#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dx5 s VAL 17 N 0.00 5.44 -1.78 1.39 1.01 0.66 -4.30 120.40 122.82 1dx5 s VAL 17 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.26 1dx5 s VAL 17 Cb 0.00 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.93 1dx5 s VAL 17 CO 0.00 0.57 0.00 -0.62 0.00 0.00 0.00 175.10 175.05 1dx5 n GLU 18 N 2.33 -1.67 -0.49 2.72 -0.58 -1.26 -2.31 120.64 119.38 1dx5 n GLU 18 Ca -0.18 1.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.56 1dx5 n GLU 18 Cb 0.54 -5.56 0.00 0.00 -0.57 0.00 0.00 31.44 25.85 1dx5 n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1dx5 n GLY 19 N -0.78 1.81 3.26 0.62 0.00 -1.26 -4.70 105.19 104.14 1dx5 n GLY 19 Ca -0.22 -2.07 -0.13 0.00 0.00 0.00 0.00 46.02 43.61 1dx5 n GLY 19 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dx5 s SER 20 N -1.00 0.31 0.08 1.61 1.04 0.09 -4.88 113.70 110.95 1dx5 s SER 20 Ca 0.00 -1.38 -0.31 0.00 0.48 0.00 0.00 55.95 54.74 1dx5 s SER 20 Cb 0.00 0.43 -0.09 0.00 0.10 0.00 0.00 66.02 66.46 1dx5 s SER 20 CO 0.00 -0.91 1.74 -1.81 0.98 0.00 0.00 173.24 173.24 1dx5 s ASP 21 N -3.17 6.53 0.47 7.02 1.11 -1.26 -0.39 116.67 126.98 1dx5 s ASP 21 Ca 0.37 2.58 -0.22 0.00 0.18 0.00 0.00 52.55 55.47 1dx5 s ASP 21 Cb 0.05 -2.56 -0.07 0.00 1.07 0.00 0.00 42.92 41.41 1dx5 s ASP 21 CO 0.14 -0.94 1.12 0.00 1.18 0.00 0.00 175.17 176.67 1dx5 s ALA 22 N 2.90 2.92 0.62 5.23 0.00 0.22 -4.83 121.76 128.82 1dx5 s ALA 22 Ca 0.78 0.84 -0.11 0.00 0.00 0.00 0.00 51.96 53.46 1dx5 s ALA 22 Cb -0.42 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.32 1dx5 s ALA 22 CO 0.34 -0.57 1.03 -1.21 0.00 0.00 0.00 175.76 175.35 1dx5 s GLU 23 N -2.85 3.56 0.15 0.00 2.02 -1.26 -4.88 118.70 115.44 1dx5 s GLU 23 Ca 0.65 0.76 -0.31 0.00 0.02 0.00 0.00 54.97 56.08 1dx5 s GLU 23 Cb -0.25 -2.08 -0.10 0.00 0.10 0.00 0.00 34.13 31.80 1dx5 s GLU 23 CO 0.30 -0.60 1.68 0.42 0.02 0.00 0.00 175.26 177.09 1dx5 s ILE 24 N -3.18 2.52 -0.79 -1.63 -1.09 -1.26 -2.07 121.20 113.71 1dx5 s ILE 24 Ca 0.55 0.25 0.00 0.00 -2.23 0.00 0.00 60.65 59.22 1dx5 s ILE 24 Cb -0.11 -3.16 0.00 0.00 -1.58 0.00 0.00 42.46 37.61 1dx5 s ILE 24 CO 0.54 0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.87 1dx5 n GLY 25 N 3.97 0.93 0.16 6.18 0.00 -1.26 -4.91 105.19 110.25 1dx5 n GLY 25 Ca 0.16 -0.48 0.03 0.00 0.00 0.00 0.00 46.02 45.73 1dx5 n GLY 25 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1dx5 h MET 26 N 0.12 0.00 -2.12 1.61 -1.53 -1.78 -3.37 114.93 107.85 1dx5 h MET 26 Ca -0.15 0.00 -0.56 0.00 -3.44 0.00 0.00 59.70 55.54 1dx5 h MET 26 Cb 0.58 0.00 -0.38 0.00 -0.55 0.00 0.00 31.60 31.25 1dx5 h MET 26 CO 0.22 0.47 -1.04 0.43 0.14 0.00 0.00 176.91 177.13 1dx5 n SER 27 N -3.39 -0.19 0.06 1.39 7.64 -1.26 -4.97 113.62 112.89 1dx5 n SER 27 Ca 0.01 -2.56 0.06 0.00 1.01 0.00 0.00 58.87 57.39 1dx5 n SER 27 Cb 0.63 -0.55 0.30 0.00 -1.01 0.00 0.00 64.21 63.58 1dx5 n SER 27 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1dx5 n PRO 28 N 2.05 0.07 0.01 1.43 -0.02 -1.26 -1.50 135.00 135.77 1dx5 n PRO 28 Ca 0.25 0.46 0.11 0.00 -2.02 0.00 0.00 63.50 62.30 1dx5 n PRO 28 Cb 0.51 -1.67 0.10 0.00 -0.02 0.00 0.00 33.50 32.42 1dx5 n PRO 28 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 1dx5 n TRP 29 N -1.81 0.12 -1.81 6.00 2.14 -1.00 -1.84 117.44 119.25 1dx5 n TRP 29 Ca 0.01 0.03 -0.42 0.00 2.07 0.00 0.00 57.50 59.19 1dx5 n TRP 29 Cb 0.09 -0.29 -0.03 0.00 -0.81 0.00 0.00 31.31 30.28 1dx5 n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1dx5 s GLN 30 N -3.07 4.16 0.03 -2.67 2.00 -0.56 -0.58 119.66 118.97 1dx5 s GLN 30 Ca 0.08 2.45 0.06 0.00 -2.00 0.00 0.00 55.36 55.95 1dx5 s GLN 30 Cb 0.16 -3.93 -0.03 0.00 0.80 0.00 0.00 33.01 30.00 1dx5 s GLN 30 CO 0.77 -0.87 -0.13 0.08 -0.50 0.00 0.00 175.29 174.63 1dx5 s VAL 31 N 3.78 3.16 -0.23 1.34 1.01 -0.06 -4.14 120.40 125.26 1dx5 s VAL 31 Ca 0.81 -1.04 -0.05 0.00 0.00 0.00 0.00 61.98 61.70 1dx5 s VAL 31 Cb -0.40 -2.37 -0.01 0.00 0.00 0.00 0.00 36.38 33.60 1dx5 s VAL 31 CO 0.36 0.34 -0.01 -0.32 0.00 0.00 0.00 175.10 175.47 1dx5 s MET 32 N -1.50 3.44 -0.29 2.72 1.75 0.14 -1.20 119.30 124.36 1dx5 s MET 32 Ca 0.16 -0.59 -0.23 0.00 -1.25 0.00 0.00 55.69 53.78 1dx5 s MET 32 Cb -0.11 -3.11 -0.00 0.00 2.84 0.00 0.00 34.83 34.45 1dx5 s MET 32 CO 0.07 -0.21 0.77 -0.51 -0.65 0.00 0.00 175.02 174.49 1dx5 s LEU 33 N 1.52 4.08 -0.17 4.11 1.43 0.45 -1.06 118.68 129.05 1dx5 s LEU 33 Ca 0.06 0.74 -0.02 0.00 -1.03 0.00 0.00 54.13 53.88 1dx5 s LEU 33 Cb -0.15 -3.06 -0.01 0.00 0.03 0.00 0.00 46.19 43.00 1dx5 s LEU 33 CO -0.01 -0.56 -0.10 0.12 0.23 0.00 0.00 176.35 176.04 1dx5 s PHE 34 N 2.86 2.88 0.08 0.29 5.36 0.34 -0.91 117.98 128.88 1dx5 s PHE 34 Ca 0.32 -0.76 -0.29 0.00 -0.96 0.00 0.00 56.93 55.23 1dx5 s PHE 34 Cb -0.15 -1.95 -0.05 0.00 -0.34 0.00 0.00 43.02 40.54 1dx5 s PHE 34 CO 0.11 -0.34 0.94 0.50 -1.46 0.00 0.00 175.22 174.97 1dx5 s ARG 35 N 0.78 4.65 0.14 10.12 3.52 0.22 -0.28 118.95 138.10 1dx5 s ARG 35 Ca -0.04 1.39 -0.04 0.00 -0.13 0.00 0.00 55.73 56.91 1dx5 s ARG 35 Cb -0.15 -3.39 -0.05 0.00 -1.56 0.00 0.00 34.95 29.80 1dx5 s ARG 35 CO 0.01 0.18 1.35 0.87 -0.81 0.00 0.00 175.30 176.90 1dx5 h LYS 36 N 5.80 0.45 -2.62 5.12 1.57 -1.68 -2.67 116.57 122.54 1dx5 h LYS 36 Ca -0.43 -0.42 -0.40 0.00 -1.87 0.00 0.00 60.65 57.53 1dx5 h LYS 36 Cb 1.21 0.11 -0.37 0.00 0.08 0.00 0.00 32.23 33.25 1dx5 h LYS 36 CO 0.72 1.07 -0.69 0.45 -0.57 0.00 0.00 179.45 180.43 1dx5 s SER 36 N -7.05 2.17 0.95 0.86 0.15 -1.26 -3.23 113.70 106.29 1dx5 s SER 36 Ca -0.06 -0.68 -0.12 0.00 0.70 0.00 0.00 55.95 55.79 1dx5 s SER 36 Cb 0.09 0.10 0.16 0.00 -1.71 0.00 0.00 66.02 64.66 1dx5 s SER 36 CO 0.86 -0.37 1.11 -2.16 1.20 0.00 0.00 173.24 173.88 1dx5 s PRO 37 N 2.24 0.85 -0.55 5.44 0.04 -1.26 -5.05 135.00 136.71 1dx5 s PRO 37 Ca 0.07 0.48 -0.28 0.00 0.04 0.00 0.00 61.00 61.31 1dx5 s PRO 37 Cb -0.15 -1.79 0.02 0.00 0.04 0.00 0.00 34.50 32.61 1dx5 s PRO 37 CO -0.22 -2.44 1.38 -0.65 0.04 0.00 0.00 177.00 175.12 1dx5 s GLN 38 N -5.08 3.36 0.05 4.56 -1.52 -1.20 -4.62 119.66 115.21 1dx5 s GLN 38 Ca 0.64 0.47 -0.27 0.00 -1.95 0.00 0.00 55.36 54.26 1dx5 s GLN 38 Cb -0.17 -4.10 0.09 0.00 -0.22 0.00 0.00 33.01 28.61 1dx5 s GLN 38 CO 0.56 -1.86 0.80 -1.83 -0.25 0.00 0.00 175.29 172.70 1dx5 s GLU 39 N 5.37 0.97 0.14 2.91 -1.05 -1.01 -5.00 118.70 121.04 1dx5 s GLU 39 Ca 0.52 -0.36 -0.31 0.00 -0.15 0.00 0.00 54.97 54.66 1dx5 s GLU 39 Cb -0.11 0.45 -0.09 0.00 -0.44 0.00 0.00 34.13 33.94 1dx5 s GLU 39 CO 0.26 -0.43 1.55 -1.17 0.95 0.00 0.00 175.26 176.43 1dx5 s LEU 40 N -2.57 4.37 -0.20 1.83 2.96 -1.26 -0.61 118.68 123.20 1dx5 s LEU 40 Ca 0.04 2.55 -0.15 0.00 -0.22 0.00 0.00 54.13 56.35 1dx5 s LEU 40 Cb -0.01 -3.59 -0.09 0.00 0.50 0.00 0.00 46.19 43.00 1dx5 s LEU 40 CO -0.10 -0.81 -0.21 -0.11 -1.32 0.00 0.00 176.35 173.79 1dx5 n LEU 41 N 4.22 1.90 -3.82 -0.68 7.94 -0.09 -4.83 117.00 121.64 1dx5 n LEU 41 Ca 0.14 0.43 -0.04 0.00 -1.11 0.00 0.00 56.01 55.43 1dx5 n LEU 41 Cb 0.39 -0.83 0.01 0.00 0.53 0.00 0.00 43.42 43.52 1dx5 n LEU 41 CO 0.61 -0.04 0.76 0.00 -1.11 0.00 0.00 177.39 177.61 1dx5 n GLY 43 N -0.59 0.73 3.94 0.00 0.00 0.16 -0.41 105.19 109.02 1dx5 n GLY 43 Ca -0.05 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 43.95 1dx5 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dx5 s ALA 44 N -3.07 -2.14 0.04 4.61 0.00 -0.34 -4.02 121.76 116.84 1dx5 s ALA 44 Ca 0.53 -0.09 0.02 0.00 0.00 0.00 0.00 51.96 52.41 1dx5 s ALA 44 Cb -0.03 0.84 -0.03 0.00 0.00 0.00 0.00 23.12 23.90 1dx5 s ALA 44 CO 0.35 -1.12 -0.07 -1.54 0.00 0.00 0.00 175.76 173.39 1dx5 s SER 45 N -3.64 0.74 -0.35 0.00 1.04 0.20 -0.88 113.70 110.81 1dx5 s SER 45 Ca 0.26 -0.59 -0.17 0.00 0.48 0.00 0.00 55.95 55.94 1dx5 s SER 45 Cb -0.01 0.06 -0.01 0.00 0.10 0.00 0.00 66.02 66.16 1dx5 s SER 45 CO 0.01 -0.25 0.46 -0.22 0.98 0.00 0.00 173.24 174.22 1dx5 s LEU 46 N -1.70 4.39 0.00 2.42 2.96 0.25 -0.46 118.68 126.54 1dx5 s LEU 46 Ca -0.09 -0.11 0.16 0.00 -0.22 0.00 0.00 54.13 53.87 1dx5 s LEU 46 Cb -0.08 -2.49 0.06 0.00 0.50 0.00 0.00 46.19 44.18 1dx5 s LEU 46 CO -0.01 -0.43 0.93 2.30 -1.32 0.00 0.00 176.35 177.83 1dx5 n ILE 47 N 5.35 0.00 -3.86 6.68 -5.35 -0.71 -1.52 119.36 119.96 1dx5 n ILE 47 Ca -0.06 -0.41 -0.00 0.00 -0.27 0.00 0.00 62.75 62.00 1dx5 n ILE 47 Cb 0.49 1.27 0.01 0.00 -1.74 0.00 0.00 39.64 39.67 1dx5 n ILE 47 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1dx5 n SER 48 N 0.39 -1.10 0.00 7.28 3.41 -1.21 -4.77 113.62 117.62 1dx5 n SER 48 Ca 0.08 -1.45 0.13 0.00 -0.26 0.00 0.00 58.87 57.37 1dx5 n SER 48 Cb 0.37 1.75 0.63 0.00 -0.26 0.00 0.00 64.21 66.70 1dx5 n SER 48 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1dx5 n ASP 49 N -0.98 0.00 0.00 4.04 5.75 -1.26 -3.77 116.55 120.33 1dx5 n ASP 49 Ca 0.01 0.06 0.00 0.00 -0.01 0.00 0.00 54.79 54.85 1dx5 n ASP 49 Cb 0.43 -0.34 0.00 0.00 -1.03 0.00 0.00 41.12 40.18 1dx5 n ASP 49 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 1dx5 n ARG 50 N -1.34 0.50 -5.18 0.11 0.63 -1.26 -0.05 116.66 110.07 1dx5 n ARG 50 Ca 0.11 -0.11 -0.30 0.00 -0.92 0.00 0.00 57.85 56.63 1dx5 n ARG 50 Cb 0.23 -0.51 -0.16 0.00 0.45 0.00 0.00 32.46 32.47 1dx5 n ARG 50 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 1dx5 s TRP 51 N -0.10 2.22 -0.03 -0.14 0.52 -1.25 -1.09 118.94 119.08 1dx5 s TRP 51 Ca 0.00 -0.57 0.05 0.00 0.02 0.00 0.00 56.10 55.61 1dx5 s TRP 51 Cb 0.00 -1.45 -0.01 0.00 -1.15 0.00 0.00 33.47 30.86 1dx5 s TRP 51 CO 0.00 -0.14 -0.19 0.08 0.02 0.00 0.00 176.95 176.72 1dx5 s VAL 52 N -0.30 1.53 -0.08 4.03 1.01 -0.25 -1.73 120.40 124.61 1dx5 s VAL 52 Ca 0.02 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.19 1dx5 s VAL 52 Cb -0.12 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 34.95 1dx5 s VAL 52 CO 0.02 0.43 -0.06 -0.22 0.00 0.00 0.00 175.10 175.27 1dx5 s LEU 53 N -0.28 3.24 0.00 3.92 2.96 0.40 -0.47 118.68 128.44 1dx5 s LEU 53 Ca 0.03 0.00 -0.03 0.00 -0.22 0.00 0.00 54.13 53.91 1dx5 s LEU 53 Cb -0.09 -1.71 0.01 0.00 0.50 0.00 0.00 46.19 44.90 1dx5 s LEU 53 CO 0.00 0.36 0.30 1.07 -1.32 0.00 0.00 176.35 176.76 1dx5 n THR 54 N 2.27 0.00 -3.32 3.68 5.66 -0.47 -0.63 114.28 121.47 1dx5 n THR 54 Ca -0.18 -0.81 -0.38 0.00 -3.05 0.00 0.00 64.05 59.63 1dx5 n THR 54 Cb 0.53 0.56 -0.06 0.00 -1.55 0.00 0.00 70.33 69.81 1dx5 n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1dx5 s ALA 55 N -2.01 3.59 0.30 1.79 0.00 -1.26 -0.95 121.76 123.22 1dx5 s ALA 55 Ca 0.13 -0.05 0.02 0.00 0.00 0.00 0.00 51.96 52.07 1dx5 s ALA 55 Cb -0.01 -2.59 0.47 0.00 0.00 0.00 0.00 23.12 20.99 1dx5 s ALA 55 CO 0.10 0.36 1.78 0.00 0.00 0.00 0.00 175.76 177.99 1dx5 h ALA 56 N 4.90 1.20 0.00 0.00 0.00 -1.72 -3.01 119.26 120.63 1dx5 h ALA 56 Ca -0.49 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.14 1dx5 h ALA 56 Cb 1.21 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1dx5 h ALA 56 CO 0.65 0.52 0.00 -2.39 0.00 0.00 0.00 179.25 178.02 1dx5 n HIS 57 N -4.19 0.81 0.11 0.00 1.44 -1.26 -0.56 115.22 111.57 1dx5 n HIS 57 Ca 0.01 0.35 -0.03 0.00 -2.01 0.00 0.00 57.72 56.04 1dx5 n HIS 57 Cb 0.33 -1.06 0.07 0.00 0.12 0.00 0.00 29.99 29.45 1dx5 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1dx5 n LEU 59 N -3.60 1.20 -3.82 0.00 4.77 -0.70 -4.86 117.00 109.98 1dx5 n LEU 59 Ca -0.01 -0.05 -0.17 0.00 -0.03 0.00 0.00 56.01 55.75 1dx5 n LEU 59 Cb 0.73 -0.05 -0.16 0.00 -2.33 0.00 0.00 43.42 41.60 1dx5 n LEU 59 CO 0.43 0.60 -0.38 -0.22 -1.33 0.00 0.00 177.39 176.50 1dx5 s LEU 60 N -5.66 1.16 0.17 2.23 2.96 0.28 -1.18 118.68 118.65 1dx5 s LEU 60 Ca -0.17 -0.04 -0.24 0.00 -0.22 0.00 0.00 54.13 53.47 1dx5 s LEU 60 Cb 0.06 -0.25 0.06 0.00 0.50 0.00 0.00 46.19 46.56 1dx5 s LEU 60 CO 0.62 -0.10 0.81 -0.47 -1.32 0.00 0.00 176.35 175.89 1dx5 s TYR 60 N 1.04 -0.25 0.00 5.38 5.04 -0.16 -4.10 117.35 124.31 1dx5 s TYR 60 Ca -0.10 -0.07 0.00 0.00 -2.44 0.00 0.00 57.07 54.46 1dx5 s TYR 60 Cb -0.14 0.64 0.00 0.00 0.35 0.00 0.00 41.96 42.81 1dx5 s TYR 60 CO -0.02 -0.93 0.00 -2.30 -1.34 0.00 0.00 175.55 170.97 1dx5 n PRO 60 N -0.42 0.00 -0.55 4.97 -0.02 -1.26 -1.94 135.00 135.78 1dx5 n PRO 60 Ca -0.07 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.47 1dx5 n PRO 60 Cb 0.61 0.00 0.29 0.00 -0.02 0.00 0.00 33.50 34.38 1dx5 n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1dx5 n TRP 60 N 0.00 1.30 -3.89 6.00 8.01 -1.26 -4.92 117.44 122.68 1dx5 n TRP 60 Ca 0.00 -0.49 -0.29 0.00 -1.31 0.00 0.00 57.50 55.41 1dx5 n TRP 60 Cb 0.00 -0.28 0.02 0.00 -2.01 0.00 0.00 31.31 29.05 1dx5 n TRP 60 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1dx5 n ASP 60 N 0.69 -4.12 -4.54 -0.99 9.92 -1.15 -4.96 116.55 111.40 1dx5 n ASP 60 Ca 0.20 -0.80 -0.37 0.00 -0.53 0.00 0.00 54.79 53.30 1dx5 n ASP 60 Cb 0.80 -3.86 -0.11 0.00 -0.64 0.00 0.00 41.12 37.30 1dx5 n ASP 60 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1dx5 s LYS 60 N -6.53 3.84 -0.31 -1.24 2.20 -0.82 -5.02 119.74 111.86 1dx5 s LYS 60 Ca 0.55 -0.38 0.05 0.00 -0.36 0.00 0.00 55.97 55.83 1dx5 s LYS 60 Cb -0.28 -3.47 0.18 0.00 -1.51 0.00 0.00 37.83 32.75 1dx5 s LYS 60 CO 0.83 -0.13 0.53 1.21 -0.36 0.00 0.00 175.35 177.43 1dx5 s ASN 60 N 1.53 -0.85 -0.03 1.43 2.47 -1.23 -0.99 114.94 117.28 1dx5 s ASN 60 Ca 0.06 -0.22 -0.22 0.00 0.42 0.00 0.00 52.86 52.91 1dx5 s ASN 60 Cb -0.15 1.66 -0.05 0.00 -1.45 0.00 0.00 41.25 41.26 1dx5 s ASN 60 CO 0.07 -0.30 0.64 -0.36 -3.72 0.00 0.00 177.10 173.43 1dx5 s PHE 60 N 2.53 3.64 0.58 0.43 0.08 -0.32 -5.03 117.98 119.89 1dx5 s PHE 60 Ca 0.11 1.22 0.09 0.00 0.12 0.00 0.00 56.93 58.48 1dx5 s PHE 60 Cb -0.10 -2.70 0.09 0.00 -0.57 0.00 0.00 43.02 39.74 1dx5 s PHE 60 CO -0.24 0.23 0.80 0.96 -0.10 0.00 0.00 175.22 176.88 1dx5 s ILE 60 N 0.26 2.13 0.16 0.64 -4.36 -1.26 -4.93 121.20 113.84 1dx5 s ILE 60 Ca 0.34 -0.99 -0.18 0.00 -0.26 0.00 0.00 60.65 59.56 1dx5 s ILE 60 Cb -0.18 -2.14 0.07 0.00 1.25 0.00 0.00 42.46 41.46 1dx5 s ILE 60 CO 0.18 0.00 1.67 -0.33 0.24 0.00 0.00 174.94 176.69 1dx5 h GLU 61 N 0.15 -0.04 0.00 0.37 4.39 -1.94 -2.23 114.58 115.28 1dx5 h GLU 61 Ca -0.30 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.40 1dx5 h GLU 61 Cb 1.29 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.95 1dx5 h GLU 61 CO 0.41 -0.02 0.00 0.09 -1.16 0.00 0.00 179.01 178.32 1dx5 n ASN 62 N -5.30 0.00 0.03 1.42 3.02 -1.26 -3.00 115.26 110.17 1dx5 n ASN 62 Ca 0.01 -0.06 0.12 0.00 -0.03 0.00 0.00 54.58 54.63 1dx5 n ASN 62 Cb 0.22 -0.24 0.27 0.00 -0.61 0.00 0.00 39.78 39.41 1dx5 n ASN 62 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1dx5 n ASP 63 N -1.24 0.55 -4.31 6.41 8.00 -0.84 -4.93 116.55 120.19 1dx5 n ASP 63 Ca 0.09 0.06 -0.16 0.00 0.71 0.00 0.00 54.79 55.49 1dx5 n ASP 63 Cb 0.13 0.06 -0.10 0.00 -0.02 0.00 0.00 41.12 41.18 1dx5 n ASP 63 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1dx5 s LEU 64 N -3.67 1.87 -0.02 0.64 1.43 -1.16 -1.87 118.68 115.90 1dx5 s LEU 64 Ca 0.09 -1.31 0.04 0.00 -1.03 0.00 0.00 54.13 51.91 1dx5 s LEU 64 Cb 0.15 -0.07 -0.01 0.00 0.03 0.00 0.00 46.19 46.30 1dx5 s LEU 64 CO 0.68 -0.65 -0.12 -0.76 0.23 0.00 0.00 176.35 175.73 1dx5 s LEU 65 N -3.30 1.95 -0.34 1.79 1.43 0.62 -4.74 118.68 116.10 1dx5 s LEU 65 Ca 0.33 -0.23 -0.12 0.00 -1.03 0.00 0.00 54.13 53.08 1dx5 s LEU 65 Cb 0.07 -0.66 -0.01 0.00 0.03 0.00 0.00 46.19 45.62 1dx5 s LEU 65 CO 0.11 0.13 0.21 -0.69 0.23 0.00 0.00 176.35 176.35 1dx5 s VAL 66 N -0.13 5.03 -0.34 -1.59 1.01 -1.05 -0.51 120.40 122.82 1dx5 s VAL 66 Ca 0.02 -0.34 -0.07 0.00 0.00 0.00 0.00 61.98 61.59 1dx5 s VAL 66 Cb -0.07 -3.60 0.03 0.00 0.00 0.00 0.00 36.38 32.75 1dx5 s VAL 66 CO 0.00 -0.01 0.12 -0.13 0.00 0.00 0.00 175.10 175.07 1dx5 s ARG 67 N 1.68 2.72 0.06 2.72 0.52 -0.22 -1.04 118.95 125.39 1dx5 s ARG 67 Ca 0.05 -1.12 0.04 0.00 -0.52 0.00 0.00 55.73 54.19 1dx5 s ARG 67 Cb -0.17 -3.49 -0.04 0.00 0.52 0.00 0.00 34.95 31.77 1dx5 s ARG 67 CO 0.09 -0.64 -0.04 0.42 0.02 0.00 0.00 175.30 175.15 1dx5 s ILE 68 N 1.44 3.81 0.00 1.52 1.01 -0.41 -0.68 121.20 127.90 1dx5 s ILE 68 Ca -0.01 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 59.70 1dx5 s ILE 68 Cb -0.19 -2.76 0.00 0.00 0.01 0.00 0.00 42.46 39.52 1dx5 s ILE 68 CO 0.03 0.21 0.00 0.61 0.00 0.00 0.00 174.94 175.80 1dx5 n GLY 69 N 0.93 0.54 3.86 6.18 0.00 -1.26 -0.26 105.19 115.18 1dx5 n GLY 69 Ca -0.13 -0.53 -0.31 0.00 0.00 0.00 0.00 46.02 45.05 1dx5 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dx5 s LYS 70 N -1.04 3.87 0.10 1.61 1.02 -1.26 -4.15 119.74 119.89 1dx5 s LYS 70 Ca 0.00 0.59 0.00 0.00 0.02 0.00 0.00 55.97 56.58 1dx5 s LYS 70 Cb 0.00 -2.37 0.00 0.00 -0.52 0.00 0.00 37.83 34.94 1dx5 s LYS 70 CO 0.00 -0.00 0.00 1.58 -0.92 0.00 0.00 175.35 176.01 1dx5 n HIS 71 N -1.04 -0.48 -2.18 3.18 -0.00 -1.26 -4.95 115.22 108.48 1dx5 n HIS 71 Ca 0.03 0.09 -0.38 0.00 -0.00 0.00 0.00 57.72 57.46 1dx5 n HIS 71 Cb 0.54 0.16 -0.00 0.00 -0.00 0.00 0.00 29.99 30.68 1dx5 n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1dx5 s SER 72 N -5.36 6.15 0.07 0.26 0.15 -1.26 -0.62 113.70 113.08 1dx5 s SER 72 Ca 0.00 2.41 -0.12 0.00 0.70 0.00 0.00 55.95 58.93 1dx5 s SER 72 Cb 0.00 -2.61 -0.26 0.00 -1.71 0.00 0.00 66.02 61.44 1dx5 s SER 72 CO 0.00 -0.94 1.14 -0.09 1.20 0.00 0.00 173.24 174.55 1dx5 h ARG 73 N 2.17 0.57 0.00 5.44 2.43 -1.58 -3.40 114.38 120.01 1dx5 h ARG 73 Ca -0.49 -0.75 -0.33 0.00 -0.81 0.00 0.00 59.98 57.60 1dx5 h ARG 73 Cb 1.25 0.24 -0.06 0.00 -0.42 0.00 0.00 29.97 30.98 1dx5 h ARG 73 CO 0.61 1.33 -2.23 0.25 -1.51 0.00 0.00 179.97 178.41 1dx5 n THR 74 N -3.76 1.23 -2.16 0.20 -2.24 -1.26 -5.00 114.28 101.29 1dx5 n THR 74 Ca -0.12 -0.67 -0.40 0.00 -2.27 0.00 0.00 64.05 60.59 1dx5 n THR 74 Cb 0.96 -0.77 -0.02 0.00 -2.10 0.00 0.00 70.33 68.40 1dx5 n THR 74 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1dx5 s ARG 75 N -2.43 4.32 -0.60 -0.78 3.52 -1.26 -4.95 118.95 116.76 1dx5 s ARG 75 Ca -0.16 2.14 -0.22 0.00 -0.13 0.00 0.00 55.73 57.36 1dx5 s ARG 75 Cb 0.06 -3.02 0.06 0.00 -1.56 0.00 0.00 34.95 30.49 1dx5 s ARG 75 CO 0.66 -0.19 0.90 -0.47 -0.81 0.00 0.00 175.30 175.39 1dx5 s TYR 76 N -1.18 2.78 -1.38 5.12 5.04 -1.26 -4.85 117.35 121.62 1dx5 s TYR 76 Ca 0.50 -0.39 -0.16 0.00 -2.44 0.00 0.00 57.07 54.58 1dx5 s TYR 76 Cb -0.38 -4.11 0.06 0.00 0.35 0.00 0.00 41.96 37.88 1dx5 s TYR 76 CO 0.50 -1.45 1.98 0.39 -1.34 0.00 0.00 175.55 175.63 1dx5 n GLU 77 N 7.36 3.04 -1.63 4.97 1.02 -1.26 -4.97 120.64 129.17 1dx5 n GLU 77 Ca -0.03 -2.96 -0.46 0.00 -0.02 0.00 0.00 57.16 53.69 1dx5 n GLU 77 Cb 0.46 -3.39 -0.03 0.00 -0.02 0.00 0.00 31.44 28.46 1dx5 n GLU 77 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1dx5 n ARG 77 N 7.20 1.69 -0.77 3.49 0.63 -1.26 -0.43 116.66 127.21 1dx5 n ARG 77 Ca 0.50 0.60 0.00 0.00 -0.92 0.00 0.00 57.85 58.03 1dx5 n ARG 77 Cb 0.42 -2.19 0.00 0.00 0.45 0.00 0.00 32.46 31.14 1dx5 n ARG 77 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1dx5 n ASN 78 N 2.06 -1.49 0.02 6.15 4.05 -1.26 -4.67 115.26 120.12 1dx5 n ASN 78 Ca 0.13 0.00 -0.02 0.00 0.45 0.00 0.00 54.58 55.14 1dx5 n ASN 78 Cb 0.29 -1.91 -0.01 0.00 1.23 0.00 0.00 39.78 39.38 1dx5 n ASN 78 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 177.26 173.83 1dx5 n ILE 79 N -2.10 1.22 -2.52 -1.44 5.41 -0.67 -5.04 119.36 114.22 1dx5 n ILE 79 Ca 0.00 0.33 -0.32 0.00 1.00 0.00 0.00 62.75 63.76 1dx5 n ILE 79 Cb 0.10 -1.73 -0.04 0.00 -0.71 0.00 0.00 39.64 37.26 1dx5 n ILE 79 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1dx5 s GLU 80 N -2.18 3.92 -0.03 0.38 -1.05 0.42 -4.75 118.70 115.41 1dx5 s GLU 80 Ca -0.06 0.85 0.03 0.00 -0.15 0.00 0.00 54.97 55.64 1dx5 s GLU 80 Cb 0.01 -2.20 0.00 0.00 -0.44 0.00 0.00 34.13 31.50 1dx5 s GLU 80 CO 0.09 -0.20 -0.12 0.15 0.95 0.00 0.00 175.26 176.13 1dx5 s LYS 81 N -3.98 1.23 -0.17 -4.83 3.01 0.64 -4.81 119.74 110.84 1dx5 s LYS 81 Ca 0.57 -0.40 -0.12 0.00 -1.01 0.00 0.00 55.97 55.01 1dx5 s LYS 81 Cb -0.10 -1.11 -0.05 0.00 -1.01 0.00 0.00 37.83 35.56 1dx5 s LYS 81 CO 0.31 0.15 0.24 0.42 0.51 0.00 0.00 175.35 176.98 1dx5 s ILE 82 N 0.16 5.34 -0.03 2.17 1.01 -1.26 -1.28 121.20 127.31 1dx5 s ILE 82 Ca -0.04 0.43 0.07 0.00 0.00 0.00 0.00 60.65 61.12 1dx5 s ILE 82 Cb -0.10 -3.58 -0.02 0.00 0.01 0.00 0.00 42.46 38.78 1dx5 s ILE 82 CO 0.01 0.42 -0.24 -0.44 0.00 0.00 0.00 174.94 174.69 1dx5 s SER 83 N 0.31 2.90 0.17 3.58 0.01 -0.20 -4.99 113.70 115.48 1dx5 s SER 83 Ca 0.14 -0.46 -0.16 0.00 1.31 0.00 0.00 55.95 56.79 1dx5 s SER 83 Cb -0.12 -0.44 -0.07 0.00 0.21 0.00 0.00 66.02 65.60 1dx5 s SER 83 CO 0.02 0.29 0.60 -0.04 0.41 0.00 0.00 173.24 174.52 1dx5 s MET 84 N -0.47 4.06 -0.16 12.44 -1.94 -1.26 -2.51 119.30 129.45 1dx5 s MET 84 Ca 0.06 0.60 -0.27 0.00 -1.71 0.00 0.00 55.69 54.38 1dx5 s MET 84 Cb -0.10 -2.92 -0.01 0.00 2.01 0.00 0.00 34.83 33.81 1dx5 s MET 84 CO 0.00 0.46 0.92 -0.51 -0.01 0.00 0.00 175.02 175.88 1dx5 s LEU 85 N -1.95 4.18 -0.15 -0.03 1.43 -1.26 -1.27 118.68 119.63 1dx5 s LEU 85 Ca 0.39 1.32 -0.25 0.00 -1.03 0.00 0.00 54.13 54.56 1dx5 s LEU 85 Cb -0.16 -3.39 -0.24 0.00 0.03 0.00 0.00 46.19 42.43 1dx5 s LEU 85 CO 0.20 -0.46 0.59 -0.08 0.23 0.00 0.00 176.35 176.82 1dx5 h GLU 86 N 7.29 0.04 -2.37 1.70 4.81 -0.73 -3.44 114.58 121.87 1dx5 h GLU 86 Ca -0.28 -0.08 -0.08 0.00 -0.13 0.00 0.00 59.36 58.79 1dx5 h GLU 86 Cb 1.12 0.03 -0.22 0.00 0.63 0.00 0.00 28.75 30.31 1dx5 h GLU 86 CO 0.87 1.04 -0.05 0.21 -0.73 0.00 0.00 179.01 180.34 1dx5 s LYS 87 N -2.30 0.66 -0.18 1.92 2.47 -1.10 -5.00 119.74 116.21 1dx5 s LYS 87 Ca -0.22 0.78 -0.09 0.00 -1.56 0.00 0.00 55.97 54.88 1dx5 s LYS 87 Cb 0.01 0.32 -0.05 0.00 -1.46 0.00 0.00 37.83 36.65 1dx5 s LYS 87 CO 0.68 -0.08 0.11 0.42 0.16 0.00 0.00 175.35 176.63 1dx5 s ILE 88 N 0.28 5.20 -0.34 5.43 1.01 -1.26 -0.78 121.20 130.74 1dx5 s ILE 88 Ca -0.00 0.11 0.04 0.00 0.00 0.00 0.00 60.65 60.80 1dx5 s ILE 88 Cb -0.04 -3.35 0.10 0.00 0.01 0.00 0.00 42.46 39.18 1dx5 s ILE 88 CO 0.01 0.47 0.04 -0.31 0.00 0.00 0.00 174.94 175.16 1dx5 s TYR 89 N 0.14 3.72 0.06 3.97 2.02 0.11 -4.99 117.35 122.39 1dx5 s TYR 89 Ca 0.08 -2.96 -0.19 0.00 -0.37 0.00 0.00 57.07 53.63 1dx5 s TYR 89 Cb -0.12 -2.86 -0.07 0.00 -0.40 0.00 0.00 41.96 38.52 1dx5 s TYR 89 CO -0.00 -0.95 0.55 0.42 -1.57 0.00 0.00 175.55 174.00 1dx5 s ILE 90 N 0.92 4.78 0.02 2.71 1.01 -1.26 -0.59 121.20 128.79 1dx5 s ILE 90 Ca 0.10 1.16 -0.32 0.00 0.00 0.00 0.00 60.65 61.59 1dx5 s ILE 90 Cb -0.19 -3.87 -0.10 0.00 0.01 0.00 0.00 42.46 38.31 1dx5 s ILE 90 CO -0.08 0.55 1.91 1.57 0.00 0.00 0.00 174.94 178.90 1dx5 n HIS 91 N 1.72 2.48 0.28 3.97 -0.00 -1.08 -4.85 115.22 117.74 1dx5 n HIS 91 Ca -0.11 -0.22 0.18 0.00 -0.00 0.00 0.00 57.72 57.57 1dx5 n HIS 91 Cb 0.51 -2.75 0.89 0.00 -0.00 0.00 0.00 29.99 28.64 1dx5 n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1dx5 h PRO 92 N 9.70 0.00 -0.29 1.57 0.13 -1.94 -1.50 132.00 139.67 1dx5 h PRO 92 Ca -0.49 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.61 1dx5 h PRO 92 Cb 1.25 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.36 1dx5 h PRO 92 CO 0.94 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 179.26 1dx5 n ARG 93 N -3.19 2.79 -1.74 0.86 1.74 -1.26 -4.98 116.66 110.88 1dx5 n ARG 93 Ca -0.00 -2.89 -0.43 0.00 -0.77 0.00 0.00 57.85 53.75 1dx5 n ARG 93 Cb 0.34 -1.85 -0.03 0.00 -1.02 0.00 0.00 32.46 29.90 1dx5 n ARG 93 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1dx5 s TYR 94 N -2.89 1.41 -1.29 -1.55 5.04 -0.57 -4.78 117.35 112.72 1dx5 s TYR 94 Ca 0.43 0.21 -0.14 0.00 -2.44 0.00 0.00 57.07 55.14 1dx5 s TYR 94 Cb 0.35 -4.05 0.13 0.00 0.35 0.00 0.00 41.96 38.74 1dx5 s TYR 94 CO 0.08 -4.31 1.75 -1.71 -1.34 0.00 0.00 175.55 170.02 1dx5 n ASN 95 N 9.64 4.91 0.15 4.32 2.85 -0.27 -4.72 115.26 132.13 1dx5 n ASN 95 Ca 0.24 -2.98 0.13 0.00 -0.11 0.00 0.00 54.58 51.86 1dx5 n ASN 95 Cb 0.44 -1.60 0.42 0.00 1.24 0.00 0.00 39.78 40.28 1dx5 n ASN 95 CO 0.00 0.00 0.00 4.11 -2.11 0.00 0.00 177.26 179.26 1dx5 h TRP 96 N 6.67 0.00 -0.40 1.20 5.08 -1.90 0.50 115.95 127.10 1dx5 h TRP 96 Ca 0.41 0.00 -0.06 0.00 1.08 0.00 0.00 58.89 60.32 1dx5 h TRP 96 Cb 0.77 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.91 1dx5 h TRP 96 CO 1.27 0.00 0.01 -0.09 -1.28 0.00 0.00 178.44 178.36 1dx5 h ARG 97 N 0.00 0.63 0.00 0.12 9.65 -1.99 -3.44 114.38 119.35 1dx5 h ARG 97 Ca 0.00 -0.14 0.00 0.00 -1.10 0.00 0.00 59.98 58.74 1dx5 h ARG 97 Cb 0.65 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.15 1dx5 h ARG 97 CO 0.00 0.64 0.00 -1.91 2.80 0.00 0.00 179.97 181.50 1dx5 n GLU 97 N -4.26 0.00 0.18 0.20 2.13 -1.22 -5.00 120.64 112.67 1dx5 n GLU 97 Ca 0.02 0.00 0.09 0.00 0.66 0.00 0.00 57.16 57.94 1dx5 n GLU 97 Cb 0.26 0.00 0.10 0.00 0.27 0.00 0.00 31.44 32.07 1dx5 n GLU 97 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1dx5 h ASN 98 N 0.00 0.00 -0.67 4.31 -0.26 -1.87 -3.47 115.58 113.62 1dx5 h ASN 98 Ca 0.00 0.00 -0.14 0.00 -0.56 0.00 0.00 56.30 55.60 1dx5 h ASN 98 Cb 0.00 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 37.23 1dx5 h ASN 98 CO 0.00 0.13 -0.16 0.18 -1.06 0.00 0.00 177.43 176.52 1dx5 n LEU 99 N -3.05 -0.91 -4.77 1.61 4.32 0.18 -4.97 117.00 109.41 1dx5 n LEU 99 Ca 0.02 0.09 -0.40 0.00 -0.02 0.00 0.00 56.01 55.70 1dx5 n LEU 99 Cb 0.59 -1.32 -0.00 0.00 -1.62 0.00 0.00 43.42 41.07 1dx5 n LEU 99 CO 0.37 -0.23 1.06 -0.62 -1.22 0.00 0.00 177.39 176.75 1dx5 s ASP 100 N -2.80 6.28 -1.20 -1.43 2.15 -1.22 -2.81 116.67 115.64 1dx5 s ASP 100 Ca 0.00 2.89 -0.01 0.00 0.43 0.00 0.00 52.55 55.85 1dx5 s ASP 100 Cb 0.00 -2.66 0.00 0.00 -0.30 0.00 0.00 42.92 39.97 1dx5 s ASP 100 CO 0.00 -0.89 1.01 0.54 -0.17 0.00 0.00 175.17 175.65 1dx5 n ARG 101 N 0.28 -6.70 -2.61 4.34 1.74 -1.26 -1.12 116.66 111.33 1dx5 n ARG 101 Ca 0.02 0.83 -0.43 0.00 -0.77 0.00 0.00 57.85 57.51 1dx5 n ARG 101 Cb 0.41 -5.82 -0.00 0.00 -1.02 0.00 0.00 32.46 26.03 1dx5 n ARG 101 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1dx5 s ASP 102 N -4.20 6.85 -0.12 0.55 2.15 -1.12 -4.41 116.67 116.37 1dx5 s ASP 102 Ca 0.08 -2.46 -0.19 0.00 0.43 0.00 0.00 52.55 50.41 1dx5 s ASP 102 Cb -0.03 -2.57 0.05 0.00 -0.30 0.00 0.00 42.92 40.07 1dx5 s ASP 102 CO 0.72 -1.15 0.48 -0.51 -0.17 0.00 0.00 175.17 174.54 1dx5 s ILE 103 N 4.04 0.02 -0.00 4.11 2.07 -1.26 -3.89 121.20 126.28 1dx5 s ILE 103 Ca 0.53 -0.12 -0.12 0.00 -1.41 0.00 0.00 60.65 59.53 1dx5 s ILE 103 Cb 0.03 -0.72 0.01 0.00 0.13 0.00 0.00 42.46 41.91 1dx5 s ILE 103 CO 0.07 -0.07 0.24 0.00 -1.91 0.00 0.00 174.94 173.27 1dx5 s ALA 104 N -0.41 -0.58 0.05 1.50 0.00 -0.13 -2.63 121.76 119.56 1dx5 s ALA 104 Ca -0.05 0.10 0.07 0.00 0.00 0.00 0.00 51.96 52.08 1dx5 s ALA 104 Cb -0.03 0.11 -0.03 0.00 0.00 0.00 0.00 23.12 23.17 1dx5 s ALA 104 CO 0.03 -0.25 -0.19 -0.51 0.00 0.00 0.00 175.76 174.84 1dx5 s LEU 105 N -1.43 2.57 -0.10 0.00 1.43 0.24 -1.36 118.68 120.03 1dx5 s LEU 105 Ca -0.13 -0.45 0.01 0.00 -1.03 0.00 0.00 54.13 52.52 1dx5 s LEU 105 Cb -0.06 -1.50 0.02 0.00 0.03 0.00 0.00 46.19 44.69 1dx5 s LEU 105 CO 0.02 0.25 -0.11 -0.04 0.23 0.00 0.00 176.35 176.71 1dx5 s MET 106 N -1.48 1.76 -0.16 1.70 -1.94 0.38 0.09 119.30 119.65 1dx5 s MET 106 Ca 0.15 -0.38 -0.16 0.00 -1.71 0.00 0.00 55.69 53.59 1dx5 s MET 106 Cb -0.10 -1.63 -0.04 0.00 2.01 0.00 0.00 34.83 35.06 1dx5 s MET 106 CO 0.05 -0.14 0.38 0.21 -0.01 0.00 0.00 175.02 175.51 1dx5 s LYS 107 N 1.26 4.27 0.19 2.03 2.20 0.04 -1.09 119.74 128.63 1dx5 s LYS 107 Ca -0.03 0.24 -0.20 0.00 -0.36 0.00 0.00 55.97 55.62 1dx5 s LYS 107 Cb -0.14 -3.46 -0.08 0.00 -1.51 0.00 0.00 37.83 32.65 1dx5 s LYS 107 CO -0.04 0.15 0.69 -0.51 -0.36 0.00 0.00 175.35 175.28 1dx5 s LEU 108 N 0.72 4.39 0.36 5.43 1.43 -0.25 -0.06 118.68 130.71 1dx5 s LEU 108 Ca 0.20 1.39 0.03 0.00 -1.03 0.00 0.00 54.13 54.72 1dx5 s LEU 108 Cb -0.14 -3.44 0.66 0.00 0.03 0.00 0.00 46.19 43.31 1dx5 s LEU 108 CO 0.07 0.09 1.99 0.11 0.23 0.00 0.00 176.35 178.84 1dx5 h LYS 109 N 3.67 0.74 -4.86 1.70 1.57 -1.48 -3.43 116.57 114.48 1dx5 h LYS 109 Ca -0.48 -0.06 -0.31 0.00 -1.87 0.00 0.00 60.65 57.93 1dx5 h LYS 109 Cb 1.20 -0.16 -0.20 0.00 0.08 0.00 0.00 32.23 33.15 1dx5 h LYS 109 CO 0.65 0.52 -0.74 0.15 -0.57 0.00 0.00 179.45 179.47 1dx5 s LYS 110 N -5.56 0.72 0.27 3.15 -0.14 -1.26 -5.01 119.74 111.90 1dx5 s LYS 110 Ca -0.09 -0.98 -0.29 0.00 -1.36 0.00 0.00 55.97 53.24 1dx5 s LYS 110 Cb 0.17 -0.47 -0.10 0.00 -1.68 0.00 0.00 37.83 35.76 1dx5 s LYS 110 CO 0.76 0.08 1.26 -1.25 -0.76 0.00 0.00 175.35 175.44 1dx5 s PRO 111 N -2.20 4.44 0.37 -1.68 0.04 -1.26 -4.82 135.00 129.88 1dx5 s PRO 111 Ca -0.01 2.06 -0.24 0.00 0.04 0.00 0.00 61.00 62.84 1dx5 s PRO 111 Cb -0.06 -3.15 -0.10 0.00 0.04 0.00 0.00 34.50 31.23 1dx5 s PRO 111 CO 0.00 -0.12 0.96 0.14 0.04 0.00 0.00 177.00 178.03 1dx5 s VAL 112 N -0.66 4.18 -0.20 -0.36 -7.23 0.93 -5.01 120.40 112.05 1dx5 s VAL 112 Ca 0.51 1.64 -0.25 0.00 -1.81 0.00 0.00 61.98 62.06 1dx5 s VAL 112 Cb -0.37 -3.83 -0.01 0.00 0.56 0.00 0.00 36.38 32.74 1dx5 s VAL 112 CO 0.44 -0.02 0.84 0.00 -0.31 0.00 0.00 175.10 176.05 1dx5 s ALA 113 N -1.80 3.58 0.55 1.32 0.00 -1.26 -4.87 121.76 119.28 1dx5 s ALA 113 Ca 0.55 -0.02 -0.18 0.00 0.00 0.00 0.00 51.96 52.31 1dx5 s ALA 113 Cb -0.16 -3.26 -0.05 0.00 0.00 0.00 0.00 23.12 19.64 1dx5 s ALA 113 CO 0.21 -0.77 1.08 -0.06 0.00 0.00 0.00 175.76 176.22 1dx5 s PHE 114 N 2.46 2.85 0.00 0.00 0.08 -1.26 -4.83 117.98 117.29 1dx5 s PHE 114 Ca 0.37 1.55 0.00 0.00 0.12 0.00 0.00 56.93 58.97 1dx5 s PHE 114 Cb -0.16 -3.13 0.00 0.00 -0.57 0.00 0.00 43.02 39.16 1dx5 s PHE 114 CO 0.10 -1.23 0.00 -1.13 -0.10 0.00 0.00 175.22 172.86 1dx5 n SER 115 N -1.54 0.00 0.29 1.36 3.41 0.15 -4.92 113.62 112.37 1dx5 n SER 115 Ca 0.10 -0.92 0.17 0.00 -0.26 0.00 0.00 58.87 57.96 1dx5 n SER 115 Cb 0.52 0.00 0.84 0.00 -0.26 0.00 0.00 64.21 65.31 1dx5 n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1dx5 h ASP 116 N 0.00 0.00 0.00 4.04 3.32 -1.98 -2.98 116.42 118.82 1dx5 h ASP 116 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1dx5 h ASP 116 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1dx5 h ASP 116 CO 0.00 0.04 -1.09 -1.22 -1.72 0.00 0.00 179.24 175.25 1dx5 n TYR 117 N -3.24 0.00 -4.00 4.55 4.01 -1.26 -4.70 117.16 112.52 1dx5 n TYR 117 Ca -0.01 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.43 1dx5 n TYR 117 Cb 0.23 -0.14 -0.16 0.00 -0.31 0.00 0.00 39.34 38.95 1dx5 n TYR 117 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1dx5 s ILE 118 N -2.60 1.56 -0.29 -0.72 1.01 -1.13 -4.01 121.20 115.02 1dx5 s ILE 118 Ca 0.01 -0.74 -0.19 0.00 0.00 0.00 0.00 60.65 59.73 1dx5 s ILE 118 Cb 0.10 -1.53 0.13 0.00 0.01 0.00 0.00 42.46 41.16 1dx5 s ILE 118 CO 0.58 0.36 0.93 -2.28 0.00 0.00 0.00 174.94 174.53 1dx5 s HIS 119 N 1.47 -0.64 0.45 3.97 2.46 -0.77 -0.67 115.29 121.57 1dx5 s HIS 119 Ca 0.03 1.34 -0.24 0.00 0.47 0.00 0.00 55.06 56.66 1dx5 s HIS 119 Cb -0.14 0.39 -0.07 0.00 -0.13 0.00 0.00 32.58 32.63 1dx5 s HIS 119 CO -0.10 -0.31 1.22 -1.25 -2.47 0.00 0.00 174.74 171.83 1dx5 s PRO 120 N 1.06 3.76 0.40 2.88 0.04 -1.26 -2.37 135.00 139.50 1dx5 s PRO 120 Ca -0.06 1.92 -0.05 0.00 0.04 0.00 0.00 61.00 62.86 1dx5 s PRO 120 Cb -0.04 -2.50 -0.04 0.00 0.04 0.00 0.00 34.50 31.96 1dx5 s PRO 120 CO -0.13 -0.59 0.68 0.54 0.04 0.00 0.00 177.00 177.54 1dx5 s VAL 121 N -1.44 4.96 0.39 -0.36 0.11 -0.57 -4.92 120.40 118.57 1dx5 s VAL 121 Ca 0.62 0.08 -0.12 0.00 -2.93 0.00 0.00 61.98 59.63 1dx5 s VAL 121 Cb -0.32 -3.82 -0.07 0.00 -1.53 0.00 0.00 36.38 30.64 1dx5 s VAL 121 CO 0.40 -0.62 0.78 0.00 -3.33 0.00 0.00 175.10 172.33 1dx5 s LEU 123 N -3.64 3.98 0.44 0.00 1.43 -1.26 -0.83 118.68 118.80 1dx5 s LEU 123 Ca 0.53 0.26 -0.24 0.00 -1.03 0.00 0.00 54.13 53.64 1dx5 s LEU 123 Cb -0.10 -1.96 -0.08 0.00 0.03 0.00 0.00 46.19 44.08 1dx5 s LEU 123 CO 0.28 0.33 1.26 -2.16 0.23 0.00 0.00 176.35 176.29 1dx5 s PRO 124 N -0.59 3.80 0.09 1.29 0.04 -1.26 -4.93 135.00 133.44 1dx5 s PRO 124 Ca 0.11 2.03 0.01 0.00 0.04 0.00 0.00 61.00 63.19 1dx5 s PRO 124 Cb -0.12 -2.58 0.02 0.00 0.04 0.00 0.00 34.50 31.86 1dx5 s PRO 124 CO 0.02 -0.59 0.12 -0.40 0.04 0.00 0.00 177.00 176.19 1dx5 n ASP 125 N -0.21 0.26 -0.06 6.66 5.68 -1.26 -4.83 116.55 122.79 1dx5 n ASP 125 Ca 0.06 -1.20 -0.09 0.00 -0.50 0.00 0.00 54.79 53.06 1dx5 n ASP 125 Cb 0.45 -0.07 -0.02 0.00 -1.14 0.00 0.00 41.12 40.35 1dx5 n ASP 125 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1dx5 h ARG 126 N 0.00 0.19 -0.48 0.11 2.43 -1.98 -3.17 114.38 111.48 1dx5 h ARG 126 Ca -0.04 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.00 1dx5 h ARG 126 Cb 0.17 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1dx5 h ARG 126 CO 0.05 0.13 -0.16 0.93 -1.51 0.00 0.00 179.97 179.42 1dx5 h GLU 127 N 0.20 0.95 -0.73 0.20 3.07 -2.03 -2.43 114.58 113.81 1dx5 h GLU 127 Ca 0.10 -0.38 0.00 0.00 -0.50 0.00 0.00 59.36 58.58 1dx5 h GLU 127 Cb 0.07 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 1dx5 h GLU 127 CO -0.10 1.05 0.00 2.41 -1.40 0.00 0.00 179.01 180.97 1dx5 n THR 128 N -4.18 0.06 0.00 1.13 -1.04 -1.20 -1.25 114.28 107.80 1dx5 n THR 128 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1dx5 n THR 128 Cb 0.42 -0.26 0.00 0.00 -1.82 0.00 0.00 70.33 68.67 1dx5 n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1dx5 n ALA 129 N 0.58 0.00 -0.03 2.41 0.00 -0.91 -0.90 120.51 121.65 1dx5 n ALA 129 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1dx5 n ALA 129 Cb 0.06 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.42 1dx5 n ALA 129 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1dx5 h SER 129 N 0.00 0.18 0.33 0.00 0.02 -1.45 -3.38 113.55 109.25 1dx5 h SER 129 Ca 0.00 -0.51 -0.33 0.00 -0.84 0.00 0.00 61.79 60.11 1dx5 h SER 129 Cb 0.00 -0.05 0.02 0.00 0.14 0.00 0.00 62.40 62.51 1dx5 h SER 129 CO 0.00 0.66 -1.54 -0.07 -1.14 0.00 0.00 176.83 174.74 1dx5 h LEU 129 N -0.29 0.64 -6.73 5.07 4.07 -1.26 -3.41 115.31 113.41 1dx5 h LEU 129 Ca 0.01 -0.79 -0.63 0.00 0.08 0.00 0.00 57.88 56.55 1dx5 h LEU 129 Cb 0.62 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.14 1dx5 h LEU 129 CO 0.02 1.64 2.36 0.18 -1.08 0.00 0.00 178.44 181.56 1dx5 n LEU 130 N -3.61 4.90 -3.96 1.67 4.77 -1.26 -4.85 117.00 114.65 1dx5 n LEU 130 Ca -0.18 -3.45 -0.16 0.00 -0.03 0.00 0.00 56.01 52.20 1dx5 n LEU 130 Cb 1.08 -1.45 -0.14 0.00 -2.33 0.00 0.00 43.42 40.57 1dx5 n LEU 130 CO 0.55 -0.07 -0.40 -1.10 -1.33 0.00 0.00 177.39 175.05 1dx5 s GLN 131 N 4.57 0.43 0.32 3.23 -0.21 -1.26 -4.92 119.66 121.81 1dx5 s GLN 131 Ca 0.55 -0.22 -0.28 0.00 0.02 0.00 0.00 55.36 55.43 1dx5 s GLN 131 Cb 0.11 -0.40 -0.13 0.00 1.00 0.00 0.00 33.01 33.59 1dx5 s GLN 131 CO 0.05 0.11 1.12 0.00 -2.12 0.00 0.00 175.29 174.45 1dx5 n ALA 132 N 2.86 0.41 0.00 6.09 0.00 -1.26 -1.51 120.51 127.10 1dx5 n ALA 132 Ca -0.13 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1dx5 n ALA 132 Cb 0.58 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.91 1dx5 n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dx5 n GLY 133 N 1.03 2.84 3.71 0.00 0.00 0.63 -4.91 105.19 108.51 1dx5 n GLY 133 Ca 0.08 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1dx5 n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1dx5 s TYR 134 N -2.08 3.37 0.09 1.61 1.51 -0.57 -4.66 117.35 116.62 1dx5 s TYR 134 Ca 0.00 1.20 -0.17 0.00 -1.01 0.00 0.00 57.07 57.09 1dx5 s TYR 134 Cb 0.00 -3.49 -0.07 0.00 -0.11 0.00 0.00 41.96 38.30 1dx5 s TYR 134 CO 0.00 -1.56 0.54 0.15 -1.11 0.00 0.00 175.55 173.57 1dx5 s LYS 135 N 1.15 4.09 0.22 -0.62 1.02 -1.26 -0.30 119.74 124.04 1dx5 s LYS 135 Ca 0.60 0.62 0.00 0.00 0.02 0.00 0.00 55.97 57.21 1dx5 s LYS 135 Cb -0.31 -3.13 0.00 0.00 -0.52 0.00 0.00 37.83 33.87 1dx5 s LYS 135 CO 0.29 0.59 0.01 0.41 -0.92 0.00 0.00 175.35 175.74 1dx5 n GLY 136 N 1.43 3.86 2.86 -3.33 0.00 0.07 -4.85 105.19 105.24 1dx5 n GLY 136 Ca -0.09 -2.28 -0.19 0.00 0.00 0.00 0.00 46.02 43.46 1dx5 n GLY 136 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1dx5 s ARG 137 N -2.78 0.63 -0.04 1.61 3.52 0.19 -1.30 118.95 120.78 1dx5 s ARG 137 Ca 0.01 -0.03 0.06 0.00 -0.13 0.00 0.00 55.73 55.64 1dx5 s ARG 137 Cb -0.00 -0.71 -0.02 0.00 -1.56 0.00 0.00 34.95 32.66 1dx5 s ARG 137 CO 0.01 -0.11 -0.21 0.08 -0.81 0.00 0.00 175.30 174.26 1dx5 s VAL 138 N 0.99 2.49 0.09 7.11 1.01 -0.53 0.22 120.40 131.78 1dx5 s VAL 138 Ca -0.10 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 60.99 1dx5 s VAL 138 Cb -0.14 -1.92 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 1dx5 s VAL 138 CO -0.01 0.58 -0.13 0.42 0.00 0.00 0.00 175.10 175.97 1dx5 s THR 139 N -0.63 1.13 0.00 3.92 -4.23 -1.24 -1.44 115.64 113.15 1dx5 s THR 139 Ca 0.10 -1.53 0.00 0.00 -1.18 0.00 0.00 61.69 59.08 1dx5 s THR 139 Cb -0.11 -1.29 0.00 0.00 1.34 0.00 0.00 72.50 72.44 1dx5 s THR 139 CO -0.00 -0.38 0.00 0.61 -0.54 0.00 0.00 174.62 174.31 1dx5 n GLY 140 N 0.84 1.12 1.02 3.99 0.00 -0.72 -4.51 105.19 106.94 1dx5 n GLY 140 Ca -0.18 -0.86 0.08 0.00 0.00 0.00 0.00 46.02 45.06 1dx5 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1dx5 n TRP 141 N -0.36 1.02 -0.72 1.61 8.01 -1.26 -1.26 117.44 124.47 1dx5 n TRP 141 Ca 0.00 -0.74 -0.13 0.00 -1.31 0.00 0.00 57.50 55.32 1dx5 n TRP 141 Cb 0.00 -0.26 0.11 0.00 -2.01 0.00 0.00 31.31 29.15 1dx5 n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1dx5 n GLY 142 N 0.06 -2.61 3.70 6.99 0.00 -1.26 -4.56 105.19 107.51 1dx5 n GLY 142 Ca 0.20 -1.46 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 1dx5 n GLY 142 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1dx5 n ASN 143 N -3.82 2.74 0.09 1.61 3.02 0.57 -3.37 115.26 116.11 1dx5 n ASN 143 Ca 0.07 1.20 0.13 0.00 -0.03 0.00 0.00 54.58 55.94 1dx5 n ASN 143 Cb 0.26 -1.49 0.42 0.00 -0.61 0.00 0.00 39.78 38.36 1dx5 n ASN 143 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1dx5 n LEU 144 N 0.71 0.71 -3.57 3.41 4.77 0.92 -1.47 117.00 122.48 1dx5 n LEU 144 Ca 0.05 0.55 -0.11 0.00 -0.03 0.00 0.00 56.01 56.46 1dx5 n LEU 144 Cb 0.36 -0.33 -0.04 0.00 -2.33 0.00 0.00 43.42 41.08 1dx5 n LEU 144 CO 0.62 -0.15 0.24 -0.54 -1.33 0.00 0.00 177.39 176.22 1dx5 s LYS 145 N -3.09 1.12 0.20 3.23 1.02 -1.26 -4.31 119.74 116.64 1dx5 s LYS 145 Ca 0.11 -0.59 -0.10 0.00 0.02 0.00 0.00 55.97 55.42 1dx5 s LYS 145 Cb 0.13 0.50 0.13 0.00 -0.52 0.00 0.00 37.83 38.07 1dx5 s LYS 145 CO 0.60 -0.45 1.77 1.49 -0.92 0.00 0.00 175.35 177.84 1dx5 h GLU 146 N 2.33 1.06 0.00 1.68 4.81 -1.90 -3.45 114.58 119.11 1dx5 h GLU 146 Ca -0.34 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 1dx5 h GLU 146 Cb 1.26 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.46 1dx5 h GLU 146 CO 0.44 0.85 0.00 -2.37 -0.73 0.00 0.00 179.01 177.20 1dx5 n THR 147 N -4.39 0.00 -3.33 0.32 5.66 -1.26 -4.82 114.28 106.46 1dx5 n THR 147 Ca 0.06 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.85 1dx5 n THR 147 Cb 0.15 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 68.92 1dx5 n THR 147 CO 0.00 0.00 0.00 -2.67 -3.05 0.00 0.00 175.07 169.35 1dx5 n TRP 148 N 4.15 -1.69 0.01 1.09 4.27 -1.26 -4.43 117.44 119.58 1dx5 n TRP 148 Ca 0.00 0.38 0.00 0.00 -3.89 0.00 0.00 57.50 53.99 1dx5 n TRP 148 Cb 0.00 -2.34 0.00 0.00 -1.36 0.00 0.00 31.31 27.61 1dx5 n TRP 148 CO 0.00 0.00 0.00 -2.37 -2.29 0.00 0.00 177.69 173.03 1dx5 n THR 149 N -3.62 0.00 0.00 -1.67 5.66 -1.26 -5.12 114.28 108.27 1dx5 n THR 149 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1dx5 n THR 149 Cb 0.52 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 1dx5 n THR 149 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1dx5 n ALA 149 N -2.48 0.00 -3.64 1.79 0.00 -1.26 -5.19 120.51 109.72 1dx5 n ALA 149 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1dx5 n ALA 149 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 1dx5 n ALA 149 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1dx5 s ASN 149 N 0.00 -0.25 -0.44 0.00 3.04 -1.26 -4.88 114.94 111.15 1dx5 s ASN 149 Ca 0.00 0.45 -0.29 0.00 0.04 0.00 0.00 52.86 53.06 1dx5 s ASN 149 Cb 0.00 0.69 0.02 0.00 -1.54 0.00 0.00 41.25 40.42 1dx5 s ASN 149 CO 0.00 -0.08 1.26 -0.69 -3.04 0.00 0.00 177.10 174.56 1dx5 s VAL 149 N 0.50 4.07 0.06 -5.21 1.01 -1.26 -4.95 120.40 114.62 1dx5 s VAL 149 Ca 0.01 1.10 -0.28 0.00 0.00 0.00 0.00 61.98 62.80 1dx5 s VAL 149 Cb -0.04 -4.42 0.09 0.00 0.00 0.00 0.00 36.38 32.02 1dx5 s VAL 149 CO -0.12 -0.88 1.14 -0.83 0.00 0.00 0.00 175.10 174.41 1dx5 s GLY 149 N 3.12 -0.33 0.00 4.51 0.00 -1.26 -5.02 107.32 108.34 1dx5 s GLY 149 Ca 0.54 0.43 0.30 0.00 0.00 0.00 0.00 44.72 45.99 1dx5 s GLY 149 CO 0.32 0.10 2.03 0.28 0.00 0.00 0.00 173.10 175.83 1dx5 n LYS 149 N -0.49 0.66 0.00 2.90 5.02 -1.26 -4.96 118.16 120.03 1dx5 n LYS 149 Ca -0.07 -0.10 0.00 0.00 -2.02 0.00 0.00 58.31 56.12 1dx5 n LYS 149 Cb 0.62 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.13 1dx5 n LYS 149 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1dx5 n GLY 150 N 1.22 1.63 3.60 0.72 0.00 -1.26 -4.72 105.19 106.38 1dx5 n GLY 150 Ca 0.17 0.23 -0.33 0.00 0.00 0.00 0.00 46.02 46.08 1dx5 n GLY 150 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dx5 s GLN 151 N 0.00 2.72 0.65 1.61 -0.21 -1.26 -0.06 119.66 123.11 1dx5 s GLN 151 Ca 0.00 -0.58 -0.13 0.00 0.02 0.00 0.00 55.36 54.66 1dx5 s GLN 151 Cb 0.00 -2.59 -0.01 0.00 1.00 0.00 0.00 33.01 31.41 1dx5 s GLN 151 CO 0.00 0.65 1.06 -1.25 -2.12 0.00 0.00 175.29 173.63 1dx5 s PRO 152 N -1.03 3.10 0.24 2.91 0.04 -1.26 -4.95 135.00 134.05 1dx5 s PRO 152 Ca 0.14 1.08 0.23 0.00 0.04 0.00 0.00 61.00 62.50 1dx5 s PRO 152 Cb -0.11 -2.01 0.14 0.00 0.04 0.00 0.00 34.50 32.56 1dx5 s PRO 152 CO 0.04 -0.98 1.22 0.66 0.04 0.00 0.00 177.00 177.98 1dx5 h SER 153 N -0.16 0.00 -5.15 6.66 4.64 -1.97 -3.43 113.55 114.13 1dx5 h SER 153 Ca -0.45 -0.03 -0.13 0.00 -0.47 0.00 0.00 61.79 60.70 1dx5 h SER 153 Cb 1.22 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.14 1dx5 h SER 153 CO 0.57 0.02 -0.66 -0.69 -0.87 0.00 0.00 176.83 175.19 1dx5 s VAL 154 N -3.30 0.18 0.09 0.95 1.01 -1.26 -1.60 120.40 116.47 1dx5 s VAL 154 Ca 0.02 -1.48 -0.36 0.00 0.00 0.00 0.00 61.98 60.16 1dx5 s VAL 154 Cb 0.09 -1.12 -0.16 0.00 0.00 0.00 0.00 36.38 35.19 1dx5 s VAL 154 CO 0.75 -0.82 1.40 -0.11 0.00 0.00 0.00 175.10 176.32 1dx5 n LEU 155 N 0.56 1.96 -4.93 3.92 7.94 0.20 -4.83 117.00 121.83 1dx5 n LEU 155 Ca -0.17 1.11 -0.28 0.00 -1.11 0.00 0.00 56.01 55.56 1dx5 n LEU 155 Cb 0.59 -1.24 -0.03 0.00 0.53 0.00 0.00 43.42 43.27 1dx5 n LEU 155 CO 0.25 -0.87 -0.07 -1.10 -1.11 0.00 0.00 177.39 174.49 1dx5 s GLN 156 N 0.68 3.48 -0.00 1.96 -1.52 -0.39 -0.61 119.66 123.25 1dx5 s GLN 156 Ca 0.84 -0.45 0.00 0.00 -1.95 0.00 0.00 55.36 53.80 1dx5 s GLN 156 Cb -0.90 -2.94 0.00 0.00 -0.22 0.00 0.00 33.01 28.94 1dx5 s GLN 156 CO 0.46 0.51 -0.01 0.54 -0.25 0.00 0.00 175.29 176.54 1dx5 s VAL 157 N -1.70 0.08 -0.04 1.09 0.11 0.47 -1.75 120.40 118.66 1dx5 s VAL 157 Ca 0.36 -0.03 -0.04 0.00 -2.93 0.00 0.00 61.98 59.35 1dx5 s VAL 157 Cb -0.12 -0.08 0.01 0.00 -1.53 0.00 0.00 36.38 34.66 1dx5 s VAL 157 CO 0.28 0.03 0.10 0.54 -3.33 0.00 0.00 175.10 172.73 1dx5 s VAL 158 N 0.05 0.01 -0.25 2.04 0.11 -0.52 -0.73 120.40 121.10 1dx5 s VAL 158 Ca -0.00 -0.04 -0.12 0.00 -2.93 0.00 0.00 61.98 58.89 1dx5 s VAL 158 Cb -0.01 -0.17 -0.05 0.00 -1.53 0.00 0.00 36.38 34.62 1dx5 s VAL 158 CO -0.00 -0.02 0.22 0.20 -3.33 0.00 0.00 175.10 172.16 1dx5 s ASN 159 N -0.02 6.14 -0.04 3.54 0.01 -1.26 -1.45 114.94 121.85 1dx5 s ASN 159 Ca -0.01 0.14 0.02 0.00 -0.71 0.00 0.00 52.86 52.30 1dx5 s ASN 159 Cb -0.01 -2.14 0.01 0.00 0.41 0.00 0.00 41.25 39.53 1dx5 s ASN 159 CO 0.00 -0.01 -0.07 -0.76 -1.51 0.00 0.00 177.10 174.75 1dx5 s LEU 160 N 1.40 1.56 0.34 0.60 1.43 -0.42 -4.94 118.68 118.66 1dx5 s LEU 160 Ca 0.10 -0.18 -0.26 0.00 -1.03 0.00 0.00 54.13 52.76 1dx5 s LEU 160 Cb -0.15 -0.54 -0.09 0.00 0.03 0.00 0.00 46.19 45.44 1dx5 s LEU 160 CO 0.07 0.01 1.01 -2.16 0.23 0.00 0.00 176.35 175.51 1dx5 s PRO 161 N 0.59 4.45 0.32 1.29 0.04 -1.26 -0.75 135.00 139.68 1dx5 s PRO 161 Ca -0.09 1.49 -0.28 0.00 0.04 0.00 0.00 61.00 62.15 1dx5 s PRO 161 Cb -0.12 -2.80 -0.10 0.00 0.04 0.00 0.00 34.50 31.52 1dx5 s PRO 161 CO 0.01 0.12 1.18 0.42 0.04 0.00 0.00 177.00 178.77 1dx5 s ILE 162 N -1.53 3.19 -0.06 0.56 1.01 0.59 -0.92 121.20 124.04 1dx5 s ILE 162 Ca 0.52 1.16 -0.01 0.00 0.00 0.00 0.00 60.65 62.32 1dx5 s ILE 162 Cb -0.23 -3.72 -0.03 0.00 0.01 0.00 0.00 42.46 38.49 1dx5 s ILE 162 CO 0.29 0.25 -0.01 -0.69 0.00 0.00 0.00 174.94 174.77 1dx5 s VAL 163 N -1.21 4.18 0.36 2.92 1.01 -0.73 -0.26 120.40 126.67 1dx5 s VAL 163 Ca 0.48 -0.38 -0.28 0.00 0.00 0.00 0.00 61.98 61.80 1dx5 s VAL 163 Cb -0.34 -2.78 -0.12 0.00 0.00 0.00 0.00 36.38 33.14 1dx5 s VAL 163 CO 0.44 0.54 1.42 -1.84 0.00 0.00 0.00 175.10 175.66 1dx5 n GLU 164 N 1.95 2.47 -0.27 2.72 0.00 -1.26 -4.59 120.64 121.66 1dx5 n GLU 164 Ca -0.17 0.87 0.08 0.00 0.00 0.00 0.00 57.16 57.94 1dx5 n GLU 164 Cb 0.53 -2.54 0.22 0.00 0.00 0.00 0.00 31.44 29.65 1dx5 n GLU 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1dx5 h ARG 165 N 2.82 0.22 -0.35 3.44 3.08 -1.98 -1.72 114.38 119.90 1dx5 h ARG 165 Ca -0.49 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 59.49 1dx5 h ARG 165 Cb 1.26 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 31.24 1dx5 h ARG 165 CO 0.64 0.15 -0.01 -1.00 -1.07 0.00 0.00 179.97 178.67 1dx5 h PRO 166 N 0.23 0.55 -0.07 0.04 0.13 -1.99 0.08 132.00 130.97 1dx5 h PRO 166 Ca 0.47 -0.13 -0.12 0.00 -0.87 0.00 0.00 66.00 65.36 1dx5 h PRO 166 Cb 0.87 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.91 1dx5 h PRO 166 CO -0.59 0.59 -0.48 0.28 -0.23 0.00 0.00 178.00 177.57 1dx5 h VAL 167 N 0.53 1.34 -0.26 1.56 2.07 -1.70 -1.11 116.25 118.69 1dx5 h VAL 167 Ca 0.11 -1.69 -0.10 0.00 0.82 0.00 0.00 66.70 65.83 1dx5 h VAL 167 Cb 0.36 1.83 -0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1dx5 h VAL 167 CO 0.01 0.50 -0.24 0.00 0.02 0.00 0.00 177.57 177.86 1dx5 h LYS 169 N 0.34 0.74 0.00 0.00 3.64 -0.75 -2.89 116.57 117.64 1dx5 h LYS 169 Ca 0.04 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1dx5 h LYS 169 Cb 0.80 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1dx5 h LYS 169 CO 0.06 0.52 0.00 -0.25 -2.27 0.00 0.00 179.45 177.51 1dx5 n ASP 170 N -4.67 0.00 0.12 4.20 8.00 -0.44 -3.42 116.55 120.34 1dx5 n ASP 170 Ca 0.03 0.32 0.13 0.00 0.71 0.00 0.00 54.79 55.98 1dx5 n ASP 170 Cb 0.04 -0.44 0.32 0.00 -0.02 0.00 0.00 41.12 41.02 1dx5 n ASP 170 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 1dx5 h SER 171 N 0.00 0.00 -5.34 -2.24 4.64 -1.27 -3.47 113.55 105.87 1dx5 h SER 171 Ca 0.00 -0.03 -0.15 0.00 -0.47 0.00 0.00 61.79 61.14 1dx5 h SER 171 Cb 0.40 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.35 1dx5 h SER 171 CO 0.00 0.01 -0.53 0.28 -0.87 0.00 0.00 176.83 175.73 1dx5 s THR 172 N -3.14 0.10 -0.86 2.95 -1.32 -1.22 -4.82 115.64 107.33 1dx5 s THR 172 Ca 0.09 -1.69 0.22 0.00 -1.21 0.00 0.00 61.69 59.10 1dx5 s THR 172 Cb 0.11 -1.90 -0.16 0.00 -1.51 0.00 0.00 72.50 69.04 1dx5 s THR 172 CO 0.63 -0.46 1.01 0.54 -2.21 0.00 0.00 174.62 174.13 1dx5 n ARG 173 N -0.12 0.10 -2.44 7.08 1.74 -1.26 -4.92 116.66 116.84 1dx5 n ARG 173 Ca -0.07 -0.01 -0.40 0.00 -0.77 0.00 0.00 57.85 56.59 1dx5 n ARG 173 Cb 0.63 -1.52 -0.04 0.00 -1.02 0.00 0.00 32.46 30.51 1dx5 n ARG 173 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1dx5 s ILE 174 N -3.07 3.45 0.15 0.55 1.01 -1.26 -4.98 121.20 117.05 1dx5 s ILE 174 Ca 0.07 1.44 -0.31 0.00 0.00 0.00 0.00 60.65 61.85 1dx5 s ILE 174 Cb 0.16 -3.91 -0.08 0.00 0.01 0.00 0.00 42.46 38.63 1dx5 s ILE 174 CO 0.82 0.33 1.35 -0.60 0.00 0.00 0.00 174.94 176.84 1dx5 s ARG 175 N -1.35 4.35 -0.16 2.79 3.52 -1.26 -5.02 118.95 121.82 1dx5 s ARG 175 Ca 0.45 2.06 -0.07 0.00 -0.13 0.00 0.00 55.73 58.04 1dx5 s ARG 175 Cb -0.32 -3.23 -0.04 0.00 -1.56 0.00 0.00 34.95 29.80 1dx5 s ARG 175 CO 0.41 -0.35 0.09 0.42 -0.81 0.00 0.00 175.30 175.06 1dx5 s ILE 176 N 0.67 5.02 0.42 4.11 -1.09 -1.26 -4.91 121.20 124.17 1dx5 s ILE 176 Ca 0.61 0.04 0.07 0.00 -2.23 0.00 0.00 60.65 59.15 1dx5 s ILE 176 Cb -0.36 -3.24 -0.02 0.00 -1.58 0.00 0.00 42.46 37.26 1dx5 s ILE 176 CO 0.34 0.51 0.34 0.42 -1.23 0.00 0.00 174.94 175.32 1dx5 s THR 177 N -0.10 2.52 -1.13 2.92 -4.23 -1.26 -5.00 115.64 109.36 1dx5 s THR 177 Ca 0.08 -1.42 0.17 0.00 -1.18 0.00 0.00 61.69 59.34 1dx5 s THR 177 Cb -0.12 -2.95 0.19 0.00 1.34 0.00 0.00 72.50 70.96 1dx5 s THR 177 CO 0.01 0.00 1.54 0.47 -0.54 0.00 0.00 174.62 176.10 1dx5 n ASP 178 N -1.50 0.00 -0.58 3.99 9.92 -1.26 -2.14 116.55 124.98 1dx5 n ASP 178 Ca 0.02 0.36 0.04 0.00 -0.53 0.00 0.00 54.79 54.69 1dx5 n ASP 178 Cb 0.62 -0.44 0.13 0.00 -0.64 0.00 0.00 41.12 40.79 1dx5 n ASP 178 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1dx5 n ASN 179 N -1.44 1.65 -4.11 -2.24 3.02 -1.26 -4.85 115.26 106.02 1dx5 n ASN 179 Ca 0.05 -2.04 -0.08 0.00 -0.03 0.00 0.00 54.58 52.48 1dx5 n ASN 179 Cb 0.18 -0.23 -0.10 0.00 -0.61 0.00 0.00 39.78 39.02 1dx5 n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1dx5 s MET 180 N -1.63 0.71 0.11 3.52 -1.94 -0.91 -0.94 119.30 118.21 1dx5 s MET 180 Ca 0.19 -1.29 -0.11 0.00 -1.71 0.00 0.00 55.69 52.77 1dx5 s MET 180 Cb 0.10 0.16 0.01 0.00 2.01 0.00 0.00 34.83 37.12 1dx5 s MET 180 CO 0.12 -0.13 0.28 -0.59 -0.01 0.00 0.00 175.02 174.68 1dx5 s PHE 181 N -3.91 0.03 0.12 -0.03 -0.12 -0.83 -4.80 117.98 108.44 1dx5 s PHE 181 Ca 0.12 -0.42 0.09 0.00 -0.05 0.00 0.00 56.93 56.67 1dx5 s PHE 181 Cb 0.08 0.06 -0.04 0.00 -0.63 0.00 0.00 43.02 42.49 1dx5 s PHE 181 CO -0.07 -0.61 -0.23 0.00 -0.05 0.00 0.00 175.22 174.26 1dx5 s ALA 183 N -1.24 0.90 0.00 0.00 0.00 -0.39 -1.77 121.76 119.26 1dx5 s ALA 183 Ca 0.11 -1.35 0.00 0.00 0.00 0.00 0.00 51.96 50.72 1dx5 s ALA 183 Cb -0.09 0.28 0.00 0.00 0.00 0.00 0.00 23.12 23.30 1dx5 s ALA 183 CO 0.05 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 175.93 1dx5 n GLY 184 N -0.03 3.94 3.85 0.00 0.00 -0.10 -1.95 105.19 110.90 1dx5 n GLY 184 Ca -0.12 -1.68 -0.32 0.00 0.00 0.00 0.00 46.02 43.91 1dx5 n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1dx5 s TYR 184 N -2.33 3.47 0.44 1.61 2.02 -1.26 -4.55 117.35 116.75 1dx5 s TYR 184 Ca 0.00 1.43 -0.04 0.00 -0.37 0.00 0.00 57.07 58.09 1dx5 s TYR 184 Cb 0.00 -2.77 -0.04 0.00 -0.40 0.00 0.00 41.96 38.75 1dx5 s TYR 184 CO 0.00 -0.39 0.71 0.15 -1.57 0.00 0.00 175.55 174.45 1dx5 s LYS 185 N -4.18 3.54 0.32 -0.62 1.02 -1.26 -4.87 119.74 113.68 1dx5 s LYS 185 Ca 0.58 0.05 0.06 0.00 0.02 0.00 0.00 55.97 56.68 1dx5 s LYS 185 Cb -0.10 -2.47 0.73 0.00 -0.52 0.00 0.00 37.83 35.47 1dx5 s LYS 185 CO 0.34 -0.09 1.82 -1.35 -0.92 0.00 0.00 175.35 175.15 1dx5 h PRO 186 N 0.45 0.77 0.00 -1.68 0.11 -1.96 -1.27 132.00 128.42 1dx5 h PRO 186 Ca -0.48 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1dx5 h PRO 186 Cb 1.21 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1dx5 h PRO 186 CO 0.62 0.51 0.00 -0.25 -0.21 0.00 0.00 178.00 178.67 1dx5 n ASP 186 N -4.65 0.00 0.15 -2.05 9.92 -1.26 -3.00 116.55 115.65 1dx5 n ASP 186 Ca 0.20 -0.05 0.12 0.00 -0.53 0.00 0.00 54.79 54.53 1dx5 n ASP 186 Cb 0.50 -0.29 0.13 0.00 -0.64 0.00 0.00 41.12 40.82 1dx5 n ASP 186 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 1dx5 h GLU 186 N 0.00 0.00 0.00 -1.24 5.08 -1.61 -3.47 114.58 113.34 1dx5 h GLU 186 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1dx5 h GLU 186 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1dx5 h GLU 186 CO 0.00 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 1dx5 n GLY 186 N 1.18 1.17 3.76 -3.84 0.00 -1.16 -4.94 105.19 101.36 1dx5 n GLY 186 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 1dx5 n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dx5 s LYS 186 N 0.00 3.09 0.00 1.61 1.02 -1.26 -5.04 119.74 119.16 1dx5 s LYS 186 Ca 0.00 1.79 0.00 0.00 0.02 0.00 0.00 55.97 57.78 1dx5 s LYS 186 Cb 0.00 -1.97 0.00 0.00 -0.52 0.00 0.00 37.83 35.34 1dx5 s LYS 186 CO 0.00 -1.10 0.00 2.89 -0.92 0.00 0.00 175.35 176.22 1dx5 n ARG 187 N -1.46 0.44 0.00 1.68 1.85 -1.26 -4.69 116.66 113.21 1dx5 n ARG 187 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.98 1dx5 n ARG 187 Cb 0.50 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.91 1dx5 n ARG 187 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1dx5 n GLY 188 N 1.08 4.24 3.60 2.89 0.00 -1.26 -4.90 105.19 110.83 1dx5 n GLY 188 Ca 0.00 -1.52 0.01 0.00 0.00 0.00 0.00 46.02 44.50 1dx5 n GLY 188 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1dx5 s ASP 189 N 0.00 -0.01 0.68 1.61 2.15 -0.98 -4.64 116.67 115.48 1dx5 s ASP 189 Ca 0.00 -0.01 -0.05 0.00 0.43 0.00 0.00 52.55 52.92 1dx5 s ASP 189 Cb 0.00 0.01 0.06 0.00 -0.30 0.00 0.00 42.92 42.69 1dx5 s ASP 189 CO 0.00 -0.03 0.97 0.00 -0.17 0.00 0.00 175.17 175.95 1dx5 s ALA 190 N -2.04 3.29 0.17 3.66 0.00 -1.26 -0.24 121.76 125.34 1dx5 s ALA 190 Ca 0.13 -0.99 -0.05 0.00 0.00 0.00 0.00 51.96 51.05 1dx5 s ALA 190 Cb 0.03 -2.51 0.02 0.00 0.00 0.00 0.00 23.12 20.66 1dx5 s ALA 190 CO -0.04 -1.20 0.31 0.00 0.00 0.00 0.00 175.76 174.83 1dx5 n GLU 192 N -0.24 1.32 0.00 0.00 2.13 -1.26 -1.11 120.64 121.47 1dx5 n GLU 192 Ca -0.03 0.48 0.00 0.00 0.66 0.00 0.00 57.16 58.27 1dx5 n GLU 192 Cb 0.26 -2.15 0.00 0.00 0.27 0.00 0.00 31.44 29.82 1dx5 n GLU 192 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1dx5 n GLY 193 N 3.09 0.99 0.09 8.31 0.00 -1.26 -0.32 105.19 116.09 1dx5 n GLY 193 Ca 0.20 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.34 1dx5 n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1dx5 h ASP 194 N 0.00 0.00 -2.57 1.61 3.32 -1.47 -3.30 116.42 114.00 1dx5 h ASP 194 Ca 0.00 -0.11 -0.60 0.00 0.02 0.00 0.00 57.03 56.34 1dx5 h ASP 194 Cb 0.00 0.00 0.14 0.00 0.22 0.00 0.00 39.33 39.69 1dx5 h ASP 194 CO 0.00 0.06 -0.17 -1.20 -1.72 0.00 0.00 179.24 176.20 1dx5 n SER 195 N -2.41 -0.02 0.00 6.45 7.64 -1.26 -0.82 113.62 123.20 1dx5 n SER 195 Ca 0.02 0.97 0.00 0.00 1.01 0.00 0.00 58.87 60.87 1dx5 n SER 195 Cb 0.49 -1.20 0.00 0.00 -1.01 0.00 0.00 64.21 62.49 1dx5 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1dx5 n GLY 196 N 1.55 3.14 3.75 0.23 0.00 -0.63 0.38 105.19 113.61 1dx5 n GLY 196 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 1dx5 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1dx5 s GLY 197 N -1.68 2.65 0.21 -0.02 0.00 0.00 -2.84 107.32 105.65 1dx5 s GLY 197 Ca 0.00 0.95 -0.18 0.00 0.00 0.00 0.00 44.72 45.49 1dx5 s GLY 197 CO 0.00 1.33 0.69 2.56 0.00 0.00 0.00 173.10 177.68 1dx5 s PRO 198 N -3.45 4.17 -0.42 2.90 0.04 -1.26 -0.44 135.00 136.55 1dx5 s PRO 198 Ca 0.76 0.77 -0.09 0.00 0.04 0.00 0.00 61.00 62.48 1dx5 s PRO 198 Cb -0.29 -2.86 0.08 0.00 0.04 0.00 0.00 34.50 31.47 1dx5 s PRO 198 CO 0.34 0.40 0.27 0.12 0.04 0.00 0.00 177.00 178.17 1dx5 s PHE 199 N -1.54 3.34 0.23 0.56 2.19 -0.20 -3.62 117.98 118.93 1dx5 s PHE 199 Ca 0.43 -1.52 0.07 0.00 0.33 0.00 0.00 56.93 56.24 1dx5 s PHE 199 Cb -0.16 -2.98 -0.04 0.00 -1.31 0.00 0.00 43.02 38.53 1dx5 s PHE 199 CO 0.20 -0.85 0.14 0.14 1.83 0.00 0.00 175.22 176.69 1dx5 s VAL 200 N 1.43 4.26 -0.01 3.12 -7.23 0.13 -0.98 120.40 121.12 1dx5 s VAL 200 Ca 0.03 -1.42 0.00 0.00 -1.81 0.00 0.00 61.98 58.79 1dx5 s VAL 200 Cb -0.23 -3.26 0.02 0.00 0.56 0.00 0.00 36.38 33.46 1dx5 s VAL 200 CO 0.02 -0.29 0.01 -0.04 -0.31 0.00 0.00 175.10 174.49 1dx5 s MET 201 N -3.61 0.04 -0.28 4.82 -1.94 -0.30 0.57 119.30 118.59 1dx5 s MET 201 Ca 0.32 0.08 -0.19 0.00 -1.71 0.00 0.00 55.69 54.19 1dx5 s MET 201 Cb -0.08 -0.18 -0.02 0.00 2.01 0.00 0.00 34.83 36.56 1dx5 s MET 201 CO 0.23 -0.08 0.59 0.21 -0.01 0.00 0.00 175.02 175.96 1dx5 s LYS 202 N 0.58 3.98 0.06 2.03 2.20 -1.26 -0.75 119.74 126.57 1dx5 s LYS 202 Ca -0.05 0.33 -0.31 0.00 -0.36 0.00 0.00 55.97 55.59 1dx5 s LYS 202 Cb -0.07 -3.69 -0.08 0.00 -1.51 0.00 0.00 37.83 32.47 1dx5 s LYS 202 CO -0.02 -0.48 1.66 0.45 -0.36 0.00 0.00 175.35 176.61 1dx5 s SER 203 N 1.58 6.61 0.00 1.43 0.15 0.11 -4.88 113.70 118.70 1dx5 s SER 203 Ca 0.24 2.47 0.22 0.00 0.70 0.00 0.00 55.95 59.58 1dx5 s SER 203 Cb -0.15 -2.56 1.04 0.00 -1.71 0.00 0.00 66.02 62.63 1dx5 s SER 203 CO 0.10 -0.90 1.73 -0.81 1.20 0.00 0.00 173.24 174.56 1dx5 n PRO 204 N 5.82 0.14 -0.07 5.44 -0.04 -1.26 -0.81 135.00 144.21 1dx5 n PRO 204 Ca 0.16 0.10 -0.09 0.00 -0.04 0.00 0.00 63.50 63.63 1dx5 n PRO 204 Cb 0.41 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.31 1dx5 n PRO 204 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1dx5 h PHE 204 N 0.00 0.00 -0.15 0.54 0.04 -1.97 -3.42 116.94 111.98 1dx5 h PHE 204 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1dx5 h PHE 204 Cb 0.31 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.46 1dx5 h PHE 204 CO 0.00 0.53 0.00 0.27 -0.60 0.00 0.00 178.31 178.51 1dx5 n ASN 204 N -4.61 2.28 -0.56 2.17 2.04 -1.24 -5.00 115.26 110.33 1dx5 n ASN 204 Ca -0.12 -1.79 -0.07 0.00 -0.44 0.00 0.00 54.58 52.15 1dx5 n ASN 204 Cb 0.34 -0.10 -0.03 0.00 -2.53 0.00 0.00 39.78 37.46 1dx5 n ASN 204 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1dx5 n ASN 205 N 0.20 -5.47 -4.90 0.53 4.13 0.01 -5.00 115.26 104.75 1dx5 n ASN 205 Ca 0.06 0.18 -0.30 0.00 1.68 0.00 0.00 54.58 56.20 1dx5 n ASN 205 Cb 0.30 -3.61 -0.04 0.00 -1.54 0.00 0.00 39.78 34.89 1dx5 n ASN 205 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1dx5 s ARG 206 N -2.47 3.63 -0.04 3.52 0.52 -1.26 -4.75 118.95 118.11 1dx5 s ARG 206 Ca 0.00 -0.05 -0.17 0.00 -0.52 0.00 0.00 55.73 54.98 1dx5 s ARG 206 Cb 0.00 -2.75 -0.05 0.00 0.52 0.00 0.00 34.95 32.67 1dx5 s ARG 206 CO 0.00 0.35 0.47 -1.58 0.02 0.00 0.00 175.30 174.56 1dx5 s TRP 207 N -1.86 3.64 -0.05 -0.53 0.52 -1.26 -0.72 118.94 118.68 1dx5 s TRP 207 Ca 0.42 1.00 0.05 0.00 0.02 0.00 0.00 56.10 57.60 1dx5 s TRP 207 Cb -0.11 -2.46 -0.01 0.00 -1.15 0.00 0.00 33.47 29.74 1dx5 s TRP 207 CO 0.27 0.40 -0.21 0.71 0.02 0.00 0.00 176.95 178.14 1dx5 s TYR 208 N -0.26 2.09 -0.58 -1.98 1.51 0.07 -2.09 117.35 116.11 1dx5 s TYR 208 Ca 0.26 -0.60 -0.24 0.00 -1.01 0.00 0.00 57.07 55.47 1dx5 s TYR 208 Cb -0.16 -1.38 0.04 0.00 -0.11 0.00 0.00 41.96 40.35 1dx5 s TYR 208 CO 0.13 -0.19 0.98 -1.14 -1.11 0.00 0.00 175.55 174.23 1dx5 s GLN 209 N -0.09 3.31 0.14 -0.62 0.74 -0.01 -1.15 119.66 121.98 1dx5 s GLN 209 Ca -0.03 -0.29 0.16 0.00 0.05 0.00 0.00 55.36 55.25 1dx5 s GLN 209 Cb -0.13 -4.08 -0.07 0.00 1.10 0.00 0.00 33.01 29.84 1dx5 s GLN 209 CO 0.03 -1.58 1.04 0.52 -0.55 0.00 0.00 175.29 174.74 1dx5 h MET 210 N 9.40 0.00 -3.90 1.67 2.86 -1.39 -3.39 114.93 120.18 1dx5 h MET 210 Ca -0.26 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.26 1dx5 h MET 210 Cb 1.07 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.63 1dx5 h MET 210 CO 1.12 0.36 -0.24 0.20 1.06 0.00 0.00 176.91 179.40 1dx5 s GLY 211 N -4.67 0.80 -0.06 8.32 0.00 -1.01 -1.83 107.32 108.87 1dx5 s GLY 211 Ca -0.01 -1.11 0.04 0.00 0.00 0.00 0.00 44.72 43.65 1dx5 s GLY 211 CO 0.79 -0.83 -0.19 -0.42 0.00 0.00 0.00 173.10 172.45 1dx5 s ILE 212 N -4.00 1.61 -0.07 0.90 1.01 -0.55 -1.03 121.20 119.07 1dx5 s ILE 212 Ca 0.27 -0.80 -0.29 0.00 0.00 0.00 0.00 60.65 59.82 1dx5 s ILE 212 Cb 0.01 -1.39 -0.07 0.00 0.01 0.00 0.00 42.46 41.03 1dx5 s ILE 212 CO 0.10 0.46 1.96 -0.69 0.00 0.00 0.00 174.94 176.77 1dx5 s VAL 213 N 0.11 3.16 -0.01 2.92 1.01 0.42 -0.58 120.40 127.43 1dx5 s VAL 213 Ca -0.07 0.19 -0.06 0.00 0.00 0.00 0.00 61.98 62.04 1dx5 s VAL 213 Cb -0.13 -3.15 -0.02 0.00 0.00 0.00 0.00 36.38 33.08 1dx5 s VAL 213 CO 0.04 -0.05 -0.12 -0.24 0.00 0.00 0.00 175.10 174.73 1dx5 n SER 214 N 8.67 1.20 -3.50 3.32 2.88 -0.92 -1.61 113.62 123.66 1dx5 n SER 214 Ca 0.22 0.18 -0.08 0.00 -1.33 0.00 0.00 58.87 57.86 1dx5 n SER 214 Cb 0.43 -0.45 -0.01 0.00 -0.75 0.00 0.00 64.21 63.43 1dx5 n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1dx5 s TRP 215 N -2.13 -0.00 0.04 0.66 1.48 -0.87 -4.95 118.94 113.16 1dx5 s TRP 215 Ca -0.10 -0.53 -0.14 0.00 -1.06 0.00 0.00 56.10 54.28 1dx5 s TRP 215 Cb 0.01 0.71 0.05 0.00 -1.16 0.00 0.00 33.47 33.08 1dx5 s TRP 215 CO 0.14 -1.35 0.63 0.41 -4.06 0.00 0.00 176.95 172.72 1dx5 n GLY 216 N -0.49 0.65 2.82 3.67 0.00 -1.26 -0.32 105.19 110.27 1dx5 n GLY 216 Ca -0.05 -0.99 -0.30 0.00 0.00 0.00 0.00 46.02 44.68 1dx5 n GLY 216 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dx5 s GLU 217 N -2.02 1.01 2.45 1.61 2.02 -1.26 -5.03 118.70 117.48 1dx5 s GLU 217 Ca 0.14 -1.01 0.00 0.00 0.02 0.00 0.00 54.97 54.12 1dx5 s GLU 217 Cb -0.01 -2.30 0.00 0.00 0.10 0.00 0.00 34.13 31.92 1dx5 s GLU 217 CO 0.01 -0.81 0.00 0.41 0.02 0.00 0.00 175.26 174.89 1dx5 n GLY 219 N 4.78 -0.73 3.14 -1.39 0.00 -1.26 -4.79 105.19 104.95 1dx5 n GLY 219 Ca -0.05 -1.15 -0.11 0.00 0.00 0.00 0.00 46.02 44.70 1dx5 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dx5 n ASP 221 N 4.91 -5.98 -4.89 0.00 2.03 -1.26 -4.54 116.55 106.81 1dx5 n ASP 221 Ca -0.14 -0.46 -0.29 0.00 0.52 0.00 0.00 54.79 54.42 1dx5 n ASP 221 Cb 0.51 -4.77 -0.01 0.00 -0.72 0.00 0.00 41.12 36.13 1dx5 n ASP 221 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1dx5 s ARG 221 N -6.11 3.63 0.19 -0.67 0.52 -1.26 -4.93 118.95 110.32 1dx5 s ARG 221 Ca 0.48 0.35 -0.30 0.00 -0.52 0.00 0.00 55.73 55.74 1dx5 s ARG 221 Cb -0.22 -2.35 -0.08 0.00 0.52 0.00 0.00 34.95 32.82 1dx5 s ARG 221 CO 0.60 -0.18 1.14 -0.51 0.02 0.00 0.00 175.30 176.37 1dx5 s ASP 222 N -3.77 7.18 0.00 0.23 1.01 -1.26 -2.74 116.67 117.32 1dx5 s ASP 222 Ca 0.49 2.17 0.00 0.00 0.71 0.00 0.00 52.55 55.92 1dx5 s ASP 222 Cb -0.10 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.22 1dx5 s ASP 222 CO 0.41 -0.29 0.00 0.61 0.21 0.00 0.00 175.17 176.11 1dx5 n GLY 223 N 2.05 0.95 3.55 0.21 0.00 -1.26 -5.02 105.19 105.68 1dx5 n GLY 223 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 1dx5 n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dx5 s LYS 224 N -0.05 2.06 0.03 1.61 -0.14 -1.11 -4.68 119.74 117.46 1dx5 s LYS 224 Ca 0.00 -1.05 0.03 0.00 -1.36 0.00 0.00 55.97 53.58 1dx5 s LYS 224 Cb 0.00 -2.26 -0.02 0.00 -1.68 0.00 0.00 37.83 33.87 1dx5 s LYS 224 CO 0.00 0.50 -0.08 0.71 -0.76 0.00 0.00 175.35 175.72 1dx5 s TYR 225 N -1.19 0.73 0.30 3.18 2.02 -1.26 -4.69 117.35 116.45 1dx5 s TYR 225 Ca 0.20 -0.34 -0.29 0.00 -0.37 0.00 0.00 57.07 56.28 1dx5 s TYR 225 Cb -0.11 -0.44 -0.10 0.00 -0.40 0.00 0.00 41.96 40.91 1dx5 s TYR 225 CO 0.13 -0.03 1.12 0.20 -1.57 0.00 0.00 175.55 175.39 1dx5 s GLY 226 N -1.03 3.02 -0.09 0.71 0.00 -0.82 -4.77 107.32 104.34 1dx5 s GLY 226 Ca -0.04 0.92 -0.02 0.00 0.00 0.00 0.00 44.72 45.58 1dx5 s GLY 226 CO 0.00 1.51 0.01 -1.36 0.00 0.00 0.00 173.10 173.26 1dx5 s PHE 227 N -1.22 3.20 0.06 1.90 0.40 0.57 -1.26 117.98 121.63 1dx5 s PHE 227 Ca 0.47 0.22 0.07 0.00 -0.60 0.00 0.00 56.93 57.09 1dx5 s PHE 227 Cb -0.32 -1.80 -0.03 0.00 0.51 0.00 0.00 43.02 41.38 1dx5 s PHE 227 CO 0.41 0.49 -0.20 0.71 0.70 0.00 0.00 175.22 177.33 1dx5 s TYR 228 N -0.89 1.71 -0.05 0.36 1.51 0.10 -2.05 117.35 118.05 1dx5 s TYR 228 Ca 0.13 -0.38 -0.30 0.00 -1.01 0.00 0.00 57.07 55.51 1dx5 s TYR 228 Cb -0.11 -1.00 -0.04 0.00 -0.11 0.00 0.00 41.96 40.70 1dx5 s TYR 228 CO 0.02 0.11 1.29 0.99 -1.11 0.00 0.00 175.55 176.85 1dx5 s THR 229 N -0.89 4.05 -0.54 -0.71 2.01 0.25 -1.96 115.64 117.86 1dx5 s THR 229 Ca 0.06 1.39 -0.27 0.00 0.31 0.00 0.00 61.69 63.17 1dx5 s THR 229 Cb -0.09 -3.89 -0.00 0.00 0.01 0.00 0.00 72.50 68.53 1dx5 s THR 229 CO 0.02 -0.02 1.62 -2.28 -0.69 0.00 0.00 174.62 173.27 1dx5 s HIS 230 N 2.46 2.01 0.12 4.92 2.46 -0.12 -1.48 115.29 125.65 1dx5 s HIS 230 Ca 0.59 0.58 -0.19 0.00 0.47 0.00 0.00 55.06 56.51 1dx5 s HIS 230 Cb -0.27 -4.26 -0.05 0.00 -0.13 0.00 0.00 32.58 27.87 1dx5 s HIS 230 CO 0.23 -2.25 1.73 0.28 -2.47 0.00 0.00 174.74 172.25 1dx5 h VAL 231 N 6.60 1.11 -0.93 0.89 2.07 -1.66 -3.10 116.25 121.23 1dx5 h VAL 231 Ca -0.28 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 1dx5 h VAL 231 Cb 1.13 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 31.69 1dx5 h VAL 231 CO 1.17 0.11 0.55 0.15 0.02 0.00 0.00 177.57 179.57 1dx5 h PHE 232 N 0.31 1.24 -0.14 1.57 3.57 -1.87 -1.24 116.94 120.38 1dx5 h PHE 232 Ca 0.09 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.60 1dx5 h PHE 232 Cb 0.05 -0.40 -0.01 0.00 2.79 0.00 0.00 35.95 38.38 1dx5 h PHE 232 CO -0.04 0.83 0.09 0.00 -2.23 0.00 0.00 178.31 176.97 1dx5 h ARG 233 N 1.29 0.12 -0.53 1.11 2.47 -1.90 -1.91 114.38 115.03 1dx5 h ARG 233 Ca 0.33 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 59.05 1dx5 h ARG 233 Cb -0.04 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.26 1dx5 h ARG 233 CO -0.06 0.08 0.00 1.28 0.56 0.00 0.00 179.97 181.83 1dx5 n LEU 234 N -4.51 3.57 0.28 3.04 7.99 -0.90 -4.61 117.00 121.86 1dx5 n LEU 234 Ca -0.00 -2.09 0.14 0.00 -0.01 0.00 0.00 56.01 54.04 1dx5 n LEU 234 Cb 0.13 -0.38 0.83 0.00 -0.11 0.00 0.00 43.42 43.89 1dx5 n LEU 234 CO 0.34 0.84 1.06 0.50 -1.51 0.00 0.00 177.39 178.63 1dx5 h LYS 235 N 3.13 0.00 -0.42 3.23 3.64 -0.40 -2.39 116.57 123.35 1dx5 h LYS 235 Ca 0.00 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 1dx5 h LYS 235 Cb 0.94 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.74 1dx5 h LYS 235 CO 0.03 0.05 -0.03 -0.22 -2.27 0.00 0.00 179.45 177.02 1dx5 h LYS 236 N 0.00 0.77 -0.39 1.90 3.64 -1.81 -0.91 116.57 119.76 1dx5 h LYS 236 Ca -0.00 -0.26 -0.14 0.00 -1.27 0.00 0.00 60.65 58.98 1dx5 h LYS 236 Cb 0.13 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 1dx5 h LYS 236 CO 0.01 0.85 -0.32 2.35 -2.27 0.00 0.00 179.45 180.07 1dx5 h TRP 237 N 0.60 1.02 0.25 1.91 7.01 -1.80 -0.87 115.95 124.08 1dx5 h TRP 237 Ca 0.12 -0.28 -0.00 0.00 2.11 0.00 0.00 58.89 60.84 1dx5 h TRP 237 Cb 0.52 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 27.35 1dx5 h TRP 237 CO 0.04 1.07 -0.20 0.82 -2.79 0.00 0.00 178.44 177.38 1dx5 h ILE 238 N 0.73 0.56 0.00 2.65 2.04 -1.23 -1.89 117.51 120.37 1dx5 h ILE 238 Ca 0.08 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.91 1dx5 h ILE 238 Cb 0.88 0.56 -0.00 0.00 -0.74 0.00 0.00 36.82 37.52 1dx5 h ILE 238 CO 0.08 0.00 -0.14 1.56 0.00 0.00 0.00 178.15 179.65 1dx5 h GLN 239 N -0.47 0.00 0.01 2.37 4.20 -1.12 -2.58 115.11 117.52 1dx5 h GLN 239 Ca -0.01 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 1dx5 h GLN 239 Cb 0.42 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.20 1dx5 h GLN 239 CO -0.02 0.14 -0.00 -0.22 -0.67 0.00 0.00 178.83 178.06 1dx5 h LYS 240 N 0.00 -0.01 -0.09 1.46 3.64 -0.60 -2.18 116.57 118.80 1dx5 h LYS 240 Ca -0.00 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.25 1dx5 h LYS 240 Cb 0.25 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 1dx5 h LYS 240 CO 0.02 0.40 -0.53 -0.39 -2.27 0.00 0.00 179.45 176.67 1dx5 h VAL 241 N -0.43 1.36 -0.43 2.00 -1.51 -1.30 -1.70 116.25 114.24 1dx5 h VAL 241 Ca -0.00 -1.81 -0.13 0.00 -1.23 0.00 0.00 66.70 63.53 1dx5 h VAL 241 Cb 0.42 1.88 -0.01 0.00 -2.13 0.00 0.00 31.29 31.44 1dx5 h VAL 241 CO 0.00 0.54 -0.23 0.40 -1.23 0.00 0.00 177.57 177.05 1dx5 h ILE 242 N 0.19 1.27 -0.12 7.19 2.04 -1.51 0.53 117.51 127.11 1dx5 h ILE 242 Ca 0.00 -1.38 -0.14 0.00 1.00 0.00 0.00 64.86 64.35 1dx5 h ILE 242 Cb 1.00 1.18 0.01 0.00 -0.74 0.00 0.00 36.82 38.27 1dx5 h ILE 242 CO 0.08 0.47 -0.46 0.44 0.00 0.00 0.00 178.15 178.68 1dx5 h ASP 243 N 0.77 0.62 -0.01 1.72 3.32 -1.32 -2.59 116.42 118.93 1dx5 h ASP 243 Ca 0.10 -0.62 -0.00 0.00 0.02 0.00 0.00 57.03 56.53 1dx5 h ASP 243 Cb 0.78 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 40.15 1dx5 h ASP 243 CO 0.06 1.13 -0.00 -0.61 -1.72 0.00 0.00 179.24 178.10 1dx5 h GLN 244 N 0.14 0.01 -0.83 3.56 4.15 -1.28 -3.25 115.11 117.61 1dx5 h GLN 244 Ca -0.02 -0.01 -0.09 0.00 0.77 0.00 0.00 58.65 59.30 1dx5 h GLN 244 Cb 1.09 -0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.73 1dx5 h GLN 244 CO 0.10 0.37 0.11 1.19 -1.93 0.00 0.00 178.83 178.67 1dx5 n PHE 245 N -4.91 1.37 -0.16 3.99 3.72 0.17 -5.01 117.46 116.65 1dx5 n PHE 245 Ca -0.08 -0.67 0.00 0.00 -0.05 0.00 0.00 57.45 56.65 1dx5 n PHE 245 Cb 0.20 -0.43 0.00 0.00 -0.94 0.00 0.00 39.48 38.30 1dx5 n PHE 245 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1dx5 n GLY 246 N 0.12 -3.36 0.26 1.37 0.00 -0.99 -4.97 105.19 97.63 1dx5 n GLY 246 Ca 0.21 -0.99 0.15 0.00 0.00 0.00 0.00 46.02 45.39 1dx5 n GLY 246 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11