00 0.00 178.00 179.74 1pcz h GLU 41 N 0.20 1.02 0.00 1.05 5.08 -1.97 -3.32 114.58 116.65 1pcz h GLU 41 Ca 0.75 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.98 1pcz h GLU 41 Cb 2.12 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 31.18 1pcz h GLU 41 CO -0.44 0.77 -0.66 0.39 -1.00 0.00 0.00 179.01 178.07 1pcz n GLU 42 N -4.34 0.47 -4.68 2.33 4.71 0.67 -4.92 120.64 114.87 1pcz n GLU 42 Ca 0.07 0.41 -0.33 0.00 -0.01 0.00 0.00 57.16 57.31 1pcz n GLU 42 Cb 0.12 -1.58 -0.16 0.00 -1.01 0.00 0.00 31.44 28.81 1pcz n GLU 42 CO 0.00 0.00 0.00 0.12 0.09 0.00 0.00 177.13 177.34 1pcz s PHE 43 N -2.44 2.71 0.35 -0.32 5.36 -0.12 -5.03 117.98 118.49 1pcz s PHE 43 Ca -0.19 -1.15 0.22 0.00 -0.96 0.00 0.00 56.93 54.85 1pcz s PHE 43 Cb 0.03 -1.83 1.13 0.00 -0.34 0.00 0.00 43.02 42.00 1pcz s PHE 43 CO 0.28 -0.51 1.95 -1.00 -1.46 0.00 0.00 175.22 174.48 1pcz h PRO 44 N 7.21 0.00 -6.81 10.12 0.13 -1.79 -3.13 132.00 137.73 1pcz h PRO 44 Ca -0.31 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.35 1pcz h PRO 44 Cb 1.20 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.36 1pcz h PRO 44 CO 0.55 0.21 -0.00 0.20 -0.23 0.00 0.00 178.00 178.73 1pcz s GLY 45 N -4.24 1.51 -0.02 1.56 0.00 -1.26 -4.70 107.32 100.17 1pcz s GLY 45 Ca -0.02 -0.81 -0.19 0.00 0.00 0.00 0.00 44.72 43.70 1pcz s GLY 45 CO 0.64 -0.64 0.54 -0.42 0.00 0.00 0.00 173.10 173.22 1pcz s ILE 46 N -2.65 4.97 -0.90 0.90 1.01 0.20 -4.67 121.20 120.05 1pcz s ILE 46 Ca 0.48 1.12 -0.18 0.00 0.00 0.00 0.00 60.65 62.07 1pcz s ILE 46 Cb -0.10 -3.87 0.14 0.00 0.01 0.00 0.00 42.46 38.64 1pcz s ILE 46 CO 0.41 0.44 1.06 -0.63 0.00 0.00 0.00 174.94 176.22 1pcz s ILE 47 N -0.25 4.86 -0.59 2.92 1.01 -0.09 0.46 121.20 129.52 1pcz s ILE 47 Ca 0.29 -1.69 -0.25 0.00 0.00 0.00 0.00 60.65 59.00 1pcz s ILE 47 Cb -0.17 -4.72 0.04 0.00 0.01 0.00 0.00 42.46 37.61 1pcz s ILE 47 CO 0.15 -1.43 1.04 0.00 0.00 0.00 0.00 174.94 174.71 1pcz s HIS 49 N 4.38 2.86 0.15 0.00 3.76 0.16 0.05 115.29 126.66 1pcz s HIS 49 Ca 0.32 -0.11 -0.21 0.00 -0.15 0.00 0.00 55.06 54.92 1pcz s HIS 49 Cb -0.12 -3.94 -0.08 0.00 1.11 0.00 0.00 32.58 29.56 1pcz s HIS 49 CO 0.19 -1.26 0.68 -0.51 -0.85 0.00 0.00 174.74 172.98 1pcz s LEU 50 N 3.63 4.47 0.05 0.89 1.43 -0.21 -2.73 118.68 126.21 1pcz s LEU 50 Ca 0.27 1.41 -0.10 0.00 -1.03 0.00 0.00 54.13 54.68 1pcz s LEU 50 Cb -0.14 -3.27 -0.32 0.00 0.03 0.00 0.00 46.19 42.49 1pcz s LEU 50 CO 0.18 0.16 1.07 0.44 0.23 0.00 0.00 176.35 178.43 1pcz h ASP 51 N 4.02 0.63 -3.04 2.29 3.32 -1.96 -3.08 116.42 118.60 1pcz h ASP 51 Ca -0.48 -0.68 -0.37 0.00 0.02 0.00 0.00 57.03 55.52 1pcz h ASP 51 Cb 1.20 -0.20 -0.38 0.00 0.22 0.00 0.00 39.33 40.17 1pcz h ASP 51 CO 0.65 1.53 -0.70 -1.81 -1.72 0.00 0.00 179.24 177.19 1pcz s ASP 52 N -7.36 1.48 0.62 6.45 1.01 -1.26 -1.78 116.67 115.83 1pcz s ASP 52 Ca -0.06 -0.13 -0.15 0.00 0.71 0.00 0.00 52.55 52.91 1pcz s ASP 52 Cb 0.06 0.02 -0.02 0.00 1.01 0.00 0.00 42.92 43.98 1pcz s ASP 52 CO 0.91 -0.29 1.07 -2.16 0.21 0.00 0.00 175.17 174.91 1pcz s PRO 53 N 2.22 3.12 -0.78 8.23 0.04 -1.26 -4.90 135.00 141.66 1pcz s PRO 53 Ca 0.04 1.25 -0.25 0.00 0.04 0.00 0.00 61.00 62.07 1pcz s PRO 53 Cb -0.14 -2.00 -0.02 0.00 0.04 0.00 0.00 34.50 32.38 1pcz s PRO 53 CO -0.07 -0.98 1.80 0.21 0.04 0.00 0.00 177.00 178.00 1pcz s LYS 54 N -4.14 2.74 0.10 4.56 2.20 -0.74 -4.40 119.74 120.06 1pcz s LYS 54 Ca 0.64 0.00 -0.11 0.00 -0.36 0.00 0.00 55.97 56.14 1pcz s LYS 54 Cb -0.17 -4.73 0.01 0.00 -1.51 0.00 0.00 37.83 31.43 1pcz s LYS 54 CO 0.40 -2.89 0.27 0.54 -0.36 0.00 0.00 175.35 173.31 1pcz s VAL 55 N 8.77 0.11 -0.13 4.02 0.11 -1.16 -4.66 120.40 127.46 1pcz s VAL 55 Ca 0.63 -0.94 0.02 0.00 -2.93 0.00 0.00 61.98 58.76 1pcz s VAL 55 Cb -0.09 -1.24 0.01 0.00 -1.53 0.00 0.00 36.38 33.54 1pcz s VAL 55 CO 0.09 -0.52 -0.18 0.00 -3.33 0.00 0.00 175.10 171.15 1pcz s ALA 56 N -3.71 1.98 -0.12 1.54 0.00 0.30 -1.05 121.76 120.71 1pcz s ALA 56 Ca 0.03 -0.93 -0.13 0.00 0.00 0.00 0.00 51.96 50.93 1pcz s ALA 56 Cb 0.03 -0.94 -0.05 0.00 0.00 0.00 0.00 23.12 22.16 1pcz s ALA 56 CO -0.11 -0.10 0.29 -0.51 0.00 0.00 0.00 175.76 175.34 1pcz s LEU 57 N 0.97 4.32 -0.50 0.00 1.43 0.11 -0.14 118.68 124.87 1pcz s LEU 57 Ca -0.05 0.60 -0.16 0.00 -1.03 0.00 0.00 54.13 53.49 1pcz s LEU 57 Cb -0.15 -2.37 0.09 0.00 0.03 0.00 0.00 46.19 43.80 1pcz s LEU 57 CO -0.03 0.21 0.47 -0.76 0.23 0.00 0.00 176.35 176.47 1pcz s LEU 58 N -0.16 5.69 -0.27 1.79 1.43 0.42 0.99 118.68 128.59 1pcz s LEU 58 Ca 0.18 -1.42 -0.16 0.00 -1.03 0.00 0.00 54.13 51.70 1pcz s LEU 58 Cb -0.14 -2.23 -0.03 0.00 0.03 0.00 0.00 46.19 43.82 1pcz s LEU 58 CO 0.06 -0.76 0.42 -0.63 0.23 0.00 0.00 176.35 175.66 1pcz s ILE 59 N 1.81 5.14 0.19 -0.59 1.01 0.17 -1.80 121.20 127.13 1pcz s ILE 59 Ca 0.05 0.67 0.04 0.00 0.00 0.00 0.00 60.65 61.41 1pcz s ILE 59 Cb -0.25 -3.74 -0.03 0.00 0.01 0.00 0.00 42.46 38.44 1pcz s ILE 59 CO 0.06 0.14 0.27 -0.36 0.00 0.00 0.00 174.94 175.04 1pcz s PHE 60 N 2.14 3.36 0.29 3.97 0.08 -0.50 0.60 117.98 127.92 1pcz s PHE 60 Ca 0.17 0.02 0.36 0.00 0.12 0.00 0.00 56.93 57.60 1pcz s PHE 60 Cb -0.16 -1.58 1.65 0.00 -0.57 0.00 0.00 43.02 42.37 1pcz s PHE 60 CO 0.10 0.50 2.09 0.66 -0.10 0.00 0.00 175.22 178.47 1pcz h SER 61 N 1.84 0.00 0.55 1.36 4.64 -1.84 -1.86 113.55 118.24 1pcz h SER 61 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1pcz h SER 61 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1pcz h SER 61 CO 0.64 0.02 0.00 -1.54 -0.87 0.00 0.00 176.83 175.09 1pcz n SER 62 N -3.16 0.23 0.00 4.97 3.41 -1.26 0.17 113.62 117.98 1pcz n SER 62 Ca -0.01 0.56 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 1pcz n SER 62 Cb 0.24 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 63.58 1pcz n SER 62 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pcz n GLY 63 N -0.08 0.69 3.78 5.00 0.00 -0.70 -4.07 105.19 109.81 1pcz n GLY 63 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 1pcz n GLY 63 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pcz s LYS 64 N -0.75 4.48 0.30 1.61 1.02 -1.26 0.26 119.74 125.40 1pcz s LYS 64 Ca 0.00 1.05 0.05 0.00 0.02 0.00 0.00 55.97 57.09 1pcz s LYS 64 Cb 0.00 -3.27 -0.06 0.00 -0.52 0.00 0.00 37.83 33.98 1pcz s LYS 64 CO 0.00 0.56 0.00 -0.51 -0.92 0.00 0.00 175.35 174.48 1pcz s LEU 65 N -1.02 2.34 -0.18 3.17 1.43 0.26 -1.41 118.68 123.27 1pcz s LEU 65 Ca 0.34 -1.28 -0.02 0.00 -1.03 0.00 0.00 54.13 52.14 1pcz s LEU 65 Cb -0.22 -0.50 0.05 0.00 0.03 0.00 0.00 46.19 45.56 1pcz s LEU 65 CO 0.24 -0.48 0.01 -0.69 0.23 0.00 0.00 176.35 175.66 1pcz s VAL 66 N -3.17 0.68 -0.25 -1.59 1.01 -0.75 -0.19 120.40 116.15 1pcz s VAL 66 Ca 0.33 -0.55 -0.24 0.00 0.00 0.00 0.00 61.98 61.52 1pcz s VAL 66 Cb 0.07 -1.08 -0.01 0.00 0.00 0.00 0.00 36.38 35.36 1pcz s VAL 66 CO 0.13 -0.10 0.79 -0.69 0.00 0.00 0.00 175.10 175.23 1pcz s VAL 67 N 1.80 4.86 0.19 2.92 1.01 0.76 -0.43 120.40 131.50 1pcz s VAL 67 Ca -0.00 1.43 0.09 0.00 0.00 0.00 0.00 61.98 63.50 1pcz s VAL 67 Cb -0.16 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 1pcz s VAL 67 CO -0.07 -0.08 -0.18 0.42 0.00 0.00 0.00 175.10 175.18 1pcz s THR 68 N 2.80 1.95 -0.54 3.92 -4.23 0.80 -1.52 115.64 118.81 1pcz s THR 68 Ca 0.33 -2.06 0.00 0.00 -1.18 0.00 0.00 61.69 58.78 1pcz s THR 68 Cb -0.15 -1.98 0.00 0.00 1.34 0.00 0.00 72.50 71.71 1pcz s THR 68 CO 0.08 -0.36 0.00 0.61 -0.54 0.00 0.00 174.62 174.41 1pcz n GLY 69 N 0.02 0.76 3.84 3.99 0.00 -1.26 -0.54 105.19 112.00 1pcz n GLY 69 Ca -0.11 -0.83 -0.36 0.00 0.00 0.00 0.00 46.02 44.72 1pcz n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pcz s ALA 70 N -2.19 3.62 -1.77 4.61 0.00 -1.20 -4.57 121.76 120.26 1pcz s ALA 70 Ca 0.00 -0.14 0.15 0.00 0.00 0.00 0.00 51.96 51.97 1pcz s ALA 70 Cb 0.00 -2.49 0.09 0.00 0.00 0.00 0.00 23.12 20.72 1pcz s ALA 70 CO 0.00 0.46 0.94 1.63 0.00 0.00 0.00 175.76 178.79 1pcz n LYS 71 N 1.22 1.26 -3.79 0.00 5.02 -1.26 0.28 118.16 120.89 1pcz n LYS 71 Ca -0.08 -1.26 -0.10 0.00 -2.02 0.00 0.00 58.31 54.85 1pcz n LYS 71 Cb 0.52 -1.28 -0.06 0.00 -0.02 0.00 0.00 35.03 34.19 1pcz n LYS 71 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1pcz s SER 72 N -1.37 -0.05 0.35 4.39 1.04 -1.26 -4.83 113.70 111.97 1pcz s SER 72 Ca 0.16 -0.56 0.17 0.00 0.48 0.00 0.00 55.95 56.20 1pcz s SER 72 Cb 0.12 0.43 0.60 0.00 0.10 0.00 0.00 66.02 67.27 1pcz s SER 72 CO 0.23 -0.83 1.70 0.58 0.98 0.00 0.00 173.24 175.90 1pcz h VAL 73 N 2.53 1.01 -0.13 5.02 2.07 -1.98 -2.82 116.25 121.95 1pcz h VAL 73 Ca -0.33 -1.66 -0.01 0.00 0.82 0.00 0.00 66.70 65.52 1pcz h VAL 73 Cb 1.23 1.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.97 1pcz h VAL 73 CO 0.50 0.42 0.06 -0.61 0.02 0.00 0.00 177.57 177.96 1pcz h GLN 74 N 0.00 0.20 -0.64 1.57 4.15 -1.98 0.58 115.11 118.99 1pcz h GLN 74 Ca -0.00 -0.03 0.11 0.00 0.77 0.00 0.00 58.65 59.49 1pcz h GLN 74 Cb 0.94 -0.03 -0.08 0.00 0.21 0.00 0.00 27.48 28.52 1pcz h GLN 74 CO 0.06 0.27 0.22 -0.44 -1.93 0.00 0.00 178.83 177.01 1pcz h ASP 75 N 0.07 0.17 0.29 -0.69 5.19 -1.92 0.28 116.42 119.83 1pcz h ASP 75 Ca 0.05 0.09 -0.01 0.00 -0.62 0.00 0.00 57.03 56.54 1pcz h ASP 75 Cb 0.15 0.09 0.00 0.00 0.18 0.00 0.00 39.33 39.75 1pcz h ASP 75 CO -0.00 0.09 -0.14 0.40 -3.12 0.00 0.00 179.24 176.47 1pcz h ILE 76 N 0.37 0.74 -0.49 0.35 2.04 -1.24 -1.19 117.51 118.09 1pcz h ILE 76 Ca 0.33 -0.31 0.06 0.00 1.00 0.00 0.00 64.86 65.94 1pcz h ILE 76 Cb 0.46 0.92 -0.05 0.00 -0.74 0.00 0.00 36.82 37.40 1pcz h ILE 76 CO -0.36 0.07 0.20 -0.33 0.00 0.00 0.00 178.15 177.73 1pcz h GLU 77 N -0.56 0.38 -0.34 2.37 4.39 -0.24 -1.30 114.58 119.28 1pcz h GLU 77 Ca -0.04 -0.02 -0.12 0.00 0.34 0.00 0.00 59.36 59.52 1pcz h GLU 77 Cb 0.41 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.96 1pcz h GLU 77 CO 0.07 0.25 -0.28 0.00 -1.16 0.00 0.00 179.01 177.89 1pcz h ARG 78 N 0.39 0.70 -0.33 2.33 3.08 -0.47 -1.69 114.38 118.38 1pcz h ARG 78 Ca 0.23 -0.30 -0.07 0.00 0.07 0.00 0.00 59.98 59.91 1pcz h ARG 78 Cb 0.22 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1pcz h ARG 78 CO -0.22 0.89 -0.09 0.00 -1.07 0.00 0.00 179.97 179.49 1pcz h ALA 79 N 1.09 0.45 -0.62 0.04 0.00 -0.82 0.20 119.26 119.61 1pcz h ALA 79 Ca 0.08 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 1pcz h ALA 79 Cb 0.78 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1pcz h ALA 79 CO 0.06 0.30 0.06 0.28 0.00 0.00 0.00 179.25 179.95 1pcz h VAL 80 N 0.42 1.26 -0.42 0.00 2.07 -1.15 0.15 116.25 118.58 1pcz h VAL 80 Ca 0.08 -1.07 -0.14 0.00 0.82 0.00 0.00 66.70 66.39 1pcz h VAL 80 Cb 0.59 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 1pcz h VAL 80 CO 0.03 0.39 -0.30 0.00 0.02 0.00 0.00 177.57 177.71 1pcz h ALA 81 N 1.08 0.67 -0.56 1.67 0.00 -1.18 0.31 119.26 121.24 1pcz h ALA 81 Ca 0.19 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1pcz h ALA 81 Cb 0.48 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1pcz h ALA 81 CO 0.02 0.67 0.24 -0.22 0.00 0.00 0.00 179.25 179.96 1pcz h LYS 82 N 0.78 0.83 0.13 0.00 1.63 -0.30 0.15 116.57 119.79 1pcz h LYS 82 Ca 0.08 -0.14 -0.01 0.00 -0.85 0.00 0.00 60.65 59.73 1pcz h LYS 82 Cb 0.88 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 32.37 1pcz h LYS 82 CO 0.08 0.71 -0.06 1.25 -3.45 0.00 0.00 179.45 177.97 1pcz h LEU 83 N 0.76 -0.15 -0.76 5.20 6.46 -0.60 -2.28 115.31 123.95 1pcz h LEU 83 Ca 0.19 -0.28 0.16 0.00 -0.12 0.00 0.00 57.88 57.83 1pcz h LEU 83 Cb 0.18 0.04 -0.11 0.00 -0.73 0.00 0.00 40.66 40.04 1pcz h LEU 83 CO -0.02 0.22 0.23 0.00 -0.62 0.00 0.00 178.44 178.25 1pcz h ALA 84 N 0.25 1.03 -0.47 1.25 0.00 -0.68 0.35 119.26 121.00 1pcz h ALA 84 Ca -0.02 0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 1pcz h ALA 84 Cb 0.43 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1pcz h ALA 84 CO 0.03 -0.31 -0.02 1.96 0.00 0.00 0.00 179.25 180.91 1pcz h GLN 85 N 0.32 0.85 -0.66 0.00 1.08 -0.69 -0.09 115.11 115.93 1pcz h GLN 85 Ca 0.43 -0.28 0.02 0.00 -1.45 0.00 0.00 58.65 57.37 1pcz h GLN 85 Cb 0.73 -0.07 -0.04 0.00 -0.05 0.00 0.00 27.48 28.05 1pcz h GLN 85 CO -0.49 0.91 0.43 0.87 -0.95 0.00 0.00 178.83 179.59 1pcz h LYS 86 N 0.70 0.83 -0.55 1.46 1.57 -0.16 -0.08 116.57 120.35 1pcz h LYS 86 Ca 0.13 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.79 1pcz h LYS 86 Cb 0.53 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 1pcz h LYS 86 CO 0.03 0.55 0.07 -0.07 -0.57 0.00 0.00 179.45 179.46 1pcz h LEU 87 N 0.86 0.85 -0.75 2.94 3.38 -0.09 -1.76 115.31 120.74 1pcz h LEU 87 Ca 0.25 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 58.04 1pcz h LEU 87 Cb -0.05 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.44 1pcz h LEU 87 CO -0.07 0.87 0.49 0.11 0.09 0.00 0.00 178.44 179.92 1pcz h LYS 88 N 0.84 0.99 0.00 1.13 1.57 0.13 0.19 116.57 121.41 1pcz h LYS 88 Ca 0.17 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1pcz h LYS 88 Cb 0.40 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1pcz h LYS 88 CO 0.01 0.66 0.00 -1.13 -0.57 0.00 0.00 179.45 178.42 1pcz n SER 89 N -4.56 0.00 -0.75 0.86 3.41 -0.15 -0.68 113.62 111.75 1pcz n SER 89 Ca 0.07 0.11 0.05 0.00 -0.26 0.00 0.00 58.87 58.85 1pcz n SER 89 Cb 0.02 -0.22 0.18 0.00 -0.26 0.00 0.00 64.21 63.94 1pcz n SER 89 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1pcz n ILE 90 N -1.22 1.90 -1.00 -1.33 -5.35 -0.48 -4.94 119.36 106.94 1pcz n ILE 90 Ca 0.03 -2.94 -0.00 0.00 -0.27 0.00 0.00 62.75 59.56 1pcz n ILE 90 Cb 0.04 -0.07 -0.00 0.00 -1.74 0.00 0.00 39.64 37.86 1pcz n ILE 90 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1pcz n GLY 91 N -0.89 0.44 3.66 3.28 0.00 0.14 -4.98 105.19 106.84 1pcz n GLY 91 Ca 0.17 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 1pcz n GLY 91 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pcz s VAL 92 N -1.87 4.67 0.02 1.61 1.01 0.53 -4.97 120.40 121.40 1pcz s VAL 92 Ca 0.00 2.00 0.01 0.00 0.00 0.00 0.00 61.98 63.99 1pcz s VAL 92 Cb 0.00 -4.32 -0.04 0.00 0.00 0.00 0.00 36.38 32.03 1pcz s VAL 92 CO 0.00 -0.20 0.04 -0.54 0.00 0.00 0.00 175.10 174.40 1pcz s LYS 93 N 3.23 2.88 -0.20 2.72 1.02 -1.26 -3.68 119.74 124.45 1pcz s LYS 93 Ca 0.44 -0.60 0.01 0.00 0.02 0.00 0.00 55.97 55.84 1pcz s LYS 93 Cb -0.15 -2.74 0.02 0.00 -0.52 0.00 0.00 37.83 34.45 1pcz s LYS 93 CO 0.07 0.62 -0.18 -0.06 -0.92 0.00 0.00 175.35 174.88 1pcz s PHE 94 N -1.19 2.87 -0.00 3.18 0.08 -1.26 -4.86 117.98 116.79 1pcz s PHE 94 Ca 0.23 -1.71 -0.25 0.00 0.12 0.00 0.00 56.93 55.32 1pcz s PHE 94 Cb -0.12 -1.94 -0.18 0.00 -0.57 0.00 0.00 43.02 40.22 1pcz s PHE 94 CO 0.14 -0.80 1.24 1.57 -0.10 0.00 0.00 175.22 177.27 1pcz h LYS 95 N 7.93 -0.21 -6.79 0.44 -0.00 -1.87 -3.47 116.57 112.60 1pcz h LYS 95 Ca -0.42 0.01 -0.49 0.00 -0.00 0.00 0.00 60.65 59.76 1pcz h LYS 95 Cb 1.13 0.05 0.05 0.00 -0.00 0.00 0.00 32.23 33.45 1pcz h LYS 95 CO 0.61 0.15 -0.03 1.03 -0.00 0.00 0.00 179.45 181.22 1pcz s ARG 96 N -4.49 2.07 0.13 0.07 0.52 -1.26 -5.09 118.95 110.90 1pcz s ARG 96 Ca -0.14 -1.54 -0.21 0.00 -0.52 0.00 0.00 55.73 53.31 1pcz s ARG 96 Cb 0.02 -2.55 -0.07 0.00 0.52 0.00 0.00 34.95 32.87 1pcz s ARG 96 CO 0.59 -1.08 0.67 0.00 0.02 0.00 0.00 175.30 175.49 1pcz s ALA 97 N -2.83 3.51 0.30 2.13 0.00 -1.26 -4.95 121.76 118.66 1pcz s ALA 97 Ca 0.64 0.17 -0.30 0.00 0.00 0.00 0.00 51.96 52.47 1pcz s ALA 97 Cb -0.05 -2.78 -0.11 0.00 0.00 0.00 0.00 23.12 20.18 1pcz s ALA 97 CO 0.41 0.35 1.57 -2.14 0.00 0.00 0.00 175.76 175.95 1pcz s PRO 98 N -1.29 4.13 -0.53 0.00 0.02 -1.26 -4.85 135.00 131.22 1pcz s PRO 98 Ca 0.34 2.56 -0.16 0.00 0.02 0.00 0.00 61.00 63.76 1pcz s PRO 98 Cb -0.20 -3.02 0.11 0.00 0.02 0.00 0.00 34.50 31.41 1pcz s PRO 98 CO 0.22 -0.60 0.49 -1.14 -0.33 0.00 0.00 177.00 175.63 1pcz s GLN 99 N -0.77 2.99 -0.26 5.54 0.74 -0.43 -4.91 119.66 122.57 1pcz s GLN 99 Ca 0.61 -1.60 -0.12 0.00 0.05 0.00 0.00 55.36 54.30 1pcz s GLN 99 Cb -0.47 -4.26 -0.05 0.00 1.10 0.00 0.00 33.01 29.33 1pcz s GLN 99 CO 0.50 -1.27 0.23 0.42 -0.55 0.00 0.00 175.29 174.62 1pcz s ILE 100 N 1.66 5.30 -0.12 -2.34 1.01 -1.26 -1.51 121.20 123.94 1pcz s ILE 100 Ca 0.04 0.29 0.00 0.00 0.00 0.00 0.00 60.65 60.98 1pcz s ILE 100 Cb -0.28 -3.56 0.02 0.00 0.01 0.00 0.00 42.46 38.64 1pcz s ILE 100 CO 0.04 0.27 -0.12 -1.81 0.00 0.00 0.00 174.94 173.32 1pcz s ASP 101 N 1.41 2.39 0.02 3.58 1.01 0.93 -4.97 116.67 121.04 1pcz s ASP 101 Ca 0.10 -0.40 -0.30 0.00 0.71 0.00 0.00 52.55 52.66 1pcz s ASP 101 Cb -0.15 -1.02 -0.08 0.00 1.01 0.00 0.00 42.92 42.69 1pcz s ASP 101 CO 0.08 -0.06 1.74 -0.69 0.21 0.00 0.00 175.17 176.45 1pcz s VAL 102 N 1.40 3.18 -0.14 -1.27 1.01 -1.26 -0.25 120.40 123.07 1pcz s VAL 102 Ca 0.01 0.42 0.18 0.00 0.00 0.00 0.00 61.98 62.60 1pcz s VAL 102 Cb -0.13 -3.27 -0.25 0.00 0.00 0.00 0.00 36.38 32.72 1pcz s VAL 102 CO -0.07 -0.02 0.32 0.00 0.00 0.00 0.00 175.10 175.33 1pcz n GLN 103 N 6.56 0.67 -3.61 2.72 1.13 0.21 -4.85 117.38 120.21 1pcz n GLN 103 Ca 0.17 -0.00 -0.12 0.00 -1.94 0.00 0.00 57.00 55.11 1pcz n GLN 103 Cb 0.41 -1.58 -0.06 0.00 0.11 0.00 0.00 30.24 29.12 1pcz n GLN 103 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 1pcz s ASN 104 N -5.33 -0.53 -0.03 1.08 2.47 -1.00 -4.82 114.94 106.77 1pcz s ASN 104 Ca -0.08 0.89 0.04 0.00 0.42 0.00 0.00 52.86 54.13 1pcz s ASN 104 Cb 0.08 0.86 -0.01 0.00 -1.45 0.00 0.00 41.25 40.73 1pcz s ASN 104 CO 0.85 -0.28 -0.15 -0.04 -3.72 0.00 0.00 177.10 173.76 1pcz s MET 105 N -0.20 1.42 -0.13 0.43 -1.94 0.44 0.15 119.30 119.46 1pcz s MET 105 Ca -0.01 -0.54 0.02 0.00 -1.71 0.00 0.00 55.69 53.46 1pcz s MET 105 Cb -0.03 -1.31 0.01 0.00 2.01 0.00 0.00 34.83 35.51 1pcz s MET 105 CO -0.01 0.27 -0.21 0.08 -0.01 0.00 0.00 175.02 175.15 1pcz s VAL 106 N -0.14 1.96 -0.06 -6.03 1.01 0.34 -3.25 120.40 114.24 1pcz s VAL 106 Ca 0.01 -0.92 0.05 0.00 0.00 0.00 0.00 61.98 61.12 1pcz s VAL 106 Cb -0.08 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 1pcz s VAL 106 CO 0.01 0.53 -0.20 -0.36 0.00 0.00 0.00 175.10 175.08 1pcz s PHE 107 N 0.84 2.56 0.28 5.22 0.40 0.17 0.12 117.98 127.57 1pcz s PHE 107 Ca -0.07 -0.46 0.03 0.00 -0.60 0.00 0.00 56.93 55.83 1pcz s PHE 107 Cb -0.15 -1.62 -0.03 0.00 0.51 0.00 0.00 43.02 41.72 1pcz s PHE 107 CO -0.02 -0.04 0.43 -1.54 0.70 0.00 0.00 175.22 174.75 1pcz s SER 108 N -0.37 6.30 0.00 1.36 1.04 0.64 0.46 113.70 123.13 1pcz s SER 108 Ca 0.03 0.21 0.00 0.00 0.48 0.00 0.00 55.95 56.67 1pcz s SER 108 Cb -0.12 -1.91 0.00 0.00 0.10 0.00 0.00 66.02 64.08 1pcz s SER 108 CO 0.02 -0.16 0.00 0.61 0.98 0.00 0.00 173.24 174.69 1pcz n GLY 109 N -1.56 1.73 3.62 7.32 0.00 0.19 -0.77 105.19 115.72 1pcz n GLY 109 Ca -0.07 -0.80 -0.05 0.00 0.00 0.00 0.00 46.02 45.10 1pcz n GLY 109 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1pcz s ASP 110 N 0.64 -0.98 0.00 1.61 2.15 -0.35 -1.32 116.67 118.41 1pcz s ASP 110 Ca 0.00 1.51 0.18 0.00 0.43 0.00 0.00 52.55 54.67 1pcz s ASP 110 Cb 0.00 1.64 0.52 0.00 -0.30 0.00 0.00 42.92 44.79 1pcz s ASP 110 CO 0.00 -0.23 1.42 2.30 -0.17 0.00 0.00 175.17 178.49 1pcz n ILE 111 N 4.68 0.47 -1.34 4.11 -5.35 0.81 -1.16 119.36 121.57 1pcz n ILE 111 Ca -0.18 -0.55 -0.09 0.00 -0.27 0.00 0.00 62.75 61.66 1pcz n ILE 111 Cb 0.56 0.43 -0.04 0.00 -1.74 0.00 0.00 39.64 38.85 1pcz n ILE 111 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1pcz n GLY 112 N 1.24 1.01 3.01 3.28 0.00 -1.24 -4.49 105.19 108.00 1pcz n GLY 112 Ca 0.16 -0.60 -0.13 0.00 0.00 0.00 0.00 46.02 45.45 1pcz n GLY 112 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pcz s ARG 113 N -2.92 0.17 0.64 1.61 1.81 -1.26 -5.06 118.95 113.93 1pcz s ARG 113 Ca 0.00 0.35 -0.12 0.00 -1.72 0.00 0.00 55.73 54.24 1pcz s ARG 113 Cb 0.00 -0.04 -0.03 0.00 -0.45 0.00 0.00 34.95 34.44 1pcz s ARG 113 CO 0.00 -0.10 1.04 -1.21 -0.68 0.00 0.00 175.30 174.35 1pcz s GLU 114 N 0.68 3.38 0.05 3.54 2.02 -1.26 -3.30 118.70 123.82 1pcz s GLU 114 Ca -0.05 0.87 -0.03 0.00 0.02 0.00 0.00 54.97 55.78 1pcz s GLU 114 Cb -0.06 -2.05 -0.03 0.00 0.10 0.00 0.00 34.13 32.09 1pcz s GLU 114 CO -0.04 -0.74 0.02 -0.06 0.02 0.00 0.00 175.26 174.46 1pcz s PHE 115 N -3.04 0.39 -0.41 1.61 0.08 0.36 -4.87 117.98 112.09 1pcz s PHE 115 Ca 0.57 -0.85 -0.08 0.00 0.12 0.00 0.00 56.93 56.69 1pcz s PHE 115 Cb -0.12 -0.28 0.08 0.00 -0.57 0.00 0.00 43.02 42.13 1pcz s PHE 115 CO 0.51 -0.38 0.24 1.21 -0.10 0.00 0.00 175.22 176.70 1pcz s ASN 116 N -2.63 5.54 0.46 1.36 3.84 -1.26 -4.34 114.94 117.91 1pcz s ASN 116 Ca 0.02 -1.58 0.14 0.00 0.21 0.00 0.00 52.86 51.65 1pcz s ASN 116 Cb 0.04 -1.95 1.06 0.00 -0.55 0.00 0.00 41.25 39.85 1pcz s ASN 116 CO -0.08 -0.53 2.03 -0.07 -2.79 0.00 0.00 177.10 175.66 1pcz h LEU 117 N 8.33 0.03 -0.31 3.21 3.38 -1.94 0.25 115.31 128.26 1pcz h LEU 117 Ca -0.21 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.71 1pcz h LEU 117 Cb 1.08 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 1pcz h LEU 117 CO 0.74 0.15 0.01 0.44 0.09 0.00 0.00 178.44 179.87 1pcz h ASP 118 N 0.03 0.53 -0.01 -0.43 3.32 -1.98 0.20 116.42 118.08 1pcz h ASP 118 Ca 0.01 -0.30 -0.00 0.00 0.02 0.00 0.00 57.03 56.76 1pcz h ASP 118 Cb 0.22 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 1pcz h ASP 118 CO 0.01 0.70 -0.00 0.58 -1.72 0.00 0.00 179.24 178.81 1pcz h VAL 119 N 0.35 1.28 -0.49 -1.35 2.07 -1.85 -0.59 116.25 115.67 1pcz h VAL 119 Ca 0.09 -0.84 0.10 0.00 0.82 0.00 0.00 66.70 66.87 1pcz h VAL 119 Cb 0.41 1.84 -0.10 0.00 -1.52 0.00 0.00 31.29 31.93 1pcz h VAL 119 CO 0.01 0.22 -0.15 0.58 0.02 0.00 0.00 177.57 178.25 1pcz h VAL 120 N -0.33 0.46 -0.30 2.57 2.07 -0.47 0.49 116.25 120.73 1pcz h VAL 120 Ca 0.00 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 1pcz h VAL 120 Cb 0.36 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1pcz h VAL 120 CO 0.00 0.00 -0.04 0.00 0.02 0.00 0.00 177.57 177.55 1pcz h ALA 121 N 1.42 1.38 0.01 1.67 0.00 -0.42 0.96 119.26 124.28 1pcz h ALA 121 Ca 0.24 -0.21 -0.19 0.00 0.00 0.00 0.00 54.91 54.75 1pcz h ALA 121 Cb 0.40 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1pcz h ALA 121 CO -0.53 0.43 -0.88 -0.07 0.00 0.00 0.00 179.25 178.20 1pcz h LEU 122 N 0.45 0.05 0.06 0.00 3.38 -0.24 -3.37 115.31 115.64 1pcz h LEU 122 Ca 0.09 -0.05 -0.18 0.00 0.09 0.00 0.00 57.88 57.83 1pcz h LEU 122 Cb 0.36 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1pcz h LEU 122 CO 0.01 0.91 -0.95 0.74 0.09 0.00 0.00 178.44 179.25 1pcz h THR 123 N 0.02 1.25 -3.72 0.22 2.02 0.78 -3.46 112.91 110.01 1pcz h THR 123 Ca -0.02 -2.35 -0.53 0.00 0.77 0.00 0.00 66.41 64.29 1pcz h THR 123 Cb 1.55 2.82 0.08 0.00 -1.74 0.00 0.00 68.15 70.85 1pcz h THR 123 CO 0.12 0.58 0.73 -0.76 0.37 0.00 0.00 175.52 176.56 1pcz s LEU 124 N -7.84 4.38 0.45 2.58 1.43 0.33 -4.89 118.68 115.11 1pcz s LEU 124 Ca -0.21 2.82 0.15 0.00 -1.03 0.00 0.00 54.13 55.85 1pcz s LEU 124 Cb 0.02 -3.65 1.02 0.00 0.03 0.00 0.00 46.19 43.62 1pcz s LEU 124 CO 0.71 -0.71 2.00 1.55 0.23 0.00 0.00 176.35 180.13 1pcz h PRO 125 N 3.82 0.00 -1.31 1.29 0.13 -1.90 -3.40 132.00 130.63 1pcz h PRO 125 Ca -0.49 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.61 1pcz h PRO 125 Cb 1.23 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.12 1pcz h PRO 125 CO 0.69 0.17 -0.40 1.21 -0.23 0.00 0.00 178.00 179.45 1pcz s ASN 126 N -6.99 -0.79 0.29 1.44 3.04 -1.26 -5.13 114.94 105.54 1pcz s ASN 126 Ca -0.04 0.27 -0.18 0.00 0.04 0.00 0.00 52.86 52.95 1pcz s ASN 126 Cb 0.16 1.71 0.02 0.00 -1.54 0.00 0.00 41.25 41.59 1pcz s ASN 126 CO 0.69 -0.30 0.67 0.00 -3.04 0.00 0.00 177.10 175.12 1pcz s GLU 128 N -3.73 1.70 -0.28 0.00 2.02 0.86 -4.92 118.70 114.35 1pcz s GLU 128 Ca 0.15 -0.72 0.01 0.00 0.02 0.00 0.00 54.97 54.43 1pcz s GLU 128 Cb -0.05 -1.61 0.16 0.00 0.10 0.00 0.00 34.13 32.74 1pcz s GLU 128 CO 0.08 0.41 0.43 -0.47 0.02 0.00 0.00 175.26 175.73 1pcz s TYR 129 N -0.40 -1.08 -0.44 1.61 5.04 -1.26 -0.03 117.35 120.79 1pcz s TYR 129 Ca 0.06 0.62 0.05 0.00 -2.44 0.00 0.00 57.07 55.36 1pcz s TYR 129 Cb -0.08 -0.02 0.19 0.00 0.35 0.00 0.00 41.96 42.40 1pcz s TYR 129 CO -0.00 -0.92 0.41 0.39 -1.34 0.00 0.00 175.55 174.09 1pcz n GLU 130 N 5.37 0.52 0.12 4.97 1.02 -1.26 -5.01 120.64 126.36 1pcz n GLU 130 Ca -0.00 -3.33 0.18 0.00 -0.02 0.00 0.00 57.16 53.99 1pcz n GLU 130 Cb 0.50 -1.62 0.76 0.00 -0.02 0.00 0.00 31.44 31.06 1pcz n GLU 130 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1pcz h PRO 131 N 5.15 0.00 0.00 3.49 0.13 -1.83 0.78 132.00 139.73 1pcz h PRO 131 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 1pcz h PRO 131 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 1pcz h PRO 131 CO 0.44 0.00 -0.04 0.93 -0.23 0.00 0.00 178.00 179.10 1pcz h GLU 132 N 0.00 0.00 0.00 0.86 3.07 -2.00 -3.29 114.58 113.22 1pcz h GLU 132 Ca 0.16 0.00 -0.38 0.00 -0.50 0.00 0.00 59.36 58.64 1pcz h GLU 132 Cb 0.78 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 28.62 1pcz h GLU 132 CO -0.00 0.00 -2.46 0.94 -1.40 0.00 0.00 179.01 176.09 1pcz n GLN 133 N -2.52 0.65 -3.66 2.33 7.27 0.64 -5.01 117.38 117.08 1pcz n GLN 133 Ca 0.05 0.13 -0.14 0.00 0.07 0.00 0.00 57.00 57.11 1pcz n GLN 133 Cb 0.46 -1.52 -0.08 0.00 2.41 0.00 0.00 30.24 31.52 1pcz n GLN 133 CO 0.00 0.00 0.00 -0.59 0.07 0.00 0.00 177.06 176.54 1pcz s PHE 134 N -2.51 -0.62 0.53 3.69 -0.12 0.24 -5.07 117.98 114.11 1pcz s PHE 134 Ca -0.32 1.46 -0.16 0.00 -0.05 0.00 0.00 56.93 57.87 1pcz s PHE 134 Cb 0.09 0.23 -0.07 0.00 -0.63 0.00 0.00 43.02 42.64 1pcz s PHE 134 CO 0.62 -0.35 0.99 -1.25 -0.05 0.00 0.00 175.22 175.19 1pcz s PRO 135 N 0.07 3.90 0.02 1.99 0.04 -1.26 -2.89 135.00 136.86 1pcz s PRO 135 Ca -0.02 0.93 0.00 0.00 0.04 0.00 0.00 61.00 61.95 1pcz s PRO 135 Cb -0.04 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.37 1pcz s PRO 135 CO 0.02 -0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.16 1pcz n GLY 136 N -1.73 -1.77 3.62 0.56 0.00 -1.26 -4.90 105.19 99.70 1pcz n GLY 136 Ca 0.06 -1.50 -0.34 0.00 0.00 0.00 0.00 46.02 44.24 1pcz n GLY 136 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pcz s VAL 137 N -1.76 4.20 -0.22 1.61 1.01 0.15 -4.54 120.40 120.85 1pcz s VAL 137 Ca 0.00 -0.27 -0.16 0.00 0.00 0.00 0.00 61.98 61.55 1pcz s VAL 137 Cb 0.00 -2.80 -0.04 0.00 0.00 0.00 0.00 36.38 33.54 1pcz s VAL 137 CO 0.00 0.56 0.40 -0.63 0.00 0.00 0.00 175.10 175.43 1pcz s ILE 138 N -0.37 5.18 -0.22 2.22 1.01 0.96 0.62 121.20 130.60 1pcz s ILE 138 Ca 0.07 0.69 0.02 0.00 0.00 0.00 0.00 60.65 61.43 1pcz s ILE 138 Cb -0.12 -3.73 0.05 0.00 0.01 0.00 0.00 42.46 38.66 1pcz s ILE 138 CO 0.02 0.22 -0.12 -0.47 0.00 0.00 0.00 174.94 174.59 1pcz s TYR 139 N 1.53 2.85 -0.14 3.97 5.04 0.23 -0.09 117.35 130.74 1pcz s TYR 139 Ca 0.18 -1.93 -0.10 0.00 -2.44 0.00 0.00 57.07 52.79 1pcz s TYR 139 Cb -0.15 -1.81 -0.05 0.00 0.35 0.00 0.00 41.96 40.30 1pcz s TYR 139 CO 0.08 -0.82 0.19 1.03 -1.34 0.00 0.00 175.55 174.69 1pcz s ARG 140 N 1.25 3.85 -0.09 4.97 0.52 -1.26 0.69 118.95 128.87 1pcz s ARG 140 Ca -0.04 -0.07 -0.02 0.00 -0.52 0.00 0.00 55.73 55.08 1pcz s ARG 140 Cb -0.17 -3.30 -0.03 0.00 0.52 0.00 0.00 34.95 31.96 1pcz s ARG 140 CO -0.08 0.54 -0.00 0.08 0.02 0.00 0.00 175.30 175.86 1pcz s VAL 141 N -0.36 4.28 -0.17 3.52 1.01 0.17 -4.99 120.40 123.86 1pcz s VAL 141 Ca 0.14 -0.25 -0.24 0.00 0.00 0.00 0.00 61.98 61.62 1pcz s VAL 141 Cb -0.12 -2.81 -0.22 0.00 0.00 0.00 0.00 36.38 33.23 1pcz s VAL 141 CO 0.03 0.59 0.49 0.11 0.00 0.00 0.00 175.10 176.32 1pcz h LYS 142 N 5.34 0.00 -3.70 2.72 6.56 -1.94 -2.33 116.57 123.22 1pcz h LYS 142 Ca -0.49 0.00 -0.50 0.00 -1.06 0.00 0.00 60.65 58.60 1pcz h LYS 142 Cb 1.19 0.00 -0.39 0.00 -0.57 0.00 0.00 32.23 32.46 1pcz h LYS 142 CO 0.55 0.94 -0.77 -1.21 -2.06 0.00 0.00 179.45 176.91 1pcz s GLU 143 N -2.26 0.79 0.35 3.15 8.01 -1.26 -0.43 118.70 127.05 1pcz s GLU 143 Ca -0.22 -0.30 -0.25 0.00 0.01 0.00 0.00 54.97 54.21 1pcz s GLU 143 Cb 0.01 -1.78 -0.10 0.00 -4.31 0.00 0.00 34.13 27.95 1pcz s GLU 143 CO 0.61 -0.51 0.98 -1.25 0.01 0.00 0.00 175.26 175.11 1pcz s PRO 144 N 1.85 4.44 -0.15 0.39 0.04 -1.26 -4.97 135.00 135.34 1pcz s PRO 144 Ca 0.01 1.40 -0.30 0.00 0.04 0.00 0.00 61.00 62.15 1pcz s PRO 144 Cb -0.15 -2.71 -0.07 0.00 0.04 0.00 0.00 34.50 31.61 1pcz s PRO 144 CO -0.07 0.13 2.13 1.17 0.04 0.00 0.00 177.00 180.40 1pcz n LYS 145 N 0.33 2.15 -3.91 4.56 4.81 0.43 -4.57 118.16 121.95 1pcz n LYS 145 Ca 0.03 0.68 -0.08 0.00 -0.87 0.00 0.00 58.31 58.06 1pcz n LYS 145 Cb 0.50 -3.06 -0.03 0.00 0.02 0.00 0.00 35.03 32.46 1pcz n LYS 145 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1pcz s SER 146 N 6.85 -0.11 -0.03 3.14 0.01 -0.88 -3.95 113.70 118.72 1pcz s SER 146 Ca 0.98 -0.83 -0.00 0.00 1.31 0.00 0.00 55.95 57.41 1pcz s SER 146 Cb -0.44 0.69 0.03 0.00 0.21 0.00 0.00 66.02 66.51 1pcz s SER 146 CO 0.40 -1.31 0.01 0.54 0.41 0.00 0.00 173.24 173.29 1pcz s VAL 147 N -3.72 0.11 -0.15 3.43 0.11 0.49 -0.66 120.40 120.01 1pcz s VAL 147 Ca 0.16 0.17 -0.01 0.00 -2.93 0.00 0.00 61.98 59.37 1pcz s VAL 147 Cb -0.04 -0.25 -0.01 0.00 -1.53 0.00 0.00 36.38 34.55 1pcz s VAL 147 CO 0.09 0.15 -0.10 -0.63 -3.33 0.00 0.00 175.10 171.28 1pcz s ILE 148 N 1.32 3.19 -0.26 7.04 1.01 0.22 -0.24 121.20 133.48 1pcz s ILE 148 Ca -0.06 -0.60 -0.10 0.00 0.00 0.00 0.00 60.65 59.90 1pcz s ILE 148 Cb -0.13 -2.37 -0.04 0.00 0.01 0.00 0.00 42.46 39.92 1pcz s ILE 148 CO -0.02 0.50 0.14 -0.22 0.00 0.00 0.00 174.94 175.34 1pcz s LEU 149 N 0.62 3.83 -0.14 2.97 2.96 -0.20 0.77 118.68 129.49 1pcz s LEU 149 Ca -0.06 -0.06 -0.04 0.00 -0.22 0.00 0.00 54.13 53.75 1pcz s LEU 149 Cb -0.15 -2.05 -0.03 0.00 0.50 0.00 0.00 46.19 44.46 1pcz s LEU 149 CO 0.03 -0.02 -0.00 -0.22 -1.32 0.00 0.00 176.35 174.81 1pcz s LEU 150 N 1.58 3.49 0.16 -0.68 2.96 0.20 -1.10 118.68 125.29 1pcz s LEU 150 Ca 0.07 0.01 0.06 0.00 -0.22 0.00 0.00 54.13 54.05 1pcz s LEU 150 Cb -0.15 -1.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 1pcz s LEU 150 CO 0.08 0.23 0.03 -0.36 -1.32 0.00 0.00 176.35 175.00 1pcz s PHE 151 N -0.01 2.93 0.45 5.38 0.08 0.01 0.30 117.98 127.12 1pcz s PHE 151 Ca 0.03 -0.09 0.22 0.00 0.12 0.00 0.00 56.93 57.20 1pcz s PHE 151 Cb -0.13 -1.43 1.20 0.00 -0.57 0.00 0.00 43.02 42.09 1pcz s PHE 151 CO 0.02 0.51 1.84 0.66 -0.10 0.00 0.00 175.22 178.15 1pcz h SER 152 N 2.79 0.30 0.10 1.36 4.64 -1.86 0.34 113.55 121.22 1pcz h SER 152 Ca -0.47 0.04 -0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1pcz h SER 152 Cb 1.19 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1pcz h SER 152 CO 0.59 0.10 -0.01 0.77 -0.87 0.00 0.00 176.83 177.41 1pcz h SER 153 N 0.29 0.00 0.00 4.97 4.64 -1.87 1.03 113.55 122.61 1pcz h SER 153 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 1pcz h SER 153 Cb 1.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.50 1pcz h SER 153 CO -0.15 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.43 1pcz n GLY 154 N -1.06 0.15 3.75 -0.77 0.00 0.12 -4.12 105.19 103.26 1pcz n GLY 154 Ca -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 1pcz n GLY 154 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pcz s LYS 155 N -1.00 4.53 0.16 1.61 -0.14 -1.25 -0.13 119.74 123.52 1pcz s LYS 155 Ca 0.00 1.92 0.06 0.00 -1.36 0.00 0.00 55.97 56.59 1pcz s LYS 155 Cb 0.00 -3.18 -0.04 0.00 -1.68 0.00 0.00 37.83 32.92 1pcz s LYS 155 CO 0.00 0.02 -0.13 0.96 -0.76 0.00 0.00 175.35 175.44 1pcz s ILE 156 N -0.74 1.39 -0.21 2.17 -4.36 -0.44 -0.81 121.20 118.20 1pcz s ILE 156 Ca 0.49 -2.02 -0.03 0.00 -0.26 0.00 0.00 60.65 58.83 1pcz s ILE 156 Cb -0.34 -1.83 0.07 0.00 1.25 0.00 0.00 42.46 41.61 1pcz s ILE 156 CO 0.42 -0.61 0.04 -0.69 0.24 0.00 0.00 174.94 174.34 1pcz s VAL 157 N -2.90 0.56 -0.09 8.37 1.01 -0.26 0.55 120.40 127.63 1pcz s VAL 157 Ca 0.16 -0.68 -0.19 0.00 0.00 0.00 0.00 61.98 61.27 1pcz s VAL 157 Cb -0.00 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 1pcz s VAL 157 CO 0.03 -0.29 0.53 0.00 0.00 0.00 0.00 175.10 175.37 1pcz s SER 159 N 0.47 0.31 0.00 0.00 0.15 0.67 0.42 113.70 115.72 1pcz s SER 159 Ca 0.28 -1.36 0.00 0.00 0.70 0.00 0.00 55.95 55.58 1pcz s SER 159 Cb -0.16 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.49 1pcz s SER 159 CO 0.13 -0.81 0.00 0.61 1.20 0.00 0.00 173.24 174.37 1pcz n GLY 160 N -0.26 2.88 3.82 9.45 0.00 -1.20 -0.38 105.19 119.50 1pcz n GLY 160 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1pcz n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pcz s ALA 161 N -1.78 2.70 -0.08 4.61 0.00 -1.25 -4.63 121.76 121.32 1pcz s ALA 161 Ca 0.00 0.04 0.12 0.00 0.00 0.00 0.00 51.96 52.12 1pcz s ALA 161 Cb 0.00 -3.16 0.18 0.00 0.00 0.00 0.00 23.12 20.14 1pcz s ALA 161 CO 0.00 -1.20 1.09 1.63 0.00 0.00 0.00 175.76 177.28 1pcz n LYS 162 N -3.11 0.88 -3.73 0.00 5.02 -1.26 -0.42 118.16 115.55 1pcz n LYS 162 Ca 0.07 -2.01 -0.14 0.00 -2.02 0.00 0.00 58.31 54.22 1pcz n LYS 162 Cb 0.54 -1.15 -0.09 0.00 -0.02 0.00 0.00 35.03 34.31 1pcz n LYS 162 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1pcz s SER 163 N -2.18 -0.31 0.22 4.39 0.15 -1.26 -4.93 113.70 109.78 1pcz s SER 163 Ca 0.20 0.37 0.04 0.00 0.70 0.00 0.00 55.95 57.26 1pcz s SER 163 Cb 0.18 0.49 0.19 0.00 -1.71 0.00 0.00 66.02 65.16 1pcz s SER 163 CO 0.02 -0.37 1.51 -0.08 1.20 0.00 0.00 173.24 175.53 1pcz h GLU 164 N 4.29 0.22 -0.77 5.44 4.81 -1.99 -2.68 114.58 123.90 1pcz h GLU 164 Ca -0.28 -0.17 -0.05 0.00 -0.13 0.00 0.00 59.36 58.72 1pcz h GLU 164 Cb 1.17 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.55 1pcz h GLU 164 CO 0.35 0.81 0.27 0.00 -0.73 0.00 0.00 179.01 179.72 1pcz h ALA 165 N 1.14 1.00 -0.11 2.92 0.00 -1.99 -0.97 119.26 121.26 1pcz h ALA 165 Ca -0.02 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.57 1pcz h ALA 165 Cb 1.21 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1pcz h ALA 165 CO 0.10 0.66 -0.45 -0.44 0.00 0.00 0.00 179.25 179.12 1pcz h ASP 166 N 1.13 0.27 -0.16 0.00 5.19 -1.95 0.02 116.42 120.92 1pcz h ASP 166 Ca 0.25 -0.12 -0.03 0.00 -0.62 0.00 0.00 57.03 56.51 1pcz h ASP 166 Cb 0.27 -0.08 -0.01 0.00 0.18 0.00 0.00 39.33 39.69 1pcz h ASP 166 CO -0.01 0.69 -0.01 0.00 -3.12 0.00 0.00 179.24 176.79 1pcz h ALA 167 N 1.32 0.21 -0.80 3.45 0.00 -1.09 0.66 119.26 123.02 1pcz h ALA 167 Ca 0.01 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 1pcz h ALA 167 Cb 0.88 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 1pcz h ALA 167 CO 0.07 -0.07 0.35 -1.49 0.00 0.00 0.00 179.25 178.11 1pcz h TRP 168 N 0.02 1.18 0.00 0.00 4.06 -1.00 0.37 115.95 120.58 1pcz h TRP 168 Ca 0.04 -0.07 -0.05 0.00 2.06 0.00 0.00 58.89 60.87 1pcz h TRP 168 Cb 0.39 -0.36 -0.01 0.00 -1.00 0.00 0.00 29.16 28.19 1pcz h TRP 168 CO 0.04 0.87 -0.26 0.93 -3.56 0.00 0.00 178.44 176.46 1pcz h GLU 169 N 1.15 0.00 -0.02 0.49 4.39 -0.83 0.37 114.58 120.13 1pcz h GLU 169 Ca 0.27 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.96 1pcz h GLU 169 Cb 0.16 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1pcz h GLU 169 CO -0.03 0.26 -0.04 0.00 -1.16 0.00 0.00 179.01 178.03 1pcz h ALA 170 N 1.74 0.03 -0.55 3.43 0.00 0.90 0.21 119.26 125.01 1pcz h ALA 170 Ca -0.00 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 1pcz h ALA 170 Cb 0.68 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1pcz h ALA 170 CO 0.03 -0.14 0.27 0.28 0.00 0.00 0.00 179.25 179.70 1pcz h VAL 171 N -0.51 1.18 -0.36 0.00 2.07 -0.00 -0.00 116.25 118.62 1pcz h VAL 171 Ca -0.00 -0.50 -0.03 0.00 0.82 0.00 0.00 66.70 67.00 1pcz h VAL 171 Cb 0.64 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 1pcz h VAL 171 CO 0.01 0.21 0.12 0.03 0.02 0.00 0.00 177.57 177.96 1pcz h ARG 172 N 0.77 0.56 -0.66 1.57 3.08 -0.03 -0.09 114.38 119.57 1pcz h ARG 172 Ca 0.19 -0.12 -0.04 0.00 0.07 0.00 0.00 59.98 60.09 1pcz h ARG 172 Cb 0.07 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.00 1pcz h ARG 172 CO -0.03 0.57 0.26 0.87 -1.07 0.00 0.00 179.97 180.57 1pcz h LYS 173 N 0.44 0.98 0.05 0.04 1.57 -0.33 0.22 116.57 119.54 1pcz h LYS 173 Ca 0.12 -0.17 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1pcz h LYS 173 Cb 0.24 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1pcz h LYS 173 CO -0.00 0.81 -0.02 1.25 -0.57 0.00 0.00 179.45 180.91 1pcz h LEU 174 N 0.96 -0.06 -0.70 2.94 6.46 -0.36 -0.69 115.31 123.86 1pcz h LEU 174 Ca 0.22 -0.06 -0.03 0.00 -0.12 0.00 0.00 57.88 57.89 1pcz h LEU 174 Cb 0.20 0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.11 1pcz h LEU 174 CO -0.02 0.03 0.33 -0.07 -0.62 0.00 0.00 178.44 178.09 1pcz h LEU 175 N -0.14 0.93 -1.15 2.25 3.38 -0.65 0.15 115.31 120.07 1pcz h LEU 175 Ca -0.01 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 1pcz h LEU 175 Cb 0.12 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1pcz h LEU 175 CO 0.01 0.80 0.16 -0.09 0.09 0.00 0.00 178.44 179.41 1pcz h ARG 176 N 0.98 0.76 0.03 1.13 1.12 -0.41 0.17 114.38 118.16 1pcz h ARG 176 Ca 0.24 -0.13 -0.00 0.00 -1.11 0.00 0.00 59.98 58.98 1pcz h ARG 176 Cb 0.13 -0.13 0.00 0.00 -0.01 0.00 0.00 29.97 29.96 1pcz h ARG 176 CO -0.03 0.66 -0.02 1.49 -3.11 0.00 0.00 179.97 178.96 1pcz h GLU 177 N 0.74 -0.04 -0.94 0.20 4.57 -0.30 -0.13 114.58 118.68 1pcz h GLU 177 Ca 0.17 0.00 0.06 0.00 -1.18 0.00 0.00 59.36 58.42 1pcz h GLU 177 Cb 0.22 0.01 -0.07 0.00 -0.16 0.00 0.00 28.75 28.75 1pcz h GLU 177 CO -0.01 0.49 0.59 -0.07 -1.18 0.00 0.00 179.01 178.83 1pcz h LEU 178 N -0.60 0.94 -0.31 1.64 3.38 -0.40 -1.52 115.31 118.44 1pcz h LEU 178 Ca -0.00 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1pcz h LEU 178 Cb 0.55 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1pcz h LEU 178 CO 0.01 0.60 0.09 -0.78 0.09 0.00 0.00 178.44 178.45 1pcz h ASP 179 N 1.08 0.46 -0.81 -0.43 3.58 -0.58 0.41 116.42 120.12 1pcz h ASP 179 Ca 0.41 -0.21 0.11 0.00 0.42 0.00 0.00 57.03 57.76 1pcz h ASP 179 Cb 0.18 -0.12 -0.06 0.00 1.72 0.00 0.00 39.33 41.05 1pcz h ASP 179 CO -0.18 0.55 0.53 0.50 -2.88 0.00 0.00 179.24 177.76 1pcz h LYS 180 N 0.35 0.66 -0.57 0.28 3.64 -0.23 0.07 116.57 120.76 1pcz h LYS 180 Ca 0.10 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1pcz h LYS 180 Cb 0.25 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1pcz h LYS 180 CO -0.00 0.44 0.00 0.66 -2.27 0.00 0.00 179.45 178.27 1pcz n TYR 181 N -4.52 0.89 -1.72 1.91 4.02 -0.65 -4.91 117.16 112.19 1pcz n TYR 181 Ca 0.14 -0.39 -0.16 0.00 -0.01 0.00 0.00 57.90 57.48 1pcz n TYR 181 Cb 0.39 -0.09 -0.05 0.00 -0.02 0.00 0.00 39.34 39.57 1pcz n TYR 181 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1pcz n GLY 182 N 1.15 1.04 0.41 2.72 0.00 0.01 -4.86 105.19 105.67 1pcz n GLY 182 Ca 0.18 -0.25 0.14 0.00 0.00 0.00 0.00 46.02 46.09 1pcz n GLY 182 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1pcz n LEU 183 N -1.97 1.37 -0.44 0.99 4.77 0.14 -4.99 117.00 116.87 1pcz n LEU 183 Ca -0.17 -0.43 0.05 0.00 -0.03 0.00 0.00 56.01 55.43 1pcz n LEU 183 Cb 0.56 -0.04 0.05 0.00 -2.33 0.00 0.00 43.42 41.66 1pcz n LEU 183 CO 0.24 0.24 0.42 0.18 -1.33 0.00 0.00 177.39 177.13