#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2out s SER 2 N 0.00 1.94 0.00 1.61 0.15 -1.26 -4.93 113.70 111.21 2out s SER 2 Ca 0.00 -2.33 0.00 0.00 0.70 0.00 0.00 55.95 54.32 2out s SER 2 Cb 0.00 -0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.19 2out s SER 2 CO 0.00 -0.24 0.00 1.57 1.20 0.00 0.00 173.24 175.77 2out n HIS 3 N 3.65 0.00 -0.41 3.44 -0.00 -1.26 -5.16 115.22 115.49 2out n HIS 3 Ca 0.18 0.00 0.01 0.00 -0.00 0.00 0.00 57.72 57.91 2out n HIS 3 Cb 0.43 0.00 -0.01 0.00 -0.00 0.00 0.00 29.99 30.41 2out n HIS 3 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.34 176.22 2out n MET 4 N -1.31 -1.04 -1.68 1.57 0.00 -1.26 -5.02 117.12 108.38 2out n MET 4 Ca 0.00 0.82 -0.17 0.00 -0.00 0.00 0.00 57.70 58.35 2out n MET 4 Cb 0.22 -1.06 0.10 0.00 0.00 0.00 0.00 33.22 32.47 2out n MET 4 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 175.97 175.57 2out n ASP 5 N -2.06 0.61 0.00 6.12 5.68 -1.26 -5.00 116.55 120.64 2out n ASP 5 Ca -0.01 -1.60 0.00 0.00 -0.50 0.00 0.00 54.79 52.68 2out n ASP 5 Cb 0.15 -0.51 0.00 0.00 -1.14 0.00 0.00 41.12 39.61 2out n ASP 5 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 2out n LYS 6 N -2.44 0.00 -4.81 0.11 0.00 -1.26 -5.14 118.16 104.62 2out n LYS 6 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 58.31 58.10 2out n LYS 6 Cb 0.39 0.00 -0.13 0.00 0.00 0.00 0.00 35.03 35.29 2out n LYS 6 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2out s THR 7 N -1.02 3.06 -0.03 3.15 -4.23 -1.26 -4.45 115.64 110.86 2out s THR 7 Ca 0.00 -0.82 -0.07 0.00 -1.18 0.00 0.00 61.69 59.62 2out s THR 7 Cb 0.00 -2.23 0.01 0.00 1.34 0.00 0.00 72.50 71.62 2out s THR 7 CO 0.00 0.52 0.16 0.72 -0.54 0.00 0.00 174.62 175.48 2out s PHE 8 N -0.80 -0.06 -0.20 3.99 -0.12 -1.18 -4.81 117.98 114.80 2out s PHE 8 Ca 0.13 0.13 -0.14 0.00 -0.05 0.00 0.00 56.93 57.00 2out s PHE 8 Cb -0.11 0.00 -0.04 0.00 -0.63 0.00 0.00 43.02 42.24 2out s PHE 8 CO 0.02 -0.21 0.31 0.00 -0.05 0.00 0.00 175.22 175.29 2out s VAL 10 N 1.04 3.84 -0.03 0.00 0.11 -1.00 -3.44 120.40 120.92 2out s VAL 10 Ca 0.16 -1.11 0.01 0.00 -2.93 0.00 0.00 61.98 58.10 2out s VAL 10 Cb -0.14 -2.84 0.02 0.00 -1.53 0.00 0.00 36.38 31.89 2out s VAL 10 CO 0.06 0.08 -0.01 0.54 -3.33 0.00 0.00 175.10 172.44 2out s VAL 11 N -1.35 0.27 -0.49 2.04 0.11 -1.22 0.38 120.40 120.13 2out s VAL 11 Ca 0.25 0.01 -0.17 0.00 -2.93 0.00 0.00 61.98 59.15 2out s VAL 11 Cb -0.11 -0.33 0.08 0.00 -1.53 0.00 0.00 36.38 34.48 2out s VAL 11 CO 0.17 0.15 0.47 0.68 -3.33 0.00 0.00 175.10 173.25 2out s VAL 12 N 0.85 5.13 -0.41 2.04 -7.23 -0.87 -3.78 120.40 116.12 2out s VAL 12 Ca -0.09 -0.96 -0.11 0.00 -1.81 0.00 0.00 61.98 59.01 2out s VAL 12 Cb -0.12 -4.20 0.06 0.00 0.56 0.00 0.00 36.38 32.67 2out s VAL 12 CO -0.01 -0.68 0.27 -1.58 -0.31 0.00 0.00 175.10 172.79 2out s GLN 13 N 1.92 2.75 0.04 4.82 0.74 -1.25 -3.15 119.66 125.54 2out s GLN 13 Ca 0.07 -1.31 0.05 0.00 0.05 0.00 0.00 55.36 54.22 2out s GLN 13 Cb -0.24 -3.83 -0.02 0.00 1.10 0.00 0.00 33.01 30.02 2out s GLN 13 CO 0.08 -0.88 -0.14 -0.80 -0.55 0.00 0.00 175.29 172.99 2out s ASN 14 N 2.02 1.65 -0.40 6.67 0.02 -0.61 -4.54 114.94 119.74 2out s ASN 14 Ca 0.03 -0.48 0.02 0.00 -1.02 0.00 0.00 52.86 51.41 2out s ASN 14 Cb -0.22 -0.09 0.16 0.00 0.02 0.00 0.00 41.25 41.11 2out s ASN 14 CO 0.05 0.01 0.29 0.00 0.02 0.00 0.00 177.10 177.47 2out s ARG 15 N -1.24 0.86 0.14 -0.60 3.03 -1.26 -2.78 118.95 117.09 2out s ARG 15 Ca 0.01 -1.86 0.00 0.00 2.03 0.00 0.00 55.73 55.91 2out s ARG 15 Cb -0.08 -1.51 0.00 0.00 -1.03 0.00 0.00 34.95 32.33 2out s ARG 15 CO 0.01 -1.30 0.00 -0.89 -1.13 0.00 0.00 175.30 171.99 2out n ILE 16 N 3.30 0.70 0.00 4.99 5.41 -1.26 -5.11 119.36 127.40 2out n ILE 16 Ca 0.21 0.23 0.00 0.00 1.00 0.00 0.00 62.75 64.20 2out n ILE 16 Cb 0.42 -1.15 0.00 0.00 -0.71 0.00 0.00 39.64 38.20 2out n ILE 16 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2out n LYS 17 N -3.33 0.00 0.00 0.38 5.02 -1.26 -5.08 118.16 113.89 2out n LYS 17 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2out n LYS 17 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2out n LYS 17 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 2out n GLU 18 N -0.69 0.00 -2.45 1.97 0.28 -1.26 -4.97 120.64 113.51 2out n GLU 18 Ca 0.00 0.00 -0.19 0.00 -0.16 0.00 0.00 57.16 56.81 2out n GLU 18 Cb 0.00 0.00 0.02 0.00 1.43 0.00 0.00 31.44 32.89 2out n GLU 18 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2out n GLY 19 N 0.00 4.61 2.01 -1.84 0.00 -1.25 -3.29 105.19 105.43 2out n GLY 19 Ca 0.00 -2.22 -0.15 0.00 0.00 0.00 0.00 46.02 43.66 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 -0.46 2.61 -2.23 1.61 9.36 -1.26 -4.97 117.16 121.82 2out n TYR 20 Ca 0.30 -1.56 0.15 0.00 3.32 0.00 0.00 57.90 60.11 2out n TYR 20 Cb 0.78 -0.80 -0.04 0.00 -0.63 0.00 0.00 39.34 38.66 2out n TYR 20 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2out n ARG 21 N -0.76 -2.29 0.00 2.98 5.12 -1.26 -4.90 116.66 115.55 2out n ARG 21 Ca 0.49 1.51 0.00 0.00 -1.93 0.00 0.00 57.85 57.92 2out n ARG 21 Cb 1.49 -2.79 0.00 0.00 -1.16 0.00 0.00 32.46 30.00 2out n ARG 21 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 2out n ARG 22 N -3.76 0.00 -0.07 5.56 0.00 -1.24 -4.45 116.66 112.69 2out n ARG 22 Ca 0.01 0.00 -0.22 0.00 -0.00 0.00 0.00 57.85 57.64 2out n ARG 22 Cb 0.52 0.00 -0.13 0.00 0.00 0.00 0.00 32.46 32.85 2out n ARG 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2out n ALA 23 N -1.20 1.05 0.00 5.13 0.00 -1.26 -4.91 120.51 119.32 2out n ALA 23 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 53.44 52.67 2out n ALA 23 Cb 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 19.45 19.04 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 1.87 0.00 0.00 0.00 0.00 -1.26 -5.13 105.19 100.67 2out n GLY 24 Ca -0.38 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.64 2out n GLY 24 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2out n PHE 25 N 0.00 -0.01 -3.34 1.61 -1.74 -1.26 -4.97 117.46 107.74 2out n PHE 25 Ca 0.00 0.00 -0.44 0.00 -0.56 0.00 0.00 57.45 56.45 2out n PHE 25 Cb 0.00 0.00 -0.01 0.00 1.52 0.00 0.00 39.48 40.99 2out n PHE 25 CO 0.00 0.00 0.00 0.43 -0.56 0.00 0.00 176.76 176.63 2out n SER 26 N -0.01 5.44 -4.82 5.98 7.64 -1.26 -3.72 113.62 122.87 2out n SER 26 Ca 0.00 -3.09 -0.33 0.00 1.01 0.00 0.00 58.87 56.46 2out n SER 26 Cb 0.00 -1.32 -0.05 0.00 -1.01 0.00 0.00 64.21 61.82 2out n SER 26 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 2out s PHE 27 N -1.47 3.26 -0.38 1.43 5.36 -1.26 -4.92 117.98 120.00 2out s PHE 27 Ca 0.31 1.57 -0.00 0.00 -0.96 0.00 0.00 56.93 57.85 2out s PHE 27 Cb -0.08 -2.89 0.33 0.00 -0.34 0.00 0.00 43.02 40.04 2out s PHE 27 CO -0.07 -0.35 1.88 0.72 -1.46 0.00 0.00 175.22 175.95 2out n HIS 28 N -0.94 2.02 0.00 10.12 8.25 -1.21 -3.93 115.22 129.53 2out n HIS 28 Ca 0.07 -1.99 0.00 0.00 -0.26 0.00 0.00 57.72 55.55 2out n HIS 28 Cb 0.54 -0.97 0.00 0.00 1.12 0.00 0.00 29.99 30.67 2out n HIS 28 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2out n LEU 29 N -0.20 0.00 0.00 2.41 4.32 -1.26 -4.79 117.00 117.48 2out n LEU 29 Ca 0.39 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.38 2out n LEU 29 Cb 0.81 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.61 2out n LEU 29 CO 0.47 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 177.25 2out n GLY 30 N 0.00 1.52 2.73 -0.72 0.00 -1.12 -4.43 105.19 103.18 2out n GLY 30 Ca 0.00 -0.16 -0.24 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.61 1.90 -0.12 1.61 1.47 -1.24 -1.57 116.67 115.10 2out s ASP 31 Ca 0.00 -0.28 0.03 0.00 1.18 0.00 0.00 52.55 53.48 2out s ASP 31 Cb 0.00 -0.41 0.00 0.00 -0.34 0.00 0.00 42.92 42.17 2out s ASP 31 CO 0.00 -0.24 -0.22 0.21 0.68 0.00 0.00 175.17 175.60 2out s ASN 32 N 1.99 3.18 0.21 2.11 3.84 -1.19 -4.93 114.94 120.16 2out s ASN 32 Ca 0.03 -0.56 -0.18 0.00 0.21 0.00 0.00 52.86 52.37 2out s ASN 32 Cb -0.14 -1.44 -0.08 0.00 -0.55 0.00 0.00 41.25 39.04 2out s ASN 32 CO -0.06 0.12 0.68 -0.94 -2.79 0.00 0.00 177.10 174.11 2out s SER 33 N 0.57 6.96 -0.03 -4.21 1.04 -1.26 -2.06 113.70 114.71 2out s SER 33 Ca -0.13 1.31 0.02 0.00 0.48 0.00 0.00 55.95 57.64 2out s SER 33 Cb -0.17 -2.38 -0.03 0.00 0.10 0.00 0.00 66.02 63.54 2out s SER 33 CO 0.04 0.03 -0.08 -0.22 0.98 0.00 0.00 173.24 173.98 2out s LEU 34 N -2.08 3.11 0.69 2.42 1.98 1.20 -4.91 118.68 121.09 2out s LEU 34 Ca 0.43 -0.10 -0.14 0.00 -2.89 0.00 0.00 54.13 51.43 2out s LEU 34 Cb -0.16 -1.72 0.01 0.00 0.66 0.00 0.00 46.19 44.98 2out s LEU 34 CO 0.20 0.33 1.09 0.00 -1.89 0.00 0.00 176.35 176.08 2out s ALA 35 N -0.88 2.46 -0.24 5.97 0.00 -1.26 -2.38 121.76 125.42 2out s ALA 35 Ca 0.14 0.42 -0.29 0.00 0.00 0.00 0.00 51.96 52.23 2out s ALA 35 Cb -0.11 -3.28 -0.02 0.00 0.00 0.00 0.00 23.12 19.70 2out s ALA 35 CO 0.04 -1.35 1.60 0.00 0.00 0.00 0.00 175.76 176.04 2out s ALA 36 N -2.56 3.23 0.03 0.00 0.00 -1.24 -4.40 121.76 116.83 2out s ALA 36 Ca 0.64 0.39 0.00 0.00 0.00 0.00 0.00 51.96 53.00 2out s ALA 36 Cb -0.19 -3.86 -0.00 0.00 0.00 0.00 0.00 23.12 19.07 2out s ALA 36 CO 0.46 -2.01 0.01 1.33 0.00 0.00 0.00 175.76 175.55 2out n VAL 37 N 6.51 0.00 0.00 0.00 0.24 -1.18 -4.64 118.33 119.26 2out n VAL 37 Ca 0.19 -0.20 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 2out n VAL 37 Cb 0.46 0.08 0.00 0.00 -1.47 0.00 0.00 33.84 32.90 2out n VAL 37 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 2out n SER 38 N -2.13 0.00 0.00 -1.34 2.88 -1.26 -3.11 113.62 108.66 2out n SER 38 Ca -0.00 0.76 0.00 0.00 -1.33 0.00 0.00 58.87 58.30 2out n SER 38 Cb 0.05 -0.43 0.00 0.00 -0.75 0.00 0.00 64.21 63.08 2out n SER 38 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2out n GLU 39 N -1.79 0.00 -0.37 -1.46 2.13 -1.26 -4.80 120.64 113.09 2out n GLU 39 Ca 0.00 0.00 0.31 0.00 0.66 0.00 0.00 57.16 58.13 2out n GLU 39 Cb 0.00 0.00 0.57 0.00 0.27 0.00 0.00 31.44 32.28 2out n GLU 39 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 2out h SER 40 N 0.00 0.37 -0.81 4.31 4.64 -1.98 0.46 113.55 120.53 2out h SER 40 Ca 0.00 0.18 0.03 0.00 -0.47 0.00 0.00 61.79 61.54 2out h SER 40 Cb 0.00 0.16 -0.05 0.00 -0.31 0.00 0.00 62.40 62.20 2out h SER 40 CO 0.00 -0.21 0.52 0.06 -0.87 0.00 0.00 176.83 176.32 2out h GLN 41 N 0.16 0.98 -0.01 4.77 -0.00 -1.94 1.20 115.11 120.26 2out h GLN 41 Ca 0.79 -0.06 -0.12 0.00 -0.00 0.00 0.00 58.65 59.26 2out h GLN 41 Cb 2.14 -0.22 -0.02 0.00 -0.00 0.00 0.00 27.48 29.38 2out h GLN 41 CO -0.56 0.65 -0.58 1.25 -0.00 0.00 0.00 178.83 179.59 2out h LEU 42 N 1.00 0.03 0.00 0.06 5.85 -0.49 -2.65 115.31 119.11 2out h LEU 42 Ca 0.33 -0.02 -0.23 0.00 0.84 0.00 0.00 57.88 58.80 2out h LEU 42 Cb 0.02 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 2out h LEU 42 CO -0.12 0.60 -1.50 0.00 -0.34 0.00 0.00 178.44 177.08 2out h ALA 43 N 1.40 0.70 -0.12 1.25 0.00 -0.91 -2.69 119.26 118.89 2out h ALA 43 Ca -0.01 -1.13 -0.05 0.00 0.00 0.00 0.00 54.91 53.72 2out h ALA 43 Cb 1.03 0.35 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 2out h ALA 43 CO 0.08 1.24 -0.12 1.96 0.00 0.00 0.00 179.25 182.41 2out h GLN 44 N 0.00 0.29 0.03 0.00 1.08 0.15 0.30 115.11 116.95 2out h GLN 44 Ca -0.21 -0.15 -0.22 0.00 -1.45 0.00 0.00 58.65 56.62 2out h GLN 44 Cb 1.79 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 29.21 2out h GLN 44 CO 0.07 0.69 -1.01 -0.07 -0.95 0.00 0.00 178.83 177.56 2out h LEU 45 N -0.11 0.14 0.00 1.46 3.38 -1.64 -3.22 115.31 115.33 2out h LEU 45 Ca 0.02 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2out h LEU 45 Cb 0.64 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2out h LEU 45 CO 0.03 1.06 -0.26 0.50 0.09 0.00 0.00 178.44 179.86 2out h LYS 46 N 0.03 0.00 -1.01 1.13 3.64 -1.51 -3.34 116.57 115.51 2out h LYS 46 Ca -0.04 0.00 0.25 0.00 -1.27 0.00 0.00 60.65 59.59 2out h LYS 46 Cb 1.73 0.00 -0.12 0.00 -0.41 0.00 0.00 32.23 33.43 2out h LYS 46 CO 0.14 0.00 0.61 0.00 -2.27 0.00 0.00 179.45 177.93 2out h ALA 47 N 2.43 1.86 -4.38 5.00 0.00 -0.40 -3.40 119.26 120.37 2out h ALA 47 Ca 0.00 0.12 -0.67 0.00 0.00 0.00 0.00 54.91 54.35 2out h ALA 47 Cb 0.79 0.02 -0.28 0.00 0.00 0.00 0.00 17.79 18.32 2out h ALA 47 CO 0.00 -0.33 -0.88 0.34 0.00 0.00 0.00 179.25 178.39 2out s ASP 48 N -5.20 2.97 -0.27 0.00 2.15 -1.25 -5.04 116.67 110.02 2out s ASP 48 Ca -0.10 -0.52 -0.05 0.00 0.43 0.00 0.00 52.55 52.30 2out s ASP 48 Cb 0.27 -0.29 -0.13 0.00 -0.30 0.00 0.00 42.92 42.47 2out s ASP 48 CO 0.80 0.26 3.26 -0.81 -0.17 0.00 0.00 175.17 178.51 2out n PRO 49 N 2.07 2.29 -0.13 4.34 -0.04 -1.26 -4.27 135.00 137.99 2out n PRO 49 Ca -0.16 -1.60 -0.28 0.00 -0.04 0.00 0.00 63.50 61.41 2out n PRO 49 Cb 0.52 -2.10 -0.10 0.00 -0.04 0.00 0.00 33.50 31.77 2out n PRO 49 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2out n ARG 50 N 1.94 0.59 -2.32 0.54 3.00 -1.26 -5.05 116.66 114.09 2out n ARG 50 Ca 0.47 0.32 -0.04 0.00 -0.01 0.00 0.00 57.85 58.60 2out n ARG 50 Cb 0.74 -1.55 -0.01 0.00 0.00 0.00 0.00 32.46 31.64 2out n ARG 50 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2out n LEU 51 N -4.26 0.00 -4.59 0.55 7.99 -1.26 -5.09 117.00 110.33 2out n LEU 51 Ca -0.50 -0.40 -0.33 0.00 -0.01 0.00 0.00 56.01 54.77 2out n LEU 51 Cb 0.85 0.09 -0.11 0.00 -0.11 0.00 0.00 43.42 44.14 2out n LEU 51 CO 0.07 -0.06 -0.38 0.68 -1.51 0.00 0.00 177.39 176.19 2out s VAL 52 N -1.48 3.68 -0.13 4.08 -7.23 -1.26 -4.94 120.40 113.11 2out s VAL 52 Ca 0.01 -0.69 -0.01 0.00 -1.81 0.00 0.00 61.98 59.48 2out s VAL 52 Cb 0.00 -2.57 0.03 0.00 0.56 0.00 0.00 36.38 34.40 2out s VAL 52 CO 0.01 0.45 -0.04 0.54 -0.31 0.00 0.00 175.10 175.75 2out s VAL 53 N -0.95 0.83 -0.04 1.32 0.11 -1.26 -3.74 120.40 116.67 2out s VAL 53 Ca 0.16 -0.31 0.04 0.00 -2.93 0.00 0.00 61.98 58.94 2out s VAL 53 Cb -0.11 -0.98 -0.00 0.00 -1.53 0.00 0.00 36.38 33.76 2out s VAL 53 CO 0.06 0.21 -0.15 -1.10 -3.33 0.00 0.00 175.10 170.79 2out s GLN 54 N 1.77 1.61 -0.25 1.54 -0.21 -1.25 -4.95 119.66 117.93 2out s GLN 54 Ca 0.03 -0.53 -0.21 0.00 0.02 0.00 0.00 55.36 54.67 2out s GLN 54 Cb -0.14 -1.41 -0.02 0.00 1.00 0.00 0.00 33.01 32.45 2out s GLN 54 CO -0.07 0.20 0.67 0.96 -2.12 0.00 0.00 175.29 174.93 2out s ILE 55 N 0.11 4.96 -0.30 1.08 -4.36 -1.26 -3.43 121.20 118.00 2out s ILE 55 Ca -0.04 1.23 0.03 0.00 -0.26 0.00 0.00 60.65 61.60 2out s ILE 55 Cb -0.11 -3.97 0.08 0.00 1.25 0.00 0.00 42.46 39.71 2out s ILE 55 CO 0.02 0.02 -0.01 0.42 0.24 0.00 0.00 174.94 175.63 2out s THR 56 N 2.51 1.98 -0.01 8.37 -4.23 -1.22 -5.01 115.64 118.03 2out s THR 56 Ca 0.28 -1.85 -0.14 0.00 -1.18 0.00 0.00 61.69 58.80 2out s THR 56 Cb -0.15 -2.31 -0.08 0.00 1.34 0.00 0.00 72.50 71.30 2out s THR 56 CO 0.08 -0.36 0.75 -0.08 -0.54 0.00 0.00 174.62 174.48 2out h GLU 57 N 7.76 -0.48 -5.39 3.99 4.81 -1.94 -3.39 114.58 119.94 2out h GLU 57 Ca -0.12 0.03 -0.63 0.00 -0.13 0.00 0.00 59.36 58.52 2out h GLU 57 Cb 1.03 0.11 -0.14 0.00 0.63 0.00 0.00 28.75 30.38 2out h GLU 57 CO 0.48 -0.32 -0.55 0.95 -0.73 0.00 0.00 179.01 178.84 2out s THR 58 N -3.34 4.87 0.00 0.32 -4.23 -1.26 -4.74 115.64 107.26 2out s THR 58 Ca -0.07 -0.01 0.00 0.00 -1.18 0.00 0.00 61.69 60.43 2out s THR 58 Cb 0.01 -3.17 0.00 0.00 1.34 0.00 0.00 72.50 70.67 2out s THR 58 CO 0.22 0.49 0.00 0.61 -0.54 0.00 0.00 174.62 175.40 2out n GLY 59 N 3.21 0.80 3.01 3.99 0.00 -1.26 -5.14 105.19 109.80 2out n GLY 59 Ca -0.17 -0.06 -0.20 0.00 0.00 0.00 0.00 46.02 45.59 2out n GLY 59 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2out s SER 60 N 0.00 1.16 0.96 1.61 1.04 -1.26 -5.15 113.70 112.06 2out s SER 60 Ca 0.00 -0.18 -0.11 0.00 0.48 0.00 0.00 55.95 56.14 2out s SER 60 Cb 0.00 -0.23 0.17 0.00 0.10 0.00 0.00 66.02 66.06 2out s SER 60 CO 0.00 0.09 1.09 -1.58 0.98 0.00 0.00 173.24 173.82 2out s GLN 61 N -0.00 0.72 0.31 4.02 2.00 -1.26 -5.07 119.66 120.38 2out s GLN 61 Ca 0.00 1.06 0.03 0.00 -2.00 0.00 0.00 55.36 54.45 2out s GLN 61 Cb -0.06 -1.73 -0.02 0.00 0.80 0.00 0.00 33.01 32.00 2out s GLN 61 CO 0.00 -2.68 0.31 -1.21 -0.50 0.00 0.00 175.29 171.21 2out s GLU 62 N -4.73 1.69 0.00 1.67 2.02 -1.26 -4.68 118.70 113.41 2out s GLU 62 Ca 0.65 -1.87 0.00 0.00 0.02 0.00 0.00 54.97 53.78 2out s GLU 62 Cb -0.21 0.35 0.00 0.00 0.10 0.00 0.00 34.13 34.37 2out s GLU 62 CO 0.59 -0.64 0.00 0.41 0.02 0.00 0.00 175.26 175.64 2out n GLY 63 N -0.54 4.67 0.00 -1.39 0.00 -1.26 -5.11 105.19 101.56 2out n GLY 63 Ca 0.05 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.01 2.86 -0.02 0.00 -1.26 -5.07 105.19 101.69 2out n GLY 64 Ca 0.00 0.12 -0.18 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.12 -0.23 -3.53 1.61 -0.58 -1.26 -4.89 120.64 111.65 2out n GLU 65 Ca 0.00 -1.86 -0.23 0.00 -0.42 0.00 0.00 57.16 54.64 2out n GLU 65 Cb 0.00 -0.64 -0.14 0.00 -0.57 0.00 0.00 31.44 30.08 2out n GLU 65 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 2out s GLY 66 N -4.62 0.22 -0.16 0.62 0.00 -1.26 -4.99 107.32 97.14 2out s GLY 66 Ca 0.51 -0.35 0.15 0.00 0.00 0.00 0.00 44.72 45.02 2out s GLY 66 CO 0.34 2.07 1.20 1.04 0.00 0.00 0.00 173.10 177.76 2out n LEU 67 N 5.29 2.37 -3.69 0.66 7.99 -1.26 -5.00 117.00 123.35 2out n LEU 67 Ca -0.06 -3.46 -0.17 0.00 -0.01 0.00 0.00 56.01 52.31 2out n LEU 67 Cb 0.47 -0.37 -0.16 0.00 -0.11 0.00 0.00 43.42 43.24 2out n LEU 67 CO 0.07 1.21 -0.28 -0.44 -1.51 0.00 0.00 177.39 176.44 2out s SER 68 N -2.96 0.64 -0.72 -1.43 0.01 -1.26 -5.10 113.70 102.88 2out s SER 68 Ca 0.37 0.22 -0.27 0.00 1.31 0.00 0.00 55.95 57.59 2out s SER 68 Cb 0.38 0.10 0.02 0.00 0.21 0.00 0.00 66.02 66.73 2out s SER 68 CO -0.09 -0.22 1.46 -0.75 0.41 0.00 0.00 173.24 174.05 2out s LYS 69 N 1.93 3.04 -0.33 12.44 2.20 -1.26 -4.83 119.74 132.94 2out s LYS 69 Ca 0.00 -0.05 -0.08 0.00 -0.36 0.00 0.00 55.97 55.48 2out s LYS 69 Cb -0.12 -4.31 0.19 0.00 -1.51 0.00 0.00 37.83 32.08 2out s LYS 69 CO -0.05 -2.33 1.00 -2.00 -0.36 0.00 0.00 175.35 171.61 2out s GLU 70 N 6.08 0.24 -0.49 4.03 -6.30 -1.26 -5.12 118.70 115.89 2out s GLU 70 Ca 0.45 -0.04 -0.27 0.00 -2.50 0.00 0.00 54.97 52.61 2out s GLU 70 Cb -0.09 0.04 -0.03 0.00 0.00 0.00 0.00 34.13 34.05 2out s GLU 70 CO 0.15 -0.36 1.91 -1.25 0.02 0.00 0.00 175.26 175.72 2out s PRO 71 N 2.11 2.83 0.00 4.30 0.04 -1.26 -4.64 135.00 138.37 2out s PRO 71 Ca 0.16 1.02 0.00 0.00 0.04 0.00 0.00 61.00 62.22 2out s PRO 71 Cb 0.01 -4.34 0.00 0.00 0.04 0.00 0.00 34.50 30.21 2out s PRO 71 CO -0.15 -2.47 0.00 0.00 0.04 0.00 0.00 177.00 174.41 2out n ALA 72 N 12.22 2.61 -3.00 8.56 0.00 -1.26 -5.16 120.51 134.48 2out n ALA 72 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.67 2out n ALA 72 Cb 0.50 0.19 0.00 0.00 0.00 0.00 0.00 19.45 20.14 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 2.14 1.97 2.12 0.00 0.00 -1.26 -5.16 105.19 104.99 2out n GLY 73 Ca 0.00 -0.52 0.17 0.00 0.00 0.00 0.00 46.02 45.67 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 -8.08 -4.79 1.61 7.64 -1.26 -4.90 113.62 103.84 2out n SER 74 Ca 0.00 1.33 -0.22 0.00 1.01 0.00 0.00 58.87 60.99 2out n SER 74 Cb 0.00 -3.75 -0.05 0.00 -1.01 0.00 0.00 64.21 59.41 2out n SER 74 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2out s ASP 75 N -6.67 5.15 0.68 6.43 1.11 -1.26 -5.12 116.67 116.99 2out s ASP 75 Ca 0.00 -0.47 0.04 0.00 0.18 0.00 0.00 52.55 52.30 2out s ASP 75 Cb 0.00 -1.07 0.13 0.00 1.07 0.00 0.00 42.92 43.04 2out s ASP 75 CO 0.00 -0.17 0.94 -0.70 1.18 0.00 0.00 175.17 176.42 2out s GLU 76 N -3.86 1.82 -0.79 8.23 2.12 -1.26 -4.91 118.70 120.05 2out s GLU 76 Ca 0.36 -1.44 -0.26 0.00 0.36 0.00 0.00 54.97 53.99 2out s GLU 76 Cb -0.06 -2.46 0.00 0.00 0.26 0.00 0.00 34.13 31.88 2out s GLU 76 CO 0.24 -1.30 1.62 -1.14 -0.54 0.00 0.00 175.26 174.13 2out s GLN 77 N -4.98 2.98 -1.98 4.30 -0.44 -1.26 -3.52 119.66 114.75 2out s GLN 77 Ca 0.66 -0.18 0.00 0.00 -2.50 0.00 0.00 55.36 53.34 2out s GLN 77 Cb -0.05 -4.66 0.00 0.00 -1.64 0.00 0.00 33.01 26.67 2out s GLN 77 CO 0.43 -2.58 0.00 1.17 0.50 0.00 0.00 175.29 174.81 2out n LYS 78 N 9.12 -1.53 -1.73 1.67 4.81 -1.26 -4.45 118.16 124.79 2out n LYS 78 Ca 0.22 1.11 0.00 0.00 -0.87 0.00 0.00 58.31 58.77 2out n LYS 78 Cb 0.50 -5.62 0.00 0.00 0.02 0.00 0.00 35.03 29.93 2out n LYS 78 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 2out n GLN 79 N -2.68 -4.75 -4.11 1.64 -0.06 -1.23 -4.97 117.38 101.22 2out n GLN 79 Ca -0.22 3.42 -0.35 0.00 -2.00 0.00 0.00 57.00 57.85 2out n GLN 79 Cb 0.68 -3.72 -0.09 0.00 -4.06 0.00 0.00 30.24 23.05 2out n GLN 79 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 2out s LEU 80 N -1.46 3.90 -0.11 1.69 1.43 -1.26 -4.95 118.68 117.91 2out s LEU 80 Ca 0.00 0.22 0.04 0.00 -1.03 0.00 0.00 54.13 53.36 2out s LEU 80 Cb 0.00 -1.94 0.14 0.00 0.03 0.00 0.00 46.19 44.42 2out s LEU 80 CO 0.00 0.32 0.84 0.54 0.23 0.00 0.00 176.35 178.28 2out n ARG 81 N 2.55 0.46 -1.14 1.70 1.74 -1.26 -4.99 116.66 115.71 2out n ARG 81 Ca -0.18 -0.42 0.04 0.00 -0.77 0.00 0.00 57.85 56.52 2out n ARG 81 Cb 0.54 0.17 0.06 0.00 -1.02 0.00 0.00 32.46 32.20 2out n ARG 81 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2out n ALA 82 N -0.52 2.59 -0.10 7.54 0.00 -1.26 -4.86 120.51 123.89 2out n ALA 82 Ca -0.06 -2.40 -0.18 0.00 0.00 0.00 0.00 53.44 50.79 2out n ALA 82 Cb 0.62 -0.62 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 2out n ALA 82 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2out n ASP 83 N 0.03 1.85 -4.62 0.00 2.03 -1.26 -4.85 116.55 109.74 2out n ASP 83 Ca 0.08 0.46 -0.43 0.00 0.52 0.00 0.00 54.79 55.43 2out n ASP 83 Cb 0.98 -0.93 -0.02 0.00 -0.72 0.00 0.00 41.12 40.43 2out n ASP 83 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 2out s PRO 84 N -2.35 3.86 -0.85 -0.67 0.02 -1.26 -4.92 135.00 128.83 2out s PRO 84 Ca -0.26 1.06 -0.21 0.00 0.02 0.00 0.00 61.00 61.61 2out s PRO 84 Cb 0.06 -3.88 -0.21 0.00 0.02 0.00 0.00 34.50 30.49 2out s PRO 84 CO 0.50 -1.19 2.35 -2.30 -0.33 0.00 0.00 177.00 176.03 2out n PRO 85 N 7.43 0.37 -4.26 5.54 -0.02 -1.26 -4.87 135.00 137.93 2out n PRO 85 Ca 0.14 -0.39 -0.17 0.00 -2.02 0.00 0.00 63.50 61.06 2out n PRO 85 Cb 0.47 -2.56 -0.11 0.00 -0.02 0.00 0.00 33.50 31.29 2out n PRO 85 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2out s SER 86 N 7.17 2.05 -0.30 2.55 1.04 -1.26 -5.15 113.70 119.81 2out s SER 86 Ca 1.11 -0.90 -0.17 0.00 0.48 0.00 0.00 55.95 56.47 2out s SER 86 Cb -0.48 -0.07 0.21 0.00 0.10 0.00 0.00 66.02 65.78 2out s SER 86 CO 0.31 -0.20 1.28 0.28 0.98 0.00 0.00 173.24 175.89 2out s THR 87 N -2.60 0.00 0.30 2.02 -1.32 -1.26 -5.09 115.64 107.70 2out s THR 87 Ca 0.13 0.00 -0.03 0.00 -1.21 0.00 0.00 61.69 60.58 2out s THR 87 Cb -0.02 -1.00 0.01 0.00 -1.51 0.00 0.00 72.50 69.98 2out s THR 87 CO 0.03 0.00 0.45 0.47 -2.21 0.00 0.00 174.62 173.36 2out n ASP 88 N 2.91 -1.27 0.00 8.08 8.00 -1.26 -4.87 116.55 128.15 2out n ASP 88 Ca -0.16 -2.57 0.00 0.00 0.71 0.00 0.00 54.79 52.77 2out n ASP 88 Cb 0.56 2.32 0.00 0.00 -0.02 0.00 0.00 41.12 43.98 2out n ASP 88 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2out n LEU 89 N 0.00 0.08 -0.29 0.64 7.94 -1.26 -4.65 117.00 119.46 2out n LEU 89 Ca -0.01 0.01 0.33 0.00 -1.11 0.00 0.00 56.01 55.24 2out n LEU 89 Cb 0.50 -0.02 0.73 0.00 0.53 0.00 0.00 43.42 45.16 2out n LEU 89 CO 0.24 -0.08 1.30 -1.13 -1.11 0.00 0.00 177.39 176.62 2out h ASN 90 N 0.00 0.03 0.13 1.96 -1.24 -1.95 0.28 115.58 114.79 2out h ASN 90 Ca 0.00 0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.02 2out h ASN 90 Cb 0.89 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.94 2out h ASN 90 CO 0.00 0.00 0.00 1.07 -1.29 0.00 0.00 177.43 177.21 2out n THR 91 N -4.23 1.28 -4.17 -3.57 5.66 -1.26 -4.66 114.28 103.33 2out n THR 91 Ca 0.24 0.57 -0.22 0.00 -3.05 0.00 0.00 64.05 61.58 2out n THR 91 Cb 1.16 -1.54 -0.05 0.00 -1.55 0.00 0.00 70.33 68.35 2out n THR 91 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 2out s PHE 92 N -3.33 2.98 0.00 1.09 0.08 0.99 -5.05 117.98 114.75 2out s PHE 92 Ca -0.00 -0.14 0.00 0.00 0.12 0.00 0.00 56.93 56.91 2out s PHE 92 Cb 0.05 -1.34 0.00 0.00 -0.57 0.00 0.00 43.02 41.16 2out s PHE 92 CO 0.17 0.55 0.00 2.41 -0.10 0.00 0.00 175.22 178.25 2out n THR 93 N -1.07 0.00 0.04 0.64 -1.04 -1.26 -5.04 114.28 106.55 2out n THR 93 Ca -0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 2out n THR 93 Cb 0.58 -0.01 0.00 0.00 -1.82 0.00 0.00 70.33 69.08 2out n THR 93 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2out n VAL 94 N 0.00 0.02 0.27 12.58 0.31 -1.26 -4.80 118.33 125.44 2out n VAL 94 Ca 0.00 0.01 0.16 0.00 -0.01 0.00 0.00 64.34 64.49 2out n VAL 94 Cb 0.00 -0.55 0.55 0.00 -0.91 0.00 0.00 33.84 32.93 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 0.16 5.55 4.11 -2.00 -3.12 114.58 119.28 2out h GLU 95 Ca 0.00 0.00 -0.30 0.00 0.07 0.00 0.00 59.36 59.13 2out h GLU 95 Cb 0.03 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.30 2out h GLU 95 CO 0.00 0.00 -1.35 1.96 0.07 0.00 0.00 179.01 179.69 2out h GLN 96 N 0.00 0.34 0.71 1.06 4.20 -1.97 -2.90 115.11 116.55 2out h GLN 96 Ca 0.00 -0.58 -0.03 0.00 0.06 0.00 0.00 58.65 58.09 2out h GLN 96 Cb 0.63 0.22 0.01 0.00 0.30 0.00 0.00 27.48 28.64 2out h GLN 96 CO 0.00 1.27 -0.34 -0.07 -0.67 0.00 0.00 178.83 179.02 2out h LEU 97 N 0.09 -0.81 -1.64 1.46 3.38 -1.85 0.71 115.31 116.65 2out h LEU 97 Ca -0.18 0.00 0.13 0.00 0.09 0.00 0.00 57.88 57.92 2out h LEU 97 Cb 2.03 0.21 -0.04 0.00 0.09 0.00 0.00 40.66 42.95 2out h LEU 97 CO 0.22 -0.48 0.46 0.07 0.09 0.00 0.00 178.44 178.79 2out h LYS 98 N -1.12 0.36 0.00 1.13 2.10 -1.69 0.95 116.57 118.31 2out h LYS 98 Ca -0.10 -0.02 -0.05 0.00 -2.00 0.00 0.00 60.65 58.48 2out h LYS 98 Cb 0.76 -0.08 -0.01 0.00 -0.90 0.00 0.00 32.23 32.00 2out h LYS 98 CO 0.16 0.24 -0.65 0.00 -2.00 0.00 0.00 179.45 177.20 2out h ALA 99 N 1.67 0.72 0.11 0.07 0.00 -1.30 -3.27 119.26 117.27 2out h ALA 99 Ca 0.33 -0.24 -0.33 0.00 0.00 0.00 0.00 54.91 54.67 2out h ALA 99 Cb 0.76 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2out h ALA 99 CO -0.09 0.28 -1.73 1.96 0.00 0.00 0.00 179.25 179.67 2out h GLN 100 N 0.00 0.24 -0.16 0.00 4.20 0.28 -3.01 115.11 116.66 2out h GLN 100 Ca -0.03 -0.41 0.01 0.00 0.06 0.00 0.00 58.65 58.28 2out h GLN 100 Cb 1.18 0.15 -0.01 0.00 0.30 0.00 0.00 27.48 29.10 2out h GLN 100 CO 0.02 1.08 0.08 -0.07 -0.67 0.00 0.00 178.83 179.28 2out h LEU 101 N 0.07 0.13 -0.72 1.46 3.38 0.70 1.01 115.31 121.34 2out h LEU 101 Ca -0.32 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.55 2out h LEU 101 Cb 2.04 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 42.75 2out h LEU 101 CO 0.13 0.10 -0.19 0.71 0.09 0.00 0.00 178.44 179.28 2out h THR 102 N 0.18 1.27 -0.00 0.22 1.35 -1.60 0.57 112.91 114.89 2out h THR 102 Ca 0.06 -1.29 0.00 0.00 -0.55 0.00 0.00 66.41 64.63 2out h THR 102 Cb 0.01 1.16 0.00 0.00 -1.73 0.00 0.00 68.15 67.58 2out h THR 102 CO -0.04 0.43 -0.07 1.21 -0.25 0.00 0.00 175.52 176.81 2out n GLU 103 N -4.13 0.39 -0.01 4.72 2.13 -0.96 -3.22 120.64 119.57 2out n GLU 103 Ca 0.00 -0.07 0.10 0.00 0.66 0.00 0.00 57.16 57.86 2out n GLU 103 Cb 0.41 -1.50 -0.15 0.00 0.27 0.00 0.00 31.44 30.48 2out n GLU 103 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 2out n ARG 104 N -1.24 0.36 0.00 5.31 0.63 0.35 -4.97 116.66 117.09 2out n ARG 104 Ca 0.12 -0.10 0.00 0.00 -0.92 0.00 0.00 57.85 56.95 2out n ARG 104 Cb 0.28 -1.51 0.00 0.00 0.45 0.00 0.00 32.46 31.68 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 1.38 0.97 3.06 5.14 0.00 -0.70 -5.05 105.19 109.98 2out n GLY 105 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.44 3.25 -2.64 -0.61 5.41 0.19 -4.99 119.36 119.53 2out n ILE 106 Ca 0.00 -5.21 -0.42 0.00 1.00 0.00 0.00 62.75 58.12 2out n ILE 106 Cb 0.00 -2.34 -0.03 0.00 -0.71 0.00 0.00 39.64 36.56 2out n ILE 106 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 2out s THR 107 N -1.60 4.08 0.97 1.39 -1.32 -1.26 -3.55 115.64 114.36 2out s THR 107 Ca 0.29 -0.83 -0.15 0.00 -1.21 0.00 0.00 61.69 59.79 2out s THR 107 Cb -0.04 -4.98 0.23 0.00 -1.51 0.00 0.00 72.50 66.19 2out s THR 107 CO -0.10 -1.83 0.51 2.22 -2.21 0.00 0.00 174.62 173.21 2out n PHE 108 N 8.41 -2.83 0.02 9.09 1.16 -1.26 -5.01 117.46 127.05 2out n PHE 108 Ca 0.28 -0.35 0.00 0.00 -1.87 0.00 0.00 57.45 55.51 2out n PHE 108 Cb 0.50 -1.01 0.00 0.00 -1.61 0.00 0.00 39.48 37.37 2out n PHE 108 CO 0.00 0.00 0.00 1.63 -1.87 0.00 0.00 176.76 176.52 2out n LYS 109 N -3.20 0.00 -0.95 3.97 5.02 -1.26 -5.00 118.16 116.73 2out n LYS 109 Ca 0.08 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.32 2out n LYS 109 Cb 0.36 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.31 2out n LYS 109 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2out n GLN 110 N -2.61 0.03 -0.02 1.97 6.02 -1.26 -4.96 117.38 116.55 2out n GLN 110 Ca 0.00 -0.83 -0.03 0.00 -0.01 0.00 0.00 57.00 56.14 2out n GLN 110 Cb 0.00 0.50 -0.02 0.00 1.02 0.00 0.00 30.24 31.73 2out n GLN 110 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2out n SER 111 N -0.03 3.80 -4.30 1.08 2.88 -1.26 -4.92 113.62 110.86 2out n SER 111 Ca -0.23 -0.02 -0.45 0.00 -1.33 0.00 0.00 58.87 56.84 2out n SER 111 Cb 0.62 0.10 -0.05 0.00 -0.75 0.00 0.00 64.21 64.13 2out n SER 111 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2out s ALA 112 N -2.08 3.62 0.00 -1.46 0.00 -1.26 -4.91 121.76 115.66 2out s ALA 112 Ca -0.05 -2.55 0.00 0.00 0.00 0.00 0.00 51.96 49.36 2out s ALA 112 Cb 0.01 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.92 2out s ALA 112 CO 0.11 -2.01 0.00 0.25 0.00 0.00 0.00 175.76 174.11 2out n THR 113 N 5.18 0.00 0.00 0.00 -2.24 -1.26 -4.71 114.28 111.25 2out n THR 113 Ca -0.13 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 2out n THR 113 Cb 0.40 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 2out n THR 113 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 2out n LYS 114 N -0.50 0.00 0.16 -0.78 2.85 -1.26 -4.71 118.16 113.91 2out n LYS 114 Ca 0.00 0.00 0.06 0.00 -1.05 0.00 0.00 58.31 57.32 2out n LYS 114 Cb 0.00 -0.42 0.07 0.00 -0.65 0.00 0.00 35.03 34.02 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 0.77 0.13 0.58 0.00 -1.98 -2.60 119.26 116.16 2out h ALA 115 Ca 0.00 -0.30 -0.32 0.00 0.00 0.00 0.00 54.91 54.28 2out h ALA 115 Cb 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2out h ALA 115 CO 0.00 0.40 -1.66 0.93 0.00 0.00 0.00 179.25 178.92 2out h GLU 116 N 0.00 0.27 0.00 0.00 5.08 -1.91 -2.95 114.58 115.07 2out h GLU 116 Ca -0.01 -0.46 -0.06 0.00 -1.00 0.00 0.00 59.36 57.83 2out h GLU 116 Cb 1.25 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.66 2out h GLU 116 CO 0.04 1.13 -0.36 1.37 -1.00 0.00 0.00 179.01 180.19 2out h LEU 117 N 0.07 0.00 0.00 1.33 -0.00 -1.84 0.76 115.31 115.63 2out h LEU 117 Ca -0.29 0.00 -0.20 0.00 -0.00 0.00 0.00 57.88 57.39 2out h LEU 117 Cb 2.04 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 42.67 2out h LEU 117 CO 0.15 0.27 -1.15 -0.29 -0.00 0.00 0.00 178.44 177.42 2out h ILE 118 N 0.00 1.09 0.05 0.15 -0.00 -1.60 -3.33 117.51 113.87 2out h ILE 118 Ca -0.01 -2.72 -0.30 0.00 -0.00 0.00 0.00 64.86 61.83 2out h ILE 118 Cb 1.21 2.50 -0.03 0.00 -0.00 0.00 0.00 36.82 40.50 2out h ILE 118 CO 0.03 0.62 -1.64 0.00 -0.00 0.00 0.00 178.15 177.17 2out h ALA 119 N 1.19 0.55 -0.49 0.18 0.00 -1.52 -3.37 119.26 115.79 2out h ALA 119 Ca -0.11 -1.31 0.10 0.00 0.00 0.00 0.00 54.91 53.60 2out h ALA 119 Cb 1.71 0.40 -0.10 0.00 0.00 0.00 0.00 17.79 19.81 2out h ALA 119 CO 0.09 1.39 -0.19 1.25 0.00 0.00 0.00 179.25 181.80 2out h LEU 120 N 0.03 -0.65 -8.13 0.00 7.12 -0.95 -3.33 115.31 109.39 2out h LEU 120 Ca -0.27 0.17 -0.01 0.00 0.13 0.00 0.00 57.88 57.90 2out h LEU 120 Cb 1.99 0.38 -0.00 0.00 -0.53 0.00 0.00 40.66 42.49 2out h LEU 120 CO 0.11 -0.22 0.12 0.49 -0.13 0.00 0.00 178.44 178.81 2out n PHE 121 N -5.39 0.88 -3.82 1.25 3.72 -1.25 -4.80 117.46 108.04 2out n PHE 121 Ca 0.04 -0.11 -0.09 0.00 -0.05 0.00 0.00 57.45 57.24 2out n PHE 121 Cb 0.30 -2.42 -0.07 0.00 -0.94 0.00 0.00 39.48 36.35 2out n PHE 121 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2out s ALA 122 N 15.29 -0.35 0.25 4.37 0.00 -1.25 -4.46 121.76 135.59 2out s ALA 122 Ca 0.80 -0.52 -0.03 0.00 0.00 0.00 0.00 51.96 52.21 2out s ALA 122 Cb -0.09 0.55 0.43 0.00 0.00 0.00 0.00 23.12 24.01 2out s ALA 122 CO 0.16 -0.54 1.80 -1.35 0.00 0.00 0.00 175.76 175.83 2out h PRO 123 N 2.66 0.75 -0.45 0.00 0.11 -1.88 -3.42 132.00 129.77 2out h PRO 123 Ca -0.34 -0.05 0.22 0.00 0.11 0.00 0.00 66.00 65.95 2out h PRO 123 Cb 1.21 -0.17 -0.22 0.00 0.11 0.00 0.00 31.00 31.93 2out h PRO 123 CO 0.54 0.50 0.15 0.00 -0.21 0.00 0.00 178.00 178.97 2out s ALA 124 N -6.02 -3.26 -0.41 -0.75 0.00 -1.26 -5.04 121.76 105.03 2out s ALA 124 Ca -0.12 1.57 0.05 0.00 0.00 0.00 0.00 51.96 53.46 2out s ALA 124 Cb 0.20 -2.40 0.54 0.00 0.00 0.00 0.00 23.12 21.46 2out s ALA 124 CO 0.78 -1.35 1.69 -3.47 0.00 0.00 0.00 175.76 173.41 2out n ASP 125 N 5.35 4.11 0.00 0.00 2.03 -1.26 -5.07 116.55 121.70 2out n ASP 125 Ca -0.07 -3.73 0.00 0.00 0.52 0.00 0.00 54.79 51.51 2out n ASP 125 Cb 0.53 -0.74 0.00 0.00 -0.72 0.00 0.00 41.12 40.20 2out n ASP 125 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2out n GLY 126 N -1.05 -1.39 2.70 0.27 0.00 -1.26 -5.05 105.19 99.41 2out n GLY 126 Ca 0.48 -1.39 -0.02 0.00 0.00 0.00 0.00 46.02 45.09 2out n GLY 126 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2out n GLU 127 N 0.00 -3.16 -2.92 1.61 2.13 -1.26 -4.90 120.64 112.15 2out n GLU 127 Ca 0.00 2.58 -0.44 0.00 0.66 0.00 0.00 57.16 59.97 2out n GLU 127 Cb 0.00 -5.32 0.00 0.00 0.27 0.00 0.00 31.44 26.39 2out n GLU 127 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2out n LYS 128 N 0.46 3.84 -3.99 5.31 4.81 -1.26 -4.99 118.16 122.35 2out n LYS 128 Ca 0.03 -4.15 -0.27 0.00 -0.87 0.00 0.00 58.31 53.04 2out n LYS 128 Cb 0.10 -2.72 -0.02 0.00 0.02 0.00 0.00 35.03 32.42 2out n LYS 128 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 2out s SER 129 N 0.47 4.58 -1.76 3.14 0.01 -1.26 -4.66 113.70 114.22 2out s SER 129 Ca 0.35 -1.27 -0.00 0.00 1.31 0.00 0.00 55.95 56.34 2out s SER 129 Cb 0.01 0.37 0.00 0.00 0.21 0.00 0.00 66.02 66.61 2out s SER 129 CO 0.02 -1.04 0.02 -0.62 0.41 0.00 0.00 173.24 172.02 2out n GLU 130 N -1.68 -1.81 0.00 12.44 1.02 -1.26 -5.28 120.64 124.07 2out n GLU 130 Ca -0.03 1.00 0.00 0.00 -0.02 0.00 0.00 57.16 58.10 2out n GLU 130 Cb 0.64 -5.67 0.00 0.00 -0.02 0.00 0.00 31.44 26.40 2out n GLU 130 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31