#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ucy s VAL 17 N 0.00 5.36 -1.17 1.39 1.01 0.19 -4.19 120.40 123.00 1ucy s VAL 17 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.15 1ucy s VAL 17 Cb 0.00 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.93 1ucy s VAL 17 CO 0.00 0.43 0.00 -0.62 0.00 0.00 0.00 175.10 174.91 1ucy n GLU 18 N 3.59 -1.05 -0.91 2.72 -0.58 -1.26 -1.89 120.64 121.25 1ucy n GLU 18 Ca -0.16 0.68 0.00 0.00 -0.42 0.00 0.00 57.16 57.26 1ucy n GLU 18 Cb 0.52 -4.90 0.00 0.00 -0.57 0.00 0.00 31.44 26.49 1ucy n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ucy n GLY 19 N -1.04 1.75 3.33 0.62 0.00 -1.26 -4.76 105.19 103.82 1ucy n GLY 19 Ca -0.16 -2.10 -0.10 0.00 0.00 0.00 0.00 46.02 43.66 1ucy n GLY 19 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1ucy s GLN 20 N -1.91 1.20 0.18 1.61 -2.07 -0.14 -4.92 119.66 113.60 1ucy s GLN 20 Ca 0.00 -1.31 -0.32 0.00 -1.82 0.00 0.00 55.36 51.91 1ucy s GLN 20 Cb 0.00 0.35 -0.10 0.00 -1.09 0.00 0.00 33.01 32.17 1ucy s GLN 20 CO 0.00 -0.43 1.60 -0.51 -1.32 0.00 0.00 175.29 174.63 1ucy s ASP 21 N -3.03 6.54 0.36 12.60 1.01 -1.26 -0.67 116.67 132.22 1ucy s ASP 21 Ca 0.23 2.68 -0.25 0.00 0.71 0.00 0.00 52.55 55.92 1ucy s ASP 21 Cb 0.04 -2.60 -0.10 0.00 1.01 0.00 0.00 42.92 41.28 1ucy s ASP 21 CO 0.04 -0.86 0.97 0.00 0.21 0.00 0.00 175.17 175.54 1ucy s ALA 22 N 1.12 3.15 0.79 5.23 0.00 0.14 -4.79 121.76 127.39 1ucy s ALA 22 Ca 0.71 0.55 -0.11 0.00 0.00 0.00 0.00 51.96 53.11 1ucy s ALA 22 Cb -0.45 -3.20 0.06 0.00 0.00 0.00 0.00 23.12 19.53 1ucy s ALA 22 CO 0.32 0.07 1.09 -1.21 0.00 0.00 0.00 175.76 176.02 1ucy s GLU 23 N -2.36 2.16 0.22 0.00 2.02 -1.26 -4.85 118.70 114.62 1ucy s GLU 23 Ca 0.54 1.06 -0.30 0.00 0.02 0.00 0.00 54.97 56.30 1ucy s GLU 23 Cb -0.18 -1.89 -0.08 0.00 0.10 0.00 0.00 34.13 32.07 1ucy s GLU 23 CO 0.23 -1.68 1.08 0.14 0.02 0.00 0.00 175.26 175.05 1ucy s VAL 24 N -2.94 3.74 0.00 2.63 -7.23 -1.26 -2.78 120.40 112.57 1ucy s VAL 24 Ca 0.61 1.62 0.00 0.00 -1.81 0.00 0.00 61.98 62.40 1ucy s VAL 24 Cb -0.17 -4.03 0.00 0.00 0.56 0.00 0.00 36.38 32.74 1ucy s VAL 24 CO 0.56 0.33 0.00 0.61 -0.31 0.00 0.00 175.10 176.29 1ucy n GLY 25 N 1.67 0.46 0.23 2.32 0.00 -1.26 -4.89 105.19 103.71 1ucy n GLY 25 Ca 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.02 1ucy n GLY 25 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ucy h LEU 26 N 0.00 0.36 -6.01 0.99 5.85 -1.90 -3.33 115.31 111.27 1ucy h LEU 26 Ca 0.00 -0.11 -0.56 0.00 0.84 0.00 0.00 57.88 58.06 1ucy h LEU 26 Cb 0.14 -0.10 -0.39 0.00 0.37 0.00 0.00 40.66 40.68 1ucy h LEU 26 CO 0.00 0.59 -1.07 -0.24 -0.34 0.00 0.00 178.44 177.38 1ucy n SER 27 N -4.16 0.56 0.00 1.25 2.88 -1.26 -4.96 113.62 107.93 1ucy n SER 27 Ca -0.00 -2.79 0.00 0.00 -1.33 0.00 0.00 58.87 54.75 1ucy n SER 27 Cb 0.36 -0.64 0.00 0.00 -0.75 0.00 0.00 64.21 63.18 1ucy n SER 27 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1ucy n PRO 28 N 1.25 0.00 0.00 -1.46 -0.04 -1.25 -0.76 135.00 132.73 1ucy n PRO 28 Ca 0.22 0.22 0.09 0.00 -0.04 0.00 0.00 63.50 64.00 1ucy n PRO 28 Cb 0.53 -1.53 0.02 0.00 -0.04 0.00 0.00 33.50 32.48 1ucy n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1ucy n TRP 29 N -1.19 0.00 -1.91 0.54 2.14 -1.17 -1.40 117.44 114.45 1ucy n TRP 29 Ca 0.00 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.15 1ucy n TRP 29 Cb 0.03 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.50 1ucy n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1ucy s GLN 30 N -1.94 4.20 0.04 -2.67 2.00 0.06 -0.39 119.66 120.96 1ucy s GLN 30 Ca 0.17 2.40 0.05 0.00 -2.00 0.00 0.00 55.36 55.98 1ucy s GLN 30 Cb 0.15 -3.14 -0.02 0.00 0.80 0.00 0.00 33.01 30.80 1ucy s GLN 30 CO 0.39 -0.61 -0.15 0.08 -0.50 0.00 0.00 175.29 174.50 1ucy s VAL 31 N 1.04 1.19 -0.27 1.34 1.01 -0.75 -4.09 120.40 119.87 1ucy s VAL 31 Ca 0.70 -0.99 -0.05 0.00 0.00 0.00 0.00 61.98 61.63 1ucy s VAL 31 Cb -0.45 -1.06 0.00 0.00 0.00 0.00 0.00 36.38 34.88 1ucy s VAL 31 CO 0.33 0.06 0.03 -0.32 0.00 0.00 0.00 175.10 175.19 1ucy s MET 32 N -1.07 3.18 0.03 2.72 1.75 -0.51 -0.47 119.30 124.92 1ucy s MET 32 Ca 0.03 -0.78 -0.30 0.00 -1.25 0.00 0.00 55.69 53.38 1ucy s MET 32 Cb -0.08 -3.22 -0.05 0.00 2.84 0.00 0.00 34.83 34.32 1ucy s MET 32 CO 0.01 -0.35 1.17 -0.51 -0.65 0.00 0.00 175.02 174.69 1ucy s LEU 33 N 1.48 4.35 -0.01 4.11 1.43 0.72 -1.72 118.68 129.04 1ucy s LEU 33 Ca 0.03 1.92 0.04 0.00 -1.03 0.00 0.00 54.13 55.09 1ucy s LEU 33 Cb -0.16 -3.57 -0.01 0.00 0.03 0.00 0.00 46.19 42.48 1ucy s LEU 33 CO 0.00 -0.46 -0.12 0.12 0.23 0.00 0.00 176.35 176.12 1ucy s PHE 34 N 1.29 1.05 -0.07 0.29 5.36 -0.37 -0.53 117.98 124.99 1ucy s PHE 34 Ca 0.57 -0.21 -0.30 0.00 -0.96 0.00 0.00 56.93 56.04 1ucy s PHE 34 Cb -0.27 -0.68 -0.02 0.00 -0.34 0.00 0.00 43.02 41.70 1ucy s PHE 34 CO 0.28 -0.03 1.05 0.50 -1.46 0.00 0.00 175.22 175.56 1ucy s ARG 35 N -0.23 4.43 0.37 10.12 3.52 -0.62 -0.34 118.95 136.19 1ucy s ARG 35 Ca 0.04 1.48 0.06 0.00 -0.13 0.00 0.00 55.73 57.17 1ucy s ARG 35 Cb -0.05 -3.52 0.71 0.00 -1.56 0.00 0.00 34.95 30.53 1ucy s ARG 35 CO -0.00 -0.30 1.94 -0.22 -0.81 0.00 0.00 175.30 175.91 1ucy h LYS 36 N 7.11 0.48 -1.20 5.12 3.64 -1.01 -3.37 116.57 127.35 1ucy h LYS 36 Ca -0.34 -0.08 0.14 0.00 -1.27 0.00 0.00 60.65 59.10 1ucy h LYS 36 Cb 1.16 -0.08 -0.22 0.00 -0.41 0.00 0.00 32.23 32.68 1ucy h LYS 36 CO 0.84 0.46 0.02 0.45 -2.27 0.00 0.00 179.45 178.96 1ucy s SER 36 N -6.75 -0.87 1.10 4.20 0.15 -1.26 -4.62 113.70 105.65 1ucy s SER 36 Ca -0.07 0.97 -0.18 0.00 0.70 0.00 0.00 55.95 57.36 1ucy s SER 36 Cb 0.16 1.90 0.26 0.00 -1.71 0.00 0.00 66.02 66.63 1ucy s SER 36 CO 0.75 -0.17 1.25 -2.16 1.20 0.00 0.00 173.24 174.11 1ucy s PRO 37 N 2.72 -0.47 0.00 5.44 0.04 -1.26 -5.03 135.00 136.44 1ucy s PRO 37 Ca 0.01 -0.36 0.00 0.00 0.04 0.00 0.00 61.00 60.69 1ucy s PRO 37 Cb -0.10 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 32.73 1ucy s PRO 37 CO -0.18 -3.16 0.91 0.00 0.04 0.00 0.00 177.00 174.61 1ucy n GLN 38 N -4.30 0.00 -1.53 4.56 -0.00 -1.26 -4.49 117.38 110.36 1ucy n GLN 38 Ca 0.16 0.41 -0.45 0.00 -0.00 0.00 0.00 57.00 57.12 1ucy n GLN 38 Cb 0.59 -1.57 -0.02 0.00 -0.00 0.00 0.00 30.24 29.25 1ucy n GLN 38 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.06 176.21 1ucy n GLU 39 N -1.41 0.93 -2.44 2.61 0.28 -1.26 -4.55 120.64 114.80 1ucy n GLU 39 Ca 0.00 0.33 -0.41 0.00 -0.16 0.00 0.00 57.16 56.91 1ucy n GLU 39 Cb 0.07 -1.60 -0.04 0.00 1.43 0.00 0.00 31.44 31.30 1ucy n GLU 39 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 1ucy s LEU 40 N 1.20 4.45 -0.15 -1.84 0.20 -1.26 -1.59 118.68 119.68 1ucy s LEU 40 Ca 0.60 2.12 0.11 0.00 0.69 0.00 0.00 54.13 57.65 1ucy s LEU 40 Cb -0.75 -3.60 -0.17 0.00 -0.43 0.00 0.00 46.19 41.25 1ucy s LEU 40 CO 0.59 -0.33 0.00 0.18 -0.29 0.00 0.00 176.35 176.50 1ucy n LEU 41 N 2.78 0.63 -3.74 -0.68 4.77 0.31 -4.91 117.00 116.17 1ucy n LEU 41 Ca 0.05 -0.02 0.02 0.00 -0.03 0.00 0.00 56.01 56.02 1ucy n LEU 41 Cb 0.46 0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 1ucy n LEU 41 CO 0.55 0.46 1.06 0.00 -1.33 0.00 0.00 177.39 178.13 1ucy s GLY 43 N -3.25 1.59 0.13 0.00 0.00 0.26 -0.20 107.32 105.85 1ucy s GLY 43 Ca 0.19 -1.22 -0.03 0.00 0.00 0.00 0.00 44.72 43.66 1ucy s GLY 43 CO -0.03 -1.08 0.22 0.00 0.00 0.00 0.00 173.10 172.21 1ucy n ALA 44 N -1.92 -0.35 -3.37 3.20 0.00 0.38 -3.58 120.51 114.86 1ucy n ALA 44 Ca 0.01 -0.50 -0.15 0.00 0.00 0.00 0.00 53.44 52.80 1ucy n ALA 44 Cb 0.58 0.40 -0.08 0.00 0.00 0.00 0.00 19.45 20.35 1ucy n ALA 44 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ucy s SER 45 N -1.73 -0.42 -0.37 0.00 1.04 -0.40 -1.81 113.70 110.02 1ucy s SER 45 Ca 0.08 0.49 -0.23 0.00 0.48 0.00 0.00 55.95 56.77 1ucy s SER 45 Cb -0.01 0.53 0.01 0.00 0.10 0.00 0.00 66.02 66.65 1ucy s SER 45 CO 0.06 -0.45 0.78 -0.76 0.98 0.00 0.00 173.24 173.84 1ucy s LEU 46 N -0.96 4.14 0.00 2.42 1.43 0.48 -0.29 118.68 125.90 1ucy s LEU 46 Ca -0.10 0.33 0.23 0.00 -1.03 0.00 0.00 54.13 53.56 1ucy s LEU 46 Cb -0.03 -3.01 0.11 0.00 0.03 0.00 0.00 46.19 43.28 1ucy s LEU 46 CO 0.06 -0.73 1.17 2.30 0.23 0.00 0.00 176.35 179.38 1ucy n ILE 47 N 5.80 0.00 0.00 -0.59 -5.35 -0.42 -1.89 119.36 116.90 1ucy n ILE 47 Ca 0.03 -0.32 0.00 0.00 -0.27 0.00 0.00 62.75 62.19 1ucy n ILE 47 Cb 0.48 1.26 0.00 0.00 -1.74 0.00 0.00 39.64 39.65 1ucy n ILE 47 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1ucy n SER 48 N 0.32 0.00 0.00 7.28 3.41 -1.20 -4.77 113.62 118.66 1ucy n SER 48 Ca 0.11 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.78 1ucy n SER 48 Cb 0.50 0.00 0.32 0.00 -0.26 0.00 0.00 64.21 64.77 1ucy n SER 48 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1ucy n ASP 49 N 0.00 0.00 0.00 4.04 5.75 -1.26 -3.34 116.55 121.74 1ucy n ASP 49 Ca 0.00 -0.15 0.00 0.00 -0.01 0.00 0.00 54.79 54.63 1ucy n ASP 49 Cb 0.00 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 39.96 1ucy n ASP 49 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 1ucy n ARG 50 N -1.13 2.63 -4.81 0.11 3.00 -1.26 -0.73 116.66 114.47 1ucy n ARG 50 Ca 0.07 0.00 -0.25 0.00 -0.00 0.00 0.00 57.85 57.68 1ucy n ARG 50 Cb 0.06 -0.24 -0.15 0.00 0.00 0.00 0.00 32.46 32.13 1ucy n ARG 50 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 1ucy s TRP 51 N -0.39 1.56 -0.04 -0.14 0.52 -1.21 -0.29 118.94 118.94 1ucy s TRP 51 Ca 0.00 -0.30 0.05 0.00 0.02 0.00 0.00 56.10 55.87 1ucy s TRP 51 Cb 0.00 -1.00 -0.01 0.00 -1.15 0.00 0.00 33.47 31.32 1ucy s TRP 51 CO 0.00 -0.02 -0.19 0.08 0.02 0.00 0.00 176.95 176.84 1ucy s VAL 52 N -0.44 1.56 -0.05 4.03 1.01 -0.29 -1.31 120.40 124.92 1ucy s VAL 52 Ca 0.07 -0.80 -0.01 0.00 0.00 0.00 0.00 61.98 61.24 1ucy s VAL 52 Cb -0.07 -1.33 -0.03 0.00 0.00 0.00 0.00 36.38 34.95 1ucy s VAL 52 CO -0.01 0.45 0.01 -0.22 0.00 0.00 0.00 175.10 175.33 1ucy s LEU 53 N -0.07 3.61 0.00 3.92 2.96 0.61 -0.59 118.68 129.12 1ucy s LEU 53 Ca -0.02 0.10 -0.10 0.00 -0.22 0.00 0.00 54.13 53.89 1ucy s LEU 53 Cb -0.11 -1.94 0.04 0.00 0.50 0.00 0.00 46.19 44.67 1ucy s LEU 53 CO 0.02 0.33 0.58 1.07 -1.32 0.00 0.00 176.35 177.03 1ucy n THR 54 N 1.77 0.00 -3.10 3.68 5.66 -0.56 -1.28 114.28 120.46 1ucy n THR 54 Ca -0.17 -0.84 -0.39 0.00 -3.05 0.00 0.00 64.05 59.60 1ucy n THR 54 Cb 0.53 0.77 -0.05 0.00 -1.55 0.00 0.00 70.33 70.03 1ucy n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ucy s ALA 55 N -1.92 3.45 0.44 1.79 0.00 -1.26 -1.30 121.76 122.96 1ucy s ALA 55 Ca 0.14 0.17 0.13 0.00 0.00 0.00 0.00 51.96 52.40 1ucy s ALA 55 Cb -0.03 -2.85 1.04 0.00 0.00 0.00 0.00 23.12 21.27 1ucy s ALA 55 CO 0.10 0.18 2.01 0.00 0.00 0.00 0.00 175.76 178.05 1ucy h ALA 56 N 5.30 1.98 0.00 0.00 0.00 -1.73 -1.86 119.26 122.95 1ucy h ALA 56 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1ucy h ALA 56 Cb 1.21 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1ucy h ALA 56 CO 0.69 -0.08 0.00 -2.39 0.00 0.00 0.00 179.25 177.47 1ucy n HIS 57 N -4.47 0.00 0.60 0.00 1.44 -1.26 -0.76 115.22 110.77 1ucy n HIS 57 Ca 0.07 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.91 1ucy n HIS 57 Cb 0.29 -0.19 0.31 0.00 0.12 0.00 0.00 29.99 30.52 1ucy n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1ucy n LEU 59 N -2.22 2.38 -3.76 0.00 4.77 -0.69 -4.91 117.00 112.57 1ucy n LEU 59 Ca 0.05 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.76 1ucy n LEU 59 Cb 0.44 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.36 1ucy n LEU 59 CO 0.33 0.40 -0.37 -0.22 -1.33 0.00 0.00 177.39 176.19 1ucy s LEU 60 N -4.78 1.17 0.21 2.23 2.96 0.06 -0.94 118.68 119.60 1ucy s LEU 60 Ca 0.00 -0.71 -0.16 0.00 -0.22 0.00 0.00 54.13 53.04 1ucy s LEU 60 Cb 0.00 -0.62 0.02 0.00 0.50 0.00 0.00 46.19 46.09 1ucy s LEU 60 CO 0.00 -0.28 0.52 -0.47 -1.32 0.00 0.00 176.35 174.80 1ucy s TYR 60 N 1.84 -0.01 0.00 5.38 5.04 -0.78 -4.03 117.35 124.79 1ucy s TYR 60 Ca -0.00 -0.34 0.00 0.00 -2.44 0.00 0.00 57.07 54.29 1ucy s TYR 60 Cb -0.16 0.36 0.00 0.00 0.35 0.00 0.00 41.96 42.51 1ucy s TYR 60 CO -0.07 -0.95 0.00 -0.35 -1.34 0.00 0.00 175.55 172.84 1ucy n PRO 60 N -0.35 0.00 -0.22 4.97 -0.04 -1.26 -3.17 135.00 134.92 1ucy n PRO 60 Ca -0.08 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.46 1ucy n PRO 60 Cb 0.62 0.00 0.20 0.00 -0.04 0.00 0.00 33.50 34.28 1ucy n PRO 60 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1ucy n TRP 60 N 0.00 0.59 -3.49 0.54 7.02 -1.26 -4.97 117.44 115.87 1ucy n TRP 60 Ca 0.00 -0.45 -0.22 0.00 -1.02 0.00 0.00 57.50 55.81 1ucy n TRP 60 Cb 0.00 -0.02 0.06 0.00 -2.42 0.00 0.00 31.31 28.93 1ucy n TRP 60 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1ucy n ASP 60 N 0.94 -4.95 -4.12 -0.99 9.92 -1.22 -4.99 116.55 111.15 1ucy n ASP 60 Ca 0.16 -0.83 -0.33 0.00 -0.53 0.00 0.00 54.79 53.26 1ucy n ASP 60 Cb 0.49 -4.36 -0.16 0.00 -0.64 0.00 0.00 41.12 36.45 1ucy n ASP 60 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1ucy s LYS 60 N -5.29 2.95 -0.49 -1.24 2.20 -1.19 -5.00 119.74 111.68 1ucy s LYS 60 Ca 0.36 -0.86 0.05 0.00 -0.36 0.00 0.00 55.97 55.16 1ucy s LYS 60 Cb -0.08 -2.60 0.21 0.00 -1.51 0.00 0.00 37.83 33.84 1ucy s LYS 60 CO 0.79 -0.24 0.81 -1.71 -0.36 0.00 0.00 175.35 174.65 1ucy n ASN 60 N 4.61 -3.13 -4.76 1.43 5.15 -1.15 -1.87 115.26 115.54 1ucy n ASN 60 Ca -0.20 -2.84 -0.40 0.00 -0.60 0.00 0.00 54.58 50.54 1ucy n ASN 60 Cb 0.49 1.68 -0.04 0.00 -0.53 0.00 0.00 39.78 41.38 1ucy n ASN 60 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1ucy s PHE 60 N 0.82 3.53 0.56 1.20 0.08 -0.11 -5.02 117.98 119.04 1ucy s PHE 60 Ca 0.30 1.70 0.05 0.00 0.12 0.00 0.00 56.93 59.09 1ucy s PHE 60 Cb 0.07 -3.25 0.05 0.00 -0.57 0.00 0.00 43.02 39.32 1ucy s PHE 60 CO -0.10 -0.55 0.41 0.95 -0.10 0.00 0.00 175.22 175.83 1ucy s THR 60 N -1.25 1.51 0.35 0.64 -4.23 -1.26 -4.90 115.64 106.49 1ucy s THR 60 Ca 0.47 -1.50 0.04 0.00 -1.18 0.00 0.00 61.69 59.51 1ucy s THR 60 Cb -0.30 -2.01 0.28 0.00 1.34 0.00 0.00 72.50 71.81 1ucy s THR 60 CO 0.38 0.00 1.97 0.58 -0.54 0.00 0.00 174.62 177.01 1ucy h VAL 61 N 0.69 1.08 -0.11 2.29 2.07 -1.93 -1.78 116.25 118.56 1ucy h VAL 61 Ca -0.36 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 66.87 1ucy h VAL 61 Cb 1.31 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1ucy h VAL 61 CO 0.57 0.15 0.00 -0.90 0.02 0.00 0.00 177.57 177.41 1ucy n ASP 62 N -4.47 0.85 -0.01 0.57 5.75 -1.26 -3.73 116.55 114.25 1ucy n ASP 62 Ca 0.10 -2.03 0.09 0.00 -0.01 0.00 0.00 54.79 52.94 1ucy n ASP 62 Cb 0.16 -0.17 -0.16 0.00 -1.03 0.00 0.00 41.12 39.92 1ucy n ASP 62 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1ucy n ASP 63 N -0.11 0.33 -4.23 -1.12 8.00 -0.67 -4.89 116.55 113.87 1ucy n ASP 63 Ca 0.04 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.40 1ucy n ASP 63 Cb 0.16 1.89 -0.10 0.00 -0.02 0.00 0.00 41.12 43.05 1ucy n ASP 63 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1ucy s LEU 64 N -4.46 2.50 0.20 0.64 1.43 -1.24 -0.36 118.68 117.39 1ucy s LEU 64 Ca -0.08 -0.97 0.03 0.00 -1.03 0.00 0.00 54.13 52.08 1ucy s LEU 64 Cb 0.13 -0.30 -0.05 0.00 0.03 0.00 0.00 46.19 46.00 1ucy s LEU 64 CO 0.85 -0.34 -0.01 -1.48 0.23 0.00 0.00 176.35 175.60 1ucy s LEU 65 N -3.01 2.20 -0.04 1.79 0.05 0.53 -4.27 118.68 115.93 1ucy s LEU 65 Ca 0.14 -1.18 0.07 0.00 0.05 0.00 0.00 54.13 53.21 1ucy s LEU 65 Cb 0.02 -0.19 -0.02 0.00 -2.05 0.00 0.00 46.19 43.95 1ucy s LEU 65 CO -0.00 -0.51 -0.25 -0.69 -0.55 0.00 0.00 176.35 174.34 1ucy s VAL 66 N -3.50 2.07 -0.21 1.48 1.01 -0.30 -1.24 120.40 119.71 1ucy s VAL 66 Ca 0.25 -1.08 -0.01 0.00 0.00 0.00 0.00 61.98 61.14 1ucy s VAL 66 Cb 0.05 -1.73 0.01 0.00 0.00 0.00 0.00 36.38 34.72 1ucy s VAL 66 CO 0.06 0.58 -0.12 -0.13 0.00 0.00 0.00 175.10 175.49 1ucy s ARG 67 N -0.39 3.11 0.03 2.72 0.52 -0.70 -2.25 118.95 121.98 1ucy s ARG 67 Ca 0.03 -0.78 0.07 0.00 -0.52 0.00 0.00 55.73 54.53 1ucy s ARG 67 Cb -0.12 -2.80 -0.03 0.00 0.52 0.00 0.00 34.95 32.52 1ucy s ARG 67 CO 0.01 -0.24 -0.19 0.42 0.02 0.00 0.00 175.30 175.32 1ucy s ILE 68 N 1.37 2.70 0.00 1.52 1.01 0.52 -1.42 121.20 126.90 1ucy s ILE 68 Ca 0.04 -1.15 0.00 0.00 0.00 0.00 0.00 60.65 59.54 1ucy s ILE 68 Cb -0.14 -2.11 0.00 0.00 0.01 0.00 0.00 42.46 40.22 1ucy s ILE 68 CO -0.08 0.38 0.00 0.61 0.00 0.00 0.00 174.94 175.86 1ucy n GLY 69 N 1.72 0.83 3.90 6.18 0.00 -1.26 -0.61 105.19 115.94 1ucy n GLY 69 Ca -0.16 -0.10 -0.29 0.00 0.00 0.00 0.00 46.02 45.47 1ucy n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ucy s LYS 70 N -0.67 3.22 0.00 1.61 1.02 -1.26 -4.32 119.74 119.34 1ucy s LYS 70 Ca 0.00 0.34 0.00 0.00 0.02 0.00 0.00 55.97 56.33 1ucy s LYS 70 Cb 0.00 -2.19 0.00 0.00 -0.52 0.00 0.00 37.83 35.12 1ucy s LYS 70 CO 0.00 -0.63 0.00 1.58 -0.92 0.00 0.00 175.35 175.38 1ucy n HIS 71 N -2.65 0.00 -2.75 3.18 -0.00 -1.26 -4.93 115.22 106.82 1ucy n HIS 71 Ca 0.04 0.00 -0.40 0.00 -0.00 0.00 0.00 57.72 57.36 1ucy n HIS 71 Cb 0.56 0.33 -0.05 0.00 -0.00 0.00 0.00 29.99 30.83 1ucy n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1ucy s SER 72 N -4.98 7.58 0.14 0.26 0.15 -1.26 -0.47 113.70 115.13 1ucy s SER 72 Ca 0.00 1.88 0.03 0.00 0.70 0.00 0.00 55.95 58.56 1ucy s SER 72 Cb 0.00 -2.60 -0.10 0.00 -1.71 0.00 0.00 66.02 61.61 1ucy s SER 72 CO 0.00 0.07 1.32 -0.09 1.20 0.00 0.00 173.24 175.74 1ucy h ARG 73 N 4.71 0.14 0.00 5.44 2.43 -1.57 -3.40 114.38 122.11 1ucy h ARG 73 Ca -0.44 -0.18 -0.35 0.00 -0.81 0.00 0.00 59.98 58.19 1ucy h ARG 73 Cb 1.20 0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 30.75 1ucy h ARG 73 CO 0.69 1.00 -2.33 0.25 -1.51 0.00 0.00 179.97 178.07 1ucy n THR 74 N -3.55 1.33 -3.62 0.20 -2.24 -1.26 -5.01 114.28 100.14 1ucy n THR 74 Ca -0.03 -0.64 -0.34 0.00 -2.27 0.00 0.00 64.05 60.77 1ucy n THR 74 Cb 0.88 -1.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.06 1ucy n THR 74 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ucy s ARG 75 N -2.47 3.71 -0.46 -0.78 1.70 -1.26 -5.02 118.95 114.37 1ucy s ARG 75 Ca -0.23 0.10 -0.28 0.00 -0.47 0.00 0.00 55.73 54.85 1ucy s ARG 75 Cb 0.07 -2.99 -0.00 0.00 -0.57 0.00 0.00 34.95 31.46 1ucy s ARG 75 CO 0.64 0.56 1.57 -0.47 -1.08 0.00 0.00 175.30 176.52 1ucy s TYR 76 N -1.42 2.12 -1.06 5.89 5.04 -1.26 -4.86 117.35 121.80 1ucy s TYR 76 Ca 0.33 0.62 -0.17 0.00 -2.44 0.00 0.00 57.07 55.41 1ucy s TYR 76 Cb -0.14 -4.26 0.14 0.00 0.35 0.00 0.00 41.96 38.06 1ucy s TYR 76 CO 0.19 -2.26 1.28 -1.21 -1.34 0.00 0.00 175.55 172.21 1ucy s GLU 77 N 5.55 3.81 0.63 4.97 2.02 -1.26 -4.89 118.70 129.53 1ucy s GLU 77 Ca 0.64 -2.08 0.33 0.00 0.02 0.00 0.00 54.97 53.88 1ucy s GLU 77 Cb -0.15 -5.02 1.82 0.00 0.10 0.00 0.00 34.13 30.89 1ucy s GLU 77 CO 0.29 -1.80 2.11 0.07 0.02 0.00 0.00 175.26 175.95 1ucy h ARG 77 N 8.14 0.00 -0.01 1.61 0.11 -1.91 0.31 114.38 122.63 1ucy h ARG 77 Ca 0.23 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.31 1ucy h ARG 77 Cb 0.96 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.04 1ucy h ARG 77 CO 1.19 0.00 -0.35 0.36 0.10 0.00 0.00 179.97 181.26 1ucy n LYS 78 N -3.42 1.07 0.00 0.08 2.85 -1.26 -4.61 118.16 112.87 1ucy n LYS 78 Ca -0.00 -0.78 0.00 0.00 -1.05 0.00 0.00 58.31 56.48 1ucy n LYS 78 Cb 0.29 -1.48 0.00 0.00 -0.65 0.00 0.00 35.03 33.19 1ucy n LYS 78 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 177.40 178.68 1ucy n VAL 79 N -0.29 0.00 -2.06 0.58 0.24 -1.02 -5.11 118.33 110.67 1ucy n VAL 79 Ca 0.11 0.00 -0.39 0.00 -2.04 0.00 0.00 64.34 62.01 1ucy n VAL 79 Cb 0.41 -0.30 -0.01 0.00 -1.47 0.00 0.00 33.84 32.48 1ucy n VAL 79 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1ucy s GLU 80 N -1.57 3.99 0.07 7.34 2.12 0.07 -4.74 118.70 125.97 1ucy s GLU 80 Ca 0.00 2.15 0.06 0.00 0.36 0.00 0.00 54.97 57.55 1ucy s GLU 80 Cb 0.00 -2.77 -0.03 0.00 0.26 0.00 0.00 34.13 31.59 1ucy s GLU 80 CO 0.00 -0.48 -0.17 0.15 -0.54 0.00 0.00 175.26 174.22 1ucy s LYS 81 N -2.22 1.00 0.08 4.30 -0.14 0.22 -4.88 119.74 118.09 1ucy s LYS 81 Ca 0.56 -0.99 0.04 0.00 -1.36 0.00 0.00 55.97 54.23 1ucy s LYS 81 Cb -0.38 -1.11 -0.03 0.00 -1.68 0.00 0.00 37.83 34.63 1ucy s LYS 81 CO 0.49 0.26 -0.12 0.42 -0.76 0.00 0.00 175.35 175.64 1ucy s ILE 82 N -1.12 0.97 -0.05 2.17 1.01 -1.26 -0.35 121.20 122.57 1ucy s ILE 82 Ca 0.02 -1.39 -0.29 0.00 0.00 0.00 0.00 60.65 58.99 1ucy s ILE 82 Cb -0.10 -1.10 0.06 0.00 0.01 0.00 0.00 42.46 41.34 1ucy s ILE 82 CO 0.03 -0.37 0.64 -0.55 0.00 0.00 0.00 174.94 174.69 1ucy s SER 83 N -1.97 -0.61 0.59 3.58 0.15 -0.96 -4.98 113.70 109.52 1ucy s SER 83 Ca -0.01 0.65 -0.01 0.00 0.70 0.00 0.00 55.95 57.28 1ucy s SER 83 Cb -0.08 0.51 0.04 0.00 -1.71 0.00 0.00 66.02 64.79 1ucy s SER 83 CO 0.01 -0.59 0.84 -0.04 1.20 0.00 0.00 173.24 174.66 1ucy s MET 84 N -1.21 2.44 0.05 5.44 -1.94 -1.26 -1.15 119.30 121.67 1ucy s MET 84 Ca -0.11 -0.67 -0.06 0.00 -1.71 0.00 0.00 55.69 53.14 1ucy s MET 84 Cb -0.01 -2.41 -0.05 0.00 2.01 0.00 0.00 34.83 34.38 1ucy s MET 84 CO 0.09 -0.86 0.30 -0.51 -0.01 0.00 0.00 175.02 174.04 1ucy s LEU 85 N -4.89 4.34 -0.28 -0.03 1.43 -1.26 -0.35 118.68 117.64 1ucy s LEU 85 Ca 0.58 0.56 -0.13 0.00 -1.03 0.00 0.00 54.13 54.10 1ucy s LEU 85 Cb -0.10 -2.88 -0.12 0.00 0.03 0.00 0.00 46.19 43.11 1ucy s LEU 85 CO 0.40 0.19 -0.35 -0.67 0.23 0.00 0.00 176.35 176.15 1ucy n ASP 86 N 0.77 1.96 -4.08 2.29 2.03 0.41 -4.57 116.55 115.36 1ucy n ASP 86 Ca -0.08 0.32 -0.12 0.00 0.52 0.00 0.00 54.79 55.44 1ucy n ASP 86 Cb 0.52 -0.81 -0.11 0.00 -0.72 0.00 0.00 41.12 40.01 1ucy n ASP 86 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1ucy s LYS 87 N -2.51 0.58 -0.08 -0.67 -0.14 -0.88 -4.98 119.74 111.07 1ucy s LYS 87 Ca -0.39 -0.91 0.02 0.00 -1.36 0.00 0.00 55.97 53.34 1ucy s LYS 87 Cb 0.15 -0.19 0.01 0.00 -1.68 0.00 0.00 37.83 36.12 1ucy s LYS 87 CO 0.50 0.01 -0.14 0.42 -0.76 0.00 0.00 175.35 175.38 1ucy s ILE 88 N -2.09 1.31 -0.16 2.17 1.01 -1.26 -2.06 121.20 120.12 1ucy s ILE 88 Ca -0.04 -0.57 -0.00 0.00 0.00 0.00 0.00 60.65 60.03 1ucy s ILE 88 Cb -0.05 -1.18 0.04 0.00 0.01 0.00 0.00 42.46 41.27 1ucy s ILE 88 CO -0.02 0.39 -0.07 -0.31 0.00 0.00 0.00 174.94 174.93 1ucy s TYR 89 N 0.67 1.78 -0.01 3.97 2.02 -0.39 -5.00 117.35 120.39 1ucy s TYR 89 Ca -0.14 -1.08 0.02 0.00 -0.37 0.00 0.00 57.07 55.51 1ucy s TYR 89 Cb -0.16 -1.36 -0.03 0.00 -0.40 0.00 0.00 41.96 40.00 1ucy s TYR 89 CO 0.04 -0.61 -0.05 0.42 -1.57 0.00 0.00 175.55 173.78 1ucy s ILE 90 N 1.61 3.79 0.11 2.71 1.01 -1.26 -0.64 121.20 128.52 1ucy s ILE 90 Ca 0.02 -0.69 -0.31 0.00 0.00 0.00 0.00 60.65 59.67 1ucy s ILE 90 Cb -0.14 -2.65 -0.10 0.00 0.01 0.00 0.00 42.46 39.58 1ucy s ILE 90 CO -0.08 0.42 1.77 -2.28 0.00 0.00 0.00 174.94 174.77 1ucy s HIS 91 N -1.00 2.25 0.62 3.97 5.65 -1.06 -4.85 115.29 120.87 1ucy s HIS 91 Ca 0.17 0.09 0.29 0.00 0.25 0.00 0.00 55.06 55.86 1ucy s HIS 91 Cb -0.11 -4.12 1.55 0.00 -1.18 0.00 0.00 32.58 28.73 1ucy s HIS 91 CO 0.07 -4.56 1.93 -1.00 -0.65 0.00 0.00 174.74 170.54 1ucy h PRO 92 N 8.45 0.00 -0.43 2.88 0.13 -1.93 -1.44 132.00 139.66 1ucy h PRO 92 Ca -0.45 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.54 1ucy h PRO 92 Cb 1.21 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.26 1ucy h PRO 92 CO 0.94 0.00 0.06 0.54 -0.23 0.00 0.00 178.00 179.32 1ucy n ARG 93 N -3.44 2.60 -2.07 0.86 1.74 -1.26 -4.98 116.66 110.10 1ucy n ARG 93 Ca 0.04 -3.03 -0.42 0.00 -0.77 0.00 0.00 57.85 53.67 1ucy n ARG 93 Cb 0.52 -1.92 -0.03 0.00 -1.02 0.00 0.00 32.46 30.01 1ucy n ARG 93 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1ucy s TYR 94 N -3.05 2.52 -0.55 -1.55 5.04 -0.55 -4.68 117.35 114.54 1ucy s TYR 94 Ca 0.46 0.51 -0.11 0.00 -2.44 0.00 0.00 57.07 55.49 1ucy s TYR 94 Cb 0.39 -3.82 0.14 0.00 0.35 0.00 0.00 41.96 39.02 1ucy s TYR 94 CO 0.06 -3.23 0.45 1.21 -1.34 0.00 0.00 175.55 172.70 1ucy s ASN 95 N 2.36 5.96 0.34 4.32 3.84 0.51 -4.92 114.94 127.35 1ucy s ASN 95 Ca 0.69 -2.04 0.22 0.00 0.21 0.00 0.00 52.86 51.95 1ucy s ASN 95 Cb -0.35 -2.09 0.19 0.00 -0.55 0.00 0.00 41.25 38.46 1ucy s ASN 95 CO 0.29 -0.71 1.37 4.11 -2.79 0.00 0.00 177.10 179.37 1ucy h TRP 96 N 8.40 0.00 0.26 0.43 5.08 -1.93 0.19 115.95 128.38 1ucy h TRP 96 Ca -0.18 0.00 -0.34 0.00 1.08 0.00 0.00 58.89 59.45 1ucy h TRP 96 Cb 1.07 0.00 0.04 0.00 -3.00 0.00 0.00 29.16 27.27 1ucy h TRP 96 CO 0.72 0.03 -1.49 0.87 -1.28 0.00 0.00 178.44 177.29 1ucy h LYS 97 N 0.00 0.54 0.00 0.12 1.57 -2.00 -3.41 116.57 113.39 1ucy h LYS 97 Ca -0.00 -0.93 0.00 0.00 -1.87 0.00 0.00 60.65 57.85 1ucy h LYS 97 Cb 1.02 0.35 0.00 0.00 0.08 0.00 0.00 32.23 33.68 1ucy h LYS 97 CO 0.00 1.44 -0.62 -1.91 -0.57 0.00 0.00 179.45 177.80 1ucy n GLU 97 N -3.71 0.47 -0.38 3.15 2.13 -1.26 -4.92 120.64 116.12 1ucy n GLU 97 Ca -0.17 0.46 0.00 0.00 0.66 0.00 0.00 57.16 58.11 1ucy n GLU 97 Cb 1.11 -1.64 0.00 0.00 0.27 0.00 0.00 31.44 31.18 1ucy n GLU 97 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1ucy n ASN 98 N -4.58 0.00 -3.12 4.31 0.23 -1.25 -4.81 115.26 106.04 1ucy n ASN 98 Ca -0.09 -1.53 -0.22 0.00 -0.53 0.00 0.00 54.58 52.21 1ucy n ASN 98 Cb 0.32 -0.11 0.01 0.00 -2.08 0.00 0.00 39.78 37.93 1ucy n ASN 98 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1ucy n LEU 99 N 0.00 -2.05 -4.73 -4.53 4.77 0.64 -4.91 117.00 106.18 1ucy n LEU 99 Ca 0.00 -0.29 -0.42 0.00 -0.03 0.00 0.00 56.01 55.27 1ucy n LEU 99 Cb 0.61 -2.54 -0.03 0.00 -2.33 0.00 0.00 43.42 39.13 1ucy n LEU 99 CO 0.00 0.16 1.05 -0.62 -1.33 0.00 0.00 177.39 176.65 1ucy s ASP 100 N -2.65 6.81 -0.94 -1.43 2.15 -1.06 -3.03 116.67 116.53 1ucy s ASP 100 Ca 0.32 2.42 -0.02 0.00 0.43 0.00 0.00 52.55 55.70 1ucy s ASP 100 Cb -0.16 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 39.87 1ucy s ASP 100 CO 0.39 -0.63 0.79 0.54 -0.17 0.00 0.00 175.17 176.10 1ucy n ARG 101 N 3.25 -5.27 -2.68 4.34 1.74 -1.26 -0.36 116.66 116.42 1ucy n ARG 101 Ca 0.09 0.64 -0.43 0.00 -0.77 0.00 0.00 57.85 57.38 1ucy n ARG 101 Cb 0.42 -5.06 0.00 0.00 -1.02 0.00 0.00 32.46 26.80 1ucy n ARG 101 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1ucy n ASP 102 N -2.46 5.01 -3.76 0.55 2.03 -1.17 -4.18 116.55 112.57 1ucy n ASP 102 Ca -0.17 -2.94 -0.13 0.00 0.52 0.00 0.00 54.79 52.07 1ucy n ASP 102 Cb 0.61 -1.68 -0.10 0.00 -0.72 0.00 0.00 41.12 39.23 1ucy n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1ucy s ILE 103 N 3.21 0.03 0.01 5.18 2.07 -1.26 -3.73 121.20 126.71 1ucy s ILE 103 Ca 0.50 -0.26 -0.18 0.00 -1.41 0.00 0.00 60.65 59.30 1ucy s ILE 103 Cb 0.02 -0.54 0.03 0.00 0.13 0.00 0.00 42.46 42.11 1ucy s ILE 103 CO 0.05 -0.14 0.40 0.00 -1.91 0.00 0.00 174.94 173.34 1ucy s ALA 104 N -0.61 -1.01 -0.03 1.50 0.00 -0.42 -2.56 121.76 118.62 1ucy s ALA 104 Ca -0.07 0.44 0.07 0.00 0.00 0.00 0.00 51.96 52.40 1ucy s ALA 104 Cb -0.04 0.19 -0.02 0.00 0.00 0.00 0.00 23.12 23.25 1ucy s ALA 104 CO 0.02 -0.37 -0.26 -0.51 0.00 0.00 0.00 175.76 174.65 1ucy s LEU 105 N -1.63 2.05 -0.22 0.00 1.43 0.18 -1.50 118.68 119.00 1ucy s LEU 105 Ca -0.09 -0.48 0.02 0.00 -1.03 0.00 0.00 54.13 52.54 1ucy s LEU 105 Cb -0.02 -1.34 0.04 0.00 0.03 0.00 0.00 46.19 44.90 1ucy s LEU 105 CO 0.02 0.30 -0.13 -0.76 0.23 0.00 0.00 176.35 176.00 1ucy s LEU 106 N -0.47 2.73 -0.23 1.79 1.02 0.25 -1.26 118.68 122.51 1ucy s LEU 106 Ca 0.06 -1.04 -0.22 0.00 0.02 0.00 0.00 54.13 52.95 1ucy s LEU 106 Cb -0.11 -1.43 -0.02 0.00 0.02 0.00 0.00 46.19 44.65 1ucy s LEU 106 CO 0.00 -0.13 0.69 -1.59 0.02 0.00 0.00 176.35 175.35 1ucy s LYS 107 N 1.24 4.17 0.66 1.70 0.00 -0.87 -1.13 119.74 125.51 1ucy s LYS 107 Ca -0.03 0.69 -0.15 0.00 0.00 0.00 0.00 55.97 56.49 1ucy s LYS 107 Cb -0.17 -3.62 0.00 0.00 0.00 0.00 0.00 37.83 34.04 1ucy s LYS 107 CO -0.08 -0.37 1.11 -0.51 0.00 0.00 0.00 175.35 175.50 1ucy s LEU 108 N 2.36 3.39 0.27 2.77 1.43 0.60 -0.44 118.68 129.05 1ucy s LEU 108 Ca 0.30 2.01 0.04 0.00 -1.03 0.00 0.00 54.13 55.45 1ucy s LEU 108 Cb -0.16 -4.55 0.38 0.00 0.03 0.00 0.00 46.19 41.89 1ucy s LEU 108 CO 0.09 -1.65 1.67 0.50 0.23 0.00 0.00 176.35 177.19 1ucy h LYS 109 N 0.03 0.36 -4.28 1.70 1.63 -0.94 -3.38 116.57 111.68 1ucy h LYS 109 Ca -0.47 -0.17 -0.20 0.00 -0.85 0.00 0.00 60.65 58.96 1ucy h LYS 109 Cb 1.25 -0.00 -0.19 0.00 -0.60 0.00 0.00 32.23 32.68 1ucy h LYS 109 CO 0.54 0.70 -0.71 -0.98 -3.45 0.00 0.00 179.45 175.56 1ucy s ARG 110 N -4.20 0.50 0.51 1.90 1.70 -1.26 -4.93 118.95 113.17 1ucy s ARG 110 Ca -0.06 -0.86 -0.20 0.00 -0.47 0.00 0.00 55.73 54.14 1ucy s ARG 110 Cb 0.13 -0.03 -0.07 0.00 -0.57 0.00 0.00 34.95 34.42 1ucy s ARG 110 CO 0.79 -0.03 1.11 -2.14 -1.08 0.00 0.00 175.30 173.96 1ucy s PRO 111 N -2.27 3.54 -0.02 3.89 0.02 -1.26 -4.85 135.00 134.05 1ucy s PRO 111 Ca -0.06 1.59 -0.07 0.00 0.02 0.00 0.00 61.00 62.47 1ucy s PRO 111 Cb -0.05 -2.11 -0.05 0.00 0.02 0.00 0.00 34.50 32.32 1ucy s PRO 111 CO -0.03 -0.69 0.26 0.42 -0.33 0.00 0.00 177.00 176.63 1ucy s ILE 112 N -1.77 5.31 -0.27 2.83 -1.09 0.09 -5.03 121.20 121.28 1ucy s ILE 112 Ca 0.70 0.24 -0.20 0.00 -2.23 0.00 0.00 60.65 59.16 1ucy s ILE 112 Cb -0.23 -3.55 -0.02 0.00 -1.58 0.00 0.00 42.46 37.08 1ucy s ILE 112 CO 0.27 0.43 0.61 -0.70 -1.23 0.00 0.00 174.94 174.32 1ucy s GLU 113 N -1.56 4.05 0.68 2.79 2.12 -1.26 -4.79 118.70 120.73 1ucy s GLU 113 Ca 0.25 0.45 -0.15 0.00 0.36 0.00 0.00 54.97 55.88 1ucy s GLU 113 Cb -0.13 -3.67 0.01 0.00 0.26 0.00 0.00 34.13 30.60 1ucy s GLU 113 CO 0.14 -0.44 1.12 -0.51 -0.54 0.00 0.00 175.26 175.03 1ucy s LEU 114 N 2.50 3.35 0.00 2.70 1.02 -1.26 -4.91 118.68 122.08 1ucy s LEU 114 Ca 0.25 2.04 0.00 0.00 0.02 0.00 0.00 54.13 56.44 1ucy s LEU 114 Cb -0.15 -4.55 0.00 0.00 0.02 0.00 0.00 46.19 41.50 1ucy s LEU 114 CO 0.09 -1.76 0.00 -1.54 0.02 0.00 0.00 176.35 173.17 1ucy n SER 115 N -2.54 0.00 0.12 2.29 3.41 -0.18 -4.94 113.62 111.78 1ucy n SER 115 Ca 0.11 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.70 1ucy n SER 115 Cb 0.52 0.00 0.11 0.00 -0.26 0.00 0.00 64.21 64.57 1ucy n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1ucy h ASP 116 N 0.00 0.00 -0.01 4.04 3.32 -1.99 -3.21 116.42 118.56 1ucy h ASP 116 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ucy h ASP 116 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1ucy h ASP 116 CO 0.00 0.68 -0.45 -1.22 -1.72 0.00 0.00 179.24 176.53 1ucy n TYR 117 N -3.62 0.00 -3.77 4.55 4.01 -1.26 -4.85 117.16 112.22 1ucy n TYR 117 Ca -0.01 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.46 1ucy n TYR 117 Cb 0.69 0.00 -0.17 0.00 -0.31 0.00 0.00 39.34 39.56 1ucy n TYR 117 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1ucy s ILE 118 N -2.35 0.64 -0.13 -0.72 1.01 -1.21 -4.29 121.20 114.15 1ucy s ILE 118 Ca 0.17 -0.49 -0.18 0.00 0.00 0.00 0.00 60.65 60.15 1ucy s ILE 118 Cb 0.17 -1.03 0.04 0.00 0.01 0.00 0.00 42.46 41.66 1ucy s ILE 118 CO 0.54 -0.08 0.47 -2.28 0.00 0.00 0.00 174.94 173.59 1ucy s HIS 119 N 1.82 -0.47 0.46 3.97 2.46 -0.49 -1.01 115.29 122.03 1ucy s HIS 119 Ca 0.00 1.05 -0.20 0.00 0.47 0.00 0.00 55.06 56.38 1ucy s HIS 119 Cb -0.16 0.19 -0.10 0.00 -0.13 0.00 0.00 32.58 32.38 1ucy s HIS 119 CO -0.07 -0.33 0.97 -1.25 -2.47 0.00 0.00 174.74 171.59 1ucy s PRO 120 N -0.28 4.08 0.13 2.88 0.04 -1.26 -3.04 135.00 137.55 1ucy s PRO 120 Ca -0.04 1.11 -0.02 0.00 0.04 0.00 0.00 61.00 62.09 1ucy s PRO 120 Cb -0.03 -2.15 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 1ucy s PRO 120 CO 0.03 -0.16 0.31 0.54 0.04 0.00 0.00 177.00 177.76 1ucy s VAL 121 N -2.27 5.26 0.53 -0.36 0.11 -0.79 -4.96 120.40 117.92 1ucy s VAL 121 Ca 0.62 -0.26 -0.09 0.00 -2.93 0.00 0.00 61.98 59.32 1ucy s VAL 121 Cb -0.10 -3.66 -0.04 0.00 -1.53 0.00 0.00 36.38 31.04 1ucy s VAL 121 CO 0.19 0.02 0.89 0.00 -3.33 0.00 0.00 175.10 172.87 1ucy s LEU 123 N -4.73 3.95 0.42 0.00 1.43 -1.26 -1.37 118.68 117.12 1ucy s LEU 123 Ca 0.52 0.24 -0.26 0.00 -1.03 0.00 0.00 54.13 53.59 1ucy s LEU 123 Cb -0.11 -1.96 -0.09 0.00 0.03 0.00 0.00 46.19 44.07 1ucy s LEU 123 CO 0.45 0.32 1.41 -2.16 0.23 0.00 0.00 176.35 176.60 1ucy s PRO 124 N -0.51 3.87 0.58 1.29 0.04 -1.26 -4.91 135.00 134.11 1ucy s PRO 124 Ca 0.10 2.38 0.07 0.00 0.04 0.00 0.00 61.00 63.59 1ucy s PRO 124 Cb -0.12 -2.77 0.08 0.00 0.04 0.00 0.00 34.50 31.74 1ucy s PRO 124 CO 0.02 -0.65 0.80 0.16 0.04 0.00 0.00 177.00 177.37 1ucy s ASP 125 N -0.48 5.02 0.40 6.66 1.47 -1.26 -4.90 116.67 123.58 1ucy s ASP 125 Ca 0.58 -0.64 0.07 0.00 1.18 0.00 0.00 52.55 53.73 1ucy s ASP 125 Cb -0.43 0.04 0.82 0.00 -0.34 0.00 0.00 42.92 43.01 1ucy s ASP 125 CO 0.56 -1.37 2.02 0.50 0.68 0.00 0.00 175.17 177.57 1ucy h LYS 126 N 0.08 0.51 -0.00 2.11 3.64 -1.98 -2.62 116.57 118.31 1ucy h LYS 126 Ca -0.33 -0.05 -0.18 0.00 -1.27 0.00 0.00 60.65 58.82 1ucy h LYS 126 Cb 1.28 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.98 1ucy h LYS 126 CO 0.42 0.39 -0.82 0.37 -2.27 0.00 0.00 179.45 177.54 1ucy h GLN 127 N 0.52 0.09 -0.60 1.90 5.75 -2.03 -2.73 115.11 118.01 1ucy h GLN 127 Ca 0.14 -0.09 0.00 0.00 -0.15 0.00 0.00 58.65 58.54 1ucy h GLN 127 Cb 0.02 0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.60 1ucy h GLN 127 CO -0.02 0.85 0.00 2.41 -2.65 0.00 0.00 178.83 179.42 1ucy n THR 128 N -3.64 0.04 0.00 2.39 -1.04 -0.99 -1.76 114.28 109.28 1ucy n THR 128 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1ucy n THR 128 Cb 0.77 -0.30 0.00 0.00 -1.82 0.00 0.00 70.33 68.98 1ucy n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ucy n ALA 129 N 0.27 0.00 0.04 2.41 0.00 -1.03 -0.35 120.51 121.84 1ucy n ALA 129 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1ucy n ALA 129 Cb 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.50 1ucy n ALA 129 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1ucy h LYS 129 N 0.00 -0.14 0.20 0.00 6.56 -1.62 -3.40 116.57 118.17 1ucy h LYS 129 Ca 0.00 0.01 -0.31 0.00 -1.06 0.00 0.00 60.65 59.29 1ucy h LYS 129 Cb 0.00 0.03 0.02 0.00 -0.57 0.00 0.00 32.23 31.72 1ucy h LYS 129 CO 0.00 0.33 -1.40 -0.07 -2.06 0.00 0.00 179.45 176.25 1ucy h LEU 129 N -0.72 0.67 -7.15 2.94 -0.00 -0.96 -3.43 115.31 106.66 1ucy h LEU 129 Ca -0.02 -0.73 -0.56 0.00 -0.00 0.00 0.00 57.88 56.58 1ucy h LEU 129 Cb 0.54 -0.22 -0.02 0.00 -0.00 0.00 0.00 40.66 40.96 1ucy h LEU 129 CO 0.03 1.57 2.01 0.18 -0.00 0.00 0.00 178.44 182.22 1ucy n LEU 130 N -3.64 4.33 -3.98 1.67 4.77 -1.26 -4.85 117.00 114.04 1ucy n LEU 130 Ca -0.14 -3.36 -0.19 0.00 -0.03 0.00 0.00 56.01 52.29 1ucy n LEU 130 Cb 1.07 -1.52 -0.15 0.00 -2.33 0.00 0.00 43.42 40.49 1ucy n LEU 130 CO 0.58 -0.53 -0.43 -1.00 -1.33 0.00 0.00 177.39 174.68 1ucy s HIS 131 N 6.59 0.81 0.32 -1.77 3.76 -1.26 -4.99 115.29 118.74 1ucy s HIS 131 Ca 0.59 -0.19 -0.29 0.00 -0.15 0.00 0.00 55.06 55.02 1ucy s HIS 131 Cb 0.08 -0.58 -0.12 0.00 1.11 0.00 0.00 32.58 33.06 1ucy s HIS 131 CO 0.09 -0.08 1.35 0.00 -0.85 0.00 0.00 174.74 175.24 1ucy n ALA 132 N 3.26 1.39 0.00 -1.40 0.00 -1.26 -0.74 120.51 121.76 1ucy n ALA 132 Ca -0.17 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1ucy n ALA 132 Cb 0.55 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.72 1ucy n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ucy n GLY 133 N 1.16 2.84 3.77 0.00 0.00 0.22 -4.93 105.19 108.24 1ucy n GLY 133 Ca 0.06 -0.58 -0.38 0.00 0.00 0.00 0.00 46.02 45.12 1ucy n GLY 133 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ucy s PHE 134 N -1.47 3.05 0.01 1.61 0.40 0.08 -4.61 117.98 117.06 1ucy s PHE 134 Ca 0.00 1.54 0.00 0.00 -0.60 0.00 0.00 56.93 57.88 1ucy s PHE 134 Cb 0.00 -3.41 -0.04 0.00 0.51 0.00 0.00 43.02 40.08 1ucy s PHE 134 CO 0.00 -1.37 0.07 0.15 0.70 0.00 0.00 175.22 174.78 1ucy s LYS 135 N -2.29 3.00 0.45 0.44 1.02 -1.26 -0.13 119.74 120.98 1ucy s LYS 135 Ca 0.57 -0.54 0.03 0.00 0.02 0.00 0.00 55.97 56.05 1ucy s LYS 135 Cb -0.31 -2.82 -0.03 0.00 -0.52 0.00 0.00 37.83 34.15 1ucy s LYS 135 CO 0.39 0.63 0.04 0.20 -0.92 0.00 0.00 175.35 175.69 1ucy s GLY 136 N -1.86 2.77 -0.02 -3.33 0.00 -0.43 -4.84 107.32 99.60 1ucy s GLY 136 Ca 0.24 -1.01 0.06 0.00 0.00 0.00 0.00 44.72 44.01 1ucy s GLY 136 CO 0.15 -2.05 -0.20 -1.60 0.00 0.00 0.00 173.10 169.41 1ucy s ARG 137 N -3.81 1.69 -0.06 2.90 3.52 0.16 -0.36 118.95 123.00 1ucy s ARG 137 Ca 0.17 -0.70 0.04 0.00 -0.13 0.00 0.00 55.73 55.11 1ucy s ARG 137 Cb 0.04 -1.59 0.00 0.00 -1.56 0.00 0.00 34.95 31.84 1ucy s ARG 137 CO 0.09 0.40 -0.18 0.08 -0.81 0.00 0.00 175.30 174.88 1ucy s VAL 138 N -0.37 1.53 0.12 7.11 1.01 0.52 -1.65 120.40 128.67 1ucy s VAL 138 Ca 0.05 -0.75 0.07 0.00 0.00 0.00 0.00 61.98 61.36 1ucy s VAL 138 Cb -0.09 -1.33 -0.04 0.00 0.00 0.00 0.00 36.38 34.93 1ucy s VAL 138 CO -0.00 0.44 -0.18 0.42 0.00 0.00 0.00 175.10 175.78 1ucy s THR 139 N 0.21 1.57 0.00 3.92 -4.23 -1.25 -1.67 115.64 114.19 1ucy s THR 139 Ca -0.09 -1.63 0.00 0.00 -1.18 0.00 0.00 61.69 58.80 1ucy s THR 139 Cb -0.14 -1.54 0.00 0.00 1.34 0.00 0.00 72.50 72.16 1ucy s THR 139 CO 0.04 -0.21 0.00 0.61 -0.54 0.00 0.00 174.62 174.52 1ucy n GLY 140 N 0.83 -0.10 0.35 3.99 0.00 -0.98 -4.58 105.19 104.70 1ucy n GLY 140 Ca -0.18 -0.94 0.03 0.00 0.00 0.00 0.00 46.02 44.93 1ucy n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1ucy n TRP 141 N -0.15 0.24 -1.03 1.61 8.01 -1.26 -2.22 117.44 122.65 1ucy n TRP 141 Ca 0.00 -0.46 -0.29 0.00 -1.31 0.00 0.00 57.50 55.44 1ucy n TRP 141 Cb 0.00 -0.03 0.22 0.00 -2.01 0.00 0.00 31.31 29.48 1ucy n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1ucy s GLY 142 N -0.96 1.56 0.16 6.99 0.00 -1.25 -4.42 107.32 109.39 1ucy s GLY 142 Ca 0.13 -0.63 -0.32 0.00 0.00 0.00 0.00 44.72 43.90 1ucy s GLY 142 CO 0.09 0.14 0.83 0.70 0.00 0.00 0.00 173.10 174.85 1ucy n ASN 143 N -4.59 -0.15 0.00 1.64 4.13 0.30 -1.83 115.26 114.76 1ucy n ASN 143 Ca 0.09 1.14 0.15 0.00 1.68 0.00 0.00 54.58 57.64 1ucy n ASN 143 Cb 0.58 -1.04 0.77 0.00 -1.54 0.00 0.00 39.78 38.55 1ucy n ASN 143 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1ucy n ARG 144 N 1.23 0.50 -3.58 3.52 1.74 0.23 -1.43 116.66 118.87 1ucy n ARG 144 Ca 0.17 0.01 -0.06 0.00 -0.77 0.00 0.00 57.85 57.20 1ucy n ARG 144 Cb 0.22 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.13 1ucy n ARG 144 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1ucy s ARG 145 N -2.48 0.41 0.06 5.56 1.70 -1.26 -4.50 118.95 118.45 1ucy s ARG 145 Ca 0.31 -0.08 -0.25 0.00 -0.47 0.00 0.00 55.73 55.24 1ucy s ARG 145 Cb 0.20 0.19 -0.12 0.00 -0.57 0.00 0.00 34.95 34.65 1ucy s ARG 145 CO 0.43 -0.17 1.40 1.49 -1.08 0.00 0.00 175.30 177.37 1ucy h GLU 146 N 2.12 -0.66 -6.31 3.89 4.81 -1.88 -3.44 114.58 113.10 1ucy h GLU 146 Ca -0.13 0.05 -0.66 0.00 -0.13 0.00 0.00 59.36 58.49 1ucy h GLU 146 Cb 1.18 0.15 0.06 0.00 0.63 0.00 0.00 28.75 30.78 1ucy h GLU 146 CO 0.26 -0.44 0.41 -2.37 -0.73 0.00 0.00 179.01 176.14 1ucy n THR 147 N -4.60 0.32 0.00 0.32 5.66 -1.26 -5.01 114.28 109.71 1ucy n THR 147 Ca -0.08 -0.08 0.00 0.00 -3.05 0.00 0.00 64.05 60.84 1ucy n THR 147 Cb 0.32 -0.88 0.00 0.00 -1.55 0.00 0.00 70.33 68.22 1ucy n THR 147 CO 0.00 0.00 0.00 0.79 -3.05 0.00 0.00 175.07 172.81 1ucy n TRP 148 N 2.21 0.00 0.15 1.09 8.01 -1.26 -4.91 117.44 122.73 1ucy n TRP 148 Ca 0.17 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.36 1ucy n TRP 148 Cb 0.22 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.52 1ucy n TRP 148 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.69 179.09 1ucy n THR 149 N 0.00 0.00 -0.37 -0.99 -1.04 0.01 -4.25 114.28 107.63 1ucy n THR 149 Ca 0.00 0.53 0.02 0.00 -2.04 0.00 0.00 64.05 62.56 1ucy n THR 149 Cb 0.00 -1.13 0.16 0.00 -1.82 0.00 0.00 70.33 67.54 1ucy n THR 149 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 1ucy h SER 149 N 0.00 1.07 -1.27 8.00 0.87 -2.04 0.13 113.55 120.31 1ucy h SER 149 Ca 0.00 0.00 -0.59 0.00 -1.23 0.00 0.00 61.79 59.98 1ucy h SER 149 Cb 1.07 -0.23 -0.41 0.00 -0.44 0.00 0.00 62.40 62.38 1ucy h SER 149 CO 0.00 0.70 -0.64 1.33 -0.53 0.00 0.00 176.83 177.69 1ucy n VAL 149 N -4.48 2.51 0.00 2.23 0.24 -1.26 -5.07 118.33 112.50 1ucy n VAL 149 Ca 0.15 -4.62 0.00 0.00 -2.04 0.00 0.00 64.34 57.83 1ucy n VAL 149 Cb 0.15 -1.22 0.00 0.00 -1.47 0.00 0.00 33.84 31.30 1ucy n VAL 149 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ucy n ALA 149 N -0.57 0.00 -3.27 2.33 0.00 0.44 -4.29 120.51 115.14 1ucy n ALA 149 Ca 0.42 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.53 1ucy n ALA 149 Cb 0.75 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 20.05 1ucy n ALA 149 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1ucy s GLU 149 N 0.00 3.33 -0.32 0.00 2.56 -1.26 -0.81 118.70 122.20 1ucy s GLU 149 Ca 0.00 -0.70 0.10 0.00 0.00 0.00 0.00 54.97 54.37 1ucy s GLU 149 Cb 0.00 -2.69 0.63 0.00 2.00 0.00 0.00 34.13 34.07 1ucy s GLU 149 CO 0.00 0.09 1.67 1.33 -0.56 0.00 0.00 175.26 177.79 1ucy n VAL 150 N 3.89 2.78 -3.68 3.70 0.24 -1.26 -4.97 118.33 119.03 1ucy n VAL 150 Ca -0.18 -2.04 -0.37 0.00 -2.04 0.00 0.00 64.34 59.71 1ucy n VAL 150 Cb 0.52 -0.35 -0.11 0.00 -1.47 0.00 0.00 33.84 32.43 1ucy n VAL 150 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1ucy s GLN 151 N -3.10 3.91 0.70 7.34 -0.21 -1.26 0.76 119.66 127.80 1ucy s GLN 151 Ca 0.51 -0.35 -0.15 0.00 0.02 0.00 0.00 55.36 55.38 1ucy s GLN 151 Cb 0.42 -3.52 0.02 0.00 1.00 0.00 0.00 33.01 30.94 1ucy s GLN 151 CO 0.09 -0.09 1.18 -1.25 -2.12 0.00 0.00 175.29 173.09 1ucy s PRO 152 N 1.46 2.41 0.15 2.91 0.04 -1.26 -4.94 135.00 135.76 1ucy s PRO 152 Ca 0.07 1.65 0.22 0.00 0.04 0.00 0.00 61.00 62.98 1ucy s PRO 152 Cb -0.15 -1.88 -0.07 0.00 0.04 0.00 0.00 34.50 32.44 1ucy s PRO 152 CO 0.07 -1.61 0.92 -1.13 0.04 0.00 0.00 177.00 175.30 1ucy n SER 153 N -2.53 0.67 -4.24 6.66 3.41 -1.26 -4.73 113.62 111.61 1ucy n SER 153 Ca 0.12 0.26 -0.15 0.00 -0.26 0.00 0.00 58.87 58.85 1ucy n SER 153 Cb 0.51 0.77 -0.10 0.00 -0.26 0.00 0.00 64.21 65.13 1ucy n SER 153 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1ucy s VAL 154 N -3.39 1.17 0.20 -3.33 1.01 -1.26 -1.56 120.40 113.23 1ucy s VAL 154 Ca -0.02 -1.97 -0.32 0.00 0.00 0.00 0.00 61.98 59.67 1ucy s VAL 154 Cb 0.10 -1.75 -0.13 0.00 0.00 0.00 0.00 36.38 34.61 1ucy s VAL 154 CO 0.82 -0.68 1.57 -0.11 0.00 0.00 0.00 175.10 176.70 1ucy n LEU 155 N -0.01 3.43 -4.86 3.92 7.94 0.38 -4.86 117.00 122.94 1ucy n LEU 155 Ca -0.12 1.10 -0.28 0.00 -1.11 0.00 0.00 56.01 55.60 1ucy n LEU 155 Cb 0.60 -1.48 -0.05 0.00 0.53 0.00 0.00 43.42 43.02 1ucy n LEU 155 CO 0.31 -0.18 -0.18 -1.10 -1.11 0.00 0.00 177.39 175.13 1ucy s GLN 156 N 0.51 3.17 0.02 1.96 -1.52 -0.94 0.24 119.66 123.10 1ucy s GLN 156 Ca 0.74 -0.66 0.05 0.00 -1.95 0.00 0.00 55.36 53.55 1ucy s GLN 156 Cb -0.62 -2.84 -0.02 0.00 -0.22 0.00 0.00 33.01 29.31 1ucy s GLN 156 CO 0.40 0.54 -0.16 0.08 -0.25 0.00 0.00 175.29 175.90 1ucy s VAL 157 N -1.62 1.29 -0.24 1.09 1.01 0.16 -2.31 120.40 119.79 1ucy s VAL 157 Ca 0.33 -0.91 -0.11 0.00 0.00 0.00 0.00 61.98 61.28 1ucy s VAL 157 Cb -0.11 -1.12 0.08 0.00 0.00 0.00 0.00 36.38 35.23 1ucy s VAL 157 CO 0.26 0.19 0.55 0.54 0.00 0.00 0.00 175.10 176.63 1ucy s VAL 158 N -0.64 -0.31 -0.16 2.92 0.11 -0.67 -0.97 120.40 120.69 1ucy s VAL 158 Ca 0.05 0.06 -0.08 0.00 -2.93 0.00 0.00 61.98 59.08 1ucy s VAL 158 Cb -0.07 -0.82 -0.04 0.00 -1.53 0.00 0.00 36.38 33.91 1ucy s VAL 158 CO 0.01 0.02 0.12 0.20 -3.33 0.00 0.00 175.10 172.13 1ucy s ASN 159 N 1.98 6.22 -0.02 3.54 0.01 -1.26 -0.36 114.94 125.05 1ucy s ASN 159 Ca -0.08 0.33 -0.06 0.00 -0.71 0.00 0.00 52.86 52.34 1ucy s ASN 159 Cb -0.09 -2.05 0.00 0.00 0.41 0.00 0.00 41.25 39.53 1ucy s ASN 159 CO -0.16 0.30 0.13 -1.48 -1.51 0.00 0.00 177.10 174.38 1ucy s LEU 160 N -0.35 1.54 0.28 0.60 0.05 0.52 -4.93 118.68 116.39 1ucy s LEU 160 Ca 0.11 -0.06 -0.29 0.00 0.05 0.00 0.00 54.13 53.94 1ucy s LEU 160 Cb -0.12 0.60 -0.10 0.00 -2.05 0.00 0.00 46.19 44.53 1ucy s LEU 160 CO 0.01 -0.27 1.19 -2.16 -0.55 0.00 0.00 176.35 174.57 1ucy s PRO 161 N -0.93 4.52 0.28 1.48 0.04 -1.26 -1.31 135.00 137.82 1ucy s PRO 161 Ca -0.10 1.96 -0.29 0.00 0.04 0.00 0.00 61.00 62.60 1ucy s PRO 161 Cb -0.06 -3.16 -0.10 0.00 0.04 0.00 0.00 34.50 31.23 1ucy s PRO 161 CO 0.01 0.03 1.29 -0.51 0.04 0.00 0.00 177.00 177.86 1ucy s LEU 162 N -1.35 4.44 0.15 -3.56 1.43 0.82 -0.95 118.68 119.66 1ucy s LEU 162 Ca 0.47 2.55 0.05 0.00 -1.03 0.00 0.00 54.13 56.17 1ucy s LEU 162 Cb -0.35 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.20 1ucy s LEU 162 CO 0.44 -0.49 0.11 -0.69 0.23 0.00 0.00 176.35 175.95 1ucy s VAL 163 N -0.68 4.41 0.35 -1.59 1.01 -0.80 -0.61 120.40 122.48 1ucy s VAL 163 Ca 0.51 -1.06 -0.27 0.00 0.00 0.00 0.00 61.98 61.17 1ucy s VAL 163 Cb -0.38 -3.22 -0.09 0.00 0.00 0.00 0.00 36.38 32.69 1ucy s VAL 163 CO 0.46 -0.07 1.11 -1.83 0.00 0.00 0.00 175.10 174.77 1ucy s GLU 164 N -2.96 4.32 0.30 2.72 1.03 -1.26 -4.67 118.70 118.19 1ucy s GLU 164 Ca 0.30 1.73 0.03 0.00 0.03 0.00 0.00 54.97 57.07 1ucy s GLU 164 Cb -0.10 -2.84 0.64 0.00 -0.80 0.00 0.00 34.13 31.02 1ucy s GLU 164 CO 0.23 -0.05 1.82 -0.09 -1.33 0.00 0.00 175.26 175.83 1ucy h ARG 165 N 3.06 0.87 -0.82 -4.83 2.43 -1.98 -1.88 114.38 111.23 1ucy h ARG 165 Ca -0.48 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 58.63 1ucy h ARG 165 Cb 1.22 -0.20 -0.04 0.00 -0.42 0.00 0.00 29.97 30.53 1ucy h ARG 165 CO 0.64 0.58 0.46 -1.35 -1.51 0.00 0.00 179.97 178.79 1ucy h PRO 166 N 0.90 1.14 0.00 0.20 0.11 -1.98 0.30 132.00 132.67 1ucy h PRO 166 Ca 0.52 -0.13 -0.06 0.00 0.11 0.00 0.00 66.00 66.44 1ucy h PRO 166 Cb 0.63 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.51 1ucy h PRO 166 CO -0.29 0.83 -0.30 -0.39 -0.21 0.00 0.00 178.00 177.64 1ucy h VAL 167 N 1.14 0.62 -0.00 3.15 -1.51 -1.78 -1.19 116.25 116.68 1ucy h VAL 167 Ca 0.29 -1.46 -0.03 0.00 -1.23 0.00 0.00 66.70 64.27 1ucy h VAL 167 Cb 0.01 1.99 0.00 0.00 -2.13 0.00 0.00 31.29 31.16 1ucy h VAL 167 CO -0.05 0.29 -0.12 0.00 -1.23 0.00 0.00 177.57 176.46 1ucy h LYS 169 N -0.63 0.47 0.00 0.00 1.63 -0.29 -1.80 116.57 115.95 1ucy h LYS 169 Ca -0.01 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 1ucy h LYS 169 Cb 0.89 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.41 1ucy h LYS 169 CO 0.02 0.31 0.00 0.00 -3.45 0.00 0.00 179.45 176.34 1ucy n ALA 170 N -2.49 2.27 0.73 5.00 0.00 -0.46 -3.60 120.51 121.96 1ucy n ALA 170 Ca 0.16 -0.04 0.10 0.00 0.00 0.00 0.00 53.44 53.67 1ucy n ALA 170 Cb 0.45 -1.47 0.45 0.00 0.00 0.00 0.00 19.45 18.89 1ucy n ALA 170 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1ucy n SER 171 N -2.11 0.01 -3.84 0.00 3.41 -0.68 -4.88 113.62 105.54 1ucy n SER 171 Ca 0.06 0.50 -0.10 0.00 -0.26 0.00 0.00 58.87 59.07 1ucy n SER 171 Cb 0.41 -0.50 -0.08 0.00 -0.26 0.00 0.00 64.21 63.77 1ucy n SER 171 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1ucy s THR 172 N -3.00 0.11 0.04 6.66 -1.32 -1.24 -4.84 115.64 112.06 1ucy s THR 172 Ca 0.10 -0.92 0.18 0.00 -1.21 0.00 0.00 61.69 59.85 1ucy s THR 172 Cb 0.14 -0.96 0.13 0.00 -1.51 0.00 0.00 72.50 70.30 1ucy s THR 172 CO 0.39 -0.50 1.65 0.03 -2.21 0.00 0.00 174.62 173.97 1ucy h ARG 173 N 3.38 0.00 -6.74 7.08 3.08 -1.89 -3.45 114.38 115.83 1ucy h ARG 173 Ca -0.32 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.20 1ucy h ARG 173 Cb 1.19 0.00 0.05 0.00 0.08 0.00 0.00 29.97 31.29 1ucy h ARG 173 CO 0.49 0.39 0.72 0.42 -1.07 0.00 0.00 179.97 180.92 1ucy s ILE 174 N -3.38 2.80 -0.47 2.04 1.01 -1.26 -4.94 121.20 117.00 1ucy s ILE 174 Ca 0.02 0.68 -0.28 0.00 0.00 0.00 0.00 60.65 61.07 1ucy s ILE 174 Cb 0.10 -3.43 -0.02 0.00 0.01 0.00 0.00 42.46 39.12 1ucy s ILE 174 CO 0.70 0.11 1.80 -0.60 0.00 0.00 0.00 174.94 176.95 1ucy s ARG 175 N -0.41 3.01 0.55 2.79 3.52 -1.26 -4.99 118.95 122.16 1ucy s ARG 175 Ca 0.58 1.02 -0.11 0.00 -0.13 0.00 0.00 55.73 57.09 1ucy s ARG 175 Cb -0.40 -4.28 -0.05 0.00 -1.56 0.00 0.00 34.95 28.66 1ucy s ARG 175 CO 0.43 -2.25 0.94 0.42 -0.81 0.00 0.00 175.30 174.02 1ucy s ILE 176 N 7.86 4.73 0.35 4.11 -1.09 -1.26 -4.74 121.20 131.16 1ucy s ILE 176 Ca 0.73 0.76 0.04 0.00 -2.23 0.00 0.00 60.65 59.95 1ucy s ILE 176 Cb -0.17 -3.83 -0.03 0.00 -1.58 0.00 0.00 42.46 36.85 1ucy s ILE 176 CO 0.28 -0.94 0.14 0.42 -1.23 0.00 0.00 174.94 173.60 1ucy s THR 177 N -2.90 0.56 -1.28 2.92 -4.23 -1.26 -5.01 115.64 104.43 1ucy s THR 177 Ca 0.54 -2.00 0.12 0.00 -1.18 0.00 0.00 61.69 59.17 1ucy s THR 177 Cb -0.11 -2.48 0.17 0.00 1.34 0.00 0.00 72.50 71.43 1ucy s THR 177 CO 0.46 0.00 1.33 0.47 -0.54 0.00 0.00 174.62 176.34 1ucy n ASP 178 N -1.08 0.00 -0.52 3.99 8.00 -1.26 -2.37 116.55 123.30 1ucy n ASP 178 Ca -0.02 0.24 0.14 0.00 0.71 0.00 0.00 54.79 55.86 1ucy n ASP 178 Cb 0.65 -0.36 0.44 0.00 -0.02 0.00 0.00 41.12 41.83 1ucy n ASP 178 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1ucy n ASN 179 N -1.36 1.67 -4.30 -2.24 3.02 -1.26 -4.83 115.26 105.96 1ucy n ASN 179 Ca 0.05 -1.51 -0.20 0.00 -0.03 0.00 0.00 54.58 52.88 1ucy n ASN 179 Cb 0.11 0.02 -0.11 0.00 -0.61 0.00 0.00 39.78 39.19 1ucy n ASN 179 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ucy s MET 180 N -2.06 1.18 0.13 3.52 0.23 -1.00 0.86 119.30 122.16 1ucy s MET 180 Ca 0.35 -1.34 -0.00 0.00 -1.03 0.00 0.00 55.69 53.67 1ucy s MET 180 Cb 0.21 -1.18 -0.04 0.00 -1.53 0.00 0.00 34.83 32.29 1ucy s MET 180 CO 0.35 0.24 0.02 -0.59 -2.03 0.00 0.00 175.02 173.01 1ucy s PHE 181 N -2.06 0.91 0.16 3.16 -0.12 -0.28 -4.78 117.98 114.98 1ucy s PHE 181 Ca 0.13 -1.14 0.08 0.00 -0.05 0.00 0.00 56.93 55.95 1ucy s PHE 181 Cb -0.05 -0.53 -0.04 0.00 -0.63 0.00 0.00 43.02 41.77 1ucy s PHE 181 CO 0.05 -0.40 -0.18 0.00 -0.05 0.00 0.00 175.22 174.64 1ucy s ALA 183 N -2.07 0.21 0.00 0.00 0.00 -0.96 -1.91 121.76 117.03 1ucy s ALA 183 Ca 0.16 -0.82 0.00 0.00 0.00 0.00 0.00 51.96 51.30 1ucy s ALA 183 Cb -0.06 0.23 0.00 0.00 0.00 0.00 0.00 23.12 23.29 1ucy s ALA 183 CO 0.06 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 175.95 1ucy n GLY 184 N 0.78 3.39 3.84 0.00 0.00 -0.12 -2.50 105.19 110.57 1ucy n GLY 184 Ca -0.19 -1.69 -0.33 0.00 0.00 0.00 0.00 46.02 43.82 1ucy n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ucy s TYR 184 N -2.00 3.35 0.34 1.61 2.02 -1.26 -4.49 117.35 116.92 1ucy s TYR 184 Ca 0.00 1.38 -0.07 0.00 -0.37 0.00 0.00 57.07 58.00 1ucy s TYR 184 Cb 0.00 -2.66 -0.06 0.00 -0.40 0.00 0.00 41.96 38.84 1ucy s TYR 184 CO 0.00 0.02 0.65 0.15 -1.57 0.00 0.00 175.55 174.80 1ucy s LYS 185 N -3.04 3.69 0.44 -0.62 1.02 -1.26 -4.84 119.74 115.13 1ucy s LYS 185 Ca 0.57 0.21 0.32 0.00 0.02 0.00 0.00 55.97 57.09 1ucy s LYS 185 Cb -0.10 -2.53 1.49 0.00 -0.52 0.00 0.00 37.83 36.17 1ucy s LYS 185 CO 0.16 0.10 1.59 -1.35 -0.92 0.00 0.00 175.35 174.92 1ucy h PRO 186 N 1.47 0.02 0.00 -1.68 0.11 -1.95 0.14 132.00 130.10 1ucy h PRO 186 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1ucy h PRO 186 Cb 1.19 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1ucy h PRO 186 CO 0.65 0.01 -0.91 0.41 -0.21 0.00 0.00 178.00 177.95 1ucy n GLY 186 N -1.52 -1.13 0.33 -0.55 0.00 -1.26 -4.63 105.19 96.43 1ucy n GLY 186 Ca 0.40 -0.47 0.16 0.00 0.00 0.00 0.00 46.02 46.12 1ucy n GLY 186 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1ucy h GLU 186 N 0.00 0.45 0.00 1.61 5.08 -1.09 -3.46 114.58 117.17 1ucy h GLU 186 Ca 0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1ucy h GLU 186 Cb 0.59 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1ucy h GLU 186 CO 0.00 0.30 0.00 0.41 -1.00 0.00 0.00 179.01 178.72 1ucy n GLY 186 N -1.32 0.24 3.44 -3.84 0.00 -1.26 -5.02 105.19 97.42 1ucy n GLY 186 Ca 0.25 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.05 1ucy n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ucy s LYS 186 N -0.84 1.58 0.23 1.61 1.02 -1.26 -5.16 119.74 116.92 1ucy s LYS 186 Ca 0.00 -1.75 0.03 0.00 0.02 0.00 0.00 55.97 54.27 1ucy s LYS 186 Cb 0.00 -1.46 -0.05 0.00 -0.52 0.00 0.00 37.83 35.80 1ucy s LYS 186 CO 0.00 0.21 0.02 1.03 -0.92 0.00 0.00 175.35 175.69 1ucy s ARG 187 N -3.60 1.34 0.00 1.68 0.52 -1.26 -4.77 118.95 112.85 1ucy s ARG 187 Ca 0.28 -1.69 0.00 0.00 -0.52 0.00 0.00 55.73 53.80 1ucy s ARG 187 Cb -0.01 -0.50 0.00 0.00 0.52 0.00 0.00 34.95 34.96 1ucy s ARG 187 CO 0.12 -0.15 0.00 0.41 0.02 0.00 0.00 175.30 175.70 1ucy n GLY 188 N -0.42 3.99 3.60 -3.53 0.00 -1.26 -4.88 105.19 102.70 1ucy n GLY 188 Ca -0.04 -0.52 -0.04 0.00 0.00 0.00 0.00 46.02 45.42 1ucy n GLY 188 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ucy s ASP 189 N 0.00 -0.18 0.55 1.61 2.15 -0.79 -4.63 116.67 115.38 1ucy s ASP 189 Ca 0.00 -0.08 -0.05 0.00 0.43 0.00 0.00 52.55 52.85 1ucy s ASP 189 Cb 0.00 0.25 -0.00 0.00 -0.30 0.00 0.00 42.92 42.87 1ucy s ASP 189 CO 0.00 -0.43 0.85 0.00 -0.17 0.00 0.00 175.17 175.43 1ucy s ALA 190 N -2.70 3.37 0.36 3.66 0.00 -1.26 -0.64 121.76 124.56 1ucy s ALA 190 Ca 0.10 -0.69 -0.09 0.00 0.00 0.00 0.00 51.96 51.27 1ucy s ALA 190 Cb 0.00 -2.55 0.03 0.00 0.00 0.00 0.00 23.12 20.60 1ucy s ALA 190 CO -0.05 -0.66 0.63 0.00 0.00 0.00 0.00 175.76 175.68 1ucy n GLU 192 N -0.54 1.35 0.00 0.00 0.28 -1.26 -0.94 120.64 119.52 1ucy n GLU 192 Ca -0.04 0.48 0.00 0.00 -0.16 0.00 0.00 57.16 57.45 1ucy n GLU 192 Cb 0.61 -2.12 0.00 0.00 1.43 0.00 0.00 31.44 31.36 1ucy n GLU 192 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1ucy n GLY 193 N 2.53 2.90 0.14 -1.84 0.00 -1.26 0.11 105.19 107.77 1ucy n GLY 193 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 1ucy n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ucy h ASP 194 N 0.00 0.00 -1.92 1.61 3.32 -1.37 -3.33 116.42 114.74 1ucy h ASP 194 Ca 0.00 -0.02 -0.62 0.00 0.02 0.00 0.00 57.03 56.41 1ucy h ASP 194 Cb 0.00 0.00 0.15 0.00 0.22 0.00 0.00 39.33 39.70 1ucy h ASP 194 CO 0.00 0.01 -0.67 -1.20 -1.72 0.00 0.00 179.24 175.66 1ucy n SER 195 N -2.73 -1.87 0.00 6.45 7.64 -1.26 -1.63 113.62 120.22 1ucy n SER 195 Ca 0.02 0.88 0.00 0.00 1.01 0.00 0.00 58.87 60.78 1ucy n SER 195 Cb 0.53 -0.99 0.00 0.00 -1.01 0.00 0.00 64.21 62.74 1ucy n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ucy n GLY 196 N 2.07 2.91 3.71 0.23 0.00 0.33 0.91 105.19 115.35 1ucy n GLY 196 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 1ucy n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ucy s GLY 197 N -1.50 1.61 0.30 -0.02 0.00 -0.65 -3.38 107.32 103.68 1ucy s GLY 197 Ca 0.00 -0.13 -0.20 0.00 0.00 0.00 0.00 44.72 44.39 1ucy s GLY 197 CO 0.00 0.38 0.81 -4.14 0.00 0.00 0.00 173.10 170.15 1ucy s PRO 198 N -4.95 4.25 -0.27 2.90 0.02 -1.26 -0.29 135.00 135.39 1ucy s PRO 198 Ca 0.64 0.95 -0.00 0.00 0.02 0.00 0.00 61.00 62.60 1ucy s PRO 198 Cb -0.18 -2.63 0.05 0.00 0.02 0.00 0.00 34.50 31.76 1ucy s PRO 198 CO 0.57 0.24 -0.06 0.12 -0.33 0.00 0.00 177.00 177.54 1ucy s PHE 199 N -1.77 3.21 0.26 6.54 2.19 -0.23 -3.97 117.98 124.21 1ucy s PHE 199 Ca 0.50 -1.96 0.11 0.00 0.33 0.00 0.00 56.93 55.92 1ucy s PHE 199 Cb -0.14 -2.03 -0.05 0.00 -1.31 0.00 0.00 43.02 39.49 1ucy s PHE 199 CO 0.19 -0.82 -0.16 0.14 1.83 0.00 0.00 175.22 176.40 1ucy s VAL 200 N 1.22 2.68 0.02 3.12 -7.23 -0.66 -0.83 120.40 118.71 1ucy s VAL 200 Ca -0.05 -2.23 0.02 0.00 -1.81 0.00 0.00 61.98 57.91 1ucy s VAL 200 Cb -0.19 -2.39 -0.01 0.00 0.56 0.00 0.00 36.38 34.35 1ucy s VAL 200 CO -0.03 -0.34 -0.06 -0.04 -0.31 0.00 0.00 175.10 174.31 1ucy s MET 201 N -3.39 0.44 -0.28 4.82 -1.94 -0.36 -0.66 119.30 117.93 1ucy s MET 201 Ca 0.29 -0.43 -0.10 0.00 -1.71 0.00 0.00 55.69 53.74 1ucy s MET 201 Cb -0.06 -0.32 -0.04 0.00 2.01 0.00 0.00 34.83 36.42 1ucy s MET 201 CO 0.15 0.08 0.17 0.21 -0.01 0.00 0.00 175.02 175.62 1ucy s LYS 202 N -0.76 3.80 0.15 2.03 2.20 -1.26 -0.46 119.74 125.45 1ucy s LYS 202 Ca -0.04 -0.41 -0.31 0.00 -0.36 0.00 0.00 55.97 54.85 1ucy s LYS 202 Cb -0.05 -3.61 -0.08 0.00 -1.51 0.00 0.00 37.83 32.57 1ucy s LYS 202 CO 0.00 -0.23 1.36 0.45 -0.36 0.00 0.00 175.35 176.58 1ucy s SER 203 N 1.72 6.84 0.46 1.43 0.15 0.28 -4.92 113.70 119.65 1ucy s SER 203 Ca 0.07 2.38 0.26 0.00 0.70 0.00 0.00 55.95 59.35 1ucy s SER 203 Cb -0.16 -2.60 0.87 0.00 -1.71 0.00 0.00 66.02 62.43 1ucy s SER 203 CO 0.09 -0.61 1.80 -0.65 1.20 0.00 0.00 173.24 175.07 1ucy h PRO 204 N 6.17 0.00 0.01 5.44 0.11 -1.98 -3.26 132.00 138.50 1ucy h PRO 204 Ca -0.43 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 1ucy h PRO 204 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1ucy h PRO 204 CO 0.83 0.16 -0.01 1.88 -0.21 0.00 0.00 178.00 180.65 1ucy h TYR 204 N 0.00 -0.01 -3.44 0.65 0.05 -1.98 -3.43 116.97 108.81 1ucy h TYR 204 Ca -0.00 -0.00 -0.65 0.00 0.05 0.00 0.00 58.73 58.12 1ucy h TYR 204 Cb 0.78 0.00 -0.26 0.00 1.01 0.00 0.00 36.73 38.27 1ucy h TYR 204 CO 0.00 -0.01 -0.70 0.54 -1.05 0.00 0.00 178.16 176.94 1ucy s ASN 204 N -2.68 4.51 0.00 3.88 6.03 -1.25 -5.00 114.94 120.43 1ucy s ASN 204 Ca -0.00 -0.33 -0.00 0.00 -1.03 0.00 0.00 52.86 51.50 1ucy s ASN 204 Cb 0.00 -1.78 -0.01 0.00 -3.03 0.00 0.00 41.25 36.43 1ucy s ASN 204 CO 0.01 -0.00 0.37 0.59 -2.03 0.00 0.00 177.10 176.04 1ucy n ASN 205 N 4.69 0.37 -4.82 3.54 4.13 -1.23 -3.98 115.26 117.97 1ucy n ASN 205 Ca -0.18 -1.29 -0.24 0.00 1.68 0.00 0.00 54.58 54.56 1ucy n ASN 205 Cb 0.51 -0.09 -0.05 0.00 -1.54 0.00 0.00 39.78 38.62 1ucy n ASN 205 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1ucy s ARG 206 N 2.26 2.95 -0.23 3.52 0.52 -1.26 -4.84 118.95 121.88 1ucy s ARG 206 Ca 0.02 -0.96 -0.09 0.00 -0.52 0.00 0.00 55.73 54.18 1ucy s ARG 206 Cb 0.01 -2.62 -0.04 0.00 0.52 0.00 0.00 34.95 32.82 1ucy s ARG 206 CO 0.00 0.44 0.12 -1.58 0.02 0.00 0.00 175.30 174.30 1ucy s TRP 207 N -1.97 3.25 0.04 -0.53 0.52 -1.26 -0.56 118.94 118.43 1ucy s TRP 207 Ca 0.32 0.07 0.05 0.00 0.02 0.00 0.00 56.10 56.56 1ucy s TRP 207 Cb -0.09 -2.23 -0.04 0.00 -1.15 0.00 0.00 33.47 29.97 1ucy s TRP 207 CO 0.25 -0.01 -0.09 0.71 0.02 0.00 0.00 176.95 177.83 1ucy s TYR 208 N 1.05 2.81 -0.42 -1.98 1.51 0.40 -2.25 117.35 118.47 1ucy s TYR 208 Ca 0.06 -0.10 -0.19 0.00 -1.01 0.00 0.00 57.07 55.83 1ucy s TYR 208 Cb -0.14 -1.54 0.02 0.00 -0.11 0.00 0.00 41.96 40.19 1ucy s TYR 208 CO 0.04 0.37 0.57 -1.14 -1.11 0.00 0.00 175.55 174.28 1ucy s GLN 209 N -1.66 3.28 -0.02 -0.62 0.74 -0.47 -1.23 119.66 119.69 1ucy s GLN 209 Ca 0.18 -0.44 0.14 0.00 0.05 0.00 0.00 55.36 55.29 1ucy s GLN 209 Cb -0.11 -3.93 -0.20 0.00 1.10 0.00 0.00 33.01 29.86 1ucy s GLN 209 CO 0.09 -0.92 0.68 -1.33 -0.55 0.00 0.00 175.29 173.27 1ucy n MET 210 N 6.01 0.63 -4.06 1.67 2.81 -0.01 -4.36 117.12 119.81 1ucy n MET 210 Ca -0.04 0.25 -0.11 0.00 -1.81 0.00 0.00 57.70 56.00 1ucy n MET 210 Cb 0.48 -1.78 -0.06 0.00 -0.71 0.00 0.00 33.22 31.15 1ucy n MET 210 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1ucy s GLY 211 N -5.02 0.95 -0.09 3.03 0.00 -0.90 -1.07 107.32 104.22 1ucy s GLY 211 Ca -0.04 -1.20 0.03 0.00 0.00 0.00 0.00 44.72 43.50 1ucy s GLY 211 CO 0.82 -0.88 -0.18 -0.42 0.00 0.00 0.00 173.10 172.44 1ucy s ILE 212 N -3.83 1.61 0.10 0.90 1.01 -0.94 -1.06 121.20 118.99 1ucy s ILE 212 Ca 0.28 -0.75 -0.32 0.00 0.00 0.00 0.00 60.65 59.86 1ucy s ILE 212 Cb 0.01 -1.43 -0.11 0.00 0.01 0.00 0.00 42.46 40.94 1ucy s ILE 212 CO 0.12 0.46 1.82 0.52 0.00 0.00 0.00 174.94 177.87 1ucy n VAL 213 N 3.72 0.37 0.00 2.92 0.31 0.60 -1.29 118.33 124.96 1ucy n VAL 213 Ca -0.21 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 1ucy n VAL 213 Cb 0.52 -2.04 0.00 0.00 -0.91 0.00 0.00 33.84 31.41 1ucy n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1ucy n SER 214 N 5.62 0.00 -3.63 4.52 2.88 -0.76 -0.51 113.62 121.73 1ucy n SER 214 Ca 0.19 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.57 1ucy n SER 214 Cb 0.36 -0.01 -0.08 0.00 -0.75 0.00 0.00 64.21 63.73 1ucy n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1ucy s TRP 215 N -0.11 1.39 0.04 0.66 1.48 -1.05 -4.88 118.94 116.47 1ucy s TRP 215 Ca 0.00 -1.47 -0.04 0.00 -1.06 0.00 0.00 56.10 53.54 1ucy s TRP 215 Cb 0.00 -0.52 0.01 0.00 -1.16 0.00 0.00 33.47 31.81 1ucy s TRP 215 CO 0.00 -0.85 0.18 0.41 -4.06 0.00 0.00 176.95 172.63 1ucy n GLY 216 N -0.49 1.33 2.58 3.67 0.00 -1.26 -0.43 105.19 110.59 1ucy n GLY 216 Ca 0.04 -0.98 -0.29 0.00 0.00 0.00 0.00 46.02 44.79 1ucy n GLY 216 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ucy s GLU 217 N -2.01 0.97 1.01 1.61 2.02 -1.26 -5.04 118.70 116.00 1ucy s GLU 217 Ca 0.04 -1.77 0.00 0.00 0.02 0.00 0.00 54.97 53.26 1ucy s GLU 217 Cb -0.01 -1.84 0.00 0.00 0.10 0.00 0.00 34.13 32.39 1ucy s GLU 217 CO 0.01 -1.21 0.00 0.41 0.02 0.00 0.00 175.26 174.49 1ucy n GLY 219 N 3.64 -1.80 2.72 -1.39 0.00 -1.26 -4.73 105.19 102.38 1ucy n GLY 219 Ca 0.12 -1.59 -0.21 0.00 0.00 0.00 0.00 46.02 44.34 1ucy n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ucy n ASP 221 N 5.22 -5.02 -4.87 0.00 2.03 -1.26 -4.61 116.55 108.04 1ucy n ASP 221 Ca -0.05 -0.64 -0.31 0.00 0.52 0.00 0.00 54.79 54.31 1ucy n ASP 221 Cb 0.50 -4.65 -0.05 0.00 -0.72 0.00 0.00 41.12 36.20 1ucy n ASP 221 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1ucy s ARG 221 N -6.26 3.85 0.18 -0.67 0.52 -1.26 -4.96 118.95 110.34 1ucy s ARG 221 Ca 0.49 0.42 -0.30 0.00 -0.52 0.00 0.00 55.73 55.82 1ucy s ARG 221 Cb -0.23 -2.53 -0.08 0.00 0.52 0.00 0.00 34.95 32.63 1ucy s ARG 221 CO 0.76 0.19 1.28 -0.51 0.02 0.00 0.00 175.30 177.04 1ucy s ASP 222 N -2.55 6.95 0.00 0.23 1.01 -1.26 -2.73 116.67 118.32 1ucy s ASP 222 Ca 0.50 2.32 0.00 0.00 0.71 0.00 0.00 52.55 56.08 1ucy s ASP 222 Cb -0.11 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.22 1ucy s ASP 222 CO 0.22 -0.49 0.00 0.61 0.21 0.00 0.00 175.17 175.72 1ucy n GLY 223 N 2.45 0.80 3.41 0.21 0.00 -1.26 -5.02 105.19 105.78 1ucy n GLY 223 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 1ucy n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ucy s LYS 224 N -0.06 1.79 0.07 1.61 -0.14 -1.11 -4.76 119.74 117.16 1ucy s LYS 224 Ca 0.00 -1.13 0.06 0.00 -1.36 0.00 0.00 55.97 53.53 1ucy s LYS 224 Cb 0.00 -2.04 -0.03 0.00 -1.68 0.00 0.00 37.83 34.08 1ucy s LYS 224 CO 0.00 0.50 -0.16 0.71 -0.76 0.00 0.00 175.35 175.65 1ucy s TYR 225 N -0.94 1.34 0.44 3.18 2.02 -1.26 -4.61 117.35 117.51 1ucy s TYR 225 Ca 0.14 -0.44 -0.21 0.00 -0.37 0.00 0.00 57.07 56.19 1ucy s TYR 225 Cb -0.10 -0.75 -0.10 0.00 -0.40 0.00 0.00 41.96 40.61 1ucy s TYR 225 CO 0.05 0.08 1.00 0.20 -1.57 0.00 0.00 175.55 175.32 1ucy s GLY 226 N -1.70 2.52 -0.05 0.71 0.00 -1.04 -4.71 107.32 103.04 1ucy s GLY 226 Ca 0.00 0.54 0.01 0.00 0.00 0.00 0.00 44.72 45.27 1ucy s GLY 226 CO 0.03 0.87 -0.04 -1.36 0.00 0.00 0.00 173.10 172.59 1ucy s PHE 227 N -1.98 3.00 0.03 1.90 0.40 0.43 -2.26 117.98 119.50 1ucy s PHE 227 Ca 0.63 0.06 0.05 0.00 -0.60 0.00 0.00 56.93 57.07 1ucy s PHE 227 Cb -0.15 -1.71 -0.02 0.00 0.51 0.00 0.00 43.02 41.65 1ucy s PHE 227 CO 0.19 0.39 -0.14 0.71 0.70 0.00 0.00 175.22 177.06 1ucy s TYR 228 N -0.89 1.24 0.16 0.36 1.51 -0.11 -1.83 117.35 117.79 1ucy s TYR 228 Ca 0.14 -0.33 -0.30 0.00 -1.01 0.00 0.00 57.07 55.57 1ucy s TYR 228 Cb -0.11 -0.74 -0.08 0.00 -0.11 0.00 0.00 41.96 40.92 1ucy s TYR 228 CO 0.04 0.03 1.27 0.99 -1.11 0.00 0.00 175.55 176.76 1ucy s THR 229 N -0.76 3.49 -0.98 -0.71 2.01 -0.41 -1.13 115.64 117.16 1ucy s THR 229 Ca 0.02 1.18 -0.23 0.00 0.31 0.00 0.00 61.69 62.97 1ucy s THR 229 Cb -0.07 -3.75 0.06 0.00 0.01 0.00 0.00 72.50 68.74 1ucy s THR 229 CO 0.01 0.15 1.40 -2.28 -0.69 0.00 0.00 174.62 173.21 1ucy s HIS 230 N 0.39 2.56 0.20 4.92 2.46 0.25 -2.20 115.29 123.87 1ucy s HIS 230 Ca 0.57 -0.81 -0.11 0.00 0.47 0.00 0.00 55.06 55.18 1ucy s HIS 230 Cb -0.34 -4.65 0.27 0.00 -0.13 0.00 0.00 32.58 27.73 1ucy s HIS 230 CO 0.35 -1.91 1.69 0.28 -2.47 0.00 0.00 174.74 172.68 1ucy h VAL 231 N 6.62 0.59 -0.51 0.89 2.07 -1.40 -2.26 116.25 122.26 1ucy h VAL 231 Ca 0.14 -0.06 0.04 0.00 0.82 0.00 0.00 66.70 67.64 1ucy h VAL 231 Cb 1.02 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.15 1ucy h VAL 231 CO 1.38 0.03 0.34 0.15 0.02 0.00 0.00 177.57 179.50 1ucy h PHE 232 N 0.18 0.54 0.00 1.57 3.57 -1.85 -1.44 116.94 119.51 1ucy h PHE 232 Ca 0.30 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.81 1ucy h PHE 232 Cb 0.46 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.02 1ucy h PHE 232 CO -0.29 0.31 0.00 0.00 -2.23 0.00 0.00 178.31 176.09 1ucy h ARG 233 N 0.55 0.00 -0.44 1.11 3.08 -1.78 -2.89 114.38 114.01 1ucy h ARG 233 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1ucy h ARG 233 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 1ucy h ARG 233 CO -0.06 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.12 1ucy n LEU 234 N -3.05 3.20 0.12 3.04 4.77 -0.77 -4.60 117.00 119.71 1ucy n LEU 234 Ca 0.02 -1.88 0.15 0.00 -0.03 0.00 0.00 56.01 54.27 1ucy n LEU 234 Cb 0.39 -0.29 0.67 0.00 -2.33 0.00 0.00 43.42 41.86 1ucy n LEU 234 CO 0.30 0.78 1.13 0.50 -1.33 0.00 0.00 177.39 178.77 1ucy h LYS 235 N 2.92 0.00 0.00 3.23 1.63 -1.07 -0.43 116.57 122.84 1ucy h LYS 235 Ca 0.00 0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.68 1ucy h LYS 235 Cb 0.81 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.42 1ucy h LYS 235 CO 0.00 0.00 -0.58 -0.22 -3.45 0.00 0.00 179.45 175.20 1ucy h LYS 236 N 0.00 0.00 0.02 1.90 3.64 -1.82 -2.49 116.57 117.82 1ucy h LYS 236 Ca 0.14 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 59.27 1ucy h LYS 236 Cb 0.55 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.38 1ucy h LYS 236 CO -0.00 0.58 -1.01 2.35 -2.27 0.00 0.00 179.45 179.10 1ucy h TRP 237 N 0.00 0.77 -0.18 1.91 7.01 -1.43 -1.93 115.95 122.10 1ucy h TRP 237 Ca -0.01 -0.43 0.01 0.00 2.11 0.00 0.00 58.89 60.58 1ucy h TRP 237 Cb 1.23 -0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 28.19 1ucy h TRP 237 CO 0.00 1.26 0.08 0.82 -2.79 0.00 0.00 178.44 177.81 1ucy h ILE 238 N 0.28 0.99 -0.21 2.65 2.04 -1.34 -1.54 117.51 120.37 1ucy h ILE 238 Ca -0.11 -0.06 -0.14 0.00 1.00 0.00 0.00 64.86 65.55 1ucy h ILE 238 Cb 1.66 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 38.52 1ucy h ILE 238 CO 0.18 0.03 -0.46 0.06 0.00 0.00 0.00 178.15 177.97 1ucy h GLN 239 N 0.18 0.54 -0.85 2.37 3.07 -1.50 -1.50 115.11 117.42 1ucy h GLN 239 Ca 0.07 -0.30 0.05 0.00 0.09 0.00 0.00 58.65 58.57 1ucy h GLN 239 Cb 0.02 0.02 -0.06 0.00 0.08 0.00 0.00 27.48 27.54 1ucy h GLN 239 CO -0.06 0.89 0.54 -0.22 0.09 0.00 0.00 178.83 180.07 1ucy h LYS 240 N 0.43 0.98 0.01 0.06 3.64 -0.81 0.10 116.57 120.98 1ucy h LYS 240 Ca 0.03 -0.06 -0.20 0.00 -1.27 0.00 0.00 60.65 59.15 1ucy h LYS 240 Cb 0.97 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.55 1ucy h LYS 240 CO 0.09 0.65 -0.95 -0.39 -2.27 0.00 0.00 179.45 176.57 1ucy h VAL 241 N 1.01 1.63 -0.01 2.00 -1.51 -1.13 0.48 116.25 118.71 1ucy h VAL 241 Ca 0.36 -3.08 -0.18 0.00 -1.23 0.00 0.00 66.70 62.57 1ucy h VAL 241 Cb 0.10 2.70 -0.01 0.00 -2.13 0.00 0.00 31.29 31.95 1ucy h VAL 241 CO -0.15 0.88 -0.80 0.40 -1.23 0.00 0.00 177.57 176.67 1ucy h ILE 242 N 0.02 1.48 -0.01 7.19 2.04 -0.67 -3.06 117.51 124.50 1ucy h ILE 242 Ca -0.03 -2.49 0.00 0.00 1.00 0.00 0.00 64.86 63.34 1ucy h ILE 242 Cb 1.65 2.36 0.00 0.00 -0.74 0.00 0.00 36.82 40.09 1ucy h ILE 242 CO 0.13 0.72 -0.22 0.47 0.00 0.00 0.00 178.15 179.25 1ucy n ASP 243 N -3.70 0.89 -2.13 1.72 8.00 0.29 -4.92 116.55 116.71 1ucy n ASP 243 Ca -0.03 -0.81 -0.14 0.00 0.71 0.00 0.00 54.79 54.53 1ucy n ASP 243 Cb 0.76 0.09 0.03 0.00 -0.02 0.00 0.00 41.12 41.97 1ucy n ASP 243 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1ucy n ARG 244 N -0.73 -3.81 0.00 -1.24 1.74 -1.00 -4.54 116.66 107.08 1ucy n ARG 244 Ca 0.13 0.54 0.00 0.00 -0.77 0.00 0.00 57.85 57.75 1ucy n ARG 244 Cb 0.33 -4.65 0.00 0.00 -1.02 0.00 0.00 32.46 27.13 1ucy n ARG 244 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1ucy n LEU 245 N -2.86 0.00 -2.19 0.55 7.94 0.17 -5.01 117.00 115.59 1ucy n LEU 245 Ca -0.04 0.00 0.01 0.00 -1.11 0.00 0.00 56.01 54.87 1ucy n LEU 245 Cb 0.56 0.00 0.04 0.00 0.53 0.00 0.00 43.42 44.55 1ucy n LEU 245 CO 0.34 0.00 0.08 0.61 -1.11 0.00 0.00 177.39 177.31 1ucy n GLY 246 N 0.24 1.42 0.00 -3.96 0.00 -1.21 -4.99 105.19 96.69 1ucy n GLY 246 Ca 0.00 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.16 1ucy n GLY 246 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76