#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uj3 s ILE 2 N 0.00 3.49 -0.04 0.53 1.01 -1.26 -4.99 121.20 119.93 1uj3 s ILE 2 Ca 0.00 -0.49 -0.12 0.00 0.00 0.00 0.00 60.65 60.04 1uj3 s ILE 2 Cb 0.00 -2.53 -0.05 0.00 0.01 0.00 0.00 42.46 39.89 1uj3 s ILE 2 CO 0.00 0.48 0.32 -1.10 0.00 0.00 0.00 174.94 174.64 1uj3 s GLN 3 N 0.69 3.76 -0.14 2.79 1.11 -1.26 -4.76 119.66 121.85 1uj3 s GLN 3 Ca -0.03 0.23 0.01 0.00 0.01 0.00 0.00 55.36 55.58 1uj3 s GLN 3 Cb -0.15 -3.21 -0.00 0.00 -1.01 0.00 0.00 33.01 28.64 1uj3 s GLN 3 CO 0.02 0.72 -0.17 -1.64 0.01 0.00 0.00 175.29 174.23 1uj3 s MET 4 N -1.06 3.21 -0.30 2.91 -1.94 -1.26 -0.56 119.30 120.30 1uj3 s MET 4 Ca 0.21 -0.77 -0.03 0.00 -1.71 0.00 0.00 55.69 53.39 1uj3 s MET 4 Cb -0.15 -2.55 0.04 0.00 2.01 0.00 0.00 34.83 34.18 1uj3 s MET 4 CO 0.10 0.09 0.01 0.99 -0.01 0.00 0.00 175.02 176.21 1uj3 s THR 5 N 0.61 3.13 -0.12 2.05 2.01 0.20 -4.55 115.64 118.97 1uj3 s THR 5 Ca -0.09 -1.28 -0.06 0.00 0.31 0.00 0.00 61.69 60.57 1uj3 s THR 5 Cb -0.16 -2.76 -0.04 0.00 0.01 0.00 0.00 72.50 69.55 1uj3 s THR 5 CO 0.03 -0.08 0.09 -1.58 -0.69 0.00 0.00 174.62 172.39 1uj3 s GLN 6 N 1.29 3.43 0.02 4.92 0.74 -1.26 -0.91 119.66 127.89 1uj3 s GLN 6 Ca -0.04 -0.25 -0.15 0.00 0.05 0.00 0.00 55.36 54.97 1uj3 s GLN 6 Cb -0.19 -3.09 0.02 0.00 1.10 0.00 0.00 33.01 30.85 1uj3 s GLN 6 CO -0.01 0.65 0.32 -1.54 -0.55 0.00 0.00 175.29 174.17 1uj3 s SER 7 N -0.69 -0.17 0.84 6.67 1.04 0.36 -4.57 113.70 117.18 1uj3 s SER 7 Ca 0.12 -0.07 -0.13 0.00 0.48 0.00 0.00 55.95 56.36 1uj3 s SER 7 Cb -0.12 0.35 0.10 0.00 0.10 0.00 0.00 66.02 66.46 1uj3 s SER 7 CO 0.02 -0.57 1.20 -2.16 0.98 0.00 0.00 173.24 172.71 1uj3 s PRO 8 N -2.15 1.74 0.39 4.02 0.04 -1.26 -0.70 135.00 137.08 1uj3 s PRO 8 Ca -0.08 0.05 0.21 0.00 0.04 0.00 0.00 61.00 61.23 1uj3 s PRO 8 Cb -0.02 -1.93 0.31 0.00 0.04 0.00 0.00 34.50 32.89 1uj3 s PRO 8 CO -0.01 -1.74 1.58 0.66 0.04 0.00 0.00 177.00 177.53 1uj3 h SER 9 N -1.16 0.00 -4.07 6.66 4.64 -1.80 -3.40 113.55 114.42 1uj3 h SER 9 Ca -0.46 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.72 1uj3 h SER 9 Cb 1.32 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 63.17 1uj3 h SER 9 CO 0.62 0.17 -0.31 -0.55 -0.87 0.00 0.00 176.83 175.90 1uj3 s SER 10 N -6.27 -0.33 -0.03 4.97 0.15 -1.26 -1.72 113.70 109.20 1uj3 s SER 10 Ca 0.06 0.58 -0.06 0.00 0.70 0.00 0.00 55.95 57.23 1uj3 s SER 10 Cb 0.06 0.63 0.01 0.00 -1.71 0.00 0.00 66.02 65.01 1uj3 s SER 10 CO 0.69 -0.18 0.14 -1.48 1.20 0.00 0.00 173.24 173.61 1uj3 s LEU 11 N -0.10 1.49 -0.15 3.45 0.05 -0.29 -4.93 118.68 118.20 1uj3 s LEU 11 Ca -0.03 0.10 -0.06 0.00 0.05 0.00 0.00 54.13 54.20 1uj3 s LEU 11 Cb -0.03 0.57 -0.04 0.00 -2.05 0.00 0.00 46.19 44.64 1uj3 s LEU 11 CO 0.01 -0.17 0.05 -0.44 -0.55 0.00 0.00 176.35 175.25 1uj3 s SER 12 N -0.48 5.60 0.18 1.48 0.01 -1.26 -0.56 113.70 118.67 1uj3 s SER 12 Ca -0.06 0.14 -0.10 0.00 1.31 0.00 0.00 55.95 57.24 1uj3 s SER 12 Cb -0.04 -1.86 -0.01 0.00 0.21 0.00 0.00 66.02 64.33 1uj3 s SER 12 CO 0.01 0.25 0.34 0.00 0.41 0.00 0.00 173.24 174.24 1uj3 s ALA 13 N -0.10 -0.09 0.26 1.44 0.00 -0.46 -4.85 121.76 117.95 1uj3 s ALA 13 Ca 0.06 -0.85 0.11 0.00 0.00 0.00 0.00 51.96 51.29 1uj3 s ALA 13 Cb -0.12 0.92 -0.05 0.00 0.00 0.00 0.00 23.12 23.87 1uj3 s ALA 13 CO 0.01 -0.70 -0.16 -1.12 0.00 0.00 0.00 175.76 173.79 1uj3 s SER 14 N -2.97 3.79 0.23 0.00 0.01 -1.26 -0.76 113.70 112.74 1uj3 s SER 14 Ca 0.18 -0.90 -0.32 0.00 1.31 0.00 0.00 55.95 56.23 1uj3 s SER 14 Cb 0.02 -0.43 -0.13 0.00 0.21 0.00 0.00 66.02 65.70 1uj3 s SER 14 CO 0.02 0.05 1.53 0.52 0.41 0.00 0.00 173.24 175.77 1uj3 n VAL 15 N -0.48 0.63 0.00 3.43 0.31 -1.26 -1.34 118.33 119.62 1uj3 n VAL 15 Ca -0.07 -0.16 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 1uj3 n VAL 15 Cb 0.59 -1.66 0.00 0.00 -0.91 0.00 0.00 33.84 31.86 1uj3 n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1uj3 n GLY 16 N 2.66 3.27 3.65 2.92 0.00 0.19 -4.89 105.19 113.00 1uj3 n GLY 16 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 1uj3 n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1uj3 s ASP 17 N -1.07 2.66 -0.15 1.61 1.01 -0.45 -3.81 116.67 116.48 1uj3 s ASP 17 Ca 0.00 1.47 0.00 0.00 0.71 0.00 0.00 52.55 54.73 1uj3 s ASP 17 Cb 0.00 -2.15 -0.00 0.00 1.01 0.00 0.00 42.92 41.78 1uj3 s ASP 17 CO 0.00 -3.15 -0.15 -0.60 0.21 0.00 0.00 175.17 171.49 1uj3 s ARG 18 N -4.82 3.23 0.16 8.23 3.52 -1.26 -1.12 118.95 126.90 1uj3 s ARG 18 Ca 0.65 -0.74 0.08 0.00 -0.13 0.00 0.00 55.73 55.60 1uj3 s ARG 18 Cb -0.20 -2.64 -0.04 0.00 -1.56 0.00 0.00 34.95 30.51 1uj3 s ARG 18 CO 0.59 0.03 -0.18 0.14 -0.81 0.00 0.00 175.30 175.06 1uj3 s VAL 19 N 0.79 1.79 -0.06 7.11 -7.23 0.68 -4.96 120.40 118.53 1uj3 s VAL 19 Ca -0.05 -1.88 0.02 0.00 -1.81 0.00 0.00 61.98 58.26 1uj3 s VAL 19 Cb -0.15 -1.81 0.01 0.00 0.56 0.00 0.00 36.38 34.99 1uj3 s VAL 19 CO 0.00 -0.30 -0.12 -0.89 -0.31 0.00 0.00 175.10 173.48 1uj3 s THR 20 N -1.97 1.13 -0.04 5.32 2.01 -1.26 -0.31 115.64 120.51 1uj3 s THR 20 Ca 0.15 -0.48 0.06 0.00 0.31 0.00 0.00 61.69 61.72 1uj3 s THR 20 Cb -0.06 -1.03 -0.02 0.00 0.01 0.00 0.00 72.50 71.40 1uj3 s THR 20 CO 0.06 0.35 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.50 1uj3 s ILE 21 N 0.62 2.37 0.06 1.82 1.01 0.93 -4.77 121.20 123.25 1uj3 s ILE 21 Ca -0.14 -0.97 0.09 0.00 0.00 0.00 0.00 60.65 59.63 1uj3 s ILE 21 Cb -0.15 -1.87 -0.03 0.00 0.01 0.00 0.00 42.46 40.41 1uj3 s ILE 21 CO 0.04 0.58 -0.24 -0.89 0.00 0.00 0.00 174.94 174.42 1uj3 s THR 22 N -0.48 2.35 -0.04 2.92 2.01 0.12 -0.26 115.64 122.26 1uj3 s THR 22 Ca 0.06 -1.41 0.01 0.00 0.31 0.00 0.00 61.69 60.66 1uj3 s THR 22 Cb -0.11 -1.96 0.02 0.00 0.01 0.00 0.00 72.50 70.46 1uj3 s THR 22 CO 0.01 0.30 -0.03 0.00 -0.69 0.00 0.00 174.62 174.21 1uj3 s LYS 24 N 0.99 3.05 0.23 0.00 1.02 -0.09 -0.86 119.74 124.08 1uj3 s LYS 24 Ca -0.10 -0.86 -0.05 0.00 0.02 0.00 0.00 55.97 54.98 1uj3 s LYS 24 Cb -0.14 -2.37 -0.06 0.00 -0.52 0.00 0.00 37.83 34.74 1uj3 s LYS 24 CO -0.01 0.09 0.49 0.00 -0.92 0.00 0.00 175.35 175.01 1uj3 s ALA 25 N 0.56 3.68 -0.60 5.17 0.00 0.97 -0.63 121.76 130.90 1uj3 s ALA 25 Ca -0.13 -0.54 0.23 0.00 0.00 0.00 0.00 51.96 51.51 1uj3 s ALA 25 Cb -0.17 -2.24 0.92 0.00 0.00 0.00 0.00 23.12 21.63 1uj3 s ALA 25 CO 0.04 0.42 1.70 -1.13 0.00 0.00 0.00 175.76 176.79 1uj3 n SER 26 N -0.51 0.59 -3.89 0.00 3.41 0.28 -4.79 113.62 108.71 1uj3 n SER 26 Ca -0.02 0.63 -0.09 0.00 -0.26 0.00 0.00 58.87 59.12 1uj3 n SER 26 Cb 0.53 -0.76 -0.05 0.00 -0.26 0.00 0.00 64.21 63.67 1uj3 n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1uj3 s GLN 27 N -3.23 1.40 0.03 4.33 -2.07 -1.26 -4.96 119.66 113.89 1uj3 s GLN 27 Ca 0.06 -1.08 -0.31 0.00 -1.82 0.00 0.00 55.36 52.21 1uj3 s GLN 27 Cb 0.10 0.47 -0.10 0.00 -1.09 0.00 0.00 33.01 32.39 1uj3 s GLN 27 CO 0.41 -0.57 1.94 -3.47 -1.32 0.00 0.00 175.29 172.28 1uj3 n ASP 28 N -0.33 4.01 -1.07 12.60 2.03 -1.26 -4.57 116.55 127.97 1uj3 n ASP 28 Ca -0.06 0.93 0.09 0.00 0.52 0.00 0.00 54.79 56.26 1uj3 n ASP 28 Cb 0.62 -1.50 0.25 0.00 -0.72 0.00 0.00 41.12 39.78 1uj3 n ASP 28 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 1uj3 n ILE 29 N 5.33 1.25 -4.08 5.18 -5.35 -0.74 -4.97 119.36 115.99 1uj3 n ILE 29 Ca 0.20 -1.11 -0.30 0.00 -0.27 0.00 0.00 62.75 61.28 1uj3 n ILE 29 Cb 0.38 0.37 -0.03 0.00 -1.74 0.00 0.00 39.64 38.62 1uj3 n ILE 29 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1uj3 n LYS 30 N 0.92 -3.09 -0.99 6.28 5.02 -1.26 -1.63 118.16 123.40 1uj3 n LYS 30 Ca 0.19 0.37 0.00 0.00 -2.02 0.00 0.00 58.31 56.85 1uj3 n LYS 30 Cb 0.61 -4.67 0.00 0.00 -0.02 0.00 0.00 35.03 30.95 1uj3 n LYS 30 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1uj3 n SER 31 N -2.86 -4.92 -3.68 4.39 7.64 -1.26 -4.89 113.62 108.04 1uj3 n SER 31 Ca -0.17 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.30 1uj3 n SER 31 Cb 0.62 -2.58 -0.00 0.00 -1.01 0.00 0.00 64.21 61.23 1uj3 n SER 31 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1uj3 n PHE 32 N -2.29 3.11 -4.06 1.43 3.01 -0.65 -2.31 117.46 115.71 1uj3 n PHE 32 Ca 0.00 -2.93 -0.22 0.00 1.01 0.00 0.00 57.45 55.30 1uj3 n PHE 32 Cb 0.34 -2.33 -0.17 0.00 -0.01 0.00 0.00 39.48 37.32 1uj3 n PHE 32 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 1uj3 s LEU 33 N 0.89 1.14 0.21 4.37 1.98 -1.26 -2.71 118.68 123.30 1uj3 s LEU 33 Ca 0.49 -0.16 0.05 0.00 -2.89 0.00 0.00 54.13 51.62 1uj3 s LEU 33 Cb 0.14 -0.55 -0.05 0.00 0.66 0.00 0.00 46.19 46.39 1uj3 s LEU 33 CO -0.06 -0.09 -0.06 -0.94 -1.89 0.00 0.00 176.35 173.30 1uj3 s SER 34 N 1.30 2.10 0.04 3.68 1.04 -0.46 0.06 113.70 121.45 1uj3 s SER 34 Ca -0.05 -1.12 0.07 0.00 0.48 0.00 0.00 55.95 55.33 1uj3 s SER 34 Cb -0.14 -0.05 -0.02 0.00 0.10 0.00 0.00 66.02 65.91 1uj3 s SER 34 CO -0.02 -0.37 -0.20 0.26 0.98 0.00 0.00 173.24 173.88 1uj3 s TRP 35 N -3.25 1.77 0.07 5.02 0.52 0.95 -0.23 118.94 123.79 1uj3 s TRP 35 Ca 0.24 -0.37 0.04 0.00 0.02 0.00 0.00 56.10 56.04 1uj3 s TRP 35 Cb 0.03 -1.06 -0.03 0.00 -1.15 0.00 0.00 33.47 31.26 1uj3 s TRP 35 CO 0.07 0.07 -0.12 0.71 0.02 0.00 0.00 176.95 177.70 1uj3 s TYR 36 N -0.76 1.07 0.03 -1.98 1.51 0.34 -0.40 117.35 117.16 1uj3 s TYR 36 Ca 0.07 -0.49 0.06 0.00 -1.01 0.00 0.00 57.07 55.69 1uj3 s TYR 36 Cb -0.09 -0.61 -0.03 0.00 -0.11 0.00 0.00 41.96 41.13 1uj3 s TYR 36 CO 0.01 0.02 -0.13 -1.14 -1.11 0.00 0.00 175.55 173.20 1uj3 s GLN 37 N -1.85 2.27 -0.08 -0.62 0.74 0.03 -1.18 119.66 118.97 1uj3 s GLN 37 Ca -0.03 -0.88 -0.04 0.00 0.05 0.00 0.00 55.36 54.47 1uj3 s GLN 37 Cb -0.09 -2.32 0.04 0.00 1.10 0.00 0.00 33.01 31.74 1uj3 s GLN 37 CO 0.02 0.56 0.18 -1.14 -0.55 0.00 0.00 175.29 174.36 1uj3 s GLN 38 N -1.46 0.14 0.26 1.67 0.74 0.82 -0.41 119.66 121.41 1uj3 s GLN 38 Ca 0.16 0.42 0.06 0.00 0.05 0.00 0.00 55.36 56.06 1uj3 s GLN 38 Cb -0.11 -0.15 -0.03 0.00 1.10 0.00 0.00 33.01 33.82 1uj3 s GLN 38 CO 0.07 -0.16 0.26 0.15 -0.55 0.00 0.00 175.29 175.05 1uj3 s LYS 39 N 1.16 3.06 -0.02 1.67 1.02 -1.26 -1.76 119.74 123.61 1uj3 s LYS 39 Ca -0.09 -0.99 -0.38 0.00 0.02 0.00 0.00 55.97 54.53 1uj3 s LYS 39 Cb -0.11 -2.66 -0.17 0.00 -0.52 0.00 0.00 37.83 34.37 1uj3 s LYS 39 CO -0.07 0.38 1.36 -2.30 -0.92 0.00 0.00 175.35 173.81 1uj3 n PRO 40 N -1.27 0.86 -1.33 -1.68 -0.02 -1.26 -1.10 135.00 129.20 1uj3 n PRO 40 Ca -0.08 0.31 -0.11 0.00 -2.02 0.00 0.00 63.50 61.60 1uj3 n PRO 40 Cb 0.58 -1.92 -0.05 0.00 -0.02 0.00 0.00 33.50 32.09 1uj3 n PRO 40 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1uj3 n GLU 41 N 2.84 -1.44 -4.42 -0.52 1.02 -1.26 -4.98 120.64 111.88 1uj3 n GLU 41 Ca 0.21 0.87 -0.25 0.00 -0.02 0.00 0.00 57.16 57.97 1uj3 n GLU 41 Cb 0.15 -5.15 -0.10 0.00 -0.02 0.00 0.00 31.44 26.31 1uj3 n GLU 41 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1uj3 s LYS 42 N -2.85 1.73 0.61 3.49 -0.14 -0.26 -5.12 119.74 117.20 1uj3 s LYS 42 Ca 0.00 -1.62 -0.14 0.00 -1.36 0.00 0.00 55.97 52.85 1uj3 s LYS 42 Cb 0.00 -1.87 -0.03 0.00 -1.68 0.00 0.00 37.83 34.25 1uj3 s LYS 42 CO 0.00 0.36 1.04 0.00 -0.76 0.00 0.00 175.35 175.99 1uj3 s ALA 43 N -2.19 2.81 0.81 5.17 0.00 -1.26 -4.51 121.76 122.59 1uj3 s ALA 43 Ca 0.27 0.23 -0.11 0.00 0.00 0.00 0.00 51.96 52.35 1uj3 s ALA 43 Cb -0.06 -3.18 0.08 0.00 0.00 0.00 0.00 23.12 19.96 1uj3 s ALA 43 CO 0.14 -0.81 1.13 -2.14 0.00 0.00 0.00 175.76 174.08 1uj3 s PRO 44 N -4.43 1.81 -0.02 0.00 0.02 -1.26 -4.65 135.00 126.47 1uj3 s PRO 44 Ca 0.61 1.41 0.03 0.00 0.02 0.00 0.00 61.00 63.06 1uj3 s PRO 44 Cb -0.14 -1.83 -0.00 0.00 0.02 0.00 0.00 34.50 32.55 1uj3 s PRO 44 CO 0.42 -2.01 -0.10 0.15 -0.33 0.00 0.00 177.00 175.12 1uj3 s LYS 45 N -4.61 0.98 0.09 5.54 1.02 0.45 -4.94 119.74 118.27 1uj3 s LYS 45 Ca 0.65 -0.36 -0.31 0.00 0.02 0.00 0.00 55.97 55.97 1uj3 s LYS 45 Cb -0.21 -0.93 -0.08 0.00 -0.52 0.00 0.00 37.83 36.09 1uj3 s LYS 45 CO 0.54 0.18 1.49 0.45 -0.92 0.00 0.00 175.35 177.09 1uj3 s SER 46 N -0.02 6.73 -0.11 2.83 0.15 -1.26 -0.79 113.70 121.24 1uj3 s SER 46 Ca 0.00 2.38 -0.09 0.00 0.70 0.00 0.00 55.95 58.94 1uj3 s SER 46 Cb -0.07 -2.58 -0.05 0.00 -1.71 0.00 0.00 66.02 61.61 1uj3 s SER 46 CO 0.00 -0.76 -0.20 0.18 1.20 0.00 0.00 173.24 173.67 1uj3 n LEU 47 N 4.64 1.31 -3.94 3.45 4.77 0.46 -4.82 117.00 122.87 1uj3 n LEU 47 Ca 0.13 0.21 -0.16 0.00 -0.03 0.00 0.00 56.01 56.17 1uj3 n LEU 47 Cb 0.41 -0.50 -0.15 0.00 -2.33 0.00 0.00 43.42 40.85 1uj3 n LEU 47 CO 0.60 -0.05 -0.40 -0.63 -1.33 0.00 0.00 177.39 175.58 1uj3 s ILE 48 N -2.38 0.39 0.12 -0.08 -1.09 -1.12 -1.42 121.20 115.62 1uj3 s ILE 48 Ca -0.19 -0.19 0.05 0.00 -2.23 0.00 0.00 60.65 58.09 1uj3 s ILE 48 Cb 0.05 -0.35 -0.04 0.00 -1.58 0.00 0.00 42.46 40.55 1uj3 s ILE 48 CO 0.26 0.12 -0.12 -0.72 -1.23 0.00 0.00 174.94 173.25 1uj3 s TYR 49 N 0.03 1.27 -1.35 3.97 1.13 0.11 -0.03 117.35 122.48 1uj3 s TYR 49 Ca 0.00 -0.63 -0.04 0.00 -1.41 0.00 0.00 57.07 55.00 1uj3 s TYR 49 Cb -0.04 -0.67 0.02 0.00 -1.10 0.00 0.00 41.96 40.18 1uj3 s TYR 49 CO -0.00 0.09 0.81 0.98 -2.51 0.00 0.00 175.55 174.92 1uj3 n TYR 50 N 0.36 -2.07 0.00 -3.49 9.36 -1.06 -1.26 117.16 119.00 1uj3 n TYR 50 Ca -0.14 0.87 0.00 0.00 3.32 0.00 0.00 57.90 61.95 1uj3 n TYR 50 Cb 0.58 -4.39 0.00 0.00 -0.63 0.00 0.00 39.34 34.90 1uj3 n TYR 50 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1uj3 n ALA 51 N -4.39 0.00 -0.56 2.98 0.00 0.11 -4.14 120.51 114.51 1uj3 n ALA 51 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1uj3 n ALA 51 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.09 1uj3 n ALA 51 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1uj3 n THR 52 N 0.00 0.00 -3.00 0.00 -2.24 -1.20 -3.14 114.28 104.70 1uj3 n THR 52 Ca 0.00 -0.13 -0.41 0.00 -2.27 0.00 0.00 64.05 61.24 1uj3 n THR 52 Cb 0.00 1.56 -0.05 0.00 -2.10 0.00 0.00 70.33 69.74 1uj3 n THR 52 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1uj3 s SER 53 N -0.06 6.70 -0.07 3.42 0.15 -0.38 -4.55 113.70 118.90 1uj3 s SER 53 Ca 0.00 0.84 -0.30 0.00 0.70 0.00 0.00 55.95 57.19 1uj3 s SER 53 Cb 0.00 -2.39 -0.03 0.00 -1.71 0.00 0.00 66.02 61.90 1uj3 s SER 53 CO 0.00 -0.46 1.14 -0.22 1.20 0.00 0.00 173.24 174.90 1uj3 s LEU 54 N 2.70 4.27 0.73 3.45 2.96 -1.26 -0.71 118.68 130.81 1uj3 s LEU 54 Ca 0.31 1.72 -0.14 0.00 -0.22 0.00 0.00 54.13 55.80 1uj3 s LEU 54 Cb -0.15 -3.56 0.04 0.00 0.50 0.00 0.00 46.19 43.02 1uj3 s LEU 54 CO 0.08 -0.54 1.14 0.00 -1.32 0.00 0.00 176.35 175.72 1uj3 s ALA 55 N 2.15 2.20 -0.12 5.97 0.00 -0.51 -4.89 121.76 126.56 1uj3 s ALA 55 Ca 0.53 0.62 -0.38 0.00 0.00 0.00 0.00 51.96 52.74 1uj3 s ALA 55 Cb -0.23 -3.38 -0.15 0.00 0.00 0.00 0.00 23.12 19.37 1uj3 s ALA 55 CO 0.21 -1.74 1.68 -3.47 0.00 0.00 0.00 175.76 172.44 1uj3 n ASP 56 N -2.92 2.56 0.00 0.00 2.03 -1.26 -1.44 116.55 115.52 1uj3 n ASP 56 Ca 0.11 1.06 0.00 0.00 0.52 0.00 0.00 54.79 56.48 1uj3 n ASP 56 Cb 0.52 -1.23 0.00 0.00 -0.72 0.00 0.00 41.12 39.69 1uj3 n ASP 56 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1uj3 n GLY 57 N 3.85 1.68 3.74 0.27 0.00 -1.26 -5.00 105.19 108.47 1uj3 n GLY 57 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 1uj3 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uj3 s VAL 58 N -3.21 3.83 0.46 1.61 1.01 -0.52 -4.97 120.40 118.62 1uj3 s VAL 58 Ca 0.00 1.61 -0.23 0.00 0.00 0.00 0.00 61.98 63.36 1uj3 s VAL 58 Cb 0.00 -4.02 -0.09 0.00 0.00 0.00 0.00 36.38 32.26 1uj3 s VAL 58 CO 0.00 0.29 1.01 -2.65 0.00 0.00 0.00 175.10 173.75 1uj3 n PRO 59 N 2.26 1.29 0.05 2.72 -0.02 -1.26 -4.86 135.00 135.19 1uj3 n PRO 59 Ca 0.02 0.47 0.07 0.00 -2.02 0.00 0.00 63.50 62.05 1uj3 n PRO 59 Cb 0.46 -2.09 0.32 0.00 -0.02 0.00 0.00 33.50 32.17 1uj3 n PRO 59 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1uj3 n SER 60 N 0.23 0.23 0.29 2.55 3.41 -1.26 -1.77 113.62 117.29 1uj3 n SER 60 Ca 0.10 0.57 0.15 0.00 -0.26 0.00 0.00 58.87 59.43 1uj3 n SER 60 Cb 0.41 -0.61 0.88 0.00 -0.26 0.00 0.00 64.21 64.63 1uj3 n SER 60 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1uj3 h ARG 61 N 0.00 0.00 -5.68 4.33 3.08 -1.89 -3.41 114.38 110.81 1uj3 h ARG 61 Ca 0.00 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.46 1uj3 h ARG 61 Cb 0.20 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.17 1uj3 h ARG 61 CO 0.00 0.04 -0.25 -0.06 -1.07 0.00 0.00 179.97 178.64 1uj3 s PHE 62 N -4.40 3.54 0.03 3.04 0.08 -0.73 -0.98 117.98 118.56 1uj3 s PHE 62 Ca -0.04 0.77 -0.09 0.00 0.12 0.00 0.00 56.93 57.69 1uj3 s PHE 62 Cb 0.14 -2.38 0.00 0.00 -0.57 0.00 0.00 43.02 40.21 1uj3 s PHE 62 CO 0.54 0.31 0.18 -1.54 -0.10 0.00 0.00 175.22 174.62 1uj3 s SER 63 N 0.16 0.05 0.14 1.36 1.04 -0.68 -4.96 113.70 110.81 1uj3 s SER 63 Ca 0.21 -0.37 0.05 0.00 0.48 0.00 0.00 55.95 56.33 1uj3 s SER 63 Cb -0.14 0.27 -0.04 0.00 0.10 0.00 0.00 66.02 66.21 1uj3 s SER 63 CO 0.08 -0.53 -0.12 -0.83 0.98 0.00 0.00 173.24 172.82 1uj3 s GLY 64 N -2.01 1.11 -0.05 7.32 0.00 -1.26 -0.38 107.32 112.06 1uj3 s GLY 64 Ca -0.06 -1.42 -0.22 0.00 0.00 0.00 0.00 44.72 43.02 1uj3 s GLY 64 CO -0.03 -1.50 0.48 -0.45 0.00 0.00 0.00 173.10 171.60 1uj3 s SER 65 N -2.87 -0.42 0.00 1.64 0.15 -0.36 -4.48 113.70 107.36 1uj3 s SER 65 Ca 0.14 0.44 0.00 0.00 0.70 0.00 0.00 55.95 57.23 1uj3 s SER 65 Cb -0.01 0.48 0.00 0.00 -1.71 0.00 0.00 66.02 64.78 1uj3 s SER 65 CO 0.02 -0.48 0.00 0.61 1.20 0.00 0.00 173.24 174.59 1uj3 n GLY 66 N 1.30 3.43 3.83 9.45 0.00 -1.26 -0.03 105.19 121.90 1uj3 n GLY 66 Ca -0.20 -1.77 -0.07 0.00 0.00 0.00 0.00 46.02 43.99 1uj3 n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uj3 s SER 67 N 0.00 -0.08 1.50 1.61 1.04 -1.19 -4.87 113.70 111.72 1uj3 s SER 67 Ca 0.00 -0.87 0.00 0.00 0.48 0.00 0.00 55.95 55.56 1uj3 s SER 67 Cb 0.00 0.73 0.00 0.00 0.10 0.00 0.00 66.02 66.85 1uj3 s SER 67 CO 0.00 -1.42 0.00 0.61 0.98 0.00 0.00 173.24 173.41 1uj3 n GLY 68 N -0.53 2.79 0.01 7.32 0.00 -1.26 -3.01 105.19 110.50 1uj3 n GLY 68 Ca -0.06 -0.25 0.08 0.00 0.00 0.00 0.00 46.02 45.79 1uj3 n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1uj3 n THR 69 N 0.00 0.00 -4.38 2.61 -2.24 -1.26 -1.79 114.28 107.22 1uj3 n THR 69 Ca 0.00 -0.31 -0.34 0.00 -2.27 0.00 0.00 64.05 61.13 1uj3 n THR 69 Cb 0.00 0.35 -0.12 0.00 -2.10 0.00 0.00 70.33 68.45 1uj3 n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1uj3 s ASP 70 N -3.54 4.76 0.06 3.42 1.11 -1.16 -0.02 116.67 121.29 1uj3 s ASP 70 Ca -0.03 -0.15 0.03 0.00 0.18 0.00 0.00 52.55 52.58 1uj3 s ASP 70 Cb 0.11 -1.78 -0.03 0.00 1.07 0.00 0.00 42.92 42.29 1uj3 s ASP 70 CO 0.68 0.16 -0.08 -0.31 1.18 0.00 0.00 175.17 176.79 1uj3 s TYR 71 N 0.43 0.79 0.05 4.23 2.02 -0.03 -3.18 117.35 121.67 1uj3 s TYR 71 Ca -0.04 -0.58 0.03 0.00 -0.37 0.00 0.00 57.07 56.11 1uj3 s TYR 71 Cb -0.14 -0.46 -0.03 0.00 -0.40 0.00 0.00 41.96 40.93 1uj3 s TYR 71 CO 0.03 -0.07 -0.09 0.95 -1.57 0.00 0.00 175.55 174.80 1uj3 s THR 72 N -1.84 0.64 -0.15 -0.71 -4.23 0.96 -1.38 115.64 108.91 1uj3 s THR 72 Ca -0.04 -1.18 0.01 0.00 -1.18 0.00 0.00 61.69 59.30 1uj3 s THR 72 Cb -0.07 -0.75 0.00 0.00 1.34 0.00 0.00 72.50 73.02 1uj3 s THR 72 CO -0.00 -0.40 -0.18 -0.22 -0.54 0.00 0.00 174.62 173.28 1uj3 s LEU 73 N -1.71 2.32 -0.06 4.79 2.96 0.65 -1.22 118.68 126.39 1uj3 s LEU 73 Ca -0.07 -0.53 0.05 0.00 -0.22 0.00 0.00 54.13 53.35 1uj3 s LEU 73 Cb -0.09 -1.52 -0.02 0.00 0.50 0.00 0.00 46.19 45.07 1uj3 s LEU 73 CO 0.00 0.08 -0.20 -0.89 -1.32 0.00 0.00 176.35 174.02 1uj3 s THR 74 N 0.86 2.50 -0.19 3.68 2.01 0.49 -0.05 115.64 124.95 1uj3 s THR 74 Ca -0.05 -0.91 -0.01 0.00 0.31 0.00 0.00 61.69 61.04 1uj3 s THR 74 Cb -0.15 -1.95 0.01 0.00 0.01 0.00 0.00 72.50 70.42 1uj3 s THR 74 CO -0.02 0.57 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.70 1uj3 s ILE 75 N -0.27 2.49 0.20 1.82 1.01 0.57 -1.68 121.20 125.34 1uj3 s ILE 75 Ca 0.00 -0.80 0.06 0.00 0.00 0.00 0.00 60.65 59.92 1uj3 s ILE 75 Cb -0.13 -2.08 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 1uj3 s ILE 75 CO 0.03 0.50 0.12 -0.44 0.00 0.00 0.00 174.94 175.15 1uj3 s SER 76 N 1.33 5.31 -1.48 3.58 0.01 -0.15 -0.23 113.70 122.07 1uj3 s SER 76 Ca 0.05 -0.26 -0.05 0.00 1.31 0.00 0.00 55.95 56.99 1uj3 s SER 76 Cb -0.13 -1.30 0.04 0.00 0.21 0.00 0.00 66.02 64.83 1uj3 s SER 76 CO -0.09 0.03 0.55 -1.20 0.41 0.00 0.00 173.24 172.93 1uj3 n SER 77 N -0.64 -1.32 -4.65 2.44 7.64 -1.01 -4.70 113.62 111.38 1uj3 n SER 77 Ca -0.08 -0.98 -0.58 0.00 1.01 0.00 0.00 58.87 58.23 1uj3 n SER 77 Cb 0.56 -3.08 -0.07 0.00 -1.01 0.00 0.00 64.21 60.60 1uj3 n SER 77 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1uj3 n LEU 78 N -4.42 1.61 -4.77 -3.43 -0.00 -0.27 -4.38 117.00 101.35 1uj3 n LEU 78 Ca -0.20 1.12 -0.23 0.00 -0.00 0.00 0.00 56.01 56.70 1uj3 n LEU 78 Cb 0.63 -1.08 -0.05 0.00 -0.00 0.00 0.00 43.42 42.92 1uj3 n LEU 78 CO 0.77 -0.90 -0.22 -1.10 -0.00 0.00 0.00 177.39 175.94 1uj3 s GLN 79 N 2.03 2.73 0.29 1.96 -1.52 -1.26 0.55 119.66 124.43 1uj3 s GLN 79 Ca 0.94 -1.15 0.03 0.00 -1.95 0.00 0.00 55.36 53.23 1uj3 s GLN 79 Cb -1.14 -2.44 0.70 0.00 -0.22 0.00 0.00 33.01 29.90 1uj3 s GLN 79 CO 0.62 0.40 1.71 -1.35 -0.25 0.00 0.00 175.29 176.41 1uj3 h PRO 80 N 1.69 0.42 0.00 2.91 0.11 -1.98 0.32 132.00 135.46 1uj3 h PRO 80 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1uj3 h PRO 80 Cb 1.24 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1uj3 h PRO 80 CO 0.61 0.28 0.00 -0.85 -0.21 0.00 0.00 178.00 177.82 1uj3 n GLU 81 N -5.02 0.32 0.02 1.05 0.00 -1.26 -2.60 120.64 113.16 1uj3 n GLU 81 Ca 0.21 0.09 0.12 0.00 0.00 0.00 0.00 57.16 57.58 1uj3 n GLU 81 Cb 0.62 -1.50 0.17 0.00 0.00 0.00 0.00 31.44 30.73 1uj3 n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1uj3 n ASP 82 N -1.19 0.60 -4.67 -1.84 8.00 0.11 -4.81 116.55 112.76 1uj3 n ASP 82 Ca 0.09 -0.15 -0.43 0.00 0.71 0.00 0.00 54.79 55.02 1uj3 n ASP 82 Cb 0.10 0.36 -0.02 0.00 -0.02 0.00 0.00 41.12 41.54 1uj3 n ASP 82 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1uj3 s PHE 83 N -3.10 2.76 -0.02 1.24 0.08 -1.07 -4.85 117.98 113.02 1uj3 s PHE 83 Ca 0.08 0.89 -0.09 0.00 0.12 0.00 0.00 56.93 57.93 1uj3 s PHE 83 Cb 0.15 -3.57 0.03 0.00 -0.57 0.00 0.00 43.02 39.06 1uj3 s PHE 83 CO 0.73 -2.06 0.38 0.00 -0.10 0.00 0.00 175.22 174.18 1uj3 n ALA 84 N 6.38 -1.10 -2.67 5.36 0.00 -1.12 -4.99 120.51 122.37 1uj3 n ALA 84 Ca 0.14 -0.21 -0.33 0.00 0.00 0.00 0.00 53.44 53.04 1uj3 n ALA 84 Cb 0.45 0.01 -0.09 0.00 0.00 0.00 0.00 19.45 19.81 1uj3 n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1uj3 s THR 85 N -2.03 4.11 0.05 0.00 2.01 -0.72 -0.54 115.64 118.52 1uj3 s THR 85 Ca 0.09 -0.54 0.09 0.00 0.31 0.00 0.00 61.69 61.64 1uj3 s THR 85 Cb -0.00 -2.79 -0.03 0.00 0.01 0.00 0.00 72.50 69.69 1uj3 s THR 85 CO -0.01 0.44 -0.24 -0.31 -0.69 0.00 0.00 174.62 173.81 1uj3 s TYR 86 N -1.02 2.09 0.00 4.92 1.51 -0.05 -0.12 117.35 124.69 1uj3 s TYR 86 Ca 0.18 -0.40 0.02 0.00 -1.01 0.00 0.00 57.07 55.86 1uj3 s TYR 86 Cb -0.11 -1.24 -0.01 0.00 -0.11 0.00 0.00 41.96 40.49 1uj3 s TYR 86 CO 0.08 0.13 -0.08 0.71 -1.11 0.00 0.00 175.55 175.28 1uj3 s TYR 87 N -0.83 0.70 0.33 2.71 2.02 -0.33 -0.92 117.35 121.03 1uj3 s TYR 87 Ca 0.10 -0.18 0.05 0.00 -0.37 0.00 0.00 57.07 56.67 1uj3 s TYR 87 Cb -0.09 -0.44 -0.01 0.00 -0.40 0.00 0.00 41.96 41.01 1uj3 s TYR 87 CO 0.02 -0.02 0.47 0.00 -1.57 0.00 0.00 175.55 174.46 1uj3 s LEU 89 N -4.18 0.40 -0.29 0.00 2.96 0.68 -1.20 118.68 117.04 1uj3 s LEU 89 Ca 0.43 0.39 -0.13 0.00 -0.22 0.00 0.00 54.13 54.60 1uj3 s LEU 89 Cb -0.09 0.47 -0.04 0.00 0.50 0.00 0.00 46.19 47.03 1uj3 s LEU 89 CO 0.32 -0.18 0.28 -1.58 -1.32 0.00 0.00 176.35 173.87 1uj3 s GLN 90 N 1.52 3.86 -0.12 1.98 -0.44 -0.20 -1.35 119.66 124.90 1uj3 s GLN 90 Ca -0.06 -0.26 0.23 0.00 -2.50 0.00 0.00 55.36 52.77 1uj3 s GLN 90 Cb -0.11 -3.70 0.44 0.00 -1.64 0.00 0.00 33.01 28.00 1uj3 s GLN 90 CO -0.07 -0.30 1.15 -2.39 0.50 0.00 0.00 175.29 174.19 1uj3 n HIS 91 N 5.20 0.44 0.18 1.67 1.44 -1.10 -1.90 115.22 121.16 1uj3 n HIS 91 Ca -0.11 -1.23 0.07 0.00 -2.01 0.00 0.00 57.72 54.43 1uj3 n HIS 91 Cb 0.51 -0.08 0.10 0.00 0.12 0.00 0.00 29.99 30.64 1uj3 n HIS 91 CO 0.00 0.00 0.00 0.78 -2.81 0.00 0.00 176.34 174.31 1uj3 h GLY 92 N 1.62 0.00 -5.20 -1.39 0.00 -1.89 -3.46 103.07 92.76 1uj3 h GLY 92 Ca -0.22 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.01 1uj3 h GLY 92 CO 0.10 0.00 -0.16 -1.83 0.00 0.00 0.00 176.54 174.65 1uj3 s GLU 93 N -3.09 0.55 0.46 4.80 -1.05 -1.26 -5.13 118.70 113.98 1uj3 s GLU 93 Ca 0.05 0.66 -0.17 0.00 -0.15 0.00 0.00 54.97 55.36 1uj3 s GLU 93 Cb 0.07 0.26 -0.09 0.00 -0.44 0.00 0.00 34.13 33.93 1uj3 s GLU 93 CO 0.71 -0.07 0.93 -1.54 0.95 0.00 0.00 175.26 176.24 1uj3 s SER 94 N 0.28 6.73 0.25 0.83 1.04 -1.26 -3.79 113.70 117.77 1uj3 s SER 94 Ca -0.00 1.54 -0.30 0.00 0.48 0.00 0.00 55.95 57.67 1uj3 s SER 94 Cb -0.03 -2.49 -0.09 0.00 0.10 0.00 0.00 66.02 63.51 1uj3 s SER 94 CO 0.00 -0.46 1.27 -2.16 0.98 0.00 0.00 173.24 172.87 1uj3 s PRO 95 N -3.66 4.43 0.39 4.02 0.04 -1.26 -4.92 135.00 134.03 1uj3 s PRO 95 Ca 0.59 2.05 -0.25 0.00 0.04 0.00 0.00 61.00 63.43 1uj3 s PRO 95 Cb -0.10 -3.16 -0.09 0.00 0.04 0.00 0.00 34.50 31.19 1uj3 s PRO 95 CO 0.24 -0.15 1.08 0.71 0.04 0.00 0.00 177.00 178.92 1uj3 s TYR 96 N -0.43 3.25 -0.02 0.56 4.12 -1.25 -4.63 117.35 118.95 1uj3 s TYR 96 Ca 0.52 1.63 0.01 0.00 0.02 0.00 0.00 57.07 59.25 1uj3 s TYR 96 Cb -0.36 -3.21 0.02 0.00 -1.52 0.00 0.00 41.96 36.89 1uj3 s TYR 96 CO 0.43 -0.78 -0.01 0.95 0.02 0.00 0.00 175.55 176.16 1uj3 s THR 97 N -1.54 0.19 0.19 -0.71 -4.23 -0.80 -5.00 115.64 103.74 1uj3 s THR 97 Ca 0.56 0.02 -0.06 0.00 -1.18 0.00 0.00 61.69 61.03 1uj3 s THR 97 Cb -0.25 -0.24 -0.06 0.00 1.34 0.00 0.00 72.50 73.29 1uj3 s THR 97 CO 0.32 0.11 0.46 -0.36 -0.54 0.00 0.00 174.62 174.60 1uj3 s PHE 98 N 0.63 3.46 0.90 3.99 0.08 -1.26 -1.04 117.98 124.74 1uj3 s PHE 98 Ca -0.06 0.65 -0.12 0.00 0.12 0.00 0.00 56.93 57.52 1uj3 s PHE 98 Cb -0.09 -2.09 0.13 0.00 -0.57 0.00 0.00 43.02 40.40 1uj3 s PHE 98 CO -0.01 0.34 1.13 0.20 -0.10 0.00 0.00 175.22 176.78 1uj3 s GLY 99 N -2.56 1.58 0.26 4.36 0.00 -0.34 -4.75 107.32 105.87 1uj3 s GLY 99 Ca 0.43 -0.47 0.23 0.00 0.00 0.00 0.00 44.72 44.92 1uj3 s GLY 99 CO 0.25 0.08 1.70 0.61 0.00 0.00 0.00 173.10 175.73 1uj3 n GLY 100 N -2.11 -1.24 0.00 0.20 0.00 -1.26 -4.67 105.19 96.11 1uj3 n GLY 100 Ca 0.06 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1uj3 n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uj3 n GLY 101 N -0.09 2.29 2.78 -0.02 0.00 -1.26 -5.05 105.19 103.84 1uj3 n GLY 101 Ca 0.02 -1.76 -0.23 0.00 0.00 0.00 0.00 46.02 44.05 1uj3 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1uj3 s THR 102 N -2.09 0.39 -0.22 2.61 2.01 -0.10 -4.46 115.64 113.78 1uj3 s THR 102 Ca 0.00 0.11 -0.16 0.00 0.31 0.00 0.00 61.69 61.94 1uj3 s THR 102 Cb 0.00 -0.54 -0.04 0.00 0.01 0.00 0.00 72.50 71.93 1uj3 s THR 102 CO 0.00 0.26 0.43 -0.75 -0.69 0.00 0.00 174.62 173.87 1uj3 s LYS 103 N 1.92 4.14 -0.39 4.92 2.20 -0.70 -0.87 119.74 130.96 1uj3 s LYS 103 Ca 0.04 0.22 -0.15 0.00 -0.36 0.00 0.00 55.97 55.73 1uj3 s LYS 103 Cb -0.12 -3.57 0.01 0.00 -1.51 0.00 0.00 37.83 32.64 1uj3 s LYS 103 CO -0.05 -0.13 0.31 0.08 -0.36 0.00 0.00 175.35 175.20 1uj3 s VAL 104 N 1.59 5.24 0.39 4.02 1.01 0.29 -1.14 120.40 131.81 1uj3 s VAL 104 Ca 0.19 -0.50 0.08 0.00 0.00 0.00 0.00 61.98 61.75 1uj3 s VAL 104 Cb -0.15 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.29 1uj3 s VAL 104 CO 0.09 -0.25 0.18 -1.83 0.00 0.00 0.00 175.10 173.28 1uj3 s GLU 105 N 1.76 2.27 -0.19 2.72 4.04 0.28 -2.80 118.70 126.77 1uj3 s GLU 105 Ca 0.06 -1.75 -0.26 0.00 0.04 0.00 0.00 54.97 53.05 1uj3 s GLU 105 Cb -0.18 -2.05 -0.01 0.00 0.02 0.00 0.00 34.13 31.91 1uj3 s GLU 105 CO 0.11 -0.06 0.90 0.42 -1.84 0.00 0.00 175.26 174.79 1uj3 s ILE 106 N -2.55 4.81 0.37 1.83 1.01 -1.26 -1.36 121.20 124.05 1uj3 s ILE 106 Ca 0.40 1.76 -0.24 0.00 0.00 0.00 0.00 60.65 62.58 1uj3 s ILE 106 Cb 0.02 -4.19 -0.10 0.00 0.01 0.00 0.00 42.46 38.19 1uj3 s ILE 106 CO 0.23 -0.05 0.97 -0.75 0.00 0.00 0.00 174.94 175.33 1uj3 s LYS 107 N 2.55 4.39 0.31 2.79 2.20 0.06 -4.82 119.74 127.23 1uj3 s LYS 107 Ca 0.40 1.30 -0.19 0.00 -0.36 0.00 0.00 55.97 57.12 1uj3 s LYS 107 Cb -0.16 -2.56 0.03 0.00 -1.51 0.00 0.00 37.83 33.63 1uj3 s LYS 107 CO 0.10 0.10 0.73 -0.98 -0.36 0.00 0.00 175.35 174.94 1uj3 s ARG 108 N -2.49 1.93 0.75 4.03 1.70 -1.26 -4.86 118.95 118.75 1uj3 s ARG 108 Ca 0.55 -1.17 -0.14 0.00 -0.47 0.00 0.00 55.73 54.51 1uj3 s ARG 108 Cb -0.16 0.61 0.05 0.00 -0.57 0.00 0.00 34.95 34.87 1uj3 s ARG 108 CO 0.21 -0.89 1.18 0.95 -1.08 0.00 0.00 175.30 175.68 1uj3 s THR 109 N -3.37 2.43 0.35 4.99 -4.23 -1.26 -4.93 115.64 109.62 1uj3 s THR 109 Ca 0.13 0.20 -0.28 0.00 -1.18 0.00 0.00 61.69 60.55 1uj3 s THR 109 Cb -0.05 -2.69 -0.11 0.00 1.34 0.00 0.00 72.50 70.99 1uj3 s THR 109 CO 0.09 -0.13 1.40 -0.69 -0.54 0.00 0.00 174.62 174.75 1uj3 s VAL 110 N -2.15 2.38 -0.04 2.29 1.01 -1.26 -4.80 120.40 117.81 1uj3 s VAL 110 Ca 0.72 0.38 -0.02 0.00 0.00 0.00 0.00 61.98 63.06 1uj3 s VAL 110 Cb -0.27 -3.24 0.03 0.00 0.00 0.00 0.00 36.38 32.90 1uj3 s VAL 110 CO 0.47 0.09 0.05 0.00 0.00 0.00 0.00 175.10 175.71 1uj3 s ALA 111 N -1.10 0.31 0.44 5.51 0.00 0.16 -4.91 121.76 122.17 1uj3 s ALA 111 Ca 0.51 0.14 -0.23 0.00 0.00 0.00 0.00 51.96 52.38 1uj3 s ALA 111 Cb -0.43 -0.61 -0.08 0.00 0.00 0.00 0.00 23.12 22.00 1uj3 s ALA 111 CO 0.58 -0.45 1.15 0.00 0.00 0.00 0.00 175.76 177.03 1uj3 s ALA 112 N 2.04 3.02 0.55 0.00 0.00 -1.26 -0.76 121.76 125.34 1uj3 s ALA 112 Ca 0.04 0.90 -0.16 0.00 0.00 0.00 0.00 51.96 52.74 1uj3 s ALA 112 Cb -0.12 -3.36 -0.06 0.00 0.00 0.00 0.00 23.12 19.57 1uj3 s ALA 112 CO -0.03 -0.57 1.01 -1.25 0.00 0.00 0.00 175.76 174.92 1uj3 s PRO 113 N -2.62 3.76 -0.16 0.00 0.04 -1.26 -4.62 135.00 130.15 1uj3 s PRO 113 Ca 0.62 0.98 -0.14 0.00 0.04 0.00 0.00 61.00 62.49 1uj3 s PRO 113 Cb -0.28 -2.11 -0.05 0.00 0.04 0.00 0.00 34.50 32.11 1uj3 s PRO 113 CO 0.34 -0.43 0.32 -1.12 0.04 0.00 0.00 177.00 176.15 1uj3 s SER 114 N -3.17 6.46 -0.04 6.66 0.01 -0.87 -4.82 113.70 117.92 1uj3 s SER 114 Ca 0.59 0.53 0.01 0.00 1.31 0.00 0.00 55.95 58.40 1uj3 s SER 114 Cb -0.11 -2.20 -0.03 0.00 0.21 0.00 0.00 66.02 63.89 1uj3 s SER 114 CO 0.36 0.07 -0.04 -0.69 0.41 0.00 0.00 173.24 173.35 1uj3 s VAL 115 N 0.59 3.94 -0.02 3.43 1.01 -1.26 0.19 120.40 128.28 1uj3 s VAL 115 Ca 0.18 -0.51 -0.05 0.00 0.00 0.00 0.00 61.98 61.60 1uj3 s VAL 115 Cb -0.13 -2.67 0.00 0.00 0.00 0.00 0.00 36.38 33.58 1uj3 s VAL 115 CO 0.05 0.51 0.11 -0.36 0.00 0.00 0.00 175.10 175.41 1uj3 s PHE 116 N -0.93 -0.03 0.05 5.22 0.40 -0.18 -4.97 117.98 117.56 1uj3 s PHE 116 Ca 0.15 0.07 0.09 0.00 -0.60 0.00 0.00 56.93 56.63 1uj3 s PHE 116 Cb -0.11 -0.02 -0.03 0.00 0.51 0.00 0.00 43.02 43.37 1uj3 s PHE 116 CO 0.05 -0.16 -0.24 -1.50 0.70 0.00 0.00 175.22 174.07 1uj3 s ILE 117 N -0.65 2.37 -0.07 0.64 2.07 -1.26 0.34 121.20 124.64 1uj3 s ILE 117 Ca -0.07 -1.37 0.02 0.00 -1.41 0.00 0.00 60.65 57.81 1uj3 s ILE 117 Cb -0.04 -1.97 0.02 0.00 0.13 0.00 0.00 42.46 40.60 1uj3 s ILE 117 CO 0.01 0.32 -0.10 -0.36 -1.91 0.00 0.00 174.94 172.90 1uj3 s PHE 118 N -0.88 1.32 0.74 3.50 0.40 0.23 -4.98 117.98 118.31 1uj3 s PHE 118 Ca 0.13 -0.50 -0.10 0.00 -0.60 0.00 0.00 56.93 55.86 1uj3 s PHE 118 Cb -0.10 -1.01 0.05 0.00 0.51 0.00 0.00 43.02 42.47 1uj3 s PHE 118 CO 0.04 -0.30 1.09 -1.25 0.70 0.00 0.00 175.22 175.50 1uj3 s PRO 119 N 0.88 2.31 0.52 0.24 0.04 -1.26 -1.30 135.00 136.43 1uj3 s PRO 119 Ca -0.11 0.09 -0.20 0.00 0.04 0.00 0.00 61.00 60.81 1uj3 s PRO 119 Cb -0.15 -2.05 -0.06 0.00 0.04 0.00 0.00 34.50 32.28 1uj3 s PRO 119 CO 0.01 -1.30 1.14 -1.25 0.04 0.00 0.00 177.00 175.64 1uj3 s PRO 120 N -5.39 3.46 0.59 0.56 0.04 -1.12 -4.81 135.00 128.33 1uj3 s PRO 120 Ca 0.60 1.67 -0.13 0.00 0.04 0.00 0.00 61.00 63.18 1uj3 s PRO 120 Cb -0.11 -2.12 -0.05 0.00 0.04 0.00 0.00 34.50 32.26 1uj3 s PRO 120 CO 0.48 -0.77 1.02 -1.54 0.04 0.00 0.00 177.00 176.23 1uj3 s SER 121 N -1.64 6.31 0.27 6.66 1.04 -1.26 -4.92 113.70 120.15 1uj3 s SER 121 Ca 0.70 1.49 -0.04 0.00 0.48 0.00 0.00 55.95 58.58 1uj3 s SER 121 Cb -0.25 -2.49 0.33 0.00 0.10 0.00 0.00 66.02 63.71 1uj3 s SER 121 CO 0.29 -0.81 1.91 0.44 0.98 0.00 0.00 173.24 176.05 1uj3 h ASP 122 N 0.09 1.04 -0.37 7.02 3.32 -1.98 -1.45 116.42 124.09 1uj3 h ASP 122 Ca -0.45 -0.06 0.06 0.00 0.02 0.00 0.00 57.03 56.60 1uj3 h ASP 122 Cb 1.19 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 40.43 1uj3 h ASP 122 CO 0.61 0.80 0.05 -0.08 -1.72 0.00 0.00 179.24 178.90 1uj3 h GLU 123 N 1.19 0.17 -0.42 3.56 4.81 -2.00 -0.98 114.58 120.90 1uj3 h GLU 123 Ca 0.31 -0.01 -0.14 0.00 -0.13 0.00 0.00 59.36 59.39 1uj3 h GLU 123 Cb -0.05 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 1uj3 h GLU 123 CO -0.06 0.11 -0.29 0.37 -0.73 0.00 0.00 179.01 178.42 1uj3 h GLN 124 N 0.17 0.92 -0.99 1.92 4.15 -1.72 -3.05 115.11 116.50 1uj3 h GLN 124 Ca 0.18 -0.43 0.04 0.00 0.77 0.00 0.00 58.65 59.21 1uj3 h GLN 124 Cb 0.22 -0.01 -0.06 0.00 0.21 0.00 0.00 27.48 27.83 1uj3 h GLN 124 CO -0.25 1.08 0.65 -0.07 -1.93 0.00 0.00 178.83 178.31 1uj3 h LEU 125 N 0.78 1.07 -2.74 -2.39 3.38 -0.80 -0.26 115.31 114.36 1uj3 h LEU 125 Ca 0.09 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1uj3 h LEU 125 Cb 0.86 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1uj3 h LEU 125 CO 0.08 0.73 0.05 0.11 0.09 0.00 0.00 178.44 179.50 1uj3 h LYS 126 N 1.24 0.00 -0.13 1.13 1.57 -1.08 0.21 116.57 119.51 1uj3 h LYS 126 Ca 0.40 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.18 1uj3 h LYS 126 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1uj3 h LYS 126 CO -0.13 0.00 0.00 -1.13 -0.57 0.00 0.00 179.45 177.62 1uj3 n SER 127 N -2.99 2.44 0.00 0.86 3.41 -0.11 -4.96 113.62 112.27 1uj3 n SER 127 Ca -0.03 -1.81 0.00 0.00 -0.26 0.00 0.00 58.87 56.77 1uj3 n SER 127 Cb 0.12 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 1uj3 n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uj3 n GLY 128 N 1.30 0.85 3.05 5.00 0.00 0.06 -5.04 105.19 110.41 1uj3 n GLY 128 Ca 0.17 -0.11 -0.10 0.00 0.00 0.00 0.00 46.02 45.98 1uj3 n GLY 128 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1uj3 s THR 129 N -2.00 0.09 -0.09 2.61 2.01 -1.24 -1.32 115.64 115.70 1uj3 s THR 129 Ca 0.00 -0.77 0.01 0.00 0.31 0.00 0.00 61.69 61.25 1uj3 s THR 129 Cb 0.00 -0.35 0.02 0.00 0.01 0.00 0.00 72.50 72.18 1uj3 s THR 129 CO 0.00 -0.42 -0.12 0.00 -0.69 0.00 0.00 174.62 173.39 1uj3 s ALA 130 N -1.38 1.39 -0.17 7.40 0.00 0.10 -3.47 121.76 125.63 1uj3 s ALA 130 Ca -0.15 -0.53 -0.02 0.00 0.00 0.00 0.00 51.96 51.26 1uj3 s ALA 130 Cb -0.08 -0.73 -0.01 0.00 0.00 0.00 0.00 23.12 22.29 1uj3 s ALA 130 CO 0.00 -0.08 -0.10 -1.12 0.00 0.00 0.00 175.76 174.47 1uj3 s SER 131 N 1.03 4.09 -0.12 0.00 0.01 -1.26 -1.24 113.70 116.22 1uj3 s SER 131 Ca -0.07 -0.37 0.00 0.00 1.31 0.00 0.00 55.95 56.82 1uj3 s SER 131 Cb -0.15 -1.66 -0.02 0.00 0.21 0.00 0.00 66.02 64.41 1uj3 s SER 131 CO -0.01 0.08 -0.14 -0.69 0.41 0.00 0.00 173.24 172.89 1uj3 s VAL 132 N 0.88 3.01 -0.08 3.43 1.01 -0.06 -2.77 120.40 125.82 1uj3 s VAL 132 Ca -0.02 -0.68 0.04 0.00 0.00 0.00 0.00 61.98 61.31 1uj3 s VAL 132 Cb -0.15 -2.25 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 1uj3 s VAL 132 CO 0.00 0.53 -0.20 -0.69 0.00 0.00 0.00 175.10 174.74 1uj3 s VAL 133 N 0.27 2.43 -0.14 2.92 1.01 -0.42 -0.85 120.40 125.61 1uj3 s VAL 133 Ca -0.10 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 60.97 1uj3 s VAL 133 Cb -0.16 -1.94 -0.01 0.00 0.00 0.00 0.00 36.38 34.28 1uj3 s VAL 133 CO 0.05 0.56 -0.15 0.00 0.00 0.00 0.00 175.10 175.57 1uj3 s LEU 135 N 0.62 2.62 -0.35 0.00 2.96 0.15 -1.37 118.68 123.32 1uj3 s LEU 135 Ca -0.08 -0.35 -0.05 0.00 -0.22 0.00 0.00 54.13 53.43 1uj3 s LEU 135 Cb -0.16 -1.57 0.06 0.00 0.50 0.00 0.00 46.19 45.02 1uj3 s LEU 135 CO 0.03 0.18 0.11 -0.76 -1.32 0.00 0.00 176.35 174.59 1uj3 s LEU 136 N 0.26 4.48 -0.18 -0.68 1.43 0.18 -1.01 118.68 123.16 1uj3 s LEU 136 Ca -0.10 -1.39 -0.11 0.00 -1.03 0.00 0.00 54.13 51.49 1uj3 s LEU 136 Cb -0.16 -1.83 -0.05 0.00 0.03 0.00 0.00 46.19 44.18 1uj3 s LEU 136 CO 0.06 -0.38 0.18 0.21 0.23 0.00 0.00 176.35 176.65 1uj3 s ASN 137 N 1.54 6.29 -0.80 2.29 2.47 0.13 -0.85 114.94 126.01 1uj3 s ASN 137 Ca -0.00 0.33 -0.00 0.00 0.42 0.00 0.00 52.86 53.61 1uj3 s ASN 137 Cb -0.21 -2.12 0.00 0.00 -1.45 0.00 0.00 41.25 37.48 1uj3 s ASN 137 CO 0.00 0.17 0.64 0.59 -3.72 0.00 0.00 177.10 174.78 1uj3 n ASN 138 N 3.45 -5.96 -4.55 -4.21 4.13 -0.95 -2.04 115.26 105.13 1uj3 n ASN 138 Ca -0.15 -0.63 -0.25 0.00 1.68 0.00 0.00 54.58 55.22 1uj3 n ASN 138 Cb 0.52 -3.05 -0.11 0.00 -1.54 0.00 0.00 39.78 35.61 1uj3 n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1uj3 s PHE 139 N -3.00 2.27 -0.28 3.10 -0.12 0.13 -4.61 117.98 115.47 1uj3 s PHE 139 Ca 0.00 -0.80 -0.22 0.00 -0.05 0.00 0.00 56.93 55.86 1uj3 s PHE 139 Cb -0.00 -1.56 0.09 0.00 -0.63 0.00 0.00 43.02 40.91 1uj3 s PHE 139 CO 0.84 0.25 0.80 -0.47 -0.05 0.00 0.00 175.22 176.59 1uj3 s TYR 140 N -2.96 -0.78 1.10 3.49 6.14 0.06 -0.26 117.35 124.13 1uj3 s TYR 140 Ca 0.35 1.76 -0.18 0.00 0.64 0.00 0.00 57.07 59.64 1uj3 s TYR 140 Cb 0.09 0.38 0.25 0.00 0.42 0.00 0.00 41.96 43.10 1uj3 s TYR 140 CO 0.17 -0.38 1.19 -1.25 0.64 0.00 0.00 175.55 175.92 1uj3 s PRO 141 N 0.74 -0.40 0.24 4.97 0.04 -1.26 0.39 135.00 139.72 1uj3 s PRO 141 Ca -0.03 -0.18 -0.06 0.00 0.04 0.00 0.00 61.00 60.77 1uj3 s PRO 141 Cb -0.05 -1.70 0.31 0.00 0.04 0.00 0.00 34.50 33.10 1uj3 s PRO 141 CO -0.07 -3.15 1.87 -0.09 0.04 0.00 0.00 177.00 175.60 1uj3 h ARG 142 N -2.17 1.02 -6.28 4.56 9.65 -1.98 -3.44 114.38 115.75 1uj3 h ARG 142 Ca -0.45 -0.06 -0.64 0.00 -1.10 0.00 0.00 59.98 57.73 1uj3 h ARG 142 Cb 1.27 -0.23 0.03 0.00 -1.39 0.00 0.00 29.97 29.65 1uj3 h ARG 142 CO 0.37 0.68 0.98 0.39 2.80 0.00 0.00 179.97 185.18 1uj3 n GLU 143 N -4.57 1.90 -3.64 0.20 4.71 -1.26 -4.97 120.64 113.02 1uj3 n GLU 143 Ca 0.12 0.70 -0.15 0.00 -0.01 0.00 0.00 57.16 57.81 1uj3 n GLU 143 Cb 0.13 -2.48 -0.08 0.00 -1.01 0.00 0.00 31.44 28.00 1uj3 n GLU 143 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1uj3 s ALA 144 N 3.29 -1.32 -0.16 0.62 0.00 -1.26 -4.63 121.76 118.30 1uj3 s ALA 144 Ca 0.91 0.99 0.01 0.00 0.00 0.00 0.00 51.96 53.87 1uj3 s ALA 144 Cb -0.78 -0.15 0.01 0.00 0.00 0.00 0.00 23.12 22.20 1uj3 s ALA 144 CO 0.52 -0.31 -0.18 0.21 0.00 0.00 0.00 175.76 176.00 1uj3 s LYS 145 N -0.95 3.08 -0.20 0.00 2.20 -0.51 -4.99 119.74 118.37 1uj3 s LYS 145 Ca -0.10 -0.80 0.01 0.00 -0.36 0.00 0.00 55.97 54.72 1uj3 s LYS 145 Cb -0.03 -2.57 0.02 0.00 -1.51 0.00 0.00 37.83 33.75 1uj3 s LYS 145 CO 0.06 -0.08 -0.17 0.08 -0.36 0.00 0.00 175.35 174.88 1uj3 s VAL 146 N 1.02 2.20 -0.09 4.02 1.01 -1.26 -0.99 120.40 126.32 1uj3 s VAL 146 Ca -0.02 -1.01 0.03 0.00 0.00 0.00 0.00 61.98 60.98 1uj3 s VAL 146 Cb -0.15 -1.99 -0.02 0.00 0.00 0.00 0.00 36.38 34.23 1uj3 s VAL 146 CO -0.05 0.44 -0.17 -1.10 0.00 0.00 0.00 175.10 174.21 1uj3 s GLN 147 N 1.28 2.90 -0.11 2.72 -0.21 -0.26 -4.96 119.66 121.02 1uj3 s GLN 147 Ca 0.03 -0.76 -0.14 0.00 0.02 0.00 0.00 55.36 54.52 1uj3 s GLN 147 Cb -0.14 -2.42 -0.05 0.00 1.00 0.00 0.00 33.01 31.40 1uj3 s GLN 147 CO -0.11 0.37 0.32 -1.58 -2.12 0.00 0.00 175.29 172.18 1uj3 s TRP 148 N -0.10 3.56 -0.09 0.91 0.52 -1.26 -0.78 118.94 121.69 1uj3 s TRP 148 Ca -0.03 0.73 0.00 0.00 0.02 0.00 0.00 56.10 56.82 1uj3 s TRP 148 Cb -0.14 -2.30 0.02 0.00 -1.15 0.00 0.00 33.47 29.91 1uj3 s TRP 148 CO 0.04 0.41 -0.07 0.15 0.02 0.00 0.00 176.95 177.50 1uj3 s LYS 149 N -0.14 1.34 -0.35 4.98 1.02 -0.73 0.60 119.74 126.47 1uj3 s LYS 149 Ca 0.19 -0.21 -0.05 0.00 0.02 0.00 0.00 55.97 55.92 1uj3 s LYS 149 Cb -0.14 -1.38 0.05 0.00 -0.52 0.00 0.00 37.83 35.84 1uj3 s LYS 149 CO 0.07 -0.20 0.11 0.08 -0.92 0.00 0.00 175.35 174.48 1uj3 s VAL 150 N 1.50 3.59 -1.23 3.17 1.01 -0.27 -1.33 120.40 126.83 1uj3 s VAL 150 Ca 0.00 -1.33 -0.04 0.00 0.00 0.00 0.00 61.98 60.61 1uj3 s VAL 150 Cb -0.13 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.15 1uj3 s VAL 150 CO -0.05 -0.26 1.05 0.47 0.00 0.00 0.00 175.10 176.32 1uj3 n ASP 151 N 4.75 -4.06 0.00 3.32 10.43 0.51 -1.68 116.55 129.82 1uj3 n ASP 151 Ca -0.11 -0.56 0.00 0.00 2.57 0.00 0.00 54.79 56.69 1uj3 n ASP 151 Cb 0.44 -4.93 0.00 0.00 1.84 0.00 0.00 41.12 38.47 1uj3 n ASP 151 CO 0.00 0.00 0.00 -3.20 -1.07 0.00 0.00 177.20 172.93 1uj3 n ASN 152 N -2.97 -0.13 -4.63 -2.24 4.05 -1.26 -4.96 115.26 103.12 1uj3 n ASN 152 Ca -0.14 0.00 -0.40 0.00 0.45 0.00 0.00 54.58 54.49 1uj3 n ASN 152 Cb 0.61 -1.67 -0.07 0.00 1.23 0.00 0.00 39.78 39.88 1uj3 n ASN 152 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1uj3 s ALA 153 N -2.00 3.60 0.26 5.20 0.00 -0.68 -4.98 121.76 123.16 1uj3 s ALA 153 Ca 0.00 -0.46 -0.31 0.00 0.00 0.00 0.00 51.96 51.19 1uj3 s ALA 153 Cb 0.00 -2.98 -0.12 0.00 0.00 0.00 0.00 23.12 20.02 1uj3 s ALA 153 CO 0.00 -0.76 1.60 1.28 0.00 0.00 0.00 175.76 177.89 1uj3 n LEU 154 N 5.58 4.08 -4.95 0.00 7.99 -1.26 -1.12 117.00 127.33 1uj3 n LEU 154 Ca -0.02 1.12 -0.23 0.00 -0.01 0.00 0.00 56.01 56.88 1uj3 n LEU 154 Cb 0.49 -1.56 -0.00 0.00 -0.11 0.00 0.00 43.42 42.24 1uj3 n LEU 154 CO 0.42 0.07 0.21 -1.10 -1.51 0.00 0.00 177.39 175.48 1uj3 s GLN 155 N -0.06 3.30 -0.28 3.23 -1.52 0.20 -4.90 119.66 119.63 1uj3 s GLN 155 Ca 0.68 -0.44 -0.25 0.00 -1.95 0.00 0.00 55.36 53.40 1uj3 s GLN 155 Cb -0.52 -2.63 0.11 0.00 -0.22 0.00 0.00 33.01 29.74 1uj3 s GLN 155 CO 0.45 -0.02 0.95 0.45 -0.25 0.00 0.00 175.29 176.87 1uj3 s SER 156 N -4.11 -0.53 0.00 5.90 0.15 -1.26 -4.70 113.70 109.14 1uj3 s SER 156 Ca 0.43 1.02 0.00 0.00 0.70 0.00 0.00 55.95 58.11 1uj3 s SER 156 Cb -0.10 1.04 0.00 0.00 -1.71 0.00 0.00 66.02 65.26 1uj3 s SER 156 CO 0.36 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.24 1uj3 n GLY 157 N 2.37 0.79 0.54 9.45 0.00 -1.26 -4.85 105.19 112.23 1uj3 n GLY 157 Ca -0.13 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.95 1uj3 n GLY 157 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1uj3 n ASN 158 N -0.02 1.62 -4.11 1.61 6.94 -1.26 -5.05 115.26 114.99 1uj3 n ASN 158 Ca 0.00 -3.14 -0.10 0.00 -0.02 0.00 0.00 54.58 51.32 1uj3 n ASN 158 Cb 0.01 -0.42 -0.10 0.00 -2.36 0.00 0.00 39.78 36.90 1uj3 n ASN 158 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 1uj3 s SER 159 N -2.68 0.86 0.02 0.53 1.04 -1.26 -1.56 113.70 110.66 1uj3 s SER 159 Ca 0.31 -0.87 0.02 0.00 0.48 0.00 0.00 55.95 55.89 1uj3 s SER 159 Cb 0.30 0.11 -0.02 0.00 0.10 0.00 0.00 66.02 66.51 1uj3 s SER 159 CO -0.04 -0.43 -0.07 -1.10 0.98 0.00 0.00 173.24 172.58 1uj3 s GLN 160 N -3.18 0.50 0.23 4.02 -0.21 -0.12 -4.92 119.66 115.96 1uj3 s GLN 160 Ca 0.04 -0.52 0.10 0.00 0.02 0.00 0.00 55.36 55.00 1uj3 s GLN 160 Cb 0.01 -0.36 -0.04 0.00 1.00 0.00 0.00 33.01 33.62 1uj3 s GLN 160 CO -0.05 0.08 -0.13 -1.21 -2.12 0.00 0.00 175.29 171.87 1uj3 s GLU 161 N -0.96 1.92 -0.06 2.91 2.02 -1.26 0.28 118.70 123.55 1uj3 s GLU 161 Ca -0.05 -1.48 -0.05 0.00 0.02 0.00 0.00 54.97 53.42 1uj3 s GLU 161 Cb -0.07 -2.00 0.02 0.00 0.10 0.00 0.00 34.13 32.18 1uj3 s GLU 161 CO 0.00 0.38 0.15 0.45 0.02 0.00 0.00 175.26 176.27 1uj3 s SER 162 N -3.19 -0.15 0.00 -0.19 0.15 -0.68 -4.98 113.70 104.66 1uj3 s SER 162 Ca 0.27 0.31 0.05 0.00 0.70 0.00 0.00 55.95 57.28 1uj3 s SER 162 Cb -0.07 0.28 -0.02 0.00 -1.71 0.00 0.00 66.02 64.50 1uj3 s SER 162 CO 0.15 -0.08 -0.16 0.54 1.20 0.00 0.00 173.24 174.89 1uj3 s VAL 163 N 0.40 1.29 0.73 4.45 0.11 -1.26 -0.92 120.40 125.20 1uj3 s VAL 163 Ca -0.03 -0.80 -0.10 0.00 -2.93 0.00 0.00 61.98 58.12 1uj3 s VAL 163 Cb -0.04 -1.09 0.05 0.00 -1.53 0.00 0.00 36.38 33.77 1uj3 s VAL 163 CO -0.02 0.28 1.09 0.42 -3.33 0.00 0.00 175.10 173.54 1uj3 s THR 164 N -0.51 2.59 0.58 5.04 -4.23 -0.52 -5.01 115.64 113.58 1uj3 s THR 164 Ca 0.06 0.04 -0.14 0.00 -1.18 0.00 0.00 61.69 60.47 1uj3 s THR 164 Cb -0.07 -3.16 -0.05 0.00 1.34 0.00 0.00 72.50 70.57 1uj3 s THR 164 CO 0.00 -0.19 1.02 -1.61 -0.54 0.00 0.00 174.62 173.30 1uj3 s GLU 165 N -5.38 3.65 0.04 3.99 0.41 -1.26 -4.62 118.70 115.53 1uj3 s GLU 165 Ca 0.60 0.89 -0.36 0.00 -0.41 0.00 0.00 54.97 55.69 1uj3 s GLU 165 Cb -0.11 -2.09 -0.15 0.00 -1.78 0.00 0.00 34.13 30.01 1uj3 s GLU 165 CO 0.48 -0.53 1.58 0.94 -0.49 0.00 0.00 175.26 177.24 1uj3 n GLN 166 N -2.27 1.73 -1.70 1.61 7.27 -1.26 -4.82 117.38 117.94 1uj3 n GLN 166 Ca 0.07 0.63 -0.44 0.00 0.07 0.00 0.00 57.00 57.33 1uj3 n GLN 166 Cb 0.54 -2.36 -0.03 0.00 2.41 0.00 0.00 30.24 30.80 1uj3 n GLN 166 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 1uj3 n ASP 167 N 3.96 3.38 0.21 1.69 2.03 0.62 -4.86 116.55 123.58 1uj3 n ASP 167 Ca 0.20 1.12 0.06 0.00 0.52 0.00 0.00 54.79 56.69 1uj3 n ASP 167 Cb 0.24 -1.50 0.46 0.00 -0.72 0.00 0.00 41.12 39.60 1uj3 n ASP 167 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1uj3 h SER 168 N 5.14 0.00 0.00 1.67 4.64 -1.91 -0.39 113.55 122.71 1uj3 h SER 168 Ca -0.45 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.76 1uj3 h SER 168 Cb 1.24 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 1uj3 h SER 168 CO 0.83 0.29 -0.61 0.50 -0.87 0.00 0.00 176.83 176.96 1uj3 h LYS 169 N 0.00 0.00 -0.11 4.77 1.63 -1.98 -3.42 116.57 117.46 1uj3 h LYS 169 Ca -0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1uj3 h LYS 169 Cb 0.61 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.24 1uj3 h LYS 169 CO 0.04 0.88 0.00 -0.40 -3.45 0.00 0.00 179.45 176.52 1uj3 n ASP 170 N -4.54 2.39 -1.73 4.20 5.68 -1.25 -5.00 116.55 116.31 1uj3 n ASP 170 Ca -0.19 -2.15 -0.15 0.00 -0.50 0.00 0.00 54.79 51.80 1uj3 n ASP 170 Cb 0.53 -0.13 -0.05 0.00 -1.14 0.00 0.00 41.12 40.33 1uj3 n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1uj3 n SER 171 N -0.29 -4.08 -4.99 -1.12 7.64 -0.15 -4.93 113.62 105.70 1uj3 n SER 171 Ca 0.06 0.30 -0.19 0.00 1.01 0.00 0.00 58.87 60.05 1uj3 n SER 171 Cb 0.37 -3.65 0.03 0.00 -1.01 0.00 0.00 64.21 59.95 1uj3 n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1uj3 s THR 172 N -2.40 2.74 0.27 0.44 -4.23 -1.26 -4.57 115.64 106.64 1uj3 s THR 172 Ca 0.00 -0.90 0.11 0.00 -1.18 0.00 0.00 61.69 59.72 1uj3 s THR 172 Cb 0.00 -2.84 -0.05 0.00 1.34 0.00 0.00 72.50 70.95 1uj3 s THR 172 CO 0.00 0.00 -0.15 -0.31 -0.54 0.00 0.00 174.62 173.62 1uj3 s TYR 173 N -2.54 2.39 0.05 3.99 1.51 0.64 -0.28 117.35 123.12 1uj3 s TYR 173 Ca 0.57 -0.30 0.03 0.00 -1.01 0.00 0.00 57.07 56.36 1uj3 s TYR 173 Cb -0.09 -1.04 -0.03 0.00 -0.11 0.00 0.00 41.96 40.69 1uj3 s TYR 173 CO 0.36 0.69 -0.09 -1.12 -1.11 0.00 0.00 175.55 174.28 1uj3 s SER 174 N -3.53 1.08 -0.02 2.29 0.01 -1.26 0.18 113.70 112.45 1uj3 s SER 174 Ca 0.30 -0.59 -0.08 0.00 1.31 0.00 0.00 55.95 56.90 1uj3 s SER 174 Cb -0.05 0.02 0.01 0.00 0.21 0.00 0.00 66.02 66.20 1uj3 s SER 174 CO 0.16 -0.18 0.17 -0.22 0.41 0.00 0.00 173.24 173.58 1uj3 s LEU 175 N -1.69 1.41 0.11 2.44 0.20 -0.03 -1.44 118.68 119.69 1uj3 s LEU 175 Ca -0.07 -0.04 0.09 0.00 0.69 0.00 0.00 54.13 54.80 1uj3 s LEU 175 Cb -0.09 0.73 -0.04 0.00 -0.43 0.00 0.00 46.19 46.36 1uj3 s LEU 175 CO 0.01 -0.31 -0.22 -0.94 -0.29 0.00 0.00 176.35 174.60 1uj3 s SER 176 N -1.03 2.70 -0.06 3.68 1.04 -0.10 -0.64 113.70 119.29 1uj3 s SER 176 Ca -0.11 -0.72 0.01 0.00 0.48 0.00 0.00 55.95 55.61 1uj3 s SER 176 Cb -0.06 -0.16 0.02 0.00 0.10 0.00 0.00 66.02 65.93 1uj3 s SER 176 CO 0.02 0.07 -0.07 -0.55 0.98 0.00 0.00 173.24 173.69 1uj3 s SER 177 N -2.02 1.45 -0.17 7.02 0.15 -0.47 -1.69 113.70 117.98 1uj3 s SER 177 Ca 0.09 -0.20 -0.00 0.00 0.70 0.00 0.00 55.95 56.53 1uj3 s SER 177 Cb -0.10 -0.62 0.00 0.00 -1.71 0.00 0.00 66.02 63.59 1uj3 s SER 177 CO 0.05 -0.05 -0.14 -0.89 1.20 0.00 0.00 173.24 173.41 1uj3 s THR 178 N 1.07 2.70 -0.25 6.45 2.01 0.14 -1.71 115.64 126.07 1uj3 s THR 178 Ca -0.08 -0.74 -0.13 0.00 0.31 0.00 0.00 61.69 61.05 1uj3 s THR 178 Cb -0.14 -2.16 -0.04 0.00 0.01 0.00 0.00 72.50 70.16 1uj3 s THR 178 CO -0.01 0.50 0.28 -0.22 -0.69 0.00 0.00 174.62 174.48 1uj3 s LEU 179 N 1.03 4.08 -0.19 4.42 2.96 -0.03 -0.95 118.68 130.00 1uj3 s LEU 179 Ca -0.01 0.22 -0.01 0.00 -0.22 0.00 0.00 54.13 54.11 1uj3 s LEU 179 Cb -0.15 -2.28 0.01 0.00 0.50 0.00 0.00 46.19 44.27 1uj3 s LEU 179 CO -0.03 -0.06 -0.14 -0.89 -1.32 0.00 0.00 176.35 173.91 1uj3 s THR 180 N 1.53 2.58 0.05 3.68 2.01 -0.60 -0.88 115.64 124.02 1uj3 s THR 180 Ca 0.12 -0.76 0.05 0.00 0.31 0.00 0.00 61.69 61.40 1uj3 s THR 180 Cb -0.15 -2.12 -0.02 0.00 0.01 0.00 0.00 72.50 70.21 1uj3 s THR 180 CO 0.08 0.50 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.60 1uj3 s LEU 181 N 1.32 2.21 0.88 4.42 1.43 -0.37 -4.90 118.68 123.67 1uj3 s LEU 181 Ca 0.04 -0.52 -0.10 0.00 -1.03 0.00 0.00 54.13 52.53 1uj3 s LEU 181 Cb -0.14 -0.58 0.12 0.00 0.03 0.00 0.00 46.19 45.63 1uj3 s LEU 181 CO -0.08 -0.01 1.12 -0.94 0.23 0.00 0.00 176.35 176.67 1uj3 s SER 182 N -1.36 3.37 0.22 2.29 1.04 -1.26 0.03 113.70 118.03 1uj3 s SER 182 Ca 0.00 2.03 -0.09 0.00 0.48 0.00 0.00 55.95 58.37 1uj3 s SER 182 Cb -0.09 -2.53 0.18 0.00 0.10 0.00 0.00 66.02 63.69 1uj3 s SER 182 CO 0.02 -2.79 1.87 0.50 0.98 0.00 0.00 173.24 173.82 1uj3 h LYS 183 N -1.65 1.12 0.50 4.02 3.64 -1.50 -1.26 116.57 121.44 1uj3 h LYS 183 Ca -0.44 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 58.83 1uj3 h LYS 183 Cb 1.26 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.82 1uj3 h LYS 183 CO 0.45 0.77 -0.51 0.00 -2.27 0.00 0.00 179.45 177.90 1uj3 h ALA 184 N 1.28 -1.15 -0.54 5.00 0.00 -1.90 -0.17 119.26 121.77 1uj3 h ALA 184 Ca 0.30 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1uj3 h ALA 184 Cb -0.07 0.74 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1uj3 h ALA 184 CO -0.06 -1.19 0.36 -0.44 0.00 0.00 0.00 179.25 177.92 1uj3 h ASP 185 N -1.02 0.56 -0.69 0.00 3.32 -1.89 -2.31 116.42 114.39 1uj3 h ASP 185 Ca -0.06 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 56.92 1uj3 h ASP 185 Cb 0.88 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 40.27 1uj3 h ASP 185 CO -0.07 0.39 0.19 0.22 -1.72 0.00 0.00 179.24 178.26 1uj3 h TYR 186 N 0.65 1.14 0.00 4.55 3.20 -0.73 -2.81 116.97 122.98 1uj3 h TYR 186 Ca 0.21 -0.12 0.00 0.00 3.14 0.00 0.00 58.73 61.96 1uj3 h TYR 186 Cb 0.04 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 37.98 1uj3 h TYR 186 CO -0.00 0.92 0.00 0.39 -1.64 0.00 0.00 178.16 177.83 1uj3 n GLU 187 N -4.25 0.30 -0.51 1.82 1.02 -0.12 -3.27 120.64 115.64 1uj3 n GLU 187 Ca 0.05 0.05 0.07 0.00 -0.02 0.00 0.00 57.16 57.32 1uj3 n GLU 187 Cb 0.24 -1.50 0.29 0.00 -0.02 0.00 0.00 31.44 30.45 1uj3 n GLU 187 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 1uj3 n LYS 188 N -1.32 3.24 -4.01 3.49 2.85 -1.06 -4.91 118.16 116.44 1uj3 n LYS 188 Ca 0.11 -2.26 -0.09 0.00 -1.05 0.00 0.00 58.31 55.01 1uj3 n LYS 188 Cb 0.21 -1.80 -0.08 0.00 -0.65 0.00 0.00 35.03 32.71 1uj3 n LYS 188 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 177.40 176.34 1uj3 s HIS 189 N -1.84 0.51 -0.01 5.58 3.76 -1.20 -5.11 115.29 116.97 1uj3 s HIS 189 Ca 0.40 -0.90 -0.04 0.00 -0.15 0.00 0.00 55.06 54.37 1uj3 s HIS 189 Cb 0.27 -0.21 -0.02 0.00 1.11 0.00 0.00 32.58 33.72 1uj3 s HIS 189 CO 0.19 -0.61 -0.08 1.17 -0.85 0.00 0.00 174.74 174.56 1uj3 n LYS 190 N -0.13 0.13 -3.03 1.40 4.81 -1.26 -4.73 118.16 115.35 1uj3 n LYS 190 Ca -0.08 0.06 -0.41 0.00 -0.87 0.00 0.00 58.31 57.00 1uj3 n LYS 190 Cb 0.63 -0.73 -0.05 0.00 0.02 0.00 0.00 35.03 34.90 1uj3 n LYS 190 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1uj3 s VAL 191 N -2.18 4.96 -0.26 3.15 1.01 -1.26 -0.01 120.40 125.81 1uj3 s VAL 191 Ca -0.08 1.34 -0.01 0.00 0.00 0.00 0.00 61.98 63.23 1uj3 s VAL 191 Cb 0.02 -4.01 0.03 0.00 0.00 0.00 0.00 36.38 32.42 1uj3 s VAL 191 CO 0.11 0.06 -0.05 -0.31 0.00 0.00 0.00 175.10 174.91 1uj3 s TYR 192 N 2.13 3.13 0.09 5.22 2.02 -0.63 -0.36 117.35 128.94 1uj3 s TYR 192 Ca 0.32 -1.71 0.07 0.00 -0.37 0.00 0.00 57.07 55.38 1uj3 s TYR 192 Cb -0.16 -2.06 -0.03 0.00 -0.40 0.00 0.00 41.96 39.31 1uj3 s TYR 192 CO 0.10 -0.76 -0.19 0.00 -1.57 0.00 0.00 175.55 173.13 1uj3 s ALA 193 N 1.29 1.64 -0.19 3.71 0.00 -0.44 -1.71 121.76 126.05 1uj3 s ALA 193 Ca -0.02 -1.15 -0.01 0.00 0.00 0.00 0.00 51.96 50.78 1uj3 s ALA 193 Cb -0.18 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.73 1uj3 s ALA 193 CO -0.04 0.32 -0.15 0.00 0.00 0.00 0.00 175.76 175.89 1uj3 s GLU 195 N 1.35 3.62 -0.16 0.00 2.12 0.04 -1.35 118.70 124.31 1uj3 s GLU 195 Ca 0.05 -0.50 -0.02 0.00 0.36 0.00 0.00 54.97 54.86 1uj3 s GLU 195 Cb -0.14 -3.22 -0.02 0.00 0.26 0.00 0.00 34.13 31.02 1uj3 s GLU 195 CO -0.10 -0.13 -0.09 0.08 -0.54 0.00 0.00 175.26 174.49 1uj3 s VAL 196 N 1.41 3.32 -0.17 3.70 1.01 0.27 -1.10 120.40 128.84 1uj3 s VAL 196 Ca 0.05 -0.55 -0.02 0.00 0.00 0.00 0.00 61.98 61.46 1uj3 s VAL 196 Cb -0.15 -2.44 -0.01 0.00 0.00 0.00 0.00 36.38 33.79 1uj3 s VAL 196 CO 0.02 0.49 -0.10 -0.89 0.00 0.00 0.00 175.10 174.63 1uj3 s THR 197 N 0.62 3.13 -0.17 3.92 2.01 -0.16 -0.35 115.64 124.63 1uj3 s THR 197 Ca -0.05 -0.61 -0.26 0.00 0.31 0.00 0.00 61.69 61.08 1uj3 s THR 197 Cb -0.15 -2.36 0.07 0.00 0.01 0.00 0.00 72.50 70.07 1uj3 s THR 197 CO 0.03 0.49 0.66 -2.28 -0.69 0.00 0.00 174.62 172.83 1uj3 s HIS 198 N 0.85 -0.69 0.46 4.92 2.46 -1.26 -1.43 115.29 120.60 1uj3 s HIS 198 Ca -0.03 1.52 0.29 0.00 0.47 0.00 0.00 55.06 57.30 1uj3 s HIS 198 Cb -0.15 0.30 1.36 0.00 -0.13 0.00 0.00 32.58 33.96 1uj3 s HIS 198 CO 0.01 -0.45 1.73 0.37 -2.47 0.00 0.00 174.74 173.93 1uj3 h GLN 199 N 4.29 0.17 -0.00 2.88 4.15 -1.93 0.44 115.11 125.11 1uj3 h GLN 199 Ca -0.28 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.13 1uj3 h GLN 199 Cb 1.16 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.81 1uj3 h GLN 199 CO 0.20 0.11 -0.00 0.41 -1.93 0.00 0.00 178.83 177.62 1uj3 n GLY 200 N -1.61 -1.06 3.37 2.39 0.00 -1.26 -4.72 105.19 102.31 1uj3 n GLY 200 Ca 0.29 -0.19 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 1uj3 n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uj3 s LEU 201 N -2.15 2.98 0.32 0.99 1.43 0.15 -4.52 118.68 117.88 1uj3 s LEU 201 Ca 0.43 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 53.22 1uj3 s LEU 201 Cb 0.22 -1.74 0.55 0.00 0.03 0.00 0.00 46.19 45.25 1uj3 s LEU 201 CO 0.39 0.05 1.95 0.77 0.23 0.00 0.00 176.35 179.74 1uj3 h SER 202 N 7.62 0.86 -4.64 2.29 4.64 -1.84 -3.43 113.55 119.04 1uj3 h SER 202 Ca -0.37 -0.01 -0.17 0.00 -0.47 0.00 0.00 61.79 60.78 1uj3 h SER 202 Cb 1.18 -0.19 -0.22 0.00 -0.31 0.00 0.00 62.40 62.85 1uj3 h SER 202 CO 0.60 0.58 -0.57 -0.94 -0.87 0.00 0.00 176.83 175.63 1uj3 s SER 203 N -6.19 0.04 0.15 4.97 1.04 -1.26 -5.12 113.70 107.33 1uj3 s SER 203 Ca -0.11 -0.16 -0.33 0.00 0.48 0.00 0.00 55.95 55.83 1uj3 s SER 203 Cb 0.19 0.18 -0.17 0.00 0.10 0.00 0.00 66.02 66.32 1uj3 s SER 203 CO 0.79 -0.26 0.92 -2.65 0.98 0.00 0.00 173.24 173.02 1uj3 n PRO 204 N 1.93 0.51 -4.05 4.02 -0.02 -1.26 -4.95 135.00 131.19 1uj3 n PRO 204 Ca -0.20 0.18 -0.34 0.00 -2.02 0.00 0.00 63.50 61.13 1uj3 n PRO 204 Cb 0.56 -1.51 -0.07 0.00 -0.02 0.00 0.00 33.50 32.47 1uj3 n PRO 204 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1uj3 s VAL 205 N -0.48 4.94 -0.01 -1.45 1.01 0.52 -4.88 120.40 120.06 1uj3 s VAL 205 Ca 0.73 -0.28 0.04 0.00 0.00 0.00 0.00 61.98 62.47 1uj3 s VAL 205 Cb -0.97 -3.25 -0.01 0.00 0.00 0.00 0.00 36.38 32.15 1uj3 s VAL 205 CO 0.55 0.39 -0.13 -0.89 0.00 0.00 0.00 175.10 175.02 1uj3 s THR 206 N -1.19 1.04 -0.01 3.92 2.01 -1.26 0.97 115.64 121.11 1uj3 s THR 206 Ca 0.22 -0.60 0.04 0.00 0.31 0.00 0.00 61.69 61.67 1uj3 s THR 206 Cb -0.12 -0.87 -0.01 0.00 0.01 0.00 0.00 72.50 71.51 1uj3 s THR 206 CO 0.13 0.27 -0.12 -0.54 -0.69 0.00 0.00 174.62 173.67 1uj3 s LYS 207 N -0.38 1.02 0.28 4.92 -0.14 -0.46 -4.96 119.74 120.03 1uj3 s LYS 207 Ca 0.05 -0.43 -0.19 0.00 -1.36 0.00 0.00 55.97 54.04 1uj3 s LYS 207 Cb -0.05 -0.98 0.02 0.00 -1.68 0.00 0.00 37.83 35.14 1uj3 s LYS 207 CO -0.00 0.25 0.67 -1.54 -0.76 0.00 0.00 175.35 173.97 1uj3 s SER 208 N -0.23 -0.19 0.21 2.83 1.04 -1.26 0.94 113.70 117.03 1uj3 s SER 208 Ca 0.04 -0.73 -0.10 0.00 0.48 0.00 0.00 55.95 55.64 1uj3 s SER 208 Cb -0.05 0.71 -0.01 0.00 0.10 0.00 0.00 66.02 66.77 1uj3 s SER 208 CO -0.00 -1.33 0.36 0.72 0.98 0.00 0.00 173.24 173.97 1uj3 s PHE 209 N -3.82 0.45 -0.15 5.02 -0.71 -0.69 -5.00 117.98 113.07 1uj3 s PHE 209 Ca 0.14 -0.79 -0.02 0.00 -1.04 0.00 0.00 56.93 55.22 1uj3 s PHE 209 Cb -0.05 0.02 -0.02 0.00 -1.21 0.00 0.00 43.02 41.76 1uj3 s PHE 209 CO 0.08 -0.84 -0.07 -0.80 -1.34 0.00 0.00 175.22 172.25 1uj3 s ASN 210 N -3.01 4.46 0.10 1.98 0.01 -1.26 -1.60 114.94 115.62 1uj3 s ASN 210 Ca 0.22 -0.23 -0.36 0.00 -0.71 0.00 0.00 52.86 51.78 1uj3 s ASN 210 Cb 0.02 -1.72 -0.16 0.00 0.41 0.00 0.00 41.25 39.80 1uj3 s ASN 210 CO 0.05 0.14 1.30 -1.14 -1.51 0.00 0.00 177.10 175.95 1uj3 n ARG 211 N 3.68 1.15 0.00 -0.60 0.63 0.98 -1.51 116.66 120.99 1uj3 n ARG 211 Ca -0.18 0.41 0.00 0.00 -0.92 0.00 0.00 57.85 57.17 1uj3 n ARG 211 Cb 0.52 -2.02 0.00 0.00 0.45 0.00 0.00 32.46 31.41 1uj3 n ARG 211 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1uj3 n GLY 212 N 2.41 2.96 0.91 5.14 0.00 -1.26 -4.88 105.19 110.46 1uj3 n GLY 212 Ca 0.18 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.19 1uj3 n GLY 212 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1uj3 n GLU 213 N -1.41 1.16 0.00 1.61 1.02 -0.57 -5.25 120.64 117.20 1uj3 n GLU 213 Ca 0.00 -0.22 0.02 0.00 -0.02 0.00 0.00 57.16 56.95 1uj3 n GLU 213 Cb 0.00 -1.25 0.02 0.00 -0.02 0.00 0.00 31.44 30.19 1uj3 n GLU 213 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31