#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2out n SER 2 N 0.00 1.16 -0.94 1.61 3.41 -1.26 -5.10 113.62 112.49 2out n SER 2 Ca 0.00 -0.50 0.07 0.00 -0.26 0.00 0.00 58.87 58.17 2out n SER 2 Cb 0.00 1.18 -0.02 0.00 -0.26 0.00 0.00 64.21 65.12 2out n SER 2 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2out n HIS 3 N -1.48 -2.43 -2.06 7.33 8.25 -1.26 -4.91 115.22 118.66 2out n HIS 3 Ca 0.01 0.60 -0.13 0.00 -0.26 0.00 0.00 57.72 57.94 2out n HIS 3 Cb 0.22 -0.97 -0.02 0.00 1.12 0.00 0.00 29.99 30.34 2out n HIS 3 CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 2out n MET 4 N -2.42 -1.00 -2.46 -0.41 0.00 -1.26 -4.39 117.12 105.19 2out n MET 4 Ca 0.00 0.69 -0.02 0.00 0.00 0.00 0.00 57.70 58.38 2out n MET 4 Cb 0.22 -4.87 -0.02 0.00 0.00 0.00 0.00 33.22 28.55 2out n MET 4 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 2out n ASP 5 N -0.37 -5.65 -3.65 6.12 8.00 -1.26 -5.07 116.55 114.67 2out n ASP 5 Ca -0.15 1.61 -0.05 0.00 0.71 0.00 0.00 54.79 56.91 2out n ASP 5 Cb 0.57 -4.87 -0.06 0.00 -0.02 0.00 0.00 41.12 36.75 2out n ASP 5 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2out s LYS 6 N -0.56 0.61 -0.03 -1.24 2.47 -1.26 -5.15 119.74 114.57 2out s LYS 6 Ca -0.10 1.30 0.01 0.00 -1.56 0.00 0.00 55.97 55.61 2out s LYS 6 Cb 0.01 0.47 0.02 0.00 -1.46 0.00 0.00 37.83 36.87 2out s LYS 6 CO 0.28 -0.18 -0.03 -0.08 0.16 0.00 0.00 175.35 175.50 2out s THR 7 N 2.24 0.41 -0.04 3.43 -1.32 -1.15 -3.30 115.64 115.91 2out s THR 7 Ca -0.08 -0.07 -0.09 0.00 -1.21 0.00 0.00 61.69 60.24 2out s THR 7 Cb -0.09 -0.44 0.02 0.00 -1.51 0.00 0.00 72.50 70.47 2out s THR 7 CO -0.19 0.19 0.22 0.12 -2.21 0.00 0.00 174.62 172.75 2out s PHE 8 N 0.82 -0.14 -0.15 9.09 5.36 0.45 -4.75 117.98 128.66 2out s PHE 8 Ca -0.10 0.28 0.01 0.00 -0.96 0.00 0.00 56.93 56.16 2out s PHE 8 Cb -0.13 0.04 0.02 0.00 -0.34 0.00 0.00 43.02 42.61 2out s PHE 8 CO -0.00 -0.24 -0.16 0.00 -1.46 0.00 0.00 175.22 173.36 2out s VAL 10 N 1.33 3.87 -0.03 0.00 0.11 -1.23 -4.00 120.40 120.46 2out s VAL 10 Ca 0.02 -1.21 0.04 0.00 -2.93 0.00 0.00 61.98 57.91 2out s VAL 10 Cb -0.13 -2.90 -0.01 0.00 -1.53 0.00 0.00 36.38 31.81 2out s VAL 10 CO -0.09 -0.00 -0.16 0.54 -3.33 0.00 0.00 175.10 172.06 2out s VAL 11 N -1.52 1.28 -0.38 2.04 0.11 -1.01 0.35 120.40 121.28 2out s VAL 11 Ca 0.27 -0.66 -0.05 0.00 -2.93 0.00 0.00 61.98 58.60 2out s VAL 11 Cb -0.10 -1.09 0.08 0.00 -1.53 0.00 0.00 36.38 33.73 2out s VAL 11 CO 0.18 0.37 0.17 0.68 -3.33 0.00 0.00 175.10 173.18 2out s VAL 12 N -0.11 3.61 -0.51 2.04 -7.23 -0.84 -2.61 120.40 114.75 2out s VAL 12 Ca 0.00 -1.60 -0.21 0.00 -1.81 0.00 0.00 61.98 58.36 2out s VAL 12 Cb -0.09 -3.26 0.05 0.00 0.56 0.00 0.00 36.38 33.64 2out s VAL 12 CO 0.01 -0.46 0.76 -1.58 -0.31 0.00 0.00 175.10 173.51 2out s GLN 13 N 1.29 3.23 0.04 4.82 0.74 -1.24 -3.29 119.66 125.26 2out s GLN 13 Ca 0.03 -0.55 -0.07 0.00 0.05 0.00 0.00 55.36 54.82 2out s GLN 13 Cb -0.22 -4.06 -0.05 0.00 1.10 0.00 0.00 33.01 29.78 2out s GLN 13 CO -0.01 -1.29 0.30 -0.80 -0.55 0.00 0.00 175.29 172.94 2out s ASN 14 N 2.64 6.51 -0.15 6.67 0.01 0.14 -4.52 114.94 126.25 2out s ASN 14 Ca 0.22 0.59 0.18 0.00 -0.71 0.00 0.00 52.86 53.15 2out s ASN 14 Cb -0.16 -2.10 0.38 0.00 0.41 0.00 0.00 41.25 39.79 2out s ASN 14 CO 0.16 0.22 1.19 0.54 -1.51 0.00 0.00 177.10 177.70 2out n ARG 15 N 0.94 0.85 -0.11 -0.60 5.12 -1.26 -3.34 116.66 118.26 2out n ARG 15 Ca -0.09 -2.22 -0.20 0.00 -1.93 0.00 0.00 57.85 53.41 2out n ARG 15 Cb 0.53 -0.40 -0.07 0.00 -1.16 0.00 0.00 32.46 31.36 2out n ARG 15 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 2out n ILE 16 N -0.34 1.46 0.00 0.55 5.41 -1.26 -5.09 119.36 120.10 2out n ILE 16 Ca -0.03 -0.14 0.00 0.00 1.00 0.00 0.00 62.75 63.58 2out n ILE 16 Cb 0.91 -2.06 0.00 0.00 -0.71 0.00 0.00 39.64 37.78 2out n ILE 16 CO 0.00 0.00 0.00 2.29 0.00 0.00 0.00 176.55 178.84 2out n LYS 17 N -4.28 0.00 -2.66 0.38 2.85 -1.26 -5.04 118.16 108.15 2out n LYS 17 Ca -0.35 0.00 -0.12 0.00 -1.05 0.00 0.00 58.31 56.80 2out n LYS 17 Cb 0.70 0.00 0.02 0.00 -0.65 0.00 0.00 35.03 35.10 2out n LYS 17 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2out n GLU 18 N 0.00 1.43 0.00 -1.58 1.02 -1.26 -4.18 120.64 116.07 2out n GLU 18 Ca 0.00 -3.42 0.00 0.00 -0.02 0.00 0.00 57.16 53.72 2out n GLU 18 Cb 0.00 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 2out n GLU 18 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2out n GLY 19 N -0.10 2.37 4.00 0.62 0.00 -0.71 -1.21 105.19 110.17 2out n GLY 19 Ca 0.13 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2out n GLY 19 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2out n TYR 20 N 0.00 0.00 0.00 1.61 9.36 -1.26 -4.48 117.16 122.39 2out n TYR 20 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 2out n TYR 20 Cb 0.00 -0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.71 2out n TYR 20 CO 0.00 0.00 0.00 2.89 0.22 0.00 0.00 176.86 179.97 2out n ARG 21 N -1.94 0.00 0.00 2.98 -4.01 -1.24 -4.62 116.66 107.83 2out n ARG 21 Ca 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.81 2out n ARG 21 Cb 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 29.42 2out n ARG 21 CO 0.00 0.00 0.00 -2.13 -3.04 0.00 0.00 177.63 172.46 2out n ARG 22 N -0.74 0.00 -0.54 2.89 0.63 -1.20 -3.86 116.66 113.83 2out n ARG 22 Ca 0.00 0.00 0.08 0.00 -0.92 0.00 0.00 57.85 57.01 2out n ARG 22 Cb 0.00 0.00 0.30 0.00 0.45 0.00 0.00 32.46 33.21 2out n ARG 22 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2out n ALA 23 N 0.00 3.09 0.00 5.13 0.00 -1.26 -4.85 120.51 122.61 2out n ALA 23 Ca 0.00 -1.90 0.00 0.00 0.00 0.00 0.00 53.44 51.54 2out n ALA 23 Cb 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 18.62 2out n ALA 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2out n GLY 24 N 0.24 1.81 3.53 0.00 0.00 -1.26 -5.11 105.19 104.39 2out n GLY 24 Ca 0.22 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.12 2out n GLY 24 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2out s PHE 25 N -2.00 -0.45 -0.56 1.61 -0.71 -1.26 -5.09 117.98 109.52 2out s PHE 25 Ca 0.00 0.61 -0.27 0.00 -1.04 0.00 0.00 56.93 56.23 2out s PHE 25 Cb 0.00 0.47 -0.09 0.00 -1.21 0.00 0.00 43.02 42.19 2out s PHE 25 CO 0.00 -0.51 2.46 -1.13 -1.34 0.00 0.00 175.22 174.70 2out n SER 26 N 0.40 2.05 0.00 1.98 3.41 -1.26 -3.26 113.62 116.94 2out n SER 26 Ca -0.13 -0.42 0.00 0.00 -0.26 0.00 0.00 58.87 58.06 2out n SER 26 Cb 0.59 -1.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.04 2out n SER 26 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2out n PHE 27 N 15.23 0.00 -3.80 7.33 7.35 -1.22 -4.65 117.46 137.70 2out n PHE 27 Ca 0.41 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 57.05 2out n PHE 27 Cb 0.48 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 40.29 2out n PHE 27 CO 0.00 0.00 0.00 -1.01 -0.76 0.00 0.00 176.76 174.99 2out s HIS 28 N 0.00 -0.15 -0.50 -5.13 3.76 -0.35 -4.34 115.29 108.59 2out s HIS 28 Ca 0.00 -0.22 -0.21 0.00 -0.15 0.00 0.00 55.06 54.48 2out s HIS 28 Cb 0.00 0.67 0.04 0.00 1.11 0.00 0.00 32.58 34.40 2out s HIS 28 CO 0.00 -1.01 0.72 -1.17 -0.85 0.00 0.00 174.74 172.43 2out s LEU 29 N -2.93 4.59 0.00 0.89 1.98 -1.26 -1.74 118.68 120.21 2out s LEU 29 Ca 0.12 -0.57 0.00 0.00 -2.89 0.00 0.00 54.13 50.78 2out s LEU 29 Cb -0.03 -2.65 0.00 0.00 0.66 0.00 0.00 46.19 44.17 2out s LEU 29 CO 0.04 -0.95 0.00 0.61 -1.89 0.00 0.00 176.35 174.17 2out n GLY 30 N 5.11 -0.65 2.93 7.98 0.00 -1.21 -4.98 105.19 114.36 2out n GLY 30 Ca -0.03 -0.36 -0.13 0.00 0.00 0.00 0.00 46.02 45.50 2out n GLY 30 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2out s ASP 31 N -4.00 -0.10 -0.03 1.61 1.47 -1.25 0.24 116.67 114.61 2out s ASP 31 Ca 0.00 0.28 0.06 0.00 1.18 0.00 0.00 52.55 54.07 2out s ASP 31 Cb 0.00 0.19 -0.01 0.00 -0.34 0.00 0.00 42.92 42.75 2out s ASP 31 CO 0.00 -0.13 -0.20 0.21 0.68 0.00 0.00 175.17 175.72 2out s ASN 32 N 1.01 2.44 0.21 2.11 3.84 -1.21 -4.92 114.94 118.42 2out s ASN 32 Ca -0.08 -0.39 -0.18 0.00 0.21 0.00 0.00 52.86 52.43 2out s ASN 32 Cb -0.10 -0.42 -0.08 0.00 -0.55 0.00 0.00 41.25 40.10 2out s ASN 32 CO -0.05 0.23 0.67 -0.94 -2.79 0.00 0.00 177.10 174.22 2out s SER 33 N -0.32 6.97 0.08 -4.21 1.04 -1.26 -1.98 113.70 114.02 2out s SER 33 Ca 0.04 1.31 0.01 0.00 0.48 0.00 0.00 55.95 57.78 2out s SER 33 Cb -0.10 -2.38 -0.04 0.00 0.10 0.00 0.00 66.02 63.61 2out s SER 33 CO 0.00 0.04 0.19 -0.22 0.98 0.00 0.00 173.24 174.23 2out s LEU 34 N -2.04 4.23 0.68 2.42 1.98 1.09 -4.92 118.68 122.12 2out s LEU 34 Ca 0.42 0.19 -0.14 0.00 -2.89 0.00 0.00 54.13 51.71 2out s LEU 34 Cb -0.16 -2.84 0.01 0.00 0.66 0.00 0.00 46.19 43.86 2out s LEU 34 CO 0.20 0.15 1.09 0.00 -1.89 0.00 0.00 176.35 175.91 2out s ALA 35 N -1.53 2.46 -0.50 5.97 0.00 -1.26 -3.52 121.76 123.39 2out s ALA 35 Ca 0.34 0.42 -0.28 0.00 0.00 0.00 0.00 51.96 52.44 2out s ALA 35 Cb -0.12 -3.28 -0.01 0.00 0.00 0.00 0.00 23.12 19.70 2out s ALA 35 CO 0.27 -1.34 1.70 0.00 0.00 0.00 0.00 175.76 176.39 2out s ALA 36 N -2.55 2.60 0.04 0.00 0.00 -1.21 -4.02 121.76 116.62 2out s ALA 36 Ca 0.64 -0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.27 2out s ALA 36 Cb -0.19 -4.14 -0.00 0.00 0.00 0.00 0.00 23.12 18.80 2out s ALA 36 CO 0.46 -3.16 0.00 1.33 0.00 0.00 0.00 175.76 174.39 2out n VAL 37 N 7.18 0.00 -0.89 0.00 0.24 0.64 -4.55 118.33 120.96 2out n VAL 37 Ca 0.19 -0.21 -0.13 0.00 -2.04 0.00 0.00 64.34 62.15 2out n VAL 37 Cb 0.49 0.05 -0.02 0.00 -1.47 0.00 0.00 33.84 32.90 2out n VAL 37 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2out n SER 38 N -1.35 5.98 0.00 -1.34 3.41 -1.21 0.17 113.62 119.28 2out n SER 38 Ca -0.01 -2.82 0.00 0.00 -0.26 0.00 0.00 58.87 55.78 2out n SER 38 Cb 0.06 -1.16 0.00 0.00 -0.26 0.00 0.00 64.21 62.85 2out n SER 38 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2out n GLU 39 N 1.06 0.00 -0.42 4.33 2.13 -1.26 -4.35 120.64 122.13 2out n GLU 39 Ca 0.26 0.00 0.35 0.00 0.66 0.00 0.00 57.16 58.43 2out n GLU 39 Cb 0.60 -1.27 0.66 0.00 0.27 0.00 0.00 31.44 31.69 2out n GLU 39 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 2out h SER 40 N 0.00 0.22 -0.64 4.31 0.02 -1.94 0.61 113.55 116.12 2out h SER 40 Ca 0.00 0.08 0.05 0.00 -0.84 0.00 0.00 61.79 61.08 2out h SER 40 Cb 0.00 0.06 -0.05 0.00 0.14 0.00 0.00 62.40 62.54 2out h SER 40 CO 0.00 -0.05 0.36 0.06 -1.14 0.00 0.00 176.83 176.06 2out h GLN 41 N 0.14 0.65 0.30 3.45 -0.00 -1.89 1.15 115.11 118.90 2out h GLN 41 Ca 0.73 -0.04 0.00 0.00 -0.00 0.00 0.00 58.65 59.34 2out h GLN 41 Cb 2.38 -0.15 -0.02 0.00 -0.00 0.00 0.00 27.48 29.69 2out h GLN 41 CO -0.25 0.43 -0.31 1.25 -0.00 0.00 0.00 178.83 179.95 2out h LEU 42 N 0.67 -0.83 -0.45 0.06 5.85 -0.16 -1.13 115.31 119.33 2out h LEU 42 Ca 0.29 0.07 -0.11 0.00 0.84 0.00 0.00 57.88 58.97 2out h LEU 42 Cb 0.16 0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2out h LEU 42 CO -0.17 -0.43 -0.50 0.00 -0.34 0.00 0.00 178.44 176.99 2out h ALA 43 N -0.07 0.79 -0.05 1.25 0.00 -1.48 -1.39 119.26 118.30 2out h ALA 43 Ca -0.01 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 2out h ALA 43 Cb 0.58 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2out h ALA 43 CO -0.07 0.63 0.03 0.37 0.00 0.00 0.00 179.25 180.21 2out h GLN 44 N 0.00 0.07 0.07 0.00 4.15 0.17 -1.49 115.11 118.08 2out h GLN 44 Ca -0.01 -0.01 -0.11 0.00 0.77 0.00 0.00 58.65 59.29 2out h GLN 44 Cb 1.20 -0.01 0.01 0.00 0.21 0.00 0.00 27.48 28.89 2out h GLN 44 CO 0.07 0.16 -0.48 -0.07 -1.93 0.00 0.00 178.83 176.58 2out h LEU 45 N -0.03 0.30 -2.18 -2.39 3.38 -1.27 -3.26 115.31 109.86 2out h LEU 45 Ca 0.02 -0.93 0.04 0.00 0.09 0.00 0.00 57.88 57.10 2out h LEU 45 Cb 0.11 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2out h LEU 45 CO -0.00 1.20 0.28 0.50 0.09 0.00 0.00 178.44 180.51 2out h LYS 46 N -0.55 0.00 0.00 1.13 3.64 -1.30 -3.11 116.57 116.38 2out h LYS 46 Ca -0.08 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2out h LYS 46 Cb 1.34 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.16 2out h LYS 46 CO 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.27 2out n ALA 47 N -2.11 -0.14 -1.85 5.00 0.00 -0.56 -4.31 120.51 116.54 2out n ALA 47 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 2out n ALA 47 Cb 0.38 0.34 -0.03 0.00 0.00 0.00 0.00 19.45 20.14 2out n ALA 47 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2out s ASP 48 N -2.70 6.32 -1.09 0.00 1.01 -1.18 -4.91 116.67 114.12 2out s ASP 48 Ca 0.00 2.19 -0.21 0.00 0.71 0.00 0.00 52.55 55.24 2out s ASP 48 Cb 0.00 -2.53 0.06 0.00 1.01 0.00 0.00 42.92 41.46 2out s ASP 48 CO 0.00 -1.22 1.51 -2.16 0.21 0.00 0.00 175.17 173.51 2out s PRO 49 N 4.72 3.70 0.00 8.23 0.04 -1.26 -3.98 135.00 146.45 2out s PRO 49 Ca 0.83 -1.40 0.00 0.00 0.04 0.00 0.00 61.00 60.47 2out s PRO 49 Cb -0.35 -5.38 0.00 0.00 0.04 0.00 0.00 34.50 28.81 2out s PRO 49 CO 0.35 -2.20 0.00 -2.13 0.04 0.00 0.00 177.00 173.06 2out n ARG 50 N 8.61 0.00 -2.69 4.56 3.00 -1.26 -5.15 116.66 123.73 2out n ARG 50 Ca 0.37 0.00 -0.22 0.00 -0.00 0.00 0.00 57.85 58.00 2out n ARG 50 Cb 0.50 0.00 0.07 0.00 0.00 0.00 0.00 32.46 33.03 2out n ARG 50 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2out s LEU 51 N -2.74 3.13 -0.32 6.15 2.01 -1.26 -5.09 118.68 120.56 2out s LEU 51 Ca 0.00 -0.32 -0.00 0.00 0.01 0.00 0.00 54.13 53.82 2out s LEU 51 Cb 0.00 -2.26 0.07 0.00 0.01 0.00 0.00 46.19 44.00 2out s LEU 51 CO 0.00 -1.49 0.03 -0.69 1.01 0.00 0.00 176.35 175.20 2out s VAL 52 N -2.91 2.83 -0.34 -1.59 1.01 -1.26 -5.00 120.40 113.14 2out s VAL 52 Ca 0.62 -1.67 -0.14 0.00 0.00 0.00 0.00 61.98 60.79 2out s VAL 52 Cb -0.07 -2.75 -0.02 0.00 0.00 0.00 0.00 36.38 33.54 2out s VAL 52 CO 0.41 -0.27 0.28 0.54 0.00 0.00 0.00 175.10 176.06 2out s VAL 53 N 1.16 5.25 -0.15 2.92 0.11 -1.26 -3.61 120.40 124.82 2out s VAL 53 Ca -0.01 -0.09 -0.04 0.00 -2.93 0.00 0.00 61.98 58.91 2out s VAL 53 Cb -0.20 -3.74 -0.03 0.00 -1.53 0.00 0.00 36.38 30.88 2out s VAL 53 CO -0.03 -0.02 -0.03 -1.58 -3.33 0.00 0.00 175.10 170.11 2out s GLN 54 N 1.82 3.66 -0.40 1.54 2.00 -1.07 -4.93 119.66 122.28 2out s GLN 54 Ca 0.08 -0.51 -0.08 0.00 -2.00 0.00 0.00 55.36 52.85 2out s GLN 54 Cb -0.17 -2.92 0.07 0.00 0.80 0.00 0.00 33.01 30.79 2out s GLN 54 CO 0.11 0.26 0.23 0.96 -0.50 0.00 0.00 175.29 176.35 2out s ILE 55 N 0.31 4.09 -0.29 -2.34 -5.25 -1.26 -2.39 121.20 114.06 2out s ILE 55 Ca -0.03 -1.39 0.02 0.00 -0.99 0.00 0.00 60.65 58.26 2out s ILE 55 Cb -0.14 -3.49 0.08 0.00 2.95 0.00 0.00 42.46 41.87 2out s ILE 55 CO 0.03 -0.46 -0.00 -0.89 -1.79 0.00 0.00 174.94 171.83 2out s THR 56 N 1.40 1.89 -0.52 8.37 2.01 -1.26 -5.01 115.64 122.53 2out s THR 56 Ca 0.03 -1.80 0.07 0.00 0.31 0.00 0.00 61.69 60.30 2out s THR 56 Cb -0.22 -2.25 0.30 0.00 0.01 0.00 0.00 72.50 70.34 2out s THR 56 CO 0.02 -0.36 0.77 1.21 -0.69 0.00 0.00 174.62 175.56 2out n GLU 57 N 4.47 2.08 -2.58 4.92 0.00 -1.26 -4.75 120.64 123.52 2out n GLU 57 Ca -0.05 -4.18 -0.02 0.00 0.00 0.00 0.00 57.16 52.91 2out n GLU 57 Cb 0.42 -1.94 0.10 0.00 0.00 0.00 0.00 31.44 30.03 2out n GLU 57 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.13 174.76 2out n THR 58 N 0.48 0.30 -4.54 6.31 5.66 -1.26 -5.09 114.28 116.14 2out n THR 58 Ca 0.28 -1.39 -0.26 0.00 -3.05 0.00 0.00 64.05 59.62 2out n THR 58 Cb 0.48 1.04 -0.08 0.00 -1.55 0.00 0.00 70.33 70.22 2out n THR 58 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 2out s GLY 59 N -1.77 2.68 -0.02 1.09 0.00 -1.26 -5.06 107.32 102.98 2out s GLY 59 Ca 0.13 -1.13 0.14 0.00 0.00 0.00 0.00 44.72 43.86 2out s GLY 59 CO -0.10 -1.86 0.31 -1.26 0.00 0.00 0.00 173.10 170.19 2out n SER 60 N -1.35 1.80 -2.23 1.64 2.88 -1.26 -5.08 113.62 110.02 2out n SER 60 Ca -0.07 -0.01 -0.02 0.00 -1.33 0.00 0.00 58.87 57.44 2out n SER 60 Cb 0.65 1.63 -0.02 0.00 -0.75 0.00 0.00 64.21 65.72 2out n SER 60 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2out n GLN 61 N -1.98 -2.57 -1.27 -1.46 6.02 -1.26 -4.90 117.38 109.96 2out n GLN 61 Ca -0.02 2.17 -0.30 0.00 -0.01 0.00 0.00 57.00 58.84 2out n GLN 61 Cb 0.36 -3.69 0.05 0.00 1.02 0.00 0.00 30.24 27.99 2out n GLN 61 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2out n GLU 62 N 0.76 2.41 0.00 -1.09 1.02 -1.26 -4.84 120.64 117.65 2out n GLU 62 Ca -0.13 -2.74 0.00 0.00 -0.02 0.00 0.00 57.16 54.27 2out n GLU 62 Cb 0.21 -2.08 0.00 0.00 -0.02 0.00 0.00 31.44 29.55 2out n GLU 62 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2out n GLY 63 N -0.39 2.43 0.00 0.62 0.00 -1.26 -5.09 105.19 101.51 2out n GLY 63 Ca 0.51 0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.77 2out n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2out n GLY 64 N 0.00 -2.48 2.53 -0.02 0.00 -1.26 -5.02 105.19 98.95 2out n GLY 64 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 2out n GLY 64 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2out n GLU 65 N -1.27 -4.53 0.00 1.61 -0.58 -1.26 -5.08 120.64 109.53 2out n GLU 65 Ca 0.00 3.41 0.00 0.00 -0.42 0.00 0.00 57.16 60.15 2out n GLU 65 Cb 0.00 -4.91 0.00 0.00 -0.57 0.00 0.00 31.44 25.96 2out n GLU 65 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2out n GLY 66 N 1.66 2.93 3.03 0.62 0.00 -1.26 -5.05 105.19 107.13 2out n GLY 66 Ca -0.38 0.12 -0.24 0.00 0.00 0.00 0.00 46.02 45.52 2out n GLY 66 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2out s LEU 67 N 0.00 1.67 -0.01 0.99 2.01 -1.26 -5.01 118.68 117.07 2out s LEU 67 Ca 0.00 -0.29 0.00 0.00 0.01 0.00 0.00 54.13 53.85 2out s LEU 67 Cb 0.00 -0.81 -0.01 0.00 0.01 0.00 0.00 46.19 45.38 2out s LEU 67 CO 0.00 0.04 -0.01 -0.24 1.01 0.00 0.00 176.35 177.16 2out n SER 68 N 3.72 4.09 -1.13 2.29 2.88 -1.26 -5.15 113.62 119.06 2out n SER 68 Ca -0.22 -0.01 0.14 0.00 -1.33 0.00 0.00 58.87 57.45 2out n SER 68 Cb 0.52 0.09 -0.07 0.00 -0.75 0.00 0.00 64.21 64.00 2out n SER 68 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2out n LYS 69 N -2.43 -2.59 -3.40 -1.46 4.81 -1.26 -4.87 118.16 106.96 2out n LYS 69 Ca -0.02 2.09 -0.38 0.00 -0.87 0.00 0.00 58.31 59.13 2out n LYS 69 Cb 0.52 -3.03 -0.06 0.00 0.02 0.00 0.00 35.03 32.48 2out n LYS 69 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 2out s GLU 70 N -3.84 4.04 0.00 1.64 0.41 -1.26 -5.09 118.70 114.61 2out s GLU 70 Ca 0.00 0.55 0.00 0.00 -0.41 0.00 0.00 54.97 55.11 2out s GLU 70 Cb 0.00 -3.20 0.00 0.00 -1.78 0.00 0.00 34.13 29.15 2out s GLU 70 CO 0.00 0.65 0.00 -2.30 -0.49 0.00 0.00 175.26 173.12 2out n PRO 71 N 1.68 0.30 -1.05 0.39 -0.02 -1.26 -4.88 135.00 130.16 2out n PRO 71 Ca -0.12 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.51 2out n PRO 71 Cb 0.52 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.96 2out n PRO 71 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2out n ALA 72 N -2.81 -2.81 0.00 3.55 0.00 -1.26 -5.01 120.51 112.17 2out n ALA 72 Ca 0.00 0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.77 2out n ALA 72 Cb 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.49 2out n ALA 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2out n GLY 73 N -3.11 -0.84 2.78 0.00 0.00 -1.26 -5.19 105.19 97.58 2out n GLY 73 Ca 0.01 0.08 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 2out n GLY 73 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2out n SER 74 N 0.00 1.96 -0.03 1.61 7.64 -1.26 -5.11 113.62 118.42 2out n SER 74 Ca 0.00 -2.76 -0.03 0.00 1.01 0.00 0.00 58.87 57.09 2out n SER 74 Cb 0.00 0.61 -0.01 0.00 -1.01 0.00 0.00 64.21 63.80 2out n SER 74 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2out n ASP 75 N -1.47 0.82 -4.59 6.43 8.00 -1.26 -4.89 116.55 119.59 2out n ASP 75 Ca -0.10 0.29 -0.41 0.00 0.71 0.00 0.00 54.79 55.28 2out n ASP 75 Cb 0.50 -0.64 -0.07 0.00 -0.02 0.00 0.00 41.12 40.90 2out n ASP 75 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2out s GLU 76 N -1.68 3.82 -0.29 -1.24 -6.30 -1.26 -4.98 118.70 106.76 2out s GLU 76 Ca -0.09 0.21 0.00 0.00 -2.50 0.00 0.00 54.97 52.59 2out s GLU 76 Cb 0.01 -3.76 0.19 0.00 0.00 0.00 0.00 34.13 30.58 2out s GLU 76 CO 0.14 -0.63 0.73 1.14 0.02 0.00 0.00 175.26 176.66 2out s GLN 77 N 2.64 0.43 0.00 4.30 1.03 -1.26 -5.01 119.66 121.79 2out s GLN 77 Ca 0.25 0.44 0.00 0.00 0.04 0.00 0.00 55.36 56.08 2out s GLN 77 Cb -0.15 0.20 0.00 0.00 0.03 0.00 0.00 33.01 33.09 2out s GLN 77 CO 0.13 -0.79 0.00 1.17 -2.54 0.00 0.00 175.29 173.26 2out n LYS 78 N 5.33 0.00 -3.92 9.60 4.81 -1.26 -5.12 118.16 127.60 2out n LYS 78 Ca 0.06 0.00 -0.24 0.00 -0.87 0.00 0.00 58.31 57.26 2out n LYS 78 Cb 0.55 0.00 -0.17 0.00 0.02 0.00 0.00 35.03 35.43 2out n LYS 78 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 2out s GLN 79 N -1.54 1.07 -0.20 1.64 1.11 -1.26 -5.12 119.66 115.36 2out s GLN 79 Ca 0.00 -0.09 -0.11 0.00 0.01 0.00 0.00 55.36 55.17 2out s GLN 79 Cb 0.00 -1.23 0.07 0.00 -1.01 0.00 0.00 33.01 30.84 2out s GLN 79 CO 0.00 -0.24 0.48 -0.48 0.01 0.00 0.00 175.29 175.06 2out s LEU 80 N 1.66 -0.34 0.00 2.90 0.05 -1.26 -5.17 118.68 116.52 2out s LEU 80 Ca 0.02 1.05 0.00 0.00 0.05 0.00 0.00 54.13 55.25 2out s LEU 80 Cb -0.13 1.60 0.00 0.00 -2.05 0.00 0.00 46.19 45.61 2out s LEU 80 CO -0.05 -0.21 0.00 -1.14 -0.55 0.00 0.00 176.35 174.40 2out n ARG 81 N 4.37 0.50 0.00 1.48 3.00 -1.26 -5.04 116.66 119.71 2out n ARG 81 Ca -0.21 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.64 2out n ARG 81 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.02 2out n ARG 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2out n ALA 82 N -3.00 1.99 -0.01 5.13 0.00 -1.26 -4.74 120.51 118.63 2out n ALA 82 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 2out n ALA 82 Cb 0.00 0.43 -0.00 0.00 0.00 0.00 0.00 19.45 19.88 2out n ALA 82 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2out h ASP 83 N 0.00 0.00 -0.98 0.00 3.32 -1.97 -3.38 116.42 113.41 2out h ASP 83 Ca 0.00 0.00 0.23 0.00 0.02 0.00 0.00 57.03 57.28 2out h ASP 83 Cb 0.88 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 40.24 2out h ASP 83 CO 0.00 0.06 -0.13 -0.65 -1.72 0.00 0.00 179.24 176.80 2out h PRO 84 N -0.11 0.00 -7.29 3.56 0.10 -2.02 -3.41 132.00 122.84 2out h PRO 84 Ca 0.00 -0.00 -0.52 0.00 0.10 0.00 0.00 66.00 65.58 2out h PRO 84 Cb 0.01 -0.00 0.16 0.00 0.10 0.00 0.00 31.00 31.27 2out h PRO 84 CO 0.00 0.00 0.28 -2.14 0.10 0.00 0.00 178.00 176.24 2out s PRO 85 N -6.15 1.66 -0.47 1.05 0.02 -1.26 -4.35 135.00 125.49 2out s PRO 85 Ca -0.14 1.38 -0.20 0.00 0.02 0.00 0.00 61.00 62.06 2out s PRO 85 Cb 0.28 -1.81 0.03 0.00 0.02 0.00 0.00 34.50 33.01 2out s PRO 85 CO 0.78 -2.13 0.62 0.43 -0.33 0.00 0.00 177.00 176.37 2out n SER 86 N -3.82 -7.29 0.00 2.53 7.64 -1.26 -4.93 113.62 106.49 2out n SER 86 Ca 0.11 0.29 0.00 0.00 1.01 0.00 0.00 58.87 60.28 2out n SER 86 Cb 0.52 -4.40 0.00 0.00 -1.01 0.00 0.00 64.21 59.32 2out n SER 86 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2out n THR 87 N -0.43 0.00 0.00 0.44 -2.24 -1.26 -5.06 114.28 105.73 2out n THR 87 Ca 0.05 0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.93 2out n THR 87 Cb 0.52 -0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2out n THR 87 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2out n ASP 88 N -1.05 0.00 0.14 3.42 8.00 -1.26 -4.95 116.55 120.84 2out n ASP 88 Ca 0.00 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.52 2out n ASP 88 Cb 0.00 0.00 0.05 0.00 -0.02 0.00 0.00 41.12 41.15 2out n ASP 88 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2out h LEU 89 N 0.00 0.00 -0.66 0.64 5.85 -1.95 -3.32 115.31 115.87 2out h LEU 89 Ca 0.00 0.00 0.14 0.00 0.84 0.00 0.00 57.88 58.86 2out h LEU 89 Cb 0.00 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 40.92 2out h LEU 89 CO 0.00 0.54 0.04 -1.13 -0.34 0.00 0.00 178.44 177.55 2out h ASN 90 N 0.00 -0.22 0.14 1.25 -1.24 -1.92 0.36 115.58 113.94 2out h ASN 90 Ca -0.01 0.16 0.00 0.00 0.71 0.00 0.00 56.30 57.16 2out h ASN 90 Cb 1.36 0.26 0.00 0.00 0.73 0.00 0.00 38.32 40.68 2out h ASN 90 CO 0.07 -0.10 0.00 0.35 -1.29 0.00 0.00 177.43 176.46 2out n THR 91 N -5.26 1.28 0.04 -3.57 -2.24 -1.25 -1.43 114.28 101.85 2out n THR 91 Ca 0.11 0.57 0.09 0.00 -2.27 0.00 0.00 64.05 62.55 2out n THR 91 Cb 0.39 -1.54 -0.09 0.00 -2.10 0.00 0.00 70.33 66.99 2out n THR 91 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2out n PHE 92 N -1.98 0.52 -4.94 4.78 3.01 0.12 -5.06 117.46 113.91 2out n PHE 92 Ca -0.00 0.16 0.00 0.00 1.01 0.00 0.00 57.45 58.61 2out n PHE 92 Cb 0.06 -0.78 0.00 0.00 -0.01 0.00 0.00 39.48 38.75 2out n PHE 92 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 2out n THR 93 N -2.52 0.00 0.03 4.37 -2.24 -0.52 -3.86 114.28 109.53 2out n THR 93 Ca -0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 2out n THR 93 Cb 0.61 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.84 2out n THR 93 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2out n VAL 94 N 0.00 0.60 0.31 2.28 0.31 -1.26 -4.66 118.33 115.91 2out n VAL 94 Ca 0.00 0.20 0.20 0.00 -0.01 0.00 0.00 64.34 64.73 2out n VAL 94 Cb 0.00 -1.53 0.96 0.00 -0.91 0.00 0.00 33.84 32.36 2out n VAL 94 CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 2out h GLU 95 N 0.00 0.00 0.02 5.55 4.11 -2.01 -2.67 114.58 119.59 2out h GLU 95 Ca 0.00 0.00 -0.25 0.00 0.07 0.00 0.00 59.36 59.18 2out h GLU 95 Cb 0.50 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.76 2out h GLU 95 CO 0.00 0.00 -1.04 0.37 0.07 0.00 0.00 179.01 178.41 2out h GLN 96 N 0.00 0.55 0.69 1.06 5.75 -1.85 -2.47 115.11 118.84 2out h GLN 96 Ca 0.00 -0.62 -0.03 0.00 -0.15 0.00 0.00 58.65 57.85 2out h GLN 96 Cb 0.25 0.18 0.01 0.00 1.07 0.00 0.00 27.48 28.99 2out h GLN 96 CO 0.00 1.23 -0.33 -0.07 -2.65 0.00 0.00 178.83 177.01 2out h LEU 97 N 0.29 -0.79 -1.50 -2.39 3.38 -1.58 1.19 115.31 113.92 2out h LEU 97 Ca -0.12 -0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.00 2out h LEU 97 Cb 1.69 0.20 -0.06 0.00 0.09 0.00 0.00 40.66 42.58 2out h LEU 97 CO 0.19 -0.45 0.53 0.07 0.09 0.00 0.00 178.44 178.87 2out h LYS 98 N -1.13 0.48 0.00 1.13 -0.00 -1.65 1.14 116.57 116.54 2out h LYS 98 Ca -0.10 -0.03 -0.09 0.00 -0.00 0.00 0.00 60.65 60.43 2out h LYS 98 Cb 0.74 -0.11 -0.01 0.00 -0.00 0.00 0.00 32.23 32.85 2out h LYS 98 CO 0.16 0.32 -0.81 0.00 -0.00 0.00 0.00 179.45 179.11 2out h ALA 99 N 1.63 0.68 0.17 0.07 0.00 -1.24 -3.28 119.26 117.29 2out h ALA 99 Ca 0.39 -0.43 -0.36 0.00 0.00 0.00 0.00 54.91 54.51 2out h ALA 99 Cb 0.82 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2out h ALA 99 CO -0.14 0.52 -1.82 1.96 0.00 0.00 0.00 179.25 179.76 2out h GLN 100 N 0.00 0.36 -0.30 0.00 1.08 0.33 -3.07 115.11 113.51 2out h GLN 100 Ca -0.05 -0.62 0.05 0.00 -1.45 0.00 0.00 58.65 56.57 2out h GLN 100 Cb 1.33 0.23 -0.04 0.00 -0.05 0.00 0.00 27.48 28.94 2out h GLN 100 CO 0.04 1.29 0.03 -0.07 -0.95 0.00 0.00 178.83 179.18 2out h LEU 101 N 0.10 -0.04 -0.71 1.46 3.38 0.11 1.31 115.31 120.92 2out h LEU 101 Ca -0.37 0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.60 2out h LEU 101 Cb 2.08 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 42.89 2out h LEU 101 CO 0.15 0.01 0.22 0.71 0.09 0.00 0.00 178.44 179.63 2out h THR 102 N 0.13 1.26 -0.00 0.22 1.35 -1.71 0.11 112.91 114.27 2out h THR 102 Ca 0.14 -0.89 0.00 0.00 -0.55 0.00 0.00 66.41 65.11 2out h THR 102 Cb 0.17 0.49 0.00 0.00 -1.73 0.00 0.00 68.15 67.08 2out h THR 102 CO -0.21 0.35 -0.01 -0.62 -0.25 0.00 0.00 175.52 174.78 2out n GLU 103 N -4.29 0.37 0.01 4.72 1.02 -0.70 -3.10 120.64 118.68 2out n GLU 103 Ca 0.05 -0.01 0.11 0.00 -0.02 0.00 0.00 57.16 57.29 2out n GLU 103 Cb 0.23 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 30.05 2out n GLU 103 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 2out n ARG 104 N -1.30 0.35 0.00 3.49 0.63 0.44 -4.97 116.66 115.30 2out n ARG 104 Ca 0.13 -0.07 0.00 0.00 -0.92 0.00 0.00 57.85 56.99 2out n ARG 104 Cb 0.26 -1.55 0.00 0.00 0.45 0.00 0.00 32.46 31.62 2out n ARG 104 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2out n GLY 105 N 1.36 1.32 0.10 5.14 0.00 -0.74 -5.00 105.19 107.37 2out n GLY 105 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2out n GLY 105 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2out n ILE 106 N -1.14 1.48 -2.28 -0.61 -0.00 0.30 -4.96 119.36 112.15 2out n ILE 106 Ca 0.00 -0.82 -0.08 0.00 -0.00 0.00 0.00 62.75 61.86 2out n ILE 106 Cb 0.00 -0.75 -0.01 0.00 -0.00 0.00 0.00 39.64 38.88 2out n ILE 106 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.55 176.90 2out n THR 107 N -2.90 -0.31 -3.47 1.39 -2.24 -1.20 -4.57 114.28 100.98 2out n THR 107 Ca -0.28 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.58 2out n THR 107 Cb 1.11 -1.04 -0.02 0.00 -2.10 0.00 0.00 70.33 68.28 2out n THR 107 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2out n PHE 108 N -2.83 -2.67 -3.75 4.78 3.01 -1.26 -4.97 117.46 109.77 2out n PHE 108 Ca -0.09 0.75 0.03 0.00 1.01 0.00 0.00 57.45 59.15 2out n PHE 108 Cb 0.52 -1.22 0.00 0.00 -0.01 0.00 0.00 39.48 38.77 2out n PHE 108 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 2out s LYS 109 N -0.93 0.25 0.50 -1.08 -0.14 -1.24 -4.87 119.74 112.23 2out s LYS 109 Ca 0.00 -0.15 0.22 0.00 -1.36 0.00 0.00 55.97 54.68 2out s LYS 109 Cb 0.00 0.08 1.30 0.00 -1.68 0.00 0.00 37.83 37.53 2out s LYS 109 CO 0.00 -0.12 1.99 0.37 -0.76 0.00 0.00 175.35 176.83 2out h GLN 110 N 2.00 0.11 0.00 1.68 4.15 -2.00 -1.36 115.11 119.69 2out h GLN 110 Ca -0.28 -0.01 -0.33 0.00 0.77 0.00 0.00 58.65 58.80 2out h GLN 110 Cb 1.19 -0.02 -0.06 0.00 0.21 0.00 0.00 27.48 28.80 2out h GLN 110 CO 0.30 0.07 -2.06 0.45 -1.93 0.00 0.00 178.83 175.66 2out n SER 111 N -4.41 0.42 -3.18 -0.69 2.88 -1.26 -4.49 113.62 102.89 2out n SER 111 Ca 0.10 0.20 -0.36 0.00 -1.33 0.00 0.00 58.87 57.48 2out n SER 111 Cb 0.54 0.50 -0.04 0.00 -0.75 0.00 0.00 64.21 64.46 2out n SER 111 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2out n ALA 112 N -2.65 7.38 0.08 -1.46 0.00 -0.51 -4.43 120.51 118.92 2out n ALA 112 Ca -0.25 -3.39 -0.03 0.00 0.00 0.00 0.00 53.44 49.76 2out n ALA 112 Cb 1.11 -3.20 -0.02 0.00 0.00 0.00 0.00 19.45 17.34 2out n ALA 112 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2out h THR 113 N 2.85 0.00 0.00 0.00 2.02 -1.79 -3.30 112.91 112.69 2out h THR 113 Ca 0.79 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 67.78 2out h THR 113 Cb 0.42 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.83 2out h THR 113 CO 1.59 0.00 0.00 2.29 0.37 0.00 0.00 175.52 179.77 2out n LYS 114 N -3.12 0.00 0.23 6.66 2.85 -1.26 -4.86 118.16 118.66 2out n LYS 114 Ca -0.03 0.00 0.12 0.00 -1.05 0.00 0.00 58.31 57.35 2out n LYS 114 Cb 0.09 -0.01 0.39 0.00 -0.65 0.00 0.00 35.03 34.85 2out n LYS 114 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2out h ALA 115 N 0.00 0.97 0.15 0.58 0.00 -1.93 -2.25 119.26 116.78 2out h ALA 115 Ca 0.00 -0.11 -0.33 0.00 0.00 0.00 0.00 54.91 54.47 2out h ALA 115 Cb 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 2out h ALA 115 CO 0.00 0.15 -1.65 0.93 0.00 0.00 0.00 179.25 178.68 2out h GLU 116 N 0.00 0.31 -0.24 0.00 4.39 -1.91 -3.07 114.58 114.06 2out h GLU 116 Ca -0.00 -0.52 -0.17 0.00 0.34 0.00 0.00 59.36 59.00 2out h GLU 116 Cb 0.82 0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 29.67 2out h GLU 116 CO 0.02 1.19 -0.55 1.37 -1.16 0.00 0.00 179.01 179.88 2out h LEU 117 N 0.08 0.80 -1.17 1.33 8.10 -1.83 0.45 115.31 123.07 2out h LEU 117 Ca -0.29 -0.43 -0.07 0.00 0.11 0.00 0.00 57.88 57.20 2out h LEU 117 Cb 2.05 -0.23 -0.01 0.00 -0.44 0.00 0.00 40.66 42.04 2out h LEU 117 CO 0.16 1.18 -0.33 -0.29 -4.11 0.00 0.00 178.44 175.06 2out h ILE 118 N 0.55 0.89 0.06 0.15 2.10 -1.54 -2.85 117.51 116.87 2out h ILE 118 Ca 0.01 -1.30 -0.30 0.00 1.08 0.00 0.00 64.86 64.35 2out h ILE 118 Cb 1.12 1.78 -0.03 0.00 -1.09 0.00 0.00 36.82 38.61 2out h ILE 118 CO 0.11 0.32 -1.60 0.00 -1.08 0.00 0.00 178.15 175.90 2out h ALA 119 N 1.67 0.50 -0.45 0.18 0.00 -1.42 -3.35 119.26 116.40 2out h ALA 119 Ca -0.00 -1.27 -0.06 0.00 0.00 0.00 0.00 54.91 53.59 2out h ALA 119 Cb 0.75 0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 2out h ALA 119 CO 0.04 1.35 0.05 -0.07 0.00 0.00 0.00 179.25 180.63 2out h LEU 120 N 0.03 0.66 -8.11 0.00 4.07 -0.78 -3.38 115.31 107.81 2out h LEU 120 Ca -0.26 -0.13 -0.13 0.00 0.08 0.00 0.00 57.88 57.44 2out h LEU 120 Cb 1.99 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 43.54 2out h LEU 120 CO 0.12 0.70 0.40 -0.36 -1.08 0.00 0.00 178.44 178.21 2out s PHE 121 N -5.06 1.46 0.08 1.13 0.08 -1.09 -4.86 117.98 109.72 2out s PHE 121 Ca -0.09 1.60 0.03 0.00 0.12 0.00 0.00 56.93 58.59 2out s PHE 121 Cb 0.15 -3.59 -0.03 0.00 -0.57 0.00 0.00 43.02 38.98 2out s PHE 121 CO 0.79 -1.05 -0.09 0.00 -0.10 0.00 0.00 175.22 174.76 2out s ALA 122 N 14.40 0.93 -0.72 5.36 0.00 -1.26 -4.92 121.76 135.55 2out s ALA 122 Ca 0.78 -1.07 -0.25 0.00 0.00 0.00 0.00 51.96 51.42 2out s ALA 122 Cb -0.05 0.04 -0.21 0.00 0.00 0.00 0.00 23.12 22.90 2out s ALA 122 CO 0.13 -0.05 1.87 -0.35 0.00 0.00 0.00 175.76 177.36 2out n PRO 123 N 0.79 0.93 0.00 0.00 -0.04 -1.26 -3.95 135.00 131.47 2out n PRO 123 Ca -0.18 -1.75 0.00 0.00 -0.04 0.00 0.00 63.50 61.53 2out n PRO 123 Cb 0.57 -3.16 0.00 0.00 -0.04 0.00 0.00 33.50 30.87 2out n PRO 123 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2out n ALA 124 N 11.39 2.66 -0.83 0.55 0.00 -1.26 -5.10 120.51 127.91 2out n ALA 124 Ca 0.47 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.61 2out n ALA 124 Cb 0.43 0.16 0.19 0.00 0.00 0.00 0.00 19.45 20.24 2out n ALA 124 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2out s ASP 125 N -4.42 2.23 -0.06 0.00 1.01 -1.25 -4.98 116.67 109.19 2out s ASP 125 Ca 0.00 1.60 -0.25 0.00 0.71 0.00 0.00 52.55 54.61 2out s ASP 125 Cb 0.00 -2.26 -0.24 0.00 1.01 0.00 0.00 42.92 41.43 2out s ASP 125 CO 0.00 -3.44 1.00 1.23 0.21 0.00 0.00 175.17 174.17 2out h GLY 126 N -2.10 0.17 -2.57 0.21 0.00 -1.99 -3.45 103.07 93.34 2out h GLY 126 Ca -0.54 -0.31 -0.54 0.00 0.00 0.00 0.00 47.33 45.94 2out h GLY 126 CO 0.51 0.28 0.56 -0.54 0.00 0.00 0.00 176.54 177.34 2out s GLU 127 N -3.03 3.10 0.20 4.80 2.02 -1.26 -5.03 118.70 119.51 2out s GLU 127 Ca -0.16 2.09 0.06 0.00 0.02 0.00 0.00 54.97 56.98 2out s GLU 127 Cb 0.00 -2.17 -0.04 0.00 0.10 0.00 0.00 34.13 32.03 2out s GLU 127 CO 0.74 -1.18 0.14 0.15 0.02 0.00 0.00 175.26 175.13 2out s LYS 128 N -3.01 2.84 -0.34 1.61 1.02 -1.26 -4.99 119.74 115.61 2out s LYS 128 Ca 0.73 -0.98 -0.28 0.00 0.02 0.00 0.00 55.97 55.46 2out s LYS 128 Cb -0.37 -2.57 -0.02 0.00 -0.52 0.00 0.00 37.83 34.35 2out s LYS 128 CO 0.43 0.45 1.85 0.45 -0.92 0.00 0.00 175.35 177.60 2out s SER 129 N -3.39 5.79 0.04 2.83 0.15 -1.26 -4.86 113.70 113.00 2out s SER 129 Ca 0.31 1.29 -0.16 0.00 0.70 0.00 0.00 55.95 58.09 2out s SER 129 Cb -0.09 -2.52 -0.25 0.00 -1.71 0.00 0.00 66.02 61.45 2out s SER 129 CO 0.23 -1.80 1.13 -0.08 1.20 0.00 0.00 173.24 173.93 2out h GLU 130 N 13.32 0.58 0.00 5.44 4.22 -1.99 -3.56 114.58 132.59 2out h GLU 130 Ca -0.34 -0.67 0.00 0.00 0.08 0.00 0.00 59.36 58.44 2out h GLU 130 Cb 1.18 0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.63 2out h GLU 130 CO 1.04 1.27 0.00 0.00 -2.18 0.00 0.00 179.01 179.14