#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ycp s VAL 17 N 0.00 5.21 -1.26 1.39 1.01 -1.24 -4.08 120.40 121.43 1ycp s VAL 17 Ca 0.00 0.80 0.00 0.00 0.00 0.00 0.00 61.98 62.78 1ycp s VAL 17 Cb 0.00 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.63 1ycp s VAL 17 CO 0.00 0.31 0.00 -0.62 0.00 0.00 0.00 175.10 174.79 1ycp n GLU 18 N 3.95 -1.10 -4.97 2.72 -0.58 -1.26 -5.02 120.64 114.38 1ycp n GLU 18 Ca -0.08 0.74 -0.28 0.00 -0.42 0.00 0.00 57.16 57.12 1ycp n GLU 18 Cb 0.51 -4.99 -0.16 0.00 -0.57 0.00 0.00 31.44 26.23 1ycp n GLU 18 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1ycp s GLY 19 N -2.46 1.03 0.90 0.62 0.00 -1.26 -5.14 107.32 101.01 1ycp s GLY 19 Ca 0.00 -0.81 -0.12 0.00 0.00 0.00 0.00 44.72 43.79 1ycp s GLY 19 CO 0.00 -0.47 1.11 -0.86 0.00 0.00 0.00 173.10 172.88 1ycp s GLN 20 N -0.07 1.24 0.22 2.90 -2.07 -1.26 -4.98 119.66 115.64 1ycp s GLN 20 Ca -0.03 0.52 -0.31 0.00 -1.82 0.00 0.00 55.36 53.73 1ycp s GLN 20 Cb -0.12 -1.83 -0.10 0.00 -1.09 0.00 0.00 33.01 29.87 1ycp s GLN 20 CO 0.02 -2.18 1.52 -0.51 -1.32 0.00 0.00 175.29 172.83 1ycp s ASP 21 N -3.76 6.57 0.62 12.60 1.11 -1.26 -4.98 116.67 127.57 1ycp s ASP 21 Ca 0.63 2.70 -0.15 0.00 0.18 0.00 0.00 52.55 55.91 1ycp s ASP 21 Cb -0.16 -2.61 -0.02 0.00 1.07 0.00 0.00 42.92 41.19 1ycp s ASP 21 CO 0.55 -0.79 1.07 0.00 1.18 0.00 0.00 175.17 177.18 1ycp s ALA 22 N 0.47 2.67 0.30 5.23 0.00 -1.26 -5.04 121.76 124.13 1ycp s ALA 22 Ca 0.65 0.37 -0.18 0.00 0.00 0.00 0.00 51.96 52.80 1ycp s ALA 22 Cb -0.44 -3.24 -0.09 0.00 0.00 0.00 0.00 23.12 19.35 1ycp s ALA 22 CO 0.39 -0.96 0.77 -1.21 0.00 0.00 0.00 175.76 174.74 1ycp s GLU 23 N -4.22 4.15 0.06 0.00 2.02 -1.26 -4.98 118.70 114.47 1ycp s GLU 23 Ca 0.63 0.83 -0.31 0.00 0.02 0.00 0.00 54.97 56.15 1ycp s GLU 23 Cb -0.16 -2.58 -0.08 0.00 0.10 0.00 0.00 34.13 31.40 1ycp s GLU 23 CO 0.40 0.23 1.66 0.08 0.02 0.00 0.00 175.26 177.66 1ycp s VAL 24 N -1.82 3.06 0.00 2.63 1.01 -1.26 -2.46 120.40 121.56 1ycp s VAL 24 Ca 0.51 0.48 0.00 0.00 0.00 0.00 0.00 61.98 62.97 1ycp s VAL 24 Cb -0.13 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 32.94 1ycp s VAL 24 CO 0.19 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.89 1ycp n GLY 25 N 4.02 0.77 0.26 4.51 0.00 -1.26 -4.93 105.19 108.56 1ycp n GLY 25 Ca 0.16 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.15 1ycp n GLY 25 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ycp h LEU 26 N 0.00 0.60 -6.90 0.99 6.46 -1.87 -3.36 115.31 111.22 1ycp h LEU 26 Ca 0.00 -0.16 -0.61 0.00 -0.12 0.00 0.00 57.88 56.99 1ycp h LEU 26 Cb 0.00 -0.16 -0.40 0.00 -0.73 0.00 0.00 40.66 39.37 1ycp h LEU 26 CO 0.00 0.74 -0.74 -0.55 -0.62 0.00 0.00 178.44 177.28 1ycp s SER 27 N -6.74 3.54 0.43 1.25 0.15 -1.26 -4.96 113.70 106.10 1ycp s SER 27 Ca -0.08 -3.11 0.23 0.00 0.70 0.00 0.00 55.95 53.69 1ycp s SER 27 Cb 0.14 -1.11 0.54 0.00 -1.71 0.00 0.00 66.02 63.88 1ycp s SER 27 CO 0.79 -0.19 1.67 1.55 1.20 0.00 0.00 173.24 178.27 1ycp h PRO 28 N 6.07 0.00 -0.33 5.44 0.13 -1.81 -3.18 132.00 138.33 1ycp h PRO 28 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1ycp h PRO 28 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1ycp h PRO 28 CO 0.54 0.13 0.00 -2.67 -0.23 0.00 0.00 178.00 175.77 1ycp n TRP 29 N -3.16 0.43 -2.70 1.56 2.14 -0.84 -2.60 117.44 112.28 1ycp n TRP 29 Ca 0.03 -0.22 -0.43 0.00 2.07 0.00 0.00 57.50 58.95 1ycp n TRP 29 Cb 0.52 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.99 1ycp n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1ycp s GLN 30 N -1.57 3.63 0.08 -2.67 2.00 -1.20 -1.05 119.66 118.87 1ycp s GLN 30 Ca 0.30 0.37 0.01 0.00 -2.00 0.00 0.00 55.36 54.03 1ycp s GLN 30 Cb 0.16 -3.92 -0.04 0.00 0.80 0.00 0.00 33.01 30.01 1ycp s GLN 30 CO 0.22 -1.33 0.20 0.08 -0.50 0.00 0.00 175.29 173.96 1ycp s VAL 31 N 4.17 5.23 -0.15 1.34 1.01 -0.67 -4.32 120.40 127.01 1ycp s VAL 31 Ca 0.43 -0.50 -0.02 0.00 0.00 0.00 0.00 61.98 61.90 1ycp s VAL 31 Cb -0.08 -3.57 -0.01 0.00 0.00 0.00 0.00 36.38 32.72 1ycp s VAL 31 CO 0.29 0.11 -0.10 -0.32 0.00 0.00 0.00 175.10 175.08 1ycp s MET 32 N -2.59 3.43 -0.45 2.72 1.75 -0.38 -2.68 119.30 121.10 1ycp s MET 32 Ca 0.34 -0.65 -0.18 0.00 -1.25 0.00 0.00 55.69 53.95 1ycp s MET 32 Cb -0.13 -2.76 0.04 0.00 2.84 0.00 0.00 34.83 34.82 1ycp s MET 32 CO 0.27 0.13 0.53 -0.51 -0.65 0.00 0.00 175.02 174.78 1ycp s LEU 33 N 0.60 4.88 0.31 4.11 1.43 -0.81 -1.85 118.68 127.36 1ycp s LEU 33 Ca -0.06 -0.73 0.09 0.00 -1.03 0.00 0.00 54.13 52.39 1ycp s LEU 33 Cb -0.15 -2.45 -0.04 0.00 0.03 0.00 0.00 46.19 43.57 1ycp s LEU 33 CO 0.03 -0.72 0.09 0.12 0.23 0.00 0.00 176.35 176.10 1ycp s PHE 34 N 2.37 2.71 -0.04 0.29 5.36 -0.74 -0.01 117.98 127.93 1ycp s PHE 34 Ca 0.14 -0.32 0.06 0.00 -0.96 0.00 0.00 56.93 55.85 1ycp s PHE 34 Cb -0.18 -1.47 -0.02 0.00 -0.34 0.00 0.00 43.02 41.01 1ycp s PHE 34 CO 0.14 0.45 -0.21 0.50 -1.46 0.00 0.00 175.22 174.64 1ycp s ARG 35 N -3.78 2.33 -0.07 10.12 3.52 0.14 -1.82 118.95 129.39 1ycp s ARG 35 Ca 0.35 -0.83 -0.13 0.00 -0.13 0.00 0.00 55.73 55.00 1ycp s ARG 35 Cb -0.04 -2.20 -0.09 0.00 -1.56 0.00 0.00 34.95 31.06 1ycp s ARG 35 CO 0.22 0.57 0.51 0.87 -0.81 0.00 0.00 175.30 176.65 1ycp h LYS 36 N 5.49 -0.26 -2.56 5.12 1.57 -1.89 -2.96 116.57 121.08 1ycp h LYS 36 Ca -0.43 0.02 -0.37 0.00 -1.87 0.00 0.00 60.65 57.99 1ycp h LYS 36 Cb 1.14 0.06 -0.37 0.00 0.08 0.00 0.00 32.23 33.14 1ycp h LYS 36 CO 0.49 -0.03 -0.67 0.45 -0.57 0.00 0.00 179.45 179.12 1ycp s SER 36 N -5.32 1.90 0.84 0.86 0.15 -1.26 -3.24 113.70 107.62 1ycp s SER 36 Ca -0.07 -0.55 -0.12 0.00 0.70 0.00 0.00 55.95 55.91 1ycp s SER 36 Cb 0.00 0.21 0.09 0.00 -1.71 0.00 0.00 66.02 64.62 1ycp s SER 36 CO 0.25 -0.36 1.13 -2.84 1.20 0.00 0.00 173.24 172.62 1ycp s PRO 37 N 2.27 1.75 0.38 5.44 0.02 -1.26 -5.08 135.00 138.53 1ycp s PRO 37 Ca 0.07 0.35 -0.25 0.00 0.02 0.00 0.00 61.00 61.19 1ycp s PRO 37 Cb -0.15 -1.90 -0.09 0.00 0.02 0.00 0.00 34.50 32.37 1ycp s PRO 37 CO -0.20 -1.79 1.05 -0.65 -0.33 0.00 0.00 177.00 175.08 1ycp s GLN 38 N -5.33 4.24 -0.30 5.54 -0.21 -1.20 -4.56 119.66 117.84 1ycp s GLN 38 Ca 0.62 1.52 -0.17 0.00 0.02 0.00 0.00 55.36 57.35 1ycp s GLN 38 Cb -0.13 -2.62 0.21 0.00 1.00 0.00 0.00 33.01 31.47 1ycp s GLN 38 CO 0.52 -0.08 1.29 -2.00 -2.12 0.00 0.00 175.29 172.91 1ycp s GLU 39 N -2.37 0.03 -0.53 2.91 2.12 -1.12 -4.87 118.70 114.88 1ycp s GLU 39 Ca 0.56 0.06 -0.28 0.00 0.36 0.00 0.00 54.97 55.66 1ycp s GLU 39 Cb -0.23 0.01 0.02 0.00 0.26 0.00 0.00 34.13 34.19 1ycp s GLU 39 CO 0.28 -0.01 1.28 -1.17 -0.54 0.00 0.00 175.26 175.10 1ycp s LEU 40 N 0.94 3.49 -0.05 2.70 0.20 -1.26 0.26 118.68 124.95 1ycp s LEU 40 Ca -0.07 0.32 -0.01 0.00 0.69 0.00 0.00 54.13 55.07 1ycp s LEU 40 Cb -0.02 -3.26 -0.00 0.00 -0.43 0.00 0.00 46.19 42.48 1ycp s LEU 40 CO -0.10 -1.50 -0.02 -0.07 -0.29 0.00 0.00 176.35 174.37 1ycp h LEU 41 N 12.18 0.00 0.00 -0.68 3.38 -0.77 -3.49 115.31 125.93 1ycp h LEU 41 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1ycp h LEU 41 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1ycp h LEU 41 CO 1.16 0.28 0.00 0.00 0.09 0.00 0.00 178.44 179.97 1ycp s GLY 43 N 0.00 1.38 0.37 0.00 0.00 -1.26 -1.92 107.32 105.89 1ycp s GLY 43 Ca 0.00 -1.66 -0.15 0.00 0.00 0.00 0.00 44.72 42.91 1ycp s GLY 43 CO 0.00 -1.66 0.74 0.00 0.00 0.00 0.00 173.10 172.18 1ycp s ALA 44 N -3.31 -0.60 0.02 3.20 0.00 -1.09 -4.59 121.76 115.40 1ycp s ALA 44 Ca 0.23 -0.80 0.03 0.00 0.00 0.00 0.00 51.96 51.42 1ycp s ALA 44 Cb 0.04 0.75 -0.02 0.00 0.00 0.00 0.00 23.12 23.89 1ycp s ALA 44 CO 0.06 -0.97 -0.09 -1.54 0.00 0.00 0.00 175.76 173.22 1ycp s SER 45 N -3.08 1.09 -0.27 0.00 1.04 0.50 -1.68 113.70 111.31 1ycp s SER 45 Ca 0.17 -0.36 -0.26 0.00 0.48 0.00 0.00 55.95 55.97 1ycp s SER 45 Cb -0.05 -0.05 0.00 0.00 0.10 0.00 0.00 66.02 66.02 1ycp s SER 45 CO 0.12 -0.02 0.91 -0.76 0.98 0.00 0.00 173.24 174.46 1ycp s LEU 46 N -0.92 4.06 0.00 2.42 1.43 -0.22 0.02 118.68 125.47 1ycp s LEU 46 Ca -0.02 1.03 0.18 0.00 -1.03 0.00 0.00 54.13 54.29 1ycp s LEU 46 Cb -0.07 -3.30 0.01 0.00 0.03 0.00 0.00 46.19 42.86 1ycp s LEU 46 CO 0.00 -0.63 0.92 2.30 0.23 0.00 0.00 176.35 179.18 1ycp n ILE 47 N 5.43 0.00 -2.57 -0.59 -5.35 -0.31 -2.78 119.36 113.19 1ycp n ILE 47 Ca 0.08 -0.33 0.00 0.00 -0.27 0.00 0.00 62.75 62.23 1ycp n ILE 47 Cb 0.47 1.22 0.00 0.00 -1.74 0.00 0.00 39.64 39.59 1ycp n ILE 47 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1ycp n SER 48 N -0.00 0.00 -0.67 7.28 3.41 -1.21 -4.74 113.62 117.69 1ycp n SER 48 Ca 0.08 -0.24 0.12 0.00 -0.26 0.00 0.00 58.87 58.57 1ycp n SER 48 Cb 0.38 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.50 1ycp n SER 48 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1ycp n ASP 49 N -0.16 2.25 -0.02 4.04 5.75 -1.26 -4.40 116.55 122.75 1ycp n ASP 49 Ca 0.00 -1.65 -0.02 0.00 -0.01 0.00 0.00 54.79 53.10 1ycp n ASP 49 Cb 0.00 0.16 -0.02 0.00 -1.03 0.00 0.00 41.12 40.23 1ycp n ASP 49 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 1ycp n ARG 50 N 0.53 0.08 -3.79 0.11 0.63 -1.26 0.37 116.66 113.34 1ycp n ARG 50 Ca 0.13 0.02 -0.37 0.00 -0.92 0.00 0.00 57.85 56.72 1ycp n ARG 50 Cb 0.49 -1.06 -0.07 0.00 0.45 0.00 0.00 32.46 32.28 1ycp n ARG 50 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 1ycp s TRP 51 N -2.07 3.56 -0.01 -0.14 0.52 -1.26 -0.36 118.94 119.18 1ycp s TRP 51 Ca -0.05 0.53 0.07 0.00 0.02 0.00 0.00 56.10 56.68 1ycp s TRP 51 Cb 0.01 -2.05 -0.02 0.00 -1.15 0.00 0.00 33.47 30.26 1ycp s TRP 51 CO 0.08 0.59 -0.23 0.08 0.02 0.00 0.00 176.95 177.49 1ycp s VAL 52 N -0.61 2.33 -0.10 4.03 1.01 -0.27 -1.16 120.40 125.64 1ycp s VAL 52 Ca 0.14 -1.09 -0.01 0.00 0.00 0.00 0.00 61.98 61.02 1ycp s VAL 52 Cb -0.12 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 1ycp s VAL 52 CO 0.03 0.53 -0.04 -0.22 0.00 0.00 0.00 175.10 175.40 1ycp s LEU 53 N -0.81 3.30 0.00 3.92 2.96 0.10 -1.59 118.68 126.56 1ycp s LEU 53 Ca 0.11 -0.02 -0.02 0.00 -0.22 0.00 0.00 54.13 53.98 1ycp s LEU 53 Cb -0.10 -1.75 0.01 0.00 0.50 0.00 0.00 46.19 44.84 1ycp s LEU 53 CO 0.00 0.30 0.36 1.07 -1.32 0.00 0.00 176.35 176.76 1ycp n THR 54 N 2.66 0.00 -3.61 3.68 5.66 0.15 -0.37 114.28 122.44 1ycp n THR 54 Ca -0.18 -1.19 -0.37 0.00 -3.05 0.00 0.00 64.05 59.27 1ycp n THR 54 Cb 0.53 0.75 -0.07 0.00 -1.55 0.00 0.00 70.33 70.00 1ycp n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ycp s ALA 55 N -2.35 3.67 0.35 1.79 0.00 -1.26 0.93 121.76 124.89 1ycp s ALA 55 Ca 0.19 -0.46 0.07 0.00 0.00 0.00 0.00 51.96 51.77 1ycp s ALA 55 Cb -0.01 -2.30 0.77 0.00 0.00 0.00 0.00 23.12 21.59 1ycp s ALA 55 CO 0.14 0.27 1.88 0.00 0.00 0.00 0.00 175.76 178.06 1ycp h ALA 56 N 5.96 1.78 0.00 0.00 0.00 -1.72 0.16 119.26 125.43 1ycp h ALA 56 Ca -0.46 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1ycp h ALA 56 Cb 1.19 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1ycp h ALA 56 CO 0.69 0.01 0.00 1.12 0.00 0.00 0.00 179.25 181.07 1ycp h HIS 57 N 0.74 0.00 0.00 0.00 2.07 -1.92 0.19 115.15 116.24 1ycp h HIS 57 Ca 0.43 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.87 1ycp h HIS 57 Cb 0.61 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.58 1ycp h HIS 57 CO -0.00 0.00 -0.36 0.00 -3.07 0.00 0.00 177.93 174.50 1ycp n LEU 59 N -3.75 2.33 -3.74 0.00 4.77 -0.03 -4.94 117.00 111.64 1ycp n LEU 59 Ca -0.01 -0.09 -0.26 0.00 -0.03 0.00 0.00 56.01 55.63 1ycp n LEU 59 Cb 0.45 -0.48 -0.17 0.00 -2.33 0.00 0.00 43.42 40.89 1ycp n LEU 59 CO 0.37 0.75 -0.37 -0.22 -1.33 0.00 0.00 177.39 176.59 1ycp s LEU 60 N -5.98 0.89 0.19 2.23 2.96 0.48 -1.01 118.68 118.45 1ycp s LEU 60 Ca -0.23 -0.51 -0.07 0.00 -0.22 0.00 0.00 54.13 53.10 1ycp s LEU 60 Cb 0.07 -0.52 -0.02 0.00 0.50 0.00 0.00 46.19 46.22 1ycp s LEU 60 CO 0.51 -0.26 0.28 -0.47 -1.32 0.00 0.00 176.35 175.09 1ycp s TYR 60 N 1.92 0.63 0.00 5.38 5.04 0.19 -4.25 117.35 126.26 1ycp s TYR 60 Ca 0.02 -0.96 0.00 0.00 -2.44 0.00 0.00 57.07 53.69 1ycp s TYR 60 Cb -0.15 -0.16 0.00 0.00 0.35 0.00 0.00 41.96 42.00 1ycp s TYR 60 CO -0.07 -0.76 0.00 -2.30 -1.34 0.00 0.00 175.55 171.08 1ycp n PRO 60 N -0.27 0.00 -0.37 4.97 -0.02 -1.26 -2.23 135.00 135.83 1ycp n PRO 60 Ca -0.03 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.53 1ycp n PRO 60 Cb 0.64 0.00 0.26 0.00 -0.02 0.00 0.00 33.50 34.37 1ycp n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1ycp n TRP 60 N 0.00 0.90 -1.09 6.00 8.01 -1.26 -4.91 117.44 125.09 1ycp n TRP 60 Ca 0.00 -0.58 -0.03 0.00 -1.31 0.00 0.00 57.50 55.58 1ycp n TRP 60 Cb 0.00 -0.12 -0.01 0.00 -2.01 0.00 0.00 31.31 29.17 1ycp n TRP 60 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1ycp n ASP 60 N 0.75 -4.28 -4.58 -0.99 9.92 -1.22 -4.95 116.55 111.20 1ycp n ASP 60 Ca 0.19 0.08 -0.42 0.00 -0.53 0.00 0.00 54.79 54.11 1ycp n ASP 60 Cb 0.65 -2.05 -0.02 0.00 -0.64 0.00 0.00 41.12 39.06 1ycp n ASP 60 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1ycp s LYS 60 N -1.52 3.44 -0.41 -1.24 2.20 -0.94 -4.89 119.74 116.37 1ycp s LYS 60 Ca 0.00 0.26 0.04 0.00 -0.36 0.00 0.00 55.97 55.91 1ycp s LYS 60 Cb 0.00 -4.05 0.17 0.00 -1.51 0.00 0.00 37.83 32.43 1ycp s LYS 60 CO 0.00 -1.78 0.43 1.21 -0.36 0.00 0.00 175.35 174.85 1ycp s ASN 60 N 3.36 0.81 0.19 1.43 3.84 -1.24 0.58 114.94 123.90 1ycp s ASN 60 Ca 0.45 -2.11 -0.29 0.00 0.21 0.00 0.00 52.86 51.11 1ycp s ASN 60 Cb -0.08 0.47 -0.08 0.00 -0.55 0.00 0.00 41.25 41.00 1ycp s ASN 60 CO 0.24 -0.19 0.92 -0.36 -2.79 0.00 0.00 177.10 174.93 1ycp s PHE 60 N 0.87 3.92 0.53 0.43 0.08 -0.18 -5.03 117.98 118.61 1ycp s PHE 60 Ca 0.24 1.84 0.05 0.00 0.12 0.00 0.00 56.93 59.19 1ycp s PHE 60 Cb -0.07 -2.97 0.03 0.00 -0.57 0.00 0.00 43.02 39.44 1ycp s PHE 60 CO -0.08 0.39 0.37 0.95 -0.10 0.00 0.00 175.22 176.74 1ycp s THR 60 N -0.80 1.70 0.50 0.64 -4.23 -1.26 -4.90 115.64 107.29 1ycp s THR 60 Ca 0.42 -1.53 0.27 0.00 -1.18 0.00 0.00 61.69 59.67 1ycp s THR 60 Cb -0.25 -2.23 0.45 0.00 1.34 0.00 0.00 72.50 71.81 1ycp s THR 60 CO 0.30 0.00 1.89 0.58 -0.54 0.00 0.00 174.62 176.86 1ycp h VAL 61 N 0.83 0.61 -0.27 2.29 2.07 -1.95 -2.47 116.25 117.35 1ycp h VAL 61 Ca -0.38 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.11 1ycp h VAL 61 Cb 1.30 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1ycp h VAL 61 CO 0.59 0.02 0.00 0.47 0.02 0.00 0.00 177.57 178.67 1ycp n ASP 62 N -4.35 2.01 -0.57 0.57 9.92 -1.26 -3.90 116.55 118.97 1ycp n ASP 62 Ca 0.18 -1.84 0.06 0.00 -0.53 0.00 0.00 54.79 52.66 1ycp n ASP 62 Cb 0.85 -0.18 0.09 0.00 -0.64 0.00 0.00 41.12 41.24 1ycp n ASP 62 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1ycp n ASP 63 N 0.56 2.33 -4.07 -2.24 8.00 -0.93 -4.93 116.55 115.28 1ycp n ASP 63 Ca 0.15 -1.66 -0.15 0.00 0.71 0.00 0.00 54.79 53.85 1ycp n ASP 63 Cb 0.36 -0.07 -0.12 0.00 -0.02 0.00 0.00 41.12 41.26 1ycp n ASP 63 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1ycp s LEU 64 N -1.04 2.21 0.07 0.64 1.43 -1.25 -3.50 118.68 117.24 1ycp s LEU 64 Ca 0.18 -0.47 0.08 0.00 -1.03 0.00 0.00 54.13 52.89 1ycp s LEU 64 Cb 0.11 -0.27 -0.03 0.00 0.03 0.00 0.00 46.19 46.03 1ycp s LEU 64 CO 0.16 -0.12 -0.22 -0.76 0.23 0.00 0.00 176.35 175.65 1ycp s LEU 65 N -1.30 2.22 -0.26 1.79 1.43 -0.76 -4.61 118.68 117.19 1ycp s LEU 65 Ca -0.06 -0.59 -0.00 0.00 -1.03 0.00 0.00 54.13 52.45 1ycp s LEU 65 Cb -0.08 -1.00 0.04 0.00 0.03 0.00 0.00 46.19 45.18 1ycp s LEU 65 CO 0.01 0.14 -0.07 -0.69 0.23 0.00 0.00 176.35 175.97 1ycp s VAL 66 N -0.93 2.67 -0.24 -1.59 1.01 -0.51 -1.78 120.40 119.03 1ycp s VAL 66 Ca 0.08 -1.25 -0.12 0.00 0.00 0.00 0.00 61.98 60.68 1ycp s VAL 66 Cb -0.09 -2.43 -0.05 0.00 0.00 0.00 0.00 36.38 33.81 1ycp s VAL 66 CO 0.03 0.09 0.23 -0.13 0.00 0.00 0.00 175.10 175.33 1ycp s ARG 67 N 1.25 4.06 0.26 2.72 0.52 -0.77 -1.72 118.95 125.28 1ycp s ARG 67 Ca -0.03 -0.15 0.11 0.00 -0.52 0.00 0.00 55.73 55.13 1ycp s ARG 67 Cb -0.18 -3.57 -0.05 0.00 0.52 0.00 0.00 34.95 31.67 1ycp s ARG 67 CO -0.04 -0.04 -0.13 0.42 0.02 0.00 0.00 175.30 175.53 1ycp s ILE 68 N 1.34 2.86 -1.02 1.52 1.09 0.13 -1.25 121.20 125.88 1ycp s ILE 68 Ca 0.10 -2.17 0.00 0.00 -1.10 0.00 0.00 60.65 57.49 1ycp s ILE 68 Cb -0.14 -2.50 0.00 0.00 -1.06 0.00 0.00 42.46 38.75 1ycp s ILE 68 CO 0.07 -0.36 0.00 0.61 -0.10 0.00 0.00 174.94 175.16 1ycp n GLY 69 N -0.63 0.25 3.98 6.18 0.00 -1.26 -0.78 105.19 112.92 1ycp n GLY 69 Ca -0.06 -0.44 -0.21 0.00 0.00 0.00 0.00 46.02 45.31 1ycp n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ycp s LYS 70 N -4.15 2.54 0.00 1.61 1.02 -1.26 -3.97 119.74 115.53 1ycp s LYS 70 Ca 0.00 -0.83 0.00 0.00 0.02 0.00 0.00 55.97 55.16 1ycp s LYS 70 Cb 0.00 -2.51 0.00 0.00 -0.52 0.00 0.00 37.83 34.80 1ycp s LYS 70 CO 0.00 -0.70 0.00 1.58 -0.92 0.00 0.00 175.35 175.31 1ycp n HIS 71 N -2.32 0.00 -3.90 3.18 -0.00 -1.26 -4.95 115.22 105.98 1ycp n HIS 71 Ca 0.08 0.00 -0.36 0.00 -0.00 0.00 0.00 57.72 57.45 1ycp n HIS 71 Cb 0.60 0.00 -0.12 0.00 -0.00 0.00 0.00 29.99 30.47 1ycp n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1ycp s SER 72 N -0.32 5.20 0.12 0.26 0.15 -1.26 -5.00 113.70 112.85 1ycp s SER 72 Ca 0.00 -0.13 -0.29 0.00 0.70 0.00 0.00 55.95 56.23 1ycp s SER 72 Cb 0.00 -1.91 -0.08 0.00 -1.71 0.00 0.00 66.02 62.32 1ycp s SER 72 CO 0.00 0.04 1.61 -0.09 1.20 0.00 0.00 173.24 176.00 1ycp h ARG 73 N 7.70 -0.54 -0.00 5.44 2.43 -1.98 -2.93 114.38 124.50 1ycp h ARG 73 Ca -0.37 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.84 1ycp h ARG 73 Cb 1.18 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.85 1ycp h ARG 73 CO 0.61 -0.36 0.00 2.41 -1.51 0.00 0.00 179.97 181.12 1ycp n THR 74 N -5.43 0.00 -3.88 0.20 -1.04 -1.26 -4.95 114.28 97.92 1ycp n THR 74 Ca -0.06 -0.01 -0.11 0.00 -2.04 0.00 0.00 64.05 61.82 1ycp n THR 74 Cb 0.34 -0.35 -0.12 0.00 -1.82 0.00 0.00 70.33 68.39 1ycp n THR 74 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 1ycp s ARG 75 N -2.00 0.28 0.15 -2.82 3.52 -1.11 -5.13 118.95 111.85 1ycp s ARG 75 Ca 0.36 -0.23 -0.30 0.00 -0.13 0.00 0.00 55.73 55.44 1ycp s ARG 75 Cb 0.17 0.11 -0.07 0.00 -1.56 0.00 0.00 34.95 33.60 1ycp s ARG 75 CO 0.28 -0.05 0.96 -0.47 -0.81 0.00 0.00 175.30 175.21 1ycp s TYR 76 N -0.79 3.86 -0.53 5.12 5.04 -1.26 -4.61 117.35 124.18 1ycp s TYR 76 Ca -0.09 1.83 0.04 0.00 -2.44 0.00 0.00 57.07 56.42 1ycp s TYR 76 Cb -0.05 -3.04 0.17 0.00 0.35 0.00 0.00 41.96 39.39 1ycp s TYR 76 CO 0.00 0.26 0.40 -1.21 -1.34 0.00 0.00 175.55 173.66 1ycp s GLU 77 N -0.38 1.55 0.40 4.97 2.02 -1.26 -5.00 118.70 121.00 1ycp s GLU 77 Ca 0.45 -2.60 0.37 0.00 0.02 0.00 0.00 54.97 53.21 1ycp s GLU 77 Cb -0.24 -2.28 1.26 0.00 0.10 0.00 0.00 34.13 32.96 1ycp s GLU 77 CO 0.31 -1.33 1.13 -2.13 0.02 0.00 0.00 175.26 173.25 1ycp n ARG 77 N 2.55 -0.00 0.05 1.61 0.63 -1.26 -0.22 116.66 120.02 1ycp n ARG 77 Ca 0.24 0.78 -0.17 0.00 -0.92 0.00 0.00 57.85 57.79 1ycp n ARG 77 Cb 0.42 -1.81 -0.14 0.00 0.45 0.00 0.00 32.46 31.38 1ycp n ARG 77 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 1ycp h LYS 78 N 0.00 0.24 0.00 -0.14 1.79 -2.00 -3.41 116.57 113.05 1ycp h LYS 78 Ca 0.68 -0.41 -0.26 0.00 -2.18 0.00 0.00 60.65 58.48 1ycp h LYS 78 Cb 2.74 0.15 -0.05 0.00 -1.58 0.00 0.00 32.23 33.50 1ycp h LYS 78 CO -0.01 1.09 -1.99 1.33 -1.08 0.00 0.00 179.45 178.80 1ycp n VAL 79 N -3.43 0.99 -2.55 0.50 0.24 0.16 -5.03 118.33 109.21 1ycp n VAL 79 Ca -0.18 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.34 61.21 1ycp n VAL 79 Cb 1.05 -0.87 -0.04 0.00 -1.47 0.00 0.00 33.84 32.51 1ycp n VAL 79 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1ycp s GLU 80 N -2.35 4.58 0.23 7.34 2.12 0.69 -4.46 118.70 126.85 1ycp s GLU 80 Ca -0.15 1.66 0.11 0.00 0.36 0.00 0.00 54.97 56.95 1ycp s GLU 80 Cb 0.05 -3.32 -0.05 0.00 0.26 0.00 0.00 34.13 31.08 1ycp s GLU 80 CO 0.50 0.03 -0.16 0.21 -0.54 0.00 0.00 175.26 175.30 1ycp s LYS 81 N 0.02 1.80 0.23 4.30 2.36 0.04 -4.78 119.74 123.71 1ycp s LYS 81 Ca 0.51 -1.53 0.01 0.00 -2.55 0.00 0.00 55.97 52.41 1ycp s LYS 81 Cb -0.28 -1.94 -0.05 0.00 -1.05 0.00 0.00 37.83 34.51 1ycp s LYS 81 CO 0.33 0.38 0.08 0.42 1.55 0.00 0.00 175.35 178.10 1ycp s ILE 82 N -2.04 0.54 -0.17 5.43 1.01 -1.26 -0.69 121.20 124.02 1ycp s ILE 82 Ca 0.26 -1.99 -0.32 0.00 0.00 0.00 0.00 60.65 58.60 1ycp s ILE 82 Cb -0.07 -2.50 0.14 0.00 0.01 0.00 0.00 42.46 40.04 1ycp s ILE 82 CO 0.14 -0.11 1.13 -0.55 0.00 0.00 0.00 174.94 175.55 1ycp s SER 83 N -3.27 -0.21 0.27 3.58 0.15 -0.70 -4.93 113.70 108.59 1ycp s SER 83 Ca 0.35 0.12 0.08 0.00 0.70 0.00 0.00 55.95 57.20 1ycp s SER 83 Cb 0.07 0.20 -0.04 0.00 -1.71 0.00 0.00 66.02 64.54 1ycp s SER 83 CO 0.11 -0.28 0.10 -0.04 1.20 0.00 0.00 173.24 174.33 1ycp s MET 84 N -1.88 2.58 0.46 5.44 -1.94 -1.26 -1.43 119.30 121.27 1ycp s MET 84 Ca 0.06 -1.27 0.01 0.00 -1.71 0.00 0.00 55.69 52.78 1ycp s MET 84 Cb -0.01 -2.34 0.01 0.00 2.01 0.00 0.00 34.83 34.49 1ycp s MET 84 CO -0.04 0.35 0.67 -0.51 -0.01 0.00 0.00 175.02 175.49 1ycp s LEU 85 N -3.77 3.58 -0.15 -0.03 1.43 -1.26 -0.53 118.68 117.96 1ycp s LEU 85 Ca 0.33 0.14 -0.08 0.00 -1.03 0.00 0.00 54.13 53.48 1ycp s LEU 85 Cb -0.07 -3.03 -0.06 0.00 0.03 0.00 0.00 46.19 43.06 1ycp s LEU 85 CO 0.22 -0.79 -0.21 -0.67 0.23 0.00 0.00 176.35 175.14 1ycp n ASP 86 N -2.10 1.20 -3.98 2.29 2.03 0.21 -4.27 116.55 111.94 1ycp n ASP 86 Ca 0.03 0.20 -0.08 0.00 0.52 0.00 0.00 54.79 55.46 1ycp n ASP 86 Cb 0.58 -0.49 -0.09 0.00 -0.72 0.00 0.00 41.12 40.40 1ycp n ASP 86 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1ycp s LYS 87 N -2.33 0.62 -0.04 -0.67 1.02 -1.20 -4.99 119.74 112.16 1ycp s LYS 87 Ca -0.22 -0.95 0.05 0.00 0.02 0.00 0.00 55.97 54.88 1ycp s LYS 87 Cb 0.08 0.24 -0.01 0.00 -0.52 0.00 0.00 37.83 37.61 1ycp s LYS 87 CO 0.28 -0.15 -0.20 0.42 -0.92 0.00 0.00 175.35 174.78 1ycp s ILE 88 N -3.24 1.65 -0.56 2.17 1.01 -1.26 -0.27 121.20 120.70 1ycp s ILE 88 Ca 0.00 -0.86 0.04 0.00 0.00 0.00 0.00 60.65 59.84 1ycp s ILE 88 Cb 0.03 -1.40 0.16 0.00 0.01 0.00 0.00 42.46 41.26 1ycp s ILE 88 CO -0.08 0.47 0.38 -0.31 0.00 0.00 0.00 174.94 175.40 1ycp s TYR 89 N -0.18 2.65 0.87 3.97 1.51 0.23 -4.96 117.35 121.44 1ycp s TYR 89 Ca -0.00 -2.91 -0.12 0.00 -1.01 0.00 0.00 57.07 53.03 1ycp s TYR 89 Cb -0.11 -2.16 0.12 0.00 -0.11 0.00 0.00 41.96 39.70 1ycp s TYR 89 CO 0.02 -0.68 1.13 0.42 -1.11 0.00 0.00 175.55 175.32 1ycp s ILE 90 N -0.61 2.33 -0.01 2.71 1.09 -1.26 -1.24 121.20 124.20 1ycp s ILE 90 Ca 0.24 0.11 -0.19 0.00 -1.10 0.00 0.00 60.65 59.70 1ycp s ILE 90 Cb -0.09 -2.86 -0.05 0.00 -1.06 0.00 0.00 42.46 38.39 1ycp s ILE 90 CO -0.12 -0.14 0.55 -2.28 -0.10 0.00 0.00 174.94 172.85 1ycp s HIS 91 N -3.25 3.68 0.14 3.97 2.46 -1.20 -4.92 115.29 116.17 1ycp s HIS 91 Ca 0.63 1.14 -0.18 0.00 0.47 0.00 0.00 55.06 57.12 1ycp s HIS 91 Cb -0.15 -2.54 -0.02 0.00 -0.13 0.00 0.00 32.58 29.74 1ycp s HIS 91 CO 0.53 0.39 1.78 -1.00 -2.47 0.00 0.00 174.74 173.98 1ycp h PRO 92 N 5.53 0.43 -1.13 2.88 0.13 -1.95 -2.74 132.00 135.15 1ycp h PRO 92 Ca -0.46 -0.03 -0.31 0.00 -0.87 0.00 0.00 66.00 64.33 1ycp h PRO 92 Cb 1.20 -0.09 -0.16 0.00 0.13 0.00 0.00 31.00 32.07 1ycp h PRO 92 CO 0.69 0.31 0.39 0.54 -0.23 0.00 0.00 178.00 179.69 1ycp n ARG 93 N -4.85 1.74 -2.75 0.86 3.00 -1.26 -4.91 116.66 108.50 1ycp n ARG 93 Ca -0.01 -1.67 -0.43 0.00 -0.01 0.00 0.00 57.85 55.74 1ycp n ARG 93 Cb 0.04 -1.65 -0.03 0.00 0.00 0.00 0.00 32.46 30.81 1ycp n ARG 93 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.63 177.16 1ycp s TYR 94 N -1.86 3.18 -1.03 -1.55 5.04 -1.04 -4.65 117.35 115.44 1ycp s TYR 94 Ca 0.32 1.07 -0.16 0.00 -2.44 0.00 0.00 57.07 55.87 1ycp s TYR 94 Cb 0.26 -3.50 0.17 0.00 0.35 0.00 0.00 41.96 39.24 1ycp s TYR 94 CO 0.04 -0.68 1.20 1.21 -1.34 0.00 0.00 175.55 175.98 1ycp s ASN 95 N 1.61 6.86 0.19 4.32 3.84 0.01 -4.84 114.94 126.93 1ycp s ASN 95 Ca 0.41 -2.58 -0.03 0.00 0.21 0.00 0.00 52.86 50.87 1ycp s ASN 95 Cb -0.13 -2.37 0.12 0.00 -0.55 0.00 0.00 41.25 38.32 1ycp s ASN 95 CO 0.14 -0.84 1.51 4.11 -2.79 0.00 0.00 177.10 179.23 1ycp h TRP 96 N 7.95 0.69 -0.27 0.43 5.08 -1.94 0.61 115.95 128.49 1ycp h TRP 96 Ca 0.21 -0.24 0.08 0.00 1.08 0.00 0.00 58.89 60.02 1ycp h TRP 96 Cb 0.96 -0.13 -0.01 0.00 -3.00 0.00 0.00 29.16 26.98 1ycp h TRP 96 CO 1.10 0.97 0.23 -0.22 -1.28 0.00 0.00 178.44 179.24 1ycp h LYS 97 N 0.42 0.00 0.00 0.12 3.64 -2.00 -3.40 116.57 115.36 1ycp h LYS 97 Ca 0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1ycp h LYS 97 Cb 1.09 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 1ycp h LYS 97 CO 0.10 0.00 -0.38 -1.91 -2.27 0.00 0.00 179.45 175.00 1ycp n GLU 97 N -4.15 0.44 0.00 1.90 2.13 -1.24 -4.99 120.64 114.73 1ycp n GLU 97 Ca 0.04 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.86 1ycp n GLU 97 Cb 0.39 -0.69 0.00 0.00 0.27 0.00 0.00 31.44 31.41 1ycp n GLU 97 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1ycp n ASN 98 N -1.64 0.00 -3.58 4.31 0.23 -1.22 -5.02 115.26 108.34 1ycp n ASN 98 Ca 0.00 -1.00 -0.23 0.00 -0.53 0.00 0.00 54.58 52.82 1ycp n ASN 98 Cb 0.19 0.00 0.08 0.00 -2.08 0.00 0.00 39.78 37.97 1ycp n ASN 98 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1ycp n LEU 99 N 0.00 -3.47 -4.75 -4.53 4.32 0.20 -4.95 117.00 103.82 1ycp n LEU 99 Ca 0.00 -0.55 -0.40 0.00 -0.02 0.00 0.00 56.01 55.03 1ycp n LEU 99 Cb 0.42 -3.05 -0.05 0.00 -1.62 0.00 0.00 43.42 39.13 1ycp n LEU 99 CO 0.00 0.63 0.76 -0.62 -1.22 0.00 0.00 177.39 176.94 1ycp s ASP 100 N -3.44 7.34 -1.15 -1.43 2.15 -1.19 -3.54 116.67 115.41 1ycp s ASP 100 Ca 0.52 2.14 -0.02 0.00 0.43 0.00 0.00 52.55 55.62 1ycp s ASP 100 Cb -0.23 -2.62 -0.03 0.00 -0.30 0.00 0.00 42.92 39.75 1ycp s ASP 100 CO 0.73 -0.11 0.96 0.54 -0.17 0.00 0.00 175.17 177.12 1ycp n ARG 101 N 1.67 -4.95 -3.06 4.34 1.74 -1.26 -0.81 116.66 114.33 1ycp n ARG 101 Ca 0.00 0.85 -0.44 0.00 -0.77 0.00 0.00 57.85 57.48 1ycp n ARG 101 Cb 0.46 -5.82 -0.01 0.00 -1.02 0.00 0.00 32.46 26.06 1ycp n ARG 101 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1ycp s ASP 102 N -4.00 6.98 -0.15 0.55 2.15 -1.23 -4.41 116.67 116.56 1ycp s ASP 102 Ca 0.17 -2.84 -0.16 0.00 0.43 0.00 0.00 52.55 50.15 1ycp s ASP 102 Cb -0.02 -2.34 0.04 0.00 -0.30 0.00 0.00 42.92 40.29 1ycp s ASP 102 CO 0.74 -0.72 0.43 -0.51 -0.17 0.00 0.00 175.17 174.94 1ycp s ILE 103 N 1.16 0.00 -0.18 4.11 2.07 -1.26 -4.16 121.20 122.95 1ycp s ILE 103 Ca 0.35 -0.04 -0.16 0.00 -1.41 0.00 0.00 60.65 59.39 1ycp s ILE 103 Cb -0.05 -0.62 0.05 0.00 0.13 0.00 0.00 42.46 41.96 1ycp s ILE 103 CO -0.05 -0.02 0.48 0.00 -1.91 0.00 0.00 174.94 173.44 1ycp s ALA 104 N 0.06 -1.18 0.02 1.50 0.00 0.26 -3.25 121.76 119.17 1ycp s ALA 104 Ca -0.01 1.37 -0.01 0.00 0.00 0.00 0.00 51.96 53.30 1ycp s ALA 104 Cb -0.03 -0.80 -0.04 0.00 0.00 0.00 0.00 23.12 22.25 1ycp s ALA 104 CO 0.01 -0.23 0.17 -0.51 0.00 0.00 0.00 175.76 175.20 1ycp s LEU 105 N 0.32 4.28 -0.11 0.00 1.43 -0.37 0.30 118.68 124.52 1ycp s LEU 105 Ca -0.01 0.28 -0.02 0.00 -1.03 0.00 0.00 54.13 53.36 1ycp s LEU 105 Cb -0.04 -2.66 0.04 0.00 0.03 0.00 0.00 46.19 43.56 1ycp s LEU 105 CO -0.00 0.23 0.02 -0.76 0.23 0.00 0.00 176.35 176.07 1ycp s LEU 106 N -2.10 0.72 -0.05 1.79 1.02 -0.62 0.74 118.68 120.18 1ycp s LEU 106 Ca 0.29 -0.31 -0.21 0.00 0.02 0.00 0.00 54.13 53.93 1ycp s LEU 106 Cb -0.13 -0.46 -0.05 0.00 0.02 0.00 0.00 46.19 45.57 1ycp s LEU 106 CO 0.21 -0.23 0.60 -0.75 0.02 0.00 0.00 176.35 176.20 1ycp s LYS 107 N 1.96 4.36 0.52 1.70 2.47 0.62 -1.11 119.74 130.25 1ycp s LYS 107 Ca 0.03 0.72 -0.17 0.00 -1.56 0.00 0.00 55.97 55.00 1ycp s LYS 107 Cb -0.14 -3.40 -0.08 0.00 -1.46 0.00 0.00 37.83 32.76 1ycp s LYS 107 CO -0.06 0.23 0.99 -0.51 0.16 0.00 0.00 175.35 176.16 1ycp s LEU 108 N 0.30 3.63 0.19 5.43 1.43 0.51 0.66 118.68 130.83 1ycp s LEU 108 Ca 0.32 1.61 -0.11 0.00 -1.03 0.00 0.00 54.13 54.92 1ycp s LEU 108 Cb -0.17 -4.51 0.11 0.00 0.03 0.00 0.00 46.19 41.64 1ycp s LEU 108 CO 0.16 -0.64 1.79 0.07 0.23 0.00 0.00 176.35 177.96 1ycp h LYS 109 N 0.93 0.94 -4.45 1.70 2.10 -0.99 -3.37 116.57 113.44 1ycp h LYS 109 Ca -0.47 -0.12 -0.34 0.00 -2.00 0.00 0.00 60.65 57.72 1ycp h LYS 109 Cb 1.19 -0.18 -0.28 0.00 -0.90 0.00 0.00 32.23 32.06 1ycp h LYS 109 CO 0.61 0.73 -0.76 -0.98 -2.00 0.00 0.00 179.45 177.05 1ycp s ARG 110 N -5.79 0.51 -0.22 0.07 1.70 -1.26 -4.91 118.95 109.05 1ycp s ARG 110 Ca -0.13 -0.30 -0.28 0.00 -0.47 0.00 0.00 55.73 54.55 1ycp s ARG 110 Cb 0.14 -0.47 -0.05 0.00 -0.57 0.00 0.00 34.95 34.00 1ycp s ARG 110 CO 0.79 0.12 2.17 -1.25 -1.08 0.00 0.00 175.30 176.05 1ycp s PRO 111 N -0.34 3.20 0.78 3.89 0.04 -1.26 -4.87 135.00 136.45 1ycp s PRO 111 Ca 0.01 2.00 -0.15 0.00 0.04 0.00 0.00 61.00 62.90 1ycp s PRO 111 Cb -0.03 -4.35 0.03 0.00 0.04 0.00 0.00 34.50 30.19 1ycp s PRO 111 CO -0.00 -2.03 0.92 1.51 0.04 0.00 0.00 177.00 177.45 1ycp n ILE 112 N 7.60 1.99 -2.87 0.56 3.06 0.16 -4.94 119.36 124.92 1ycp n ILE 112 Ca 0.29 -0.29 -0.42 0.00 -2.50 0.00 0.00 62.75 59.82 1ycp n ILE 112 Cb 0.45 -1.02 -0.04 0.00 0.54 0.00 0.00 39.64 39.56 1ycp n ILE 112 CO 0.00 0.00 0.00 -0.70 -2.50 0.00 0.00 176.55 173.35 1ycp s GLU 113 N -3.59 3.75 0.20 9.51 2.12 -1.26 -4.86 118.70 124.57 1ycp s GLU 113 Ca 0.70 0.39 -0.31 0.00 0.36 0.00 0.00 54.97 56.11 1ycp s GLU 113 Cb -0.31 -3.83 -0.10 0.00 0.26 0.00 0.00 34.13 30.15 1ycp s GLU 113 CO 0.54 -0.95 1.56 -0.51 -0.54 0.00 0.00 175.26 175.36 1ycp s LEU 114 N 3.35 4.37 0.00 2.70 1.02 -1.26 -4.81 118.68 124.05 1ycp s LEU 114 Ca 0.35 2.69 0.00 0.00 0.02 0.00 0.00 54.13 57.18 1ycp s LEU 114 Cb -0.12 -3.60 0.00 0.00 0.02 0.00 0.00 46.19 42.48 1ycp s LEU 114 CO 0.19 -0.83 0.00 -0.24 0.02 0.00 0.00 176.35 175.50 1ycp n SER 115 N 3.48 1.15 0.23 2.29 2.88 -0.76 -4.93 113.62 117.96 1ycp n SER 115 Ca 0.12 -0.30 0.15 0.00 -1.33 0.00 0.00 58.87 57.51 1ycp n SER 115 Cb 0.38 0.00 0.46 0.00 -0.75 0.00 0.00 64.21 64.30 1ycp n SER 115 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1ycp h ASP 116 N 0.00 0.00 0.00 -3.46 3.32 -1.98 -3.25 116.42 111.06 1ycp h ASP 116 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ycp h ASP 116 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1ycp h ASP 116 CO 0.00 0.00 -0.00 -1.22 -1.72 0.00 0.00 179.24 176.30 1ycp n TYR 117 N -2.98 0.00 -3.82 4.55 4.01 -1.26 -4.87 117.16 112.79 1ycp n TYR 117 Ca 0.02 -0.45 -0.26 0.00 -0.16 0.00 0.00 57.90 57.05 1ycp n TYR 117 Cb 0.39 -0.05 -0.17 0.00 -0.31 0.00 0.00 39.34 39.21 1ycp n TYR 117 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1ycp s ILE 118 N -0.95 0.71 -0.28 -0.72 1.01 -1.23 -4.06 121.20 115.67 1ycp s ILE 118 Ca 0.02 -0.26 -0.23 0.00 0.00 0.00 0.00 60.65 60.18 1ycp s ILE 118 Cb 0.02 -0.91 0.13 0.00 0.01 0.00 0.00 42.46 41.71 1ycp s ILE 118 CO 0.00 0.16 1.04 -2.28 0.00 0.00 0.00 174.94 173.87 1ycp s HIS 119 N 1.82 -0.47 0.82 3.97 2.46 -1.07 -1.83 115.29 120.98 1ycp s HIS 119 Ca 0.03 1.09 -0.11 0.00 0.47 0.00 0.00 55.06 56.54 1ycp s HIS 119 Cb -0.14 0.37 0.08 0.00 -0.13 0.00 0.00 32.58 32.76 1ycp s HIS 119 CO -0.07 -0.23 1.09 -2.14 -2.47 0.00 0.00 174.74 170.92 1ycp s PRO 120 N 0.50 1.90 0.31 2.88 0.02 -1.26 -1.98 135.00 137.37 1ycp s PRO 120 Ca 0.00 0.95 0.09 0.00 0.02 0.00 0.00 61.00 62.07 1ycp s PRO 120 Cb -0.05 -1.87 -0.05 0.00 0.02 0.00 0.00 34.50 32.55 1ycp s PRO 120 CO -0.09 -1.83 0.02 0.54 -0.33 0.00 0.00 177.00 175.31 1ycp s VAL 121 N -2.96 3.06 0.05 3.83 0.11 -1.12 -4.88 120.40 118.49 1ycp s VAL 121 Ca 0.62 -1.91 -0.03 0.00 -2.93 0.00 0.00 61.98 57.73 1ycp s VAL 121 Cb -0.17 -2.83 -0.04 0.00 -1.53 0.00 0.00 36.38 31.81 1ycp s VAL 121 CO 0.56 -0.28 0.24 0.00 -3.33 0.00 0.00 175.10 172.29 1ycp s LEU 123 N -2.27 4.46 1.22 0.00 1.43 -1.26 -5.05 118.68 117.21 1ycp s LEU 123 Ca 0.33 1.34 -0.14 0.00 -1.03 0.00 0.00 54.13 54.63 1ycp s LEU 123 Cb -0.13 -3.09 0.31 0.00 0.03 0.00 0.00 46.19 43.31 1ycp s LEU 123 CO 0.23 0.09 1.01 -2.84 0.23 0.00 0.00 176.35 175.07 1ycp s PRO 124 N -0.31 -1.37 0.10 1.29 0.02 -1.26 -5.08 135.00 128.38 1ycp s PRO 124 Ca 0.35 0.77 -0.01 0.00 0.02 0.00 0.00 61.00 62.12 1ycp s PRO 124 Cb -0.20 -1.51 -0.04 0.00 0.02 0.00 0.00 34.50 32.78 1ycp s PRO 124 CO 0.21 -4.01 0.02 0.16 -0.33 0.00 0.00 177.00 173.05 1ycp s ASP 125 N -2.47 0.42 0.10 2.53 1.47 -1.26 -5.06 116.67 112.40 1ycp s ASP 125 Ca 0.69 -1.13 -0.20 0.00 1.18 0.00 0.00 52.55 53.09 1ycp s ASP 125 Cb -0.25 0.25 -0.05 0.00 -0.34 0.00 0.00 42.92 42.53 1ycp s ASP 125 CO 0.65 -0.67 1.35 0.11 0.68 0.00 0.00 175.17 177.29 1ycp h LYS 126 N 2.97 -0.04 -0.17 2.11 1.57 -2.04 -2.53 116.57 118.44 1ycp h LYS 126 Ca -0.35 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.49 1ycp h LYS 126 Cb 1.18 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 33.43 1ycp h LYS 126 CO 0.62 -0.03 -0.28 -0.56 -0.57 0.00 0.00 179.45 178.63 1ycp h GLN 127 N -0.04 -0.32 0.00 3.15 -0.00 -2.05 0.69 115.11 116.54 1ycp h GLN 127 Ca 0.09 0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.77 1ycp h GLN 127 Cb 0.28 0.07 0.00 0.00 -0.00 0.00 0.00 27.48 27.84 1ycp h GLN 127 CO -0.57 -0.21 0.00 2.41 -0.00 0.00 0.00 178.83 180.46 1ycp n THR 128 N -5.39 0.00 0.00 1.86 -1.04 -0.95 -1.18 114.28 107.58 1ycp n THR 128 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1ycp n THR 128 Cb 0.31 -0.22 0.00 0.00 -1.82 0.00 0.00 70.33 68.60 1ycp n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ycp n ALA 129 N 0.04 0.00 -0.10 2.41 0.00 0.24 -0.32 120.51 122.79 1ycp n ALA 129 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 1ycp n ALA 129 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.30 1ycp n ALA 129 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ycp n LYS 129 N 0.00 0.86 -0.05 0.00 5.02 -0.32 -4.66 118.16 119.01 1ycp n LYS 129 Ca 0.00 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.17 1ycp n LYS 129 Cb 0.00 -1.49 -0.11 0.00 -0.02 0.00 0.00 35.03 33.41 1ycp n LYS 129 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1ycp h LEU 129 N 0.00 -0.01 -7.98 -0.35 -0.00 -0.89 -3.41 115.31 102.66 1ycp h LEU 129 Ca -0.52 -0.83 -0.11 0.00 -0.00 0.00 0.00 57.88 56.42 1ycp h LEU 129 Cb 2.15 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 42.81 1ycp h LEU 129 CO 0.02 0.87 0.33 0.18 -0.00 0.00 0.00 178.44 179.84 1ycp n LEU 130 N -4.67 1.73 -3.90 1.67 4.77 -1.26 -4.86 117.00 110.48 1ycp n LEU 130 Ca -0.09 -2.60 -0.21 0.00 -0.03 0.00 0.00 56.01 53.08 1ycp n LEU 130 Cb 0.40 -1.67 -0.16 0.00 -2.33 0.00 0.00 43.42 39.66 1ycp n LEU 130 CO 0.31 -3.17 -0.41 -1.00 -1.33 0.00 0.00 177.39 171.79 1ycp s HIS 131 N 15.47 0.85 0.15 -1.77 3.76 -1.26 -4.96 115.29 127.52 1ycp s HIS 131 Ca 0.78 -0.26 -0.34 0.00 -0.15 0.00 0.00 55.06 55.09 1ycp s HIS 131 Cb -0.03 -0.74 -0.15 0.00 1.11 0.00 0.00 32.58 32.76 1ycp s HIS 131 CO 0.19 -0.23 1.36 0.00 -0.85 0.00 0.00 174.74 175.21 1ycp n ALA 132 N 4.16 -0.10 0.00 -1.40 0.00 -1.26 -0.07 120.51 121.84 1ycp n ALA 132 Ca -0.22 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.69 1ycp n ALA 132 Cb 0.51 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.80 1ycp n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ycp n GLY 133 N 2.54 3.11 3.77 0.00 0.00 -1.26 -5.04 105.19 108.31 1ycp n GLY 133 Ca 0.16 -0.94 -0.41 0.00 0.00 0.00 0.00 46.02 44.83 1ycp n GLY 133 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ycp s PHE 134 N -0.40 2.74 0.32 1.61 0.40 0.90 -4.99 117.98 118.57 1ycp s PHE 134 Ca 0.00 1.07 0.03 0.00 -0.60 0.00 0.00 56.93 57.42 1ycp s PHE 134 Cb 0.00 -3.97 -0.03 0.00 0.51 0.00 0.00 43.02 39.53 1ycp s PHE 134 CO 0.00 -2.99 0.49 0.15 0.70 0.00 0.00 175.22 173.56 1ycp s LYS 135 N -1.38 3.38 0.07 0.44 1.02 -1.26 -4.88 119.74 117.12 1ycp s LYS 135 Ca 0.56 -0.58 -0.09 0.00 0.02 0.00 0.00 55.97 55.88 1ycp s LYS 135 Cb -0.45 -2.75 -0.00 0.00 -0.52 0.00 0.00 37.83 34.11 1ycp s LYS 135 CO 0.55 0.19 0.19 0.20 -0.92 0.00 0.00 175.35 175.56 1ycp s GLY 136 N -4.05 0.07 0.06 -3.33 0.00 -1.26 -5.12 107.32 93.69 1ycp s GLY 136 Ca 0.39 -0.50 0.03 0.00 0.00 0.00 0.00 44.72 44.64 1ycp s GLY 136 CO 0.33 -0.68 0.04 -1.60 0.00 0.00 0.00 173.10 171.19 1ycp s ARG 137 N -3.37 2.78 0.11 2.90 3.52 -1.26 -5.12 118.95 118.51 1ycp s ARG 137 Ca 0.01 -0.70 0.09 0.00 -0.13 0.00 0.00 55.73 55.00 1ycp s ARG 137 Cb 0.03 -2.67 -0.04 0.00 -1.56 0.00 0.00 34.95 30.71 1ycp s ARG 137 CO -0.08 0.58 -0.22 0.08 -0.81 0.00 0.00 175.30 174.85 1ycp s VAL 138 N -1.29 1.82 0.08 7.11 1.01 -1.26 -5.16 120.40 122.71 1ycp s VAL 138 Ca 0.26 -1.63 -0.08 0.00 0.00 0.00 0.00 61.98 60.53 1ycp s VAL 138 Cb -0.12 -1.66 -0.00 0.00 0.00 0.00 0.00 36.38 34.59 1ycp s VAL 138 CO 0.18 -0.07 0.17 0.42 0.00 0.00 0.00 175.10 175.80 1ycp s THR 139 N -1.25 0.15 0.00 3.92 -4.23 -1.26 -5.12 115.64 107.84 1ycp s THR 139 Ca 0.09 -1.21 0.00 0.00 -1.18 0.00 0.00 61.69 59.39 1ycp s THR 139 Cb -0.10 -1.32 0.00 0.00 1.34 0.00 0.00 72.50 72.43 1ycp s THR 139 CO 0.05 -0.67 0.00 0.61 -0.54 0.00 0.00 174.62 174.07 1ycp n GLY 140 N 0.02 3.07 1.63 3.99 0.00 -1.26 -4.97 105.19 107.66 1ycp n GLY 140 Ca -0.15 -1.10 0.09 0.00 0.00 0.00 0.00 46.02 44.85 1ycp n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1ycp n TRP 141 N -1.24 1.55 -0.31 1.61 8.01 -1.26 -4.50 117.44 121.30 1ycp n TRP 141 Ca 0.00 -0.61 -0.30 0.00 -1.31 0.00 0.00 57.50 55.29 1ycp n TRP 141 Cb 0.00 -0.27 0.29 0.00 -2.01 0.00 0.00 31.31 29.32 1ycp n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1ycp n GLY 142 N 1.11 -3.34 3.75 6.99 0.00 -1.26 -4.82 105.19 107.61 1ycp n GLY 142 Ca 0.26 -1.54 -0.42 0.00 0.00 0.00 0.00 46.02 44.32 1ycp n GLY 142 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ycp n ASN 143 N -5.55 3.62 0.10 1.61 5.03 -1.26 -1.83 115.26 116.99 1ycp n ASN 143 Ca 0.10 1.19 0.12 0.00 0.87 0.00 0.00 54.58 56.86 1ycp n ASN 143 Cb 0.58 -1.58 0.45 0.00 -1.02 0.00 0.00 39.78 38.22 1ycp n ASN 143 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1ycp n ARG 144 N 1.15 0.19 -3.59 3.52 1.74 -1.26 -1.32 116.66 117.09 1ycp n ARG 144 Ca 0.05 0.30 -0.12 0.00 -0.77 0.00 0.00 57.85 57.32 1ycp n ARG 144 Cb 0.37 -1.79 -0.05 0.00 -1.02 0.00 0.00 32.46 29.98 1ycp n ARG 144 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1ycp s ARG 145 N -3.19 1.07 0.00 5.56 3.52 -1.26 -4.35 118.95 120.30 1ycp s ARG 145 Ca 0.07 -0.53 0.28 0.00 -0.13 0.00 0.00 55.73 55.43 1ycp s ARG 145 Cb 0.11 0.48 1.70 0.00 -1.56 0.00 0.00 34.95 35.68 1ycp s ARG 145 CO 0.47 -0.42 2.04 -1.91 -0.81 0.00 0.00 175.30 174.66