#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zew s HIS 2 N 0.00 3.48 0.40 7.33 4.02 -1.26 -5.09 115.29 124.17 2zew s HIS 2 Ca 0.00 0.36 -0.22 0.00 1.02 0.00 0.00 55.06 56.22 2zew s HIS 2 Cb 0.00 -1.87 -0.11 0.00 -1.02 0.00 0.00 32.58 29.58 2zew s HIS 2 CO 0.00 0.37 0.94 -1.64 1.02 0.00 0.00 174.74 175.43 2zew s MET 3 N -3.32 4.33 -0.24 1.40 1.00 -1.26 -5.06 119.30 116.15 2zew s MET 3 Ca 0.39 1.17 -0.00 0.00 0.00 0.00 0.00 55.69 57.25 2zew s MET 3 Cb -0.11 -2.37 0.03 0.00 0.00 0.00 0.00 34.83 32.38 2zew s MET 3 CO 0.29 0.07 -0.10 0.08 0.00 0.00 0.00 175.02 175.36 2zew s VAL 4 N -2.01 2.60 -0.17 -6.03 1.01 -1.26 -5.05 120.40 109.49 2zew s VAL 4 Ca 0.58 -1.10 -0.29 0.00 0.00 0.00 0.00 61.98 61.17 2zew s VAL 4 Cb -0.12 -2.31 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 2zew s VAL 4 CO 0.16 0.23 1.15 0.21 0.00 0.00 0.00 175.10 176.86 2zew s ASN 5 N 1.28 7.04 0.00 3.32 2.47 -1.26 -3.83 114.94 123.97 2zew s ASN 5 Ca -0.00 1.58 0.29 0.00 0.42 0.00 0.00 52.86 55.15 2zew s ASN 5 Cb -0.16 -2.54 1.25 0.00 -1.45 0.00 0.00 41.25 38.34 2zew s ASN 5 CO -0.06 -0.67 1.93 0.23 -3.72 0.00 0.00 177.10 174.80 2zew n MET 6 N 6.15 0.06 -2.88 0.43 2.81 0.30 -4.78 117.12 119.21 2zew n MET 6 Ca 0.12 -0.00 -0.41 0.00 -1.81 0.00 0.00 57.70 55.60 2zew n MET 6 Cb 0.46 -1.50 -0.04 0.00 -0.71 0.00 0.00 33.22 31.43 2zew n MET 6 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2zew s VAL 7 N -2.94 4.89 0.26 2.03 1.01 -1.26 -4.83 120.40 119.56 2zew s VAL 7 Ca 0.16 1.66 -0.30 0.00 0.00 0.00 0.00 61.98 63.50 2zew s VAL 7 Cb 0.19 -4.15 -0.09 0.00 0.00 0.00 0.00 36.38 32.33 2zew s VAL 7 CO 0.53 0.06 1.00 -0.44 0.00 0.00 0.00 175.10 176.24 2zew s SER 8 N 1.11 7.49 -1.32 3.32 0.01 -1.26 -3.98 113.70 119.07 2zew s SER 8 Ca 0.39 2.06 -0.05 0.00 1.31 0.00 0.00 55.95 59.66 2zew s SER 8 Cb -0.17 -2.61 -0.00 0.00 0.21 0.00 0.00 66.02 63.44 2zew s SER 8 CO 0.14 0.04 0.56 -3.20 0.41 0.00 0.00 173.24 171.19 2zew n ASN 9 N 1.32 -1.62 0.25 2.44 5.15 -1.26 -4.86 115.26 116.68 2zew n ASN 9 Ca -0.01 -0.98 0.14 0.00 -0.60 0.00 0.00 54.58 53.13 2zew n ASN 9 Cb 0.46 -3.31 0.58 0.00 -0.53 0.00 0.00 39.78 36.98 2zew n ASN 9 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2zew h PRO 10 N -1.86 0.00 -0.42 1.20 0.13 -1.82 -2.62 132.00 126.61 2zew h PRO 10 Ca -0.64 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.49 2zew h PRO 10 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2zew h PRO 10 CO 0.58 0.11 0.00 0.41 -0.23 0.00 0.00 178.00 178.87 2zew n GLY 11 N 0.06 2.13 2.48 1.56 0.00 -1.26 -1.71 105.19 108.44 2zew n GLY 11 Ca 0.00 -0.56 -0.20 0.00 0.00 0.00 0.00 46.02 45.27 2zew n GLY 11 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2zew n PHE 12 N 1.04 -0.30 0.30 1.61 3.72 -0.99 -4.49 117.46 118.35 2zew n PHE 12 Ca 0.16 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.71 2zew n PHE 12 Cb 0.50 -3.43 0.51 0.00 -0.94 0.00 0.00 39.48 36.12 2zew n PHE 12 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 2zew h GLU 13 N 0.00 0.00 -0.89 -1.08 4.39 -1.84 -1.70 114.58 113.47 2zew h GLU 13 Ca -0.41 0.00 -0.51 0.00 0.34 0.00 0.00 59.36 58.78 2zew h GLU 13 Cb 1.29 0.00 -0.28 0.00 -0.10 0.00 0.00 28.75 29.66 2zew h GLU 13 CO 0.58 0.00 0.54 -0.25 -1.16 0.00 0.00 179.01 178.71 2zew n ASP 14 N -2.95 4.55 0.00 1.42 8.00 -1.26 -4.98 116.55 121.33 2zew n ASP 14 Ca 0.02 -3.69 0.00 0.00 0.71 0.00 0.00 54.79 51.83 2zew n ASP 14 Cb 0.36 -0.82 0.00 0.00 -0.02 0.00 0.00 41.12 40.64 2zew n ASP 14 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2zew n GLY 15 N -1.07 2.12 1.06 0.44 0.00 -0.64 -2.41 105.19 104.69 2zew n GLY 15 Ca 0.56 -0.44 0.09 0.00 0.00 0.00 0.00 46.02 46.22 2zew n GLY 15 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2zew n LEU 16 N 0.00 3.08 -4.64 0.99 4.77 -1.26 -4.61 117.00 115.33 2zew n LEU 16 Ca 0.00 -1.54 -0.46 0.00 -0.03 0.00 0.00 56.01 53.98 2zew n LEU 16 Cb 0.00 -0.39 -0.03 0.00 -2.33 0.00 0.00 43.42 40.67 2zew n LEU 16 CO 0.00 0.73 0.92 0.47 -1.33 0.00 0.00 177.39 178.18 2zew n ASP 17 N 1.09 2.30 0.00 -1.43 8.00 -1.01 -2.13 116.55 123.37 2zew n ASP 17 Ca 0.19 1.14 0.00 0.00 0.71 0.00 0.00 54.79 56.83 2zew n ASP 17 Cb 0.50 -1.36 0.00 0.00 -0.02 0.00 0.00 41.12 40.24 2zew n ASP 17 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2zew n SER 18 N 2.14 -0.13 -4.54 -2.24 7.64 -1.26 -4.67 113.62 110.55 2zew n SER 18 Ca 0.13 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.67 2zew n SER 18 Cb 0.29 -0.52 -0.12 0.00 -1.01 0.00 0.00 64.21 62.86 2zew n SER 18 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 2zew s TRP 19 N -3.35 2.91 0.08 1.43 0.52 -0.91 -4.72 118.94 114.91 2zew s TRP 19 Ca 0.00 -0.08 -0.23 0.00 0.02 0.00 0.00 56.10 55.80 2zew s TRP 19 Cb 0.00 -1.74 -0.06 0.00 -1.15 0.00 0.00 33.47 30.51 2zew s TRP 19 CO 0.00 0.23 0.71 -0.65 0.02 0.00 0.00 176.95 177.26 2zew s GLN 20 N -0.57 4.44 -0.43 4.98 -0.21 0.22 -4.93 119.66 123.17 2zew s GLN 20 Ca 0.09 0.99 -0.06 0.00 0.02 0.00 0.00 55.36 56.39 2zew s GLN 20 Cb -0.12 -3.31 0.11 0.00 1.00 0.00 0.00 33.01 30.69 2zew s GLN 20 CO 0.02 0.44 0.25 0.34 -2.12 0.00 0.00 175.29 174.22 2zew s ASP 21 N -0.58 5.45 0.33 5.90 -1.08 -1.26 -1.96 116.67 123.46 2zew s ASP 21 Ca 0.35 -1.89 0.17 0.00 -0.52 0.00 0.00 52.55 50.66 2zew s ASP 21 Cb -0.21 -1.91 0.49 0.00 -1.46 0.00 0.00 42.92 39.83 2zew s ASP 21 CO 0.22 -0.58 1.64 -0.50 0.52 0.00 0.00 175.17 176.47 2zew h TRP 22 N 8.24 0.00 0.00 -5.34 6.55 -1.69 -3.30 115.95 120.40 2zew h TRP 22 Ca -0.17 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.67 2zew h TRP 22 Cb 1.06 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.36 2zew h TRP 22 CO 0.59 0.46 -0.07 1.04 -1.05 0.00 0.00 178.44 179.41 2zew n GLN 23 N -3.49 1.52 -3.76 0.49 3.00 -1.26 -5.00 117.38 108.89 2zew n GLN 23 Ca 0.00 -1.74 -0.24 0.00 -0.01 0.00 0.00 57.00 55.01 2zew n GLN 23 Cb 0.59 -1.07 0.03 0.00 0.00 0.00 0.00 30.24 29.79 2zew n GLN 23 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 2zew n GLN 24 N -0.74 -5.36 -0.65 -1.09 3.00 -1.25 -4.89 117.38 106.41 2zew n GLN 24 Ca 0.06 0.63 0.04 0.00 -0.01 0.00 0.00 57.00 57.72 2zew n GLN 24 Cb 0.50 -5.35 0.05 0.00 0.00 0.00 0.00 30.24 25.45 2zew n GLN 24 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 2zew n ASP 25 N -2.98 0.87 -4.38 1.08 2.03 -1.26 -5.07 116.55 106.84 2zew n ASP 25 Ca -0.16 -2.41 -0.31 0.00 0.52 0.00 0.00 54.79 52.43 2zew n ASP 25 Cb 0.62 -0.30 -0.14 0.00 -0.72 0.00 0.00 41.12 40.58 2zew n ASP 25 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 2zew s MET 26 N -0.90 1.96 0.00 -0.67 -1.94 -1.26 -1.31 119.30 115.18 2zew s MET 26 Ca 0.18 -1.03 -0.09 0.00 -1.71 0.00 0.00 55.69 53.04 2zew s MET 26 Cb 0.18 -2.07 0.01 0.00 2.01 0.00 0.00 34.83 34.96 2zew s MET 26 CO -0.04 0.53 0.18 -1.54 -0.01 0.00 0.00 175.02 174.14 2zew s SER 27 N -1.20 -0.02 -0.36 3.03 1.04 -0.60 -5.01 113.70 110.59 2zew s SER 27 Ca 0.12 -0.16 -0.14 0.00 0.48 0.00 0.00 55.95 56.26 2zew s SER 27 Cb -0.10 0.23 -0.01 0.00 0.10 0.00 0.00 66.02 66.24 2zew s SER 27 CO 0.03 -0.40 0.28 0.00 0.98 0.00 0.00 173.24 174.13 2zew s ALA 28 N -1.46 3.50 0.04 5.32 0.00 -1.26 -0.26 121.76 127.63 2zew s ALA 28 Ca -0.14 -1.41 0.01 0.00 0.00 0.00 0.00 51.96 50.42 2zew s ALA 28 Cb -0.07 -2.75 -0.03 0.00 0.00 0.00 0.00 23.12 20.28 2zew s ALA 28 CO 0.02 -1.10 -0.05 0.14 0.00 0.00 0.00 175.76 174.77 2zew s VAL 29 N 1.79 0.32 0.33 0.00 -7.23 -0.52 -4.89 120.40 110.20 2zew s VAL 29 Ca 0.07 -1.14 0.04 0.00 -1.81 0.00 0.00 61.98 59.14 2zew s VAL 29 Cb -0.17 -0.62 0.16 0.00 0.56 0.00 0.00 36.38 36.30 2zew s VAL 29 CO 0.11 -0.54 1.87 -0.65 -0.31 0.00 0.00 175.10 175.58 2zew h PRO 30 N 4.31 0.53 0.00 4.82 0.11 -1.87 -1.89 132.00 138.01 2zew h PRO 30 Ca -0.34 -0.11 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2zew h PRO 30 Cb 1.20 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2zew h PRO 30 CO 0.45 0.56 0.00 1.05 -0.21 0.00 0.00 178.00 179.85 2zew h GLU 31 N 0.51 0.00 -0.14 1.05 9.09 -1.94 -2.26 114.58 120.88 2zew h GLU 31 Ca 0.11 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.52 2zew h GLU 31 Cb 0.34 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.44 2zew h GLU 31 CO 0.01 0.00 0.00 0.00 0.05 0.00 0.00 179.01 179.07 2zew n ALA 32 N -1.88 2.46 -2.50 1.06 0.00 -0.95 -4.95 120.51 113.76 2zew n ALA 32 Ca -0.00 -0.75 -0.42 0.00 0.00 0.00 0.00 53.44 52.27 2zew n ALA 32 Cb 0.14 -0.88 -0.03 0.00 0.00 0.00 0.00 19.45 18.69 2zew n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2zew s ALA 33 N -1.84 3.37 -0.15 0.00 0.00 -0.85 -3.90 121.76 118.38 2zew s ALA 33 Ca 0.32 0.72 0.17 0.00 0.00 0.00 0.00 51.96 53.17 2zew s ALA 33 Cb 0.21 -3.44 -0.24 0.00 0.00 0.00 0.00 23.12 19.64 2zew s ALA 33 CO 0.31 -0.47 0.26 1.58 0.00 0.00 0.00 175.76 177.44 2zew n HIS 34 N 4.25 0.31 -3.87 0.00 -0.00 -1.26 -4.90 115.22 109.74 2zew n HIS 34 Ca 0.09 0.11 -0.11 0.00 0.46 0.00 0.00 57.72 58.27 2zew n HIS 34 Cb 0.47 -1.05 -0.11 0.00 -0.12 0.00 0.00 29.99 29.19 2zew n HIS 34 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 2zew s ASN 35 N -5.65 0.01 0.41 0.26 2.47 -1.26 -5.11 114.94 106.07 2zew s ASN 35 Ca -0.08 -0.13 0.00 0.00 0.42 0.00 0.00 52.86 53.07 2zew s ASN 35 Cb 0.07 0.21 0.00 0.00 -1.45 0.00 0.00 41.25 40.08 2zew s ASN 35 CO 0.83 -0.30 0.00 0.61 -3.72 0.00 0.00 177.10 174.52 2zew n GLY 36 N 1.80 -0.13 0.07 1.21 0.00 -1.26 -4.27 105.19 102.61 2zew n GLY 36 Ca -0.21 -1.00 0.11 0.00 0.00 0.00 0.00 46.02 44.93 2zew n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zew n ALA 37 N 3.63 2.64 -2.40 4.61 0.00 -1.26 -4.96 120.51 122.78 2zew n ALA 37 Ca 0.00 -0.36 -0.08 0.00 0.00 0.00 0.00 53.44 53.01 2zew n ALA 37 Cb 0.00 -0.95 -0.10 0.00 0.00 0.00 0.00 19.45 18.39 2zew n ALA 37 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2zew s LEU 38 N -5.00 2.40 0.28 0.00 1.43 -1.26 -4.14 118.68 112.39 2zew s LEU 38 Ca -0.04 -0.82 0.04 0.00 -1.03 0.00 0.00 54.13 52.28 2zew s LEU 38 Cb 0.11 0.16 -0.03 0.00 0.03 0.00 0.00 46.19 46.46 2zew s LEU 38 CO 0.84 -0.49 0.21 -0.83 0.23 0.00 0.00 176.35 176.31 2zew s GLY 39 N -2.41 1.98 -0.13 -3.19 0.00 -0.75 -4.35 107.32 98.47 2zew s GLY 39 Ca -0.01 -1.89 -0.19 0.00 0.00 0.00 0.00 44.72 42.63 2zew s GLY 39 CO -0.07 -1.46 0.50 -2.27 0.00 0.00 0.00 173.10 169.80 2zew s LEU 40 N -3.30 4.25 -0.22 0.66 2.96 0.05 -1.44 118.68 121.65 2zew s LEU 40 Ca 0.39 0.81 -0.06 0.00 -0.22 0.00 0.00 54.13 55.05 2zew s LEU 40 Cb 0.04 -2.72 -0.03 0.00 0.50 0.00 0.00 46.19 43.98 2zew s LEU 40 CO 0.21 -0.04 0.03 -0.75 -1.32 0.00 0.00 176.35 174.48 2zew s LYS 41 N 0.83 3.65 -0.31 1.98 2.20 0.64 -1.09 119.74 127.64 2zew s LYS 41 Ca 0.26 -0.49 -0.09 0.00 -0.36 0.00 0.00 55.97 55.29 2zew s LYS 41 Cb -0.15 -3.19 -0.00 0.00 -1.51 0.00 0.00 37.83 32.98 2zew s LYS 41 CO 0.11 -0.06 0.14 0.42 -0.36 0.00 0.00 175.35 175.60 2zew s ILE 42 N 1.23 4.48 0.36 5.43 1.01 0.61 -1.55 121.20 132.77 2zew s ILE 42 Ca 0.04 -0.50 -0.27 0.00 0.00 0.00 0.00 60.65 59.92 2zew s ILE 42 Cb -0.15 -3.30 -0.09 0.00 0.01 0.00 0.00 42.46 38.93 2zew s ILE 42 CO 0.02 0.05 1.26 -0.83 0.00 0.00 0.00 174.94 175.44 2zew s GLY 43 N 1.59 2.96 1.01 6.18 0.00 -0.43 -1.24 107.32 117.39 2zew s GLY 43 Ca 0.04 1.16 -0.13 0.00 0.00 0.00 0.00 44.72 45.78 2zew s GLY 43 CO 0.06 1.76 1.12 -0.32 0.00 0.00 0.00 173.10 175.71 2zew s GLY 44 N -0.72 1.57 0.00 0.20 0.00 -1.22 -4.51 107.32 102.64 2zew s GLY 44 Ca 0.52 -0.53 0.00 0.00 0.00 0.00 0.00 44.72 44.71 2zew s GLY 44 CO 0.48 0.11 0.00 0.61 0.00 0.00 0.00 173.10 174.30 2zew n GLY 45 N -1.49 2.15 3.46 0.20 0.00 0.43 -4.92 105.19 105.02 2zew n GLY 45 Ca 0.07 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.95 2zew n GLY 45 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2zew s LYS 46 N -0.54 1.15 0.27 1.61 -2.85 -1.26 -4.87 119.74 113.26 2zew s LYS 46 Ca 0.00 -0.21 -0.30 0.00 -1.00 0.00 0.00 55.97 54.46 2zew s LYS 46 Cb 0.00 0.54 -0.10 0.00 -2.06 0.00 0.00 37.83 36.21 2zew s LYS 46 CO 0.00 -0.46 1.39 0.00 0.10 0.00 0.00 175.35 176.38 2zew s ALA 47 N -2.83 3.58 0.05 0.59 0.00 -1.25 -4.75 121.76 117.15 2zew s ALA 47 Ca -0.02 1.30 -0.27 0.00 0.00 0.00 0.00 51.96 52.97 2zew s ALA 47 Cb -0.01 -3.53 0.08 0.00 0.00 0.00 0.00 23.12 19.67 2zew s ALA 47 CO -0.05 -0.71 0.71 0.00 0.00 0.00 0.00 175.76 175.72 2zew s ALA 48 N -0.38 -1.71 0.00 0.00 0.00 -0.76 -5.00 121.76 113.92 2zew s ALA 48 Ca 0.56 0.87 0.00 0.00 0.00 0.00 0.00 51.96 53.39 2zew s ALA 48 Cb -0.41 0.47 0.00 0.00 0.00 0.00 0.00 23.12 23.18 2zew s ALA 48 CO 0.46 -0.63 0.00 0.41 0.00 0.00 0.00 175.76 176.00 2zew n GLY 49 N 0.01 1.75 3.43 0.00 0.00 -1.26 -0.55 105.19 108.58 2zew n GLY 49 Ca -0.15 -0.82 -0.03 0.00 0.00 0.00 0.00 46.02 45.02 2zew n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zew n GLY 50 N 0.00 0.73 0.00 -0.02 0.00 -0.36 -1.64 105.19 103.90 2zew n GLY 50 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.88 2zew n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zew n GLY 51 N -0.63 -1.28 3.39 -0.02 0.00 -0.83 -0.29 105.19 105.53 2zew n GLY 51 Ca -0.03 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 44.97 2zew n GLY 51 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2zew s GLN 52 N -0.48 1.10 0.39 1.61 -2.07 -0.41 -0.61 119.66 119.20 2zew s GLN 52 Ca 0.00 -0.37 -0.24 0.00 -1.82 0.00 0.00 55.36 52.93 2zew s GLN 52 Cb 0.00 0.50 -0.09 0.00 -1.09 0.00 0.00 33.01 32.33 2zew s GLN 52 CO 0.00 -0.43 1.02 -0.51 -1.32 0.00 0.00 175.29 174.05 2zew s ASP 53 N -2.30 6.86 -0.08 12.60 1.01 -1.26 -0.90 116.67 132.59 2zew s ASP 53 Ca -0.02 1.96 -0.02 0.00 0.71 0.00 0.00 52.55 55.17 2zew s ASP 53 Cb -0.00 -2.58 0.03 0.00 1.01 0.00 0.00 42.92 41.39 2zew s ASP 53 CO -0.06 -0.42 0.04 -0.63 0.21 0.00 0.00 175.17 174.31 2zew s ILE 54 N -1.73 0.16 -1.24 0.77 1.01 0.15 -4.87 121.20 115.45 2zew s ILE 54 Ca 0.57 0.15 -0.18 0.00 0.00 0.00 0.00 60.65 61.19 2zew s ILE 54 Cb -0.20 -0.44 0.08 0.00 0.01 0.00 0.00 42.46 41.92 2zew s ILE 54 CO 0.25 0.13 1.65 -2.16 0.00 0.00 0.00 174.94 174.81 2zew s PRO 55 N 2.06 3.93 0.51 2.79 0.04 -1.26 -3.78 135.00 139.28 2zew s PRO 55 Ca 0.04 -1.92 -0.18 0.00 0.04 0.00 0.00 61.00 58.98 2zew s PRO 55 Cb -0.13 -5.45 -0.08 0.00 0.04 0.00 0.00 34.50 28.88 2zew s PRO 55 CO -0.05 -2.19 0.99 -0.51 0.04 0.00 0.00 177.00 175.28 2zew s LEU 56 N 4.02 3.68 0.35 -3.56 1.43 -1.26 -5.05 118.68 118.28 2zew s LEU 56 Ca 0.51 1.64 -0.21 0.00 -1.03 0.00 0.00 54.13 55.04 2zew s LEU 56 Cb 0.02 -4.52 -0.10 0.00 0.03 0.00 0.00 46.19 41.63 2zew s LEU 56 CO 0.04 -0.62 0.87 -0.54 0.23 0.00 0.00 176.35 176.33 2zew s LYS 57 N -3.85 4.30 0.72 1.70 1.02 -1.26 -5.04 119.74 117.33 2zew s LYS 57 Ca 0.60 1.06 -0.11 0.00 0.02 0.00 0.00 55.97 57.54 2zew s LYS 57 Cb -0.11 -2.52 0.02 0.00 -0.52 0.00 0.00 37.83 34.70 2zew s LYS 57 CO 0.28 0.16 1.07 -1.25 -0.92 0.00 0.00 175.35 174.69 2zew s PRO 58 N -2.62 2.75 -1.59 -1.68 0.04 -1.26 -4.16 135.00 126.48 2zew s PRO 58 Ca 0.54 0.80 -0.12 0.00 0.04 0.00 0.00 61.00 62.25 2zew s PRO 58 Cb -0.13 -1.98 0.10 0.00 0.04 0.00 0.00 34.50 32.53 2zew s PRO 58 CO 0.18 -1.19 0.72 0.09 0.04 0.00 0.00 177.00 176.84 2zew n ASN 59 N -3.17 -2.69 -4.02 6.66 5.03 -0.25 -4.95 115.26 111.87 2zew n ASN 59 Ca 0.07 -0.97 -0.18 0.00 0.87 0.00 0.00 54.58 54.37 2zew n ASN 59 Cb 0.55 -3.04 -0.15 0.00 -1.02 0.00 0.00 39.78 36.13 2zew n ASN 59 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2zew s THR 60 N -3.48 0.69 -0.13 3.41 2.01 -1.25 -4.91 115.64 111.97 2zew s THR 60 Ca 0.51 -0.40 -0.20 0.00 0.31 0.00 0.00 61.69 61.91 2zew s THR 60 Cb -0.28 -0.58 -0.04 0.00 0.01 0.00 0.00 72.50 71.61 2zew s THR 60 CO 0.90 0.17 0.55 -0.89 -0.69 0.00 0.00 174.62 174.66 2zew s THR 61 N -0.25 5.12 0.10 -0.82 2.01 -1.26 -1.02 115.64 119.52 2zew s THR 61 Ca 0.03 1.09 0.09 0.00 0.31 0.00 0.00 61.69 63.21 2zew s THR 61 Cb -0.04 -3.89 -0.03 0.00 0.01 0.00 0.00 72.50 68.55 2zew s THR 61 CO -0.00 0.26 -0.23 -0.31 -0.69 0.00 0.00 174.62 173.65 2zew s TYR 62 N 0.97 1.95 -0.15 4.92 2.02 0.20 -1.61 117.35 125.65 2zew s TYR 62 Ca 0.29 -0.40 -0.01 0.00 -0.37 0.00 0.00 57.07 56.57 2zew s TYR 62 Cb -0.16 -1.08 -0.02 0.00 -0.40 0.00 0.00 41.96 40.31 2zew s TYR 62 CO 0.12 0.22 -0.10 0.42 -1.57 0.00 0.00 175.55 174.64 2zew s ILE 63 N -1.07 3.26 -0.19 2.71 -1.09 -0.11 -1.42 121.20 123.29 2zew s ILE 63 Ca 0.09 -0.58 -0.07 0.00 -2.23 0.00 0.00 60.65 57.86 2zew s ILE 63 Cb -0.10 -2.40 -0.04 0.00 -1.58 0.00 0.00 42.46 38.34 2zew s ILE 63 CO 0.04 0.50 0.05 -0.22 -1.23 0.00 0.00 174.94 174.08 2zew s LEU 64 N 0.51 3.62 0.05 2.97 2.96 -0.13 -1.05 118.68 127.61 2zew s LEU 64 Ca -0.07 -0.02 0.00 0.00 -0.22 0.00 0.00 54.13 53.82 2zew s LEU 64 Cb -0.15 -1.92 -0.03 0.00 0.50 0.00 0.00 46.19 44.58 2zew s LEU 64 CO 0.04 0.12 -0.04 -0.83 -1.32 0.00 0.00 176.35 174.32 2zew s GLY 65 N 0.66 0.44 0.03 7.98 0.00 -0.39 -0.96 107.32 115.08 2zew s GLY 65 Ca 0.02 -0.96 -0.27 0.00 0.00 0.00 0.00 44.72 43.51 2zew s GLY 65 CO 0.02 -1.05 0.71 0.00 0.00 0.00 0.00 173.10 172.78 2zew s ALA 66 N -2.68 -1.73 -0.09 3.20 0.00 -0.81 -1.25 121.76 118.40 2zew s ALA 66 Ca -0.02 0.96 -0.00 0.00 0.00 0.00 0.00 51.96 52.90 2zew s ALA 66 Cb -0.01 0.35 -0.03 0.00 0.00 0.00 0.00 23.12 23.44 2zew s ALA 66 CO -0.05 -0.57 -0.06 -1.58 0.00 0.00 0.00 175.76 173.49 2zew s TRP 67 N -2.52 2.95 0.11 0.00 0.51 -0.92 -1.87 118.94 117.20 2zew s TRP 67 Ca -0.03 -0.09 -0.15 0.00 -2.12 0.00 0.00 56.10 53.72 2zew s TRP 67 Cb -0.01 -1.77 0.03 0.00 -0.81 0.00 0.00 33.47 30.91 2zew s TRP 67 CO -0.03 0.22 0.36 0.00 -0.51 0.00 0.00 176.95 176.99 2zew s ALA 68 N -0.48 -0.80 -0.15 0.98 0.00 -0.48 -1.28 121.76 119.54 2zew s ALA 68 Ca 0.07 -0.11 -0.27 0.00 0.00 0.00 0.00 51.96 51.65 2zew s ALA 68 Cb -0.12 0.60 0.07 0.00 0.00 0.00 0.00 23.12 23.67 2zew s ALA 68 CO 0.02 -0.59 0.68 -1.59 0.00 0.00 0.00 175.76 174.28 2zew s LYS 69 N -3.61 0.92 0.23 0.00 -2.85 -0.10 -1.52 119.74 112.82 2zew s LYS 69 Ca 0.02 0.60 -0.23 0.00 -1.00 0.00 0.00 55.97 55.35 2zew s LYS 69 Cb 0.02 0.44 -0.09 0.00 -2.06 0.00 0.00 37.83 36.15 2zew s LYS 69 CO -0.10 -0.21 0.81 -0.06 0.10 0.00 0.00 175.35 175.88 2zew s PHE 70 N -0.42 3.75 -2.24 1.78 0.08 -0.10 -0.11 117.98 120.73 2zew s PHE 70 Ca -0.06 1.59 0.25 0.00 0.12 0.00 0.00 56.93 58.84 2zew s PHE 70 Cb -0.03 -2.76 1.15 0.00 -0.57 0.00 0.00 43.02 40.81 2zew s PHE 70 CO 0.05 0.36 1.78 -0.40 -0.10 0.00 0.00 175.22 176.92 2zew n ASP 71 N 0.98 0.98 -3.58 1.36 5.75 0.12 -4.39 116.55 117.76 2zew n ASP 71 Ca -0.02 -1.44 -0.10 0.00 -0.01 0.00 0.00 54.79 53.22 2zew n ASP 71 Cb 0.50 -0.03 -0.02 0.00 -1.03 0.00 0.00 41.12 40.54 2zew n ASP 71 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2zew s SER 72 N -1.80 -0.43 -0.02 -1.12 0.15 -1.26 -4.91 113.70 104.30 2zew s SER 72 Ca 0.37 -0.20 -0.33 0.00 0.70 0.00 0.00 55.95 56.49 2zew s SER 72 Cb 0.19 0.60 -0.11 0.00 -1.71 0.00 0.00 66.02 64.99 2zew s SER 72 CO 0.30 -1.03 1.90 1.17 1.20 0.00 0.00 173.24 176.78 2zew n LYS 73 N -0.39 2.45 -2.65 5.44 3.00 -1.26 -4.78 118.16 119.96 2zew n LYS 73 Ca -0.12 0.90 -0.26 0.00 -0.00 0.00 0.00 58.31 58.83 2zew n LYS 73 Cb 0.63 -2.78 0.01 0.00 0.00 0.00 0.00 35.03 32.89 2zew n LYS 73 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2zew s PRO 74 N 3.97 3.19 -0.10 1.64 0.04 -1.26 -4.63 135.00 137.85 2zew s PRO 74 Ca 0.90 -0.06 -0.03 0.00 0.04 0.00 0.00 61.00 61.85 2zew s PRO 74 Cb -0.59 -2.39 -0.26 0.00 0.04 0.00 0.00 34.50 31.30 2zew s PRO 74 CO 0.47 -0.40 0.44 0.00 0.04 0.00 0.00 177.00 177.55 2zew n ALA 75 N -2.33 1.00 -2.88 8.56 0.00 -1.26 -5.02 120.51 118.58 2zew n ALA 75 Ca 0.02 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.85 2zew n ALA 75 Cb 0.57 -0.73 0.00 0.00 0.00 0.00 0.00 19.45 19.29 2zew n ALA 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2zew n GLY 76 N 1.90 4.43 3.32 0.00 0.00 -1.26 -5.03 105.19 108.55 2zew n GLY 76 Ca -0.29 -1.41 -0.17 0.00 0.00 0.00 0.00 46.02 44.16 2zew n GLY 76 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2zew s THR 77 N 4.10 0.51 -0.11 2.61 -4.23 -1.26 -4.77 115.64 112.48 2zew s THR 77 Ca 0.00 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.53 2zew s THR 77 Cb 0.00 -2.61 -0.01 0.00 1.34 0.00 0.00 72.50 71.22 2zew s THR 77 CO 0.00 0.00 -0.18 0.12 -0.54 0.00 0.00 174.62 174.02 2zew s PHE 78 N -3.74 2.69 -0.05 3.99 5.36 -0.00 -2.15 117.98 124.07 2zew s PHE 78 Ca 0.37 -0.81 0.05 0.00 -0.96 0.00 0.00 56.93 55.59 2zew s PHE 78 Cb 0.07 -1.77 -0.02 0.00 -0.34 0.00 0.00 43.02 40.96 2zew s PHE 78 CO 0.14 -0.29 -0.22 -0.51 -1.46 0.00 0.00 175.22 172.88 2zew s ASP 79 N 0.31 3.37 -0.20 6.13 1.01 0.62 -0.18 116.67 127.72 2zew s ASP 79 Ca -0.14 -0.41 -0.04 0.00 0.71 0.00 0.00 52.55 52.67 2zew s ASP 79 Cb -0.17 -0.79 -0.02 0.00 1.01 0.00 0.00 42.92 42.96 2zew s ASP 79 CO 0.07 0.28 -0.03 -0.69 0.21 0.00 0.00 175.17 175.01 2zew s VAL 80 N -0.36 3.61 -0.04 -1.27 1.01 -0.09 -0.48 120.40 122.77 2zew s VAL 80 Ca 0.03 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.59 2zew s VAL 80 Cb -0.12 -2.62 0.02 0.00 0.00 0.00 0.00 36.38 33.65 2zew s VAL 80 CO 0.02 0.44 -0.07 -0.69 0.00 0.00 0.00 175.10 174.80 2zew s VAL 81 N 1.12 0.71 -0.19 2.92 1.01 0.01 -0.63 120.40 125.35 2zew s VAL 81 Ca 0.02 -0.25 -0.07 0.00 0.00 0.00 0.00 61.98 61.68 2zew s VAL 81 Cb -0.15 -0.69 -0.04 0.00 0.00 0.00 0.00 36.38 35.51 2zew s VAL 81 CO 0.00 0.25 0.04 -0.69 0.00 0.00 0.00 175.10 174.71 2zew s VAL 82 N 0.69 4.52 -0.00 2.92 1.01 -0.37 -0.42 120.40 128.75 2zew s VAL 82 Ca -0.11 -0.12 -0.01 0.00 0.00 0.00 0.00 61.98 61.74 2zew s VAL 82 Cb -0.13 -3.04 -0.00 0.00 0.00 0.00 0.00 36.38 33.20 2zew s VAL 82 CO 0.01 0.44 0.02 0.00 0.00 0.00 0.00 175.10 175.58 2zew s GLN 83 N 0.59 0.17 0.01 2.72 -2.07 -0.34 -0.50 119.66 120.22 2zew s GLN 83 Ca 0.02 -0.21 -0.28 0.00 -1.82 0.00 0.00 55.36 53.07 2zew s GLN 83 Cb -0.13 0.06 0.10 0.00 -1.09 0.00 0.00 33.01 31.95 2zew s GLN 83 CO 0.02 -0.03 0.85 1.52 -1.32 0.00 0.00 175.29 176.33 2zew s TYR 84 N -0.59 -0.38 0.17 9.60 -0.85 -0.88 -1.18 117.35 123.25 2zew s TYR 84 Ca -0.06 0.26 -0.22 0.00 -0.52 0.00 0.00 57.07 56.53 2zew s TYR 84 Cb -0.04 0.53 -0.08 0.00 0.38 0.00 0.00 41.96 42.76 2zew s TYR 84 CO -0.00 -0.57 0.72 -1.01 -1.52 0.00 0.00 175.55 173.16 2zew s HIS 85 N -3.08 3.78 0.86 -3.49 3.76 -1.26 -1.21 115.29 114.66 2zew s HIS 85 Ca 0.04 1.47 -0.12 0.00 -0.15 0.00 0.00 55.06 56.30 2zew s HIS 85 Cb -0.01 -2.66 0.11 0.00 1.11 0.00 0.00 32.58 31.13 2zew s HIS 85 CO -0.09 0.45 1.12 -0.51 -0.85 0.00 0.00 174.74 174.87 2zew s LEU 86 N -1.50 2.27 -0.89 0.89 1.43 0.39 -0.05 118.68 121.22 2zew s LEU 86 Ca 0.38 1.11 -0.07 0.00 -1.03 0.00 0.00 54.13 54.52 2zew s LEU 86 Cb -0.20 -3.56 0.23 0.00 0.03 0.00 0.00 46.19 42.69 2zew s LEU 86 CO 0.23 -2.29 0.81 -0.75 0.23 0.00 0.00 176.35 174.58 2zew s LYS 87 N -5.23 3.48 0.00 1.70 2.47 -0.54 -2.61 119.74 119.01 2zew s LYS 87 Ca 0.62 -2.95 0.00 0.00 -1.56 0.00 0.00 55.97 52.08 2zew s LYS 87 Cb -0.15 -4.19 0.00 0.00 -1.46 0.00 0.00 37.83 32.04 2zew s LYS 87 CO 0.54 -1.25 0.00 -0.40 0.16 0.00 0.00 175.35 174.40 2zew n ASP 88 N 3.00 1.84 -0.12 1.43 5.68 -1.26 -4.82 116.55 122.28 2zew n ASP 88 Ca 0.18 -0.83 -0.04 0.00 -0.50 0.00 0.00 54.79 53.60 2zew n ASP 88 Cb 0.40 0.00 0.03 0.00 -1.14 0.00 0.00 41.12 40.41 2zew n ASP 88 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2zew h ALA 89 N 0.94 0.35 -0.41 2.12 0.00 -2.03 -3.14 119.26 117.09 2zew h ALA 89 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2zew h ALA 89 Cb 0.00 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2zew h ALA 89 CO 0.00 -0.41 0.00 0.27 0.00 0.00 0.00 179.25 179.11 2zew n ASN 90 N -5.23 4.61 -3.71 0.00 6.94 -1.26 -4.99 115.26 111.61 2zew n ASN 90 Ca 0.03 -2.91 -0.27 0.00 -0.02 0.00 0.00 54.58 51.41 2zew n ASN 90 Cb 0.22 -0.59 0.02 0.00 -2.36 0.00 0.00 39.78 37.07 2zew n ASN 90 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2zew n ASN 91 N 0.07 -5.28 -4.72 0.53 5.03 -1.19 -4.90 115.26 104.81 2zew n ASN 91 Ca 0.24 -0.92 -0.38 0.00 0.87 0.00 0.00 54.58 54.39 2zew n ASN 91 Cb 0.99 -2.65 0.05 0.00 -1.02 0.00 0.00 39.78 37.15 2zew n ASN 91 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 2zew n THR 92 N -3.39 4.20 -4.96 3.41 -1.04 -1.25 -4.51 114.28 106.73 2zew n THR 92 Ca -0.17 -0.50 -0.32 0.00 -2.04 0.00 0.00 64.05 61.01 2zew n THR 92 Cb 0.61 -1.52 -0.16 0.00 -1.82 0.00 0.00 70.33 67.43 2zew n THR 92 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 2zew s TYR 93 N -1.35 2.65 0.06 -1.42 5.04 -1.26 0.15 117.35 121.22 2zew s TYR 93 Ca 0.76 -1.05 0.09 0.00 -2.44 0.00 0.00 57.07 54.44 2zew s TYR 93 Cb -0.41 -1.77 -0.03 0.00 0.35 0.00 0.00 41.96 40.10 2zew s TYR 93 CO 0.46 -0.44 -0.26 0.14 -1.34 0.00 0.00 175.55 174.11 2zew s VAL 94 N 0.49 2.12 -0.11 3.14 -7.23 -0.35 -5.00 120.40 113.47 2zew s VAL 94 Ca -0.14 -1.46 0.01 0.00 -1.81 0.00 0.00 61.98 58.59 2zew s VAL 94 Cb -0.17 -1.83 0.02 0.00 0.56 0.00 0.00 36.38 34.96 2zew s VAL 94 CO 0.05 0.29 -0.12 -1.10 -0.31 0.00 0.00 175.10 173.91 2zew s GLN 95 N -1.42 1.93 -0.31 4.82 -0.21 -1.26 -2.08 119.66 121.13 2zew s GLN 95 Ca 0.12 -0.45 -0.12 0.00 0.02 0.00 0.00 55.36 54.93 2zew s GLN 95 Cb -0.10 -1.73 -0.03 0.00 1.00 0.00 0.00 33.01 32.15 2zew s GLN 95 CO 0.03 -0.12 0.22 -1.01 -2.12 0.00 0.00 175.29 172.29 2zew s HIS 96 N 1.17 3.23 -0.08 0.91 3.76 0.34 -4.97 115.29 119.64 2zew s HIS 96 Ca -0.04 -0.06 0.02 0.00 -0.15 0.00 0.00 55.06 54.84 2zew s HIS 96 Cb -0.14 -2.44 0.01 0.00 1.11 0.00 0.00 32.58 31.12 2zew s HIS 96 CO -0.03 -0.27 -0.15 0.42 -0.85 0.00 0.00 174.74 173.86 2zew s ILE 97 N 1.74 1.37 -0.17 0.60 1.01 -1.26 -1.23 121.20 123.27 2zew s ILE 97 Ca 0.07 -0.60 -0.05 0.00 0.00 0.00 0.00 60.65 60.06 2zew s ILE 97 Cb -0.17 -1.24 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 2zew s ILE 97 CO 0.11 0.41 0.00 -0.76 0.00 0.00 0.00 174.94 174.70 2zew s LEU 98 N 0.70 3.48 -0.11 2.97 1.43 0.19 -4.98 118.68 122.36 2zew s LEU 98 Ca -0.13 -0.04 -0.02 0.00 -1.03 0.00 0.00 54.13 52.91 2zew s LEU 98 Cb -0.16 -1.86 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 2zew s LEU 98 CO 0.03 0.17 -0.04 0.20 0.23 0.00 0.00 176.35 176.95 2zew s ASN 99 N 0.35 4.86 -0.01 2.29 0.01 -1.26 -0.91 114.94 120.26 2zew s ASN 99 Ca -0.01 -0.03 0.06 0.00 -0.71 0.00 0.00 52.86 52.16 2zew s ASN 99 Cb -0.13 -1.53 -0.01 0.00 0.41 0.00 0.00 41.25 39.98 2zew s ASN 99 CO 0.02 0.27 -0.18 -0.36 -1.51 0.00 0.00 177.10 175.34 2zew s PHE 100 N -0.26 1.63 0.00 2.20 0.08 0.75 -4.98 117.98 117.39 2zew s PHE 100 Ca 0.05 -0.31 0.00 0.00 0.12 0.00 0.00 56.93 56.79 2zew s PHE 100 Cb -0.13 -1.05 0.00 0.00 -0.57 0.00 0.00 43.02 41.28 2zew s PHE 100 CO 0.02 -0.03 0.69 0.27 -0.10 0.00 0.00 175.22 176.07 2zew n ASN 101 N 2.64 0.00 -4.83 1.36 6.94 -1.26 -0.82 115.26 119.29 2zew n ASN 101 Ca -0.15 -1.45 -0.33 0.00 -0.02 0.00 0.00 54.58 52.63 2zew n ASN 101 Cb 0.54 -0.09 -0.05 0.00 -2.36 0.00 0.00 39.78 37.82 2zew n ASN 101 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2zew s GLU 102 N 0.00 4.06 0.00 -3.83 8.01 -1.26 -4.72 118.70 120.96 2zew s GLU 102 Ca 0.00 1.07 0.15 0.00 0.01 0.00 0.00 54.97 56.20 2zew s GLU 102 Cb 0.00 -2.15 0.34 0.00 -4.31 0.00 0.00 34.13 28.00 2zew s GLU 102 CO 0.00 -0.18 1.25 0.25 0.01 0.00 0.00 175.26 176.59 2zew n THR 103 N -1.09 0.67 -4.41 3.63 -2.24 -1.26 -0.92 114.28 108.66 2zew n THR 103 Ca 0.07 -0.84 -0.28 0.00 -2.27 0.00 0.00 64.05 60.73 2zew n THR 103 Cb 0.54 0.77 -0.12 0.00 -2.10 0.00 0.00 70.33 69.42 2zew n THR 103 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2zew s ASP 104 N -1.11 3.38 0.01 3.42 1.01 -1.26 -4.75 116.67 117.38 2zew s ASP 104 Ca 0.28 -0.81 -0.36 0.00 0.71 0.00 0.00 52.55 52.37 2zew s ASP 104 Cb 0.16 -0.24 -0.14 0.00 1.01 0.00 0.00 42.92 43.70 2zew s ASP 104 CO 0.22 0.15 1.61 0.79 0.21 0.00 0.00 175.17 178.14 2zew n TRP 105 N 0.57 2.04 -4.08 4.23 7.02 -1.26 -4.62 117.44 121.34 2zew n TRP 105 Ca -0.15 0.36 -0.17 0.00 -1.02 0.00 0.00 57.50 56.51 2zew n TRP 105 Cb 0.55 -2.50 -0.16 0.00 -2.42 0.00 0.00 31.31 26.78 2zew n TRP 105 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 2zew s THR 106 N 1.92 0.36 -0.17 -0.99 2.01 -0.58 -4.96 115.64 113.24 2zew s THR 106 Ca 0.87 -0.09 -0.08 0.00 0.31 0.00 0.00 61.69 62.70 2zew s THR 106 Cb -0.82 -0.38 -0.04 0.00 0.01 0.00 0.00 72.50 71.26 2zew s THR 106 CO 0.48 0.16 0.09 -0.47 -0.69 0.00 0.00 174.62 174.19 2zew s TYR 107 N 0.57 3.36 0.08 4.92 5.04 -1.26 -1.38 117.35 128.67 2zew s TYR 107 Ca -0.06 0.24 0.03 0.00 -2.44 0.00 0.00 57.07 54.84 2zew s TYR 107 Cb -0.10 -2.06 -0.03 0.00 0.35 0.00 0.00 41.96 40.12 2zew s TYR 107 CO -0.01 0.32 -0.10 0.15 -1.34 0.00 0.00 175.55 174.58 2zew s LYS 108 N 0.05 0.78 0.07 4.97 1.02 -0.78 -5.01 119.74 120.84 2zew s LYS 108 Ca 0.07 -1.08 -0.11 0.00 0.02 0.00 0.00 55.97 54.87 2zew s LYS 108 Cb -0.12 -0.48 0.01 0.00 -0.52 0.00 0.00 37.83 36.73 2zew s LYS 108 CO 0.00 0.07 0.25 1.14 -0.92 0.00 0.00 175.35 175.90 2zew s GLN 109 N -2.58 0.83 0.12 1.68 -2.07 -1.26 -1.93 119.66 114.44 2zew s GLN 109 Ca 0.03 -0.72 -0.06 0.00 -1.82 0.00 0.00 55.36 52.79 2zew s GLN 109 Cb -0.04 0.35 -0.02 0.00 -1.09 0.00 0.00 33.01 32.21 2zew s GLN 109 CO -0.00 -0.27 0.15 -0.48 -1.32 0.00 0.00 175.29 173.36 2zew s LEU 110 N -2.45 1.56 -0.03 2.60 0.05 -0.14 -5.00 118.68 115.27 2zew s LEU 110 Ca -0.00 -0.92 0.06 0.00 0.05 0.00 0.00 54.13 53.31 2zew s LEU 110 Cb 0.02 0.75 -0.02 0.00 -2.05 0.00 0.00 46.19 44.89 2zew s LEU 110 CO -0.07 -0.76 -0.19 -0.22 -0.55 0.00 0.00 176.35 174.56 2zew s LEU 111 N -2.95 2.47 0.10 1.48 0.20 -1.26 -0.95 118.68 117.77 2zew s LEU 111 Ca 0.14 -0.32 -0.08 0.00 0.69 0.00 0.00 54.13 54.56 2zew s LEU 111 Cb 0.06 -1.47 -0.00 0.00 -0.43 0.00 0.00 46.19 44.34 2zew s LEU 111 CO -0.04 0.33 0.19 0.72 -0.29 0.00 0.00 176.35 177.25 2zew s PHE 112 N -0.71 0.21 -0.07 5.38 -0.12 -0.51 -5.01 117.98 117.15 2zew s PHE 112 Ca 0.11 -0.64 0.05 0.00 -0.05 0.00 0.00 56.93 56.40 2zew s PHE 112 Cb -0.10 -0.08 -0.01 0.00 -0.63 0.00 0.00 43.02 42.20 2zew s PHE 112 CO 0.00 -0.56 -0.23 0.99 -0.05 0.00 0.00 175.22 175.38 2zew s THR 113 N -3.88 2.22 0.53 -4.49 2.01 -1.26 -0.63 115.64 110.15 2zew s THR 113 Ca 0.07 -0.99 -0.14 0.00 0.31 0.00 0.00 61.69 60.94 2zew s THR 113 Cb 0.05 -1.83 -0.06 0.00 0.01 0.00 0.00 72.50 70.66 2zew s THR 113 CO -0.09 0.56 0.97 0.42 -0.69 0.00 0.00 174.62 175.79 2zew s THR 114 N -0.03 4.63 1.02 -0.82 -4.23 -0.19 -4.92 115.64 111.09 2zew s THR 114 Ca -0.07 1.02 -0.15 0.00 -1.18 0.00 0.00 61.69 61.30 2zew s THR 114 Cb -0.15 -3.77 0.20 0.00 1.34 0.00 0.00 72.50 70.12 2zew s THR 114 CO 0.05 -0.82 1.16 -2.16 -0.54 0.00 0.00 174.62 172.31 2zew s PRO 115 N -4.42 0.24 0.24 3.99 0.04 -1.26 -2.63 135.00 131.21 2zew s PRO 115 Ca 0.56 0.07 -0.01 0.00 0.04 0.00 0.00 61.00 61.67 2zew s PRO 115 Cb -0.10 -1.75 0.29 0.00 0.04 0.00 0.00 34.50 32.97 2zew s PRO 115 CO 0.39 -2.77 1.67 0.22 0.04 0.00 0.00 177.00 176.55 2zew h ASP 116 N -1.90 0.64 -3.61 6.66 3.58 -1.97 -0.66 116.42 119.16 2zew h ASP 116 Ca -0.48 -0.23 -0.28 0.00 0.42 0.00 0.00 57.03 56.46 2zew h ASP 116 Cb 1.30 -0.17 -0.32 0.00 1.72 0.00 0.00 39.33 41.86 2zew h ASP 116 CO 0.49 0.87 -0.73 -0.69 -2.88 0.00 0.00 179.24 176.29 2zew s VAL 117 N -4.54 0.02 0.11 2.25 1.01 -1.26 -4.70 120.40 113.29 2zew s VAL 117 Ca -0.08 0.10 -0.19 0.00 0.00 0.00 0.00 61.98 61.80 2zew s VAL 117 Cb 0.13 -0.10 -0.07 0.00 0.00 0.00 0.00 36.38 36.35 2zew s VAL 117 CO 0.81 0.07 0.60 -0.36 0.00 0.00 0.00 175.10 176.22 2zew s PHE 118 N 0.62 3.78 -0.85 5.22 0.08 -1.26 -1.47 117.98 124.10 2zew s PHE 118 Ca -0.05 1.30 0.24 0.00 0.12 0.00 0.00 56.93 58.54 2zew s PHE 118 Cb -0.08 -2.52 0.38 0.00 -0.57 0.00 0.00 43.02 40.23 2zew s PHE 118 CO -0.02 0.54 1.32 0.41 -0.10 0.00 0.00 175.22 177.37 2zew n GLY 119 N 1.50 -1.28 3.56 4.36 0.00 0.93 -4.43 105.19 109.84 2zew n GLY 119 Ca -0.09 -0.34 -0.09 0.00 0.00 0.00 0.00 46.02 45.50 2zew n GLY 119 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2zew s SER 120 N -3.47 -0.28 -0.08 1.61 1.04 -1.22 -4.85 113.70 106.44 2zew s SER 120 Ca 0.09 -0.47 -0.30 0.00 0.48 0.00 0.00 55.95 55.75 2zew s SER 120 Cb 0.16 0.60 -0.03 0.00 0.10 0.00 0.00 66.02 66.85 2zew s SER 120 CO 0.72 -1.09 1.25 -0.89 0.98 0.00 0.00 173.24 174.21 2zew s THR 121 N -3.87 4.19 0.55 2.02 2.01 -1.26 -4.56 115.64 114.72 2zew s THR 121 Ca 0.09 1.51 -0.21 0.00 0.31 0.00 0.00 61.69 63.39 2zew s THR 121 Cb -0.02 -3.97 -0.06 0.00 0.01 0.00 0.00 72.50 68.46 2zew s THR 121 CO -0.02 -0.04 1.09 -2.65 -0.69 0.00 0.00 174.62 172.31 2zew n PRO 122 N 5.64 1.23 -5.07 4.92 -0.02 -1.25 -4.84 135.00 135.61 2zew n PRO 122 Ca 0.12 0.46 -0.29 0.00 -2.02 0.00 0.00 63.50 61.77 2zew n PRO 122 Cb 0.45 -2.26 -0.15 0.00 -0.02 0.00 0.00 33.50 31.53 2zew n PRO 122 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 2zew s GLN 123 N -2.62 1.84 -0.26 -0.52 0.74 -0.32 -0.68 119.66 117.83 2zew s GLN 123 Ca 0.72 -0.91 -0.09 0.00 0.05 0.00 0.00 55.36 55.12 2zew s GLN 123 Cb -0.45 -1.85 -0.04 0.00 1.10 0.00 0.00 33.01 31.78 2zew s GLN 123 CO 0.50 0.50 0.13 -1.17 -0.55 0.00 0.00 175.29 174.70 2zew s LEU 124 N -0.76 3.77 -0.06 3.68 2.96 -0.08 -1.20 118.68 126.99 2zew s LEU 124 Ca 0.09 -0.08 0.04 0.00 -0.22 0.00 0.00 54.13 53.97 2zew s LEU 124 Cb -0.09 -2.03 -0.02 0.00 0.50 0.00 0.00 46.19 44.55 2zew s LEU 124 CO -0.00 -0.03 -0.18 0.00 -1.32 0.00 0.00 176.35 174.82 2zew s ALA 125 N 1.60 2.47 -0.36 5.97 0.00 0.44 -1.29 121.76 130.59 2zew s ALA 125 Ca 0.07 -1.01 -0.04 0.00 0.00 0.00 0.00 51.96 50.98 2zew s ALA 125 Cb -0.15 -0.87 0.07 0.00 0.00 0.00 0.00 23.12 22.17 2zew s ALA 125 CO 0.07 0.48 0.12 -0.51 0.00 0.00 0.00 175.76 175.93 2zew s LEU 126 N -0.45 4.61 -0.25 0.00 1.43 0.60 -0.81 118.68 123.81 2zew s LEU 126 Ca 0.05 -1.55 0.03 0.00 -1.03 0.00 0.00 54.13 51.63 2zew s LEU 126 Cb -0.12 -1.81 0.06 0.00 0.03 0.00 0.00 46.19 44.35 2zew s LEU 126 CO 0.02 -0.41 -0.11 0.86 0.23 0.00 0.00 176.35 176.94 2zew s TRP 127 N 1.26 3.18 -1.11 0.29 -0.11 0.37 -1.22 118.94 121.59 2zew s TRP 127 Ca 0.01 -2.26 -0.12 0.00 1.22 0.00 0.00 56.10 54.96 2zew s TRP 127 Cb -0.21 -1.90 0.23 0.00 -1.50 0.00 0.00 33.47 30.08 2zew s TRP 127 CO -0.01 -0.87 1.19 0.21 -4.62 0.00 0.00 176.95 172.85 2zew s LYS 128 N 1.13 4.09 0.54 5.86 2.20 0.29 -0.28 119.74 133.57 2zew s LYS 128 Ca -0.08 -2.87 0.34 0.00 -0.36 0.00 0.00 55.97 53.00 2zew s LYS 128 Cb -0.20 -4.73 1.49 0.00 -1.51 0.00 0.00 37.83 32.88 2zew s LYS 128 CO -0.05 -1.45 2.02 0.78 -0.36 0.00 0.00 175.35 176.29 2zew h GLY 129 N 7.96 0.00 -4.51 5.54 0.00 -1.69 -2.01 103.07 108.37 2zew h GLY 129 Ca 0.22 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.95 2zew h GLY 129 CO 1.07 0.00 0.30 1.34 0.00 0.00 0.00 176.54 179.25 2zew n ASP 130 N -3.02 1.84 -0.52 0.19 2.03 -0.91 -4.52 116.55 111.63 2zew n ASP 130 Ca 0.00 1.18 0.05 0.00 0.52 0.00 0.00 54.79 56.54 2zew n ASP 130 Cb 0.26 -1.34 0.10 0.00 -0.72 0.00 0.00 41.12 39.42 2zew n ASP 130 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2zew n THR 131 N 0.65 0.53 -1.16 5.18 -2.24 -1.26 -3.79 114.28 112.19 2zew n THR 131 Ca 0.09 -0.77 -0.29 0.00 -2.27 0.00 0.00 64.05 60.81 2zew n THR 131 Cb 0.32 0.84 0.21 0.00 -2.10 0.00 0.00 70.33 69.60 2zew n THR 131 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2zew s SER 132 N -0.94 1.63 0.36 3.42 1.04 -1.26 -4.24 113.70 113.71 2zew s SER 132 Ca 0.17 0.81 0.27 0.00 0.48 0.00 0.00 55.95 57.68 2zew s SER 132 Cb 0.10 -1.20 1.19 0.00 0.10 0.00 0.00 66.02 66.21 2zew s SER 132 CO 0.14 -3.70 1.80 0.11 0.98 0.00 0.00 173.24 172.57 2zew h LYS 133 N -2.29 0.00 -6.65 4.02 1.57 -1.91 0.12 116.57 111.44 2zew h LYS 133 Ca -0.49 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 57.74 2zew h LYS 133 Cb 1.31 0.00 0.08 0.00 0.08 0.00 0.00 32.23 33.69 2zew h LYS 133 CO 0.43 0.00 0.79 0.00 -0.57 0.00 0.00 179.45 180.11 2zew n ALA 134 N -1.86 1.87 -2.12 3.86 0.00 -1.26 -4.19 120.51 116.80 2zew n ALA 134 Ca 0.01 0.40 -0.32 0.00 0.00 0.00 0.00 53.44 53.53 2zew n ALA 134 Cb 0.20 -2.39 -0.06 0.00 0.00 0.00 0.00 19.45 17.20 2zew n ALA 134 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2zew s ASN 135 N 0.61 6.77 -0.15 0.00 -0.87 -1.26 -3.42 114.94 116.61 2zew s ASN 135 Ca 0.70 1.30 -0.04 0.00 -1.57 0.00 0.00 52.86 53.25 2zew s ASN 135 Cb -0.59 -2.38 -0.03 0.00 -0.02 0.00 0.00 41.25 38.24 2zew s ASN 135 CO 0.44 -0.22 -0.04 -0.22 -2.57 0.00 0.00 177.10 174.49 2zew s LEU 136 N -3.02 3.24 -0.13 0.60 1.98 -0.37 -0.71 118.68 120.27 2zew s LEU 136 Ca 0.55 -0.13 -0.03 0.00 -2.89 0.00 0.00 54.13 51.62 2zew s LEU 136 Cb -0.10 -1.78 -0.03 0.00 0.66 0.00 0.00 46.19 44.94 2zew s LEU 136 CO 0.17 0.17 -0.01 -0.31 -1.89 0.00 0.00 176.35 174.48 2zew s TYR 137 N 0.34 3.09 0.01 5.38 2.02 0.85 -0.28 117.35 128.76 2zew s TYR 137 Ca -0.04 -0.06 0.00 0.00 -0.37 0.00 0.00 57.07 56.60 2zew s TYR 137 Cb -0.14 -1.90 -0.01 0.00 -0.40 0.00 0.00 41.96 39.51 2zew s TYR 137 CO 0.03 0.19 -0.02 0.54 -1.57 0.00 0.00 175.55 174.72 2zew s VAL 138 N -0.14 0.07 0.09 0.71 0.11 -0.25 -0.92 120.40 120.07 2zew s VAL 138 Ca 0.04 -0.38 -0.17 0.00 -2.93 0.00 0.00 61.98 58.54 2zew s VAL 138 Cb -0.13 -0.13 0.03 0.00 -1.53 0.00 0.00 36.38 34.62 2zew s VAL 138 CO 0.02 -0.19 0.40 -0.62 -3.33 0.00 0.00 175.10 171.38 2zew s ASP 139 N -0.59 -0.25 -1.22 3.54 2.15 -0.41 -0.77 116.67 119.11 2zew s ASP 139 Ca -0.06 -0.17 -0.07 0.00 0.43 0.00 0.00 52.55 52.68 2zew s ASP 139 Cb -0.04 0.45 -0.01 0.00 -0.30 0.00 0.00 42.92 43.01 2zew s ASP 139 CO -0.00 -0.76 0.74 0.47 -0.17 0.00 0.00 175.17 175.45 2zew n ASP 140 N 0.13 -3.14 -4.67 -0.34 8.00 -0.93 -2.17 116.55 113.44 2zew n ASP 140 Ca -0.17 -0.87 -0.43 0.00 0.71 0.00 0.00 54.79 54.03 2zew n ASP 140 Cb 0.62 -3.97 -0.02 0.00 -0.02 0.00 0.00 41.12 37.72 2zew n ASP 140 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2zew s VAL 141 N -3.59 4.73 0.06 2.53 1.01 -0.70 -4.21 120.40 120.24 2zew s VAL 141 Ca 0.21 1.99 0.06 0.00 0.00 0.00 0.00 61.98 64.23 2zew s VAL 141 Cb -0.06 -4.29 -0.03 0.00 0.00 0.00 0.00 36.38 32.00 2zew s VAL 141 CO 0.82 -0.12 -0.16 -0.31 0.00 0.00 0.00 175.10 175.33 2zew s TYR 142 N 2.83 1.42 -0.26 5.22 1.51 -0.38 -4.63 117.35 123.06 2zew s TYR 142 Ca 0.44 -0.40 -0.03 0.00 -1.01 0.00 0.00 57.07 56.07 2zew s TYR 142 Cb -0.16 -0.81 0.11 0.00 -0.11 0.00 0.00 41.96 40.98 2zew s TYR 142 CO 0.09 0.08 0.20 -1.17 -1.11 0.00 0.00 175.55 173.65 2zew s LEU 143 N -1.48 0.11 -0.03 -1.29 2.96 -1.25 -1.26 118.68 116.44 2zew s LEU 143 Ca 0.02 -0.79 0.07 0.00 -0.22 0.00 0.00 54.13 53.22 2zew s LEU 143 Cb -0.09 0.12 -0.02 0.00 0.50 0.00 0.00 46.19 46.70 2zew s LEU 143 CO 0.02 -0.39 -0.25 0.68 -1.32 0.00 0.00 176.35 175.10 2zew s VAL 144 N 2.24 1.96 0.04 1.68 -7.23 -0.22 -0.53 120.40 118.34 2zew s VAL 144 Ca 0.08 -1.05 -0.30 0.00 -1.81 0.00 0.00 61.98 58.90 2zew s VAL 144 Cb -0.15 -1.63 -0.04 0.00 0.56 0.00 0.00 36.38 35.12 2zew s VAL 144 CO -0.27 0.55 0.96 -0.70 -0.31 0.00 0.00 175.10 175.33 2zew s GLU 145 N -0.50 4.60 0.00 4.82 2.12 -1.25 -0.94 118.70 127.55 2zew s GLU 145 Ca 0.07 1.40 0.00 0.00 0.36 0.00 0.00 54.97 56.81 2zew s GLU 145 Cb -0.10 -3.43 0.00 0.00 0.26 0.00 0.00 34.13 30.86 2zew s GLU 145 CO -0.00 0.06 0.43 1.33 -0.54 0.00 0.00 175.26 176.53