#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 5.30 -1.47 1.39 1.01 0.77 -4.27 120.40 123.14 1dx5 s VAL 17 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 61.98 62.49 1dx5 s VAL 17 Cb 0.00 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.78 1dx5 s VAL 17 CO 0.00 0.46 0.00 -0.62 0.00 0.00 0.00 175.10 174.94 1dx5 n GLU 18 N 3.05 -1.25 -0.12 2.72 -0.58 -1.26 -1.82 120.64 121.38 1dx5 n GLU 18 Ca -0.14 0.86 0.00 0.00 -0.42 0.00 0.00 57.16 57.46 1dx5 n GLU 18 Cb 0.52 -5.20 0.00 0.00 -0.57 0.00 0.00 31.44 26.19 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 -1.01 1.56 3.44 0.62 0.00 -1.26 -4.72 105.19 103.82 1dx5 n GLY 19 Ca -0.18 -2.00 -0.10 0.00 0.00 0.00 0.00 46.02 43.74 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 -0.02 0.17 1.61 1.04 -0.48 -4.91 113.70 110.12 1dx5 s SER 20 Ca 0.00 -0.96 -0.32 0.00 0.48 0.00 0.00 55.95 55.15 1dx5 s SER 20 Cb 0.00 0.50 -0.11 0.00 0.10 0.00 0.00 66.02 66.51 1dx5 s SER 20 CO 0.00 -1.00 1.72 -1.81 0.98 0.00 0.00 173.24 173.13 1dx5 s ASP 21 N -3.02 6.45 0.53 7.02 1.11 -1.26 -0.78 116.67 126.72 1dx5 s ASP 21 Ca 0.23 2.76 -0.19 0.00 0.18 0.00 0.00 52.55 55.53 1dx5 s ASP 21 Cb 0.02 -2.59 -0.06 0.00 1.07 0.00 0.00 42.92 41.36 1dx5 s ASP 21 CO 0.06 -0.95 1.07 0.00 1.18 0.00 0.00 175.17 176.53 1dx5 s ALA 22 N 1.73 2.78 0.48 5.23 0.00 0.05 -4.82 121.76 127.20 1dx5 s ALA 22 Ca 0.76 0.64 -0.10 0.00 0.00 0.00 0.00 51.96 53.25 1dx5 s ALA 22 Cb -0.47 -3.29 -0.05 0.00 0.00 0.00 0.00 23.12 19.31 1dx5 s ALA 22 CO 0.33 -0.58 0.86 -1.21 0.00 0.00 0.00 175.76 175.16 1dx5 s GLU 23 N -3.42 3.71 0.18 0.00 2.02 -1.26 -4.90 118.70 115.03 1dx5 s GLU 23 Ca 0.68 0.53 -0.33 0.00 0.02 0.00 0.00 54.97 55.88 1dx5 s GLU 23 Cb -0.19 -2.29 -0.12 0.00 0.10 0.00 0.00 34.13 31.63 1dx5 s GLU 23 CO 0.26 -0.22 1.69 -0.89 0.02 0.00 0.00 175.26 176.12 1dx5 n ILE 24 N -1.86 0.06 -1.05 -1.63 2.08 -1.26 -1.70 119.36 113.99 1dx5 n ILE 24 Ca 0.03 -0.01 -0.02 0.00 0.56 0.00 0.00 62.75 63.32 1dx5 n ILE 24 Cb 0.54 -1.85 -0.01 0.00 -0.75 0.00 0.00 39.64 37.58 1dx5 n ILE 24 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1dx5 n GLY 25 N 3.83 0.47 0.16 7.39 0.00 -1.26 -4.91 105.19 110.87 1dx5 n GLY 25 Ca 0.17 -0.17 0.01 0.00 0.00 0.00 0.00 46.02 46.03 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 0.51 0.00 -2.07 1.61 -1.53 -1.69 -3.36 114.93 108.40 1dx5 h MET 26 Ca -0.03 0.00 -0.57 0.00 -3.44 0.00 0.00 59.70 55.66 1dx5 h MET 26 Cb 0.37 0.00 -0.39 0.00 -0.55 0.00 0.00 31.60 31.03 1dx5 h MET 26 CO 0.05 0.52 -1.08 0.43 0.14 0.00 0.00 176.91 176.97 1dx5 n SER 27 N -3.71 0.08 0.16 1.39 7.64 -1.26 -4.98 113.62 112.93 1dx5 n SER 27 Ca -0.01 -2.64 0.11 0.00 1.01 0.00 0.00 58.87 57.34 1dx5 n SER 27 Cb 0.57 -0.62 0.56 0.00 -1.01 0.00 0.00 64.21 63.71 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 1.68 0.14 0.04 1.43 -0.02 -1.26 -1.07 135.00 135.94 1dx5 n PRO 28 Ca 0.23 0.61 0.12 0.00 -2.02 0.00 0.00 63.50 62.44 1dx5 n PRO 28 Cb 0.52 -1.94 0.15 0.00 -0.02 0.00 0.00 33.50 32.21 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 -2.23 0.35 -1.77 6.00 2.14 -0.98 -2.17 117.44 118.77 1dx5 n TRP 29 Ca -0.01 0.10 -0.42 0.00 2.07 0.00 0.00 57.50 59.24 1dx5 n TRP 29 Cb 0.05 -0.50 -0.03 0.00 -0.81 0.00 0.00 31.31 30.02 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 -3.13 4.15 0.06 -2.67 2.00 -0.23 -0.85 119.66 118.99 1dx5 s GLN 30 Ca 0.07 2.52 0.08 0.00 -2.00 0.00 0.00 55.36 56.03 1dx5 s GLN 30 Cb 0.15 -3.66 -0.03 0.00 0.80 0.00 0.00 33.01 30.26 1dx5 s GLN 30 CO 0.74 -0.83 -0.19 0.08 -0.50 0.00 0.00 175.29 174.58 1dx5 s VAL 31 N 2.92 2.71 -0.23 1.34 1.01 -0.20 -4.11 120.40 123.85 1dx5 s VAL 31 Ca 0.80 -1.31 -0.03 0.00 0.00 0.00 0.00 61.98 61.43 1dx5 s VAL 31 Cb -0.44 -2.16 0.00 0.00 0.00 0.00 0.00 36.38 33.78 1dx5 s VAL 31 CO 0.36 0.27 -0.05 -0.32 0.00 0.00 0.00 175.10 175.36 1dx5 s MET 32 N -1.62 3.24 -0.26 2.72 1.75 -0.40 -1.13 119.30 123.60 1dx5 s MET 32 Ca 0.15 -0.72 -0.22 0.00 -1.25 0.00 0.00 55.69 53.65 1dx5 s MET 32 Cb -0.10 -3.01 -0.01 0.00 2.84 0.00 0.00 34.83 34.55 1dx5 s MET 32 CO 0.06 -0.25 0.72 -0.51 -0.65 0.00 0.00 175.02 174.39 1dx5 s LEU 33 N 1.44 4.07 -0.18 4.11 1.43 0.76 -1.17 118.68 129.14 1dx5 s LEU 33 Ca 0.05 0.82 -0.02 0.00 -1.03 0.00 0.00 54.13 53.95 1dx5 s LEU 33 Cb -0.15 -3.00 -0.01 0.00 0.03 0.00 0.00 46.19 43.06 1dx5 s LEU 33 CO -0.04 -0.45 -0.09 0.12 0.23 0.00 0.00 176.35 176.12 1dx5 s PHE 34 N 2.68 2.89 0.12 0.29 5.36 0.34 -1.04 117.98 128.61 1dx5 s PHE 34 Ca 0.30 -0.92 -0.30 0.00 -0.96 0.00 0.00 56.93 55.05 1dx5 s PHE 34 Cb -0.15 -1.99 -0.06 0.00 -0.34 0.00 0.00 43.02 40.48 1dx5 s PHE 34 CO 0.08 -0.46 1.05 0.50 -1.46 0.00 0.00 175.22 174.94 1dx5 s ARG 35 N 1.04 4.60 0.08 10.12 3.52 0.88 -0.32 118.95 138.88 1dx5 s ARG 35 Ca -0.00 1.60 -0.14 0.00 -0.13 0.00 0.00 55.73 57.06 1dx5 s ARG 35 Cb -0.15 -3.34 -0.21 0.00 -1.56 0.00 0.00 34.95 29.69 1dx5 s ARG 35 CO -0.01 0.06 1.22 0.87 -0.81 0.00 0.00 175.30 176.63 1dx5 h LYS 36 N 5.71 0.74 -2.87 5.12 1.57 -1.66 -2.32 116.57 122.85 1dx5 h LYS 36 Ca -0.43 -0.73 -0.48 0.00 -1.87 0.00 0.00 60.65 57.14 1dx5 h LYS 36 Cb 1.21 0.19 -0.40 0.00 0.08 0.00 0.00 32.23 33.32 1dx5 h LYS 36 CO 0.74 1.31 -0.75 0.45 -0.57 0.00 0.00 179.45 180.62 1dx5 s SER 36 N -7.24 2.84 0.86 0.86 0.15 -1.26 -3.05 113.70 106.85 1dx5 s SER 36 Ca -0.10 -0.92 -0.12 0.00 0.70 0.00 0.00 55.95 55.52 1dx5 s SER 36 Cb 0.07 -0.24 0.11 0.00 -1.71 0.00 0.00 66.02 64.25 1dx5 s SER 36 CO 0.92 -0.39 1.10 -2.16 1.20 0.00 0.00 173.24 173.90 1dx5 s PRO 37 N 2.14 1.59 -0.60 5.44 0.04 -1.26 -5.04 135.00 137.30 1dx5 s PRO 37 Ca 0.06 0.67 -0.27 0.00 0.04 0.00 0.00 61.00 61.49 1dx5 s PRO 37 Cb -0.16 -1.86 -0.00 0.00 0.04 0.00 0.00 34.50 32.52 1dx5 s PRO 37 CO -0.23 -1.97 1.63 -0.65 0.04 0.00 0.00 177.00 175.81 1dx5 s GLN 38 N -5.07 2.97 0.15 4.56 -1.52 -1.17 -4.62 119.66 114.96 1dx5 s GLN 38 Ca 0.62 0.47 -0.23 0.00 -1.95 0.00 0.00 55.36 54.27 1dx5 s GLN 38 Cb -0.16 -4.26 0.07 0.00 -0.22 0.00 0.00 33.01 28.43 1dx5 s GLN 38 CO 0.55 -2.34 0.65 -1.83 -0.25 0.00 0.00 175.29 172.07 1dx5 s GLU 39 N 6.28 1.28 0.21 2.91 -1.05 -0.87 -4.99 118.70 122.47 1dx5 s GLU 39 Ca 0.58 -0.51 -0.31 0.00 -0.15 0.00 0.00 54.97 54.58 1dx5 s GLU 39 Cb -0.12 0.57 -0.10 0.00 -0.44 0.00 0.00 34.13 34.04 1dx5 s GLU 39 CO 0.22 -0.57 1.50 -1.17 0.95 0.00 0.00 175.26 176.20 1dx5 s LEU 40 N -2.74 4.38 -0.23 1.83 2.96 -1.26 -0.08 118.68 123.52 1dx5 s LEU 40 Ca 0.03 2.65 -0.14 0.00 -0.22 0.00 0.00 54.13 56.44 1dx5 s LEU 40 Cb -0.02 -3.61 -0.10 0.00 0.50 0.00 0.00 46.19 42.97 1dx5 s LEU 40 CO -0.10 -0.77 -0.33 -0.11 -1.32 0.00 0.00 176.35 173.72 1dx5 n LEU 41 N 3.13 1.85 -3.81 -0.68 7.94 -0.21 -4.79 117.00 120.43 1dx5 n LEU 41 Ca 0.10 0.32 -0.01 0.00 -1.11 0.00 0.00 56.01 55.31 1dx5 n LEU 41 Cb 0.39 -0.75 0.00 0.00 0.53 0.00 0.00 43.42 43.60 1dx5 n LEU 41 CO 0.61 0.31 0.89 0.00 -1.11 0.00 0.00 177.39 178.09 1dx5 s GLY 43 N -3.25 1.77 0.19 0.00 0.00 0.88 -0.17 107.32 106.74 1dx5 s GLY 43 Ca 0.19 -1.87 -0.18 0.00 0.00 0.00 0.00 44.72 42.86 1dx5 s GLY 43 CO 0.02 -1.41 0.88 0.00 0.00 0.00 0.00 173.10 172.58 1dx5 n ALA 44 N -2.44 -2.25 -2.91 3.20 0.00 -0.28 -3.78 120.51 112.05 1dx5 n ALA 44 Ca 0.14 -0.94 -0.11 0.00 0.00 0.00 0.00 53.44 52.53 1dx5 n ALA 44 Cb 0.61 0.57 -0.12 0.00 0.00 0.00 0.00 19.45 20.51 1dx5 n ALA 44 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1dx5 s SER 45 N -3.11 0.45 -0.33 0.00 1.04 0.63 -1.03 113.70 111.35 1dx5 s SER 45 Ca 0.19 -0.42 -0.20 0.00 0.48 0.00 0.00 55.95 56.01 1dx5 s SER 45 Cb -0.03 0.05 -0.01 0.00 0.10 0.00 0.00 66.02 66.14 1dx5 s SER 45 CO 0.06 -0.20 0.59 -0.22 0.98 0.00 0.00 173.24 174.45 1dx5 s LEU 46 N -1.21 4.22 0.00 2.42 0.20 -0.03 0.12 118.68 124.39 1dx5 s LEU 46 Ca -0.11 0.23 0.14 0.00 0.69 0.00 0.00 54.13 55.09 1dx5 s LEU 46 Cb -0.08 -2.73 0.01 0.00 -0.43 0.00 0.00 46.19 42.96 1dx5 s LEU 46 CO -0.00 -0.50 0.81 2.30 -0.29 0.00 0.00 176.35 178.67 1dx5 n ILE 47 N 5.44 0.00 -3.86 6.68 -5.35 -0.88 -1.74 119.36 119.65 1dx5 n ILE 47 Ca -0.02 -0.37 -0.01 0.00 -0.27 0.00 0.00 62.75 62.07 1dx5 n ILE 47 Cb 0.49 1.19 0.01 0.00 -1.74 0.00 0.00 39.64 39.58 1dx5 n ILE 47 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1dx5 s SER 48 N -1.66 -0.02 0.00 7.28 1.04 -1.21 -4.77 113.70 114.36 1dx5 s SER 48 Ca 0.12 -0.47 0.19 0.00 0.48 0.00 0.00 55.95 56.27 1dx5 s SER 48 Cb 0.12 0.38 0.93 0.00 0.10 0.00 0.00 66.02 67.54 1dx5 s SER 48 CO 0.33 -0.74 1.57 -0.90 0.98 0.00 0.00 173.24 174.48 1dx5 n ASP 49 N -1.01 0.00 0.00 7.02 5.75 -1.26 -3.34 116.55 123.71 1dx5 n ASP 49 Ca -0.02 0.07 0.00 0.00 -0.01 0.00 0.00 54.79 54.82 1dx5 n ASP 49 Cb 0.60 -0.31 0.00 0.00 -1.03 0.00 0.00 41.12 40.38 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 -1.31 0.08 -4.81 0.11 0.63 -1.26 -0.07 116.66 110.03 1dx5 n ARG 50 Ca 0.08 -0.29 -0.25 0.00 -0.92 0.00 0.00 57.85 56.47 1dx5 n ARG 50 Cb 0.16 -0.55 -0.16 0.00 0.45 0.00 0.00 32.46 32.36 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 -0.05 1.58 -0.03 -0.14 0.52 -1.21 -0.64 118.94 118.97 1dx5 s TRP 51 Ca 0.00 -0.36 0.04 0.00 0.02 0.00 0.00 56.10 55.80 1dx5 s TRP 51 Cb 0.00 -1.04 -0.00 0.00 -1.15 0.00 0.00 33.47 31.28 1dx5 s TRP 51 CO 0.00 -0.08 -0.14 0.08 0.02 0.00 0.00 176.95 176.83 1dx5 s VAL 52 N -0.23 1.16 -0.09 4.03 1.01 -0.28 -2.08 120.40 123.92 1dx5 s VAL 52 Ca 0.03 -0.58 -0.01 0.00 0.00 0.00 0.00 61.98 61.41 1dx5 s VAL 52 Cb -0.08 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.27 1dx5 s VAL 52 CO 0.00 0.34 -0.03 -0.22 0.00 0.00 0.00 175.10 175.20 1dx5 s LEU 53 N -0.00 3.40 0.00 3.92 2.96 0.12 -0.68 118.68 128.40 1dx5 s LEU 53 Ca -0.01 0.06 -0.01 0.00 -0.22 0.00 0.00 54.13 53.94 1dx5 s LEU 53 Cb -0.09 -1.77 0.01 0.00 0.50 0.00 0.00 46.19 44.83 1dx5 s LEU 53 CO 0.01 0.35 0.18 1.07 -1.32 0.00 0.00 176.35 176.64 1dx5 n THR 54 N 2.33 0.00 -3.59 3.68 5.66 -0.53 -0.27 114.28 121.56 1dx5 n THR 54 Ca -0.18 -0.56 -0.38 0.00 -3.05 0.00 0.00 64.05 59.88 1dx5 n THR 54 Cb 0.53 0.36 -0.06 0.00 -1.55 0.00 0.00 70.33 69.62 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 -1.88 3.73 0.35 1.79 0.00 -1.26 -1.33 121.76 123.15 1dx5 s ALA 55 Ca 0.09 -0.35 0.04 0.00 0.00 0.00 0.00 51.96 51.75 1dx5 s ALA 55 Cb -0.01 -2.29 0.65 0.00 0.00 0.00 0.00 23.12 21.48 1dx5 s ALA 55 CO 0.07 0.46 1.94 0.00 0.00 0.00 0.00 175.76 178.22 1dx5 h ALA 56 N 5.04 1.47 0.00 0.00 0.00 -1.71 -2.92 119.26 121.13 1dx5 h ALA 56 Ca -0.51 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.26 1dx5 h ALA 56 Cb 1.22 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1dx5 h ALA 56 CO 0.62 0.40 0.00 1.12 0.00 0.00 0.00 179.25 181.40 1dx5 h HIS 57 N 0.60 0.00 0.00 0.00 2.07 -1.89 0.44 115.15 116.37 1dx5 h HIS 57 Ca 0.14 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.55 1dx5 h HIS 57 Cb 0.16 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.13 1dx5 h HIS 57 CO 0.01 0.00 -0.54 0.00 -3.07 0.00 0.00 177.93 174.33 1dx5 n LEU 59 N -3.78 1.59 -3.74 0.00 4.77 -0.74 -4.87 117.00 110.23 1dx5 n LEU 59 Ca -0.01 -0.06 -0.19 0.00 -0.03 0.00 0.00 56.01 55.72 1dx5 n LEU 59 Cb 0.57 -0.21 -0.17 0.00 -2.33 0.00 0.00 43.42 41.28 1dx5 n LEU 59 CO 0.40 0.65 -0.36 -0.22 -1.33 0.00 0.00 177.39 176.53 1dx5 s LEU 60 N -5.76 0.61 0.22 2.23 2.96 0.07 -1.08 118.68 117.94 1dx5 s LEU 60 Ca -0.19 0.02 -0.16 0.00 -0.22 0.00 0.00 54.13 53.58 1dx5 s LEU 60 Cb 0.06 -0.21 0.01 0.00 0.50 0.00 0.00 46.19 46.56 1dx5 s LEU 60 CO 0.58 -0.18 0.52 -0.47 -1.32 0.00 0.00 176.35 175.47 1dx5 s TYR 60 N 1.69 0.08 0.00 5.38 5.04 -0.75 -4.19 117.35 124.60 1dx5 s TYR 60 Ca -0.01 -0.45 0.00 0.00 -2.44 0.00 0.00 57.07 54.18 1dx5 s TYR 60 Cb -0.13 0.34 0.00 0.00 0.35 0.00 0.00 41.96 42.52 1dx5 s TYR 60 CO -0.03 -0.98 0.00 -2.30 -1.34 0.00 0.00 175.55 170.90 1dx5 n PRO 60 N -0.36 0.00 -0.60 4.97 -0.02 -1.26 -1.90 135.00 135.82 1dx5 n PRO 60 Ca -0.06 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.52 1dx5 n PRO 60 Cb 0.62 -0.01 0.36 0.00 -0.02 0.00 0.00 33.50 34.45 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 1.45 -3.13 6.00 8.01 -1.26 -4.93 117.44 123.58 1dx5 n TRP 60 Ca 0.00 -0.59 -0.23 0.00 -1.31 0.00 0.00 57.50 55.38 1dx5 n TRP 60 Cb 0.00 -0.23 0.03 0.00 -2.01 0.00 0.00 31.31 29.10 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 1.18 -5.44 -4.73 -0.99 9.92 -1.11 -4.96 116.55 110.42 1dx5 n ASP 60 Ca 0.26 -0.32 -0.39 0.00 -0.53 0.00 0.00 54.79 53.80 1dx5 n ASP 60 Cb 0.87 -4.41 -0.05 0.00 -0.64 0.00 0.00 41.12 36.88 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 -5.81 4.40 -0.43 -1.24 2.20 -0.80 -4.99 119.74 113.08 1dx5 s LYS 60 Ca 0.34 0.80 -0.00 0.00 -0.36 0.00 0.00 55.97 56.75 1dx5 s LYS 60 Cb -0.16 -3.41 0.20 0.00 -1.51 0.00 0.00 37.83 32.95 1dx5 s LYS 60 CO 0.42 0.18 0.91 1.21 -0.36 0.00 0.00 175.35 177.71 1dx5 s ASN 60 N 0.42 -0.86 0.05 1.43 2.47 -1.22 -1.80 114.94 115.42 1dx5 s ASN 60 Ca 0.34 -1.00 -0.28 0.00 0.42 0.00 0.00 52.86 52.35 1dx5 s ASN 60 Cb -0.18 1.12 -0.05 0.00 -1.45 0.00 0.00 41.25 40.70 1dx5 s ASN 60 CO 0.17 -0.03 0.88 -0.36 -3.72 0.00 0.00 177.10 174.04 1dx5 s PHE 60 N 0.98 3.73 0.50 0.43 0.08 -0.24 -5.03 117.98 118.42 1dx5 s PHE 60 Ca 0.26 1.62 0.07 0.00 0.12 0.00 0.00 56.93 59.01 1dx5 s PHE 60 Cb 0.06 -2.98 0.02 0.00 -0.57 0.00 0.00 43.02 39.56 1dx5 s PHE 60 CO -0.08 0.16 0.48 0.96 -0.10 0.00 0.00 175.22 176.64 1dx5 s ILE 60 N 0.32 2.19 0.28 0.64 -4.36 -1.26 -4.91 121.20 114.10 1dx5 s ILE 60 Ca 0.45 -1.31 0.02 0.00 -0.26 0.00 0.00 60.65 59.54 1dx5 s ILE 60 Cb -0.21 -2.51 0.28 0.00 1.25 0.00 0.00 42.46 41.27 1dx5 s ILE 60 CO 0.26 0.00 1.68 -0.33 0.24 0.00 0.00 174.94 176.79 1dx5 h GLU 61 N 0.74 0.32 -0.00 0.37 4.39 -1.94 -1.39 114.58 117.07 1dx5 h GLU 61 Ca -0.37 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.31 1dx5 h GLU 61 Cb 1.28 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.86 1dx5 h GLU 61 CO 0.53 0.21 -0.03 0.09 -1.16 0.00 0.00 179.01 178.66 1dx5 n ASN 62 N -5.11 0.09 0.06 1.42 3.02 -1.26 -3.52 115.26 109.95 1dx5 n ASN 62 Ca 0.20 -0.17 0.12 0.00 -0.03 0.00 0.00 54.58 54.71 1dx5 n ASN 62 Cb 0.63 -0.25 0.26 0.00 -0.61 0.00 0.00 39.78 39.80 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 -1.25 0.64 -4.39 6.41 8.00 -0.52 -4.94 116.55 120.50 1dx5 n ASP 63 Ca 0.14 0.18 -0.19 0.00 0.71 0.00 0.00 54.79 55.62 1dx5 n ASP 63 Cb 0.26 -0.04 -0.10 0.00 -0.02 0.00 0.00 41.12 41.21 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 -4.01 2.29 -0.03 0.64 1.43 -1.23 -1.82 118.68 115.95 1dx5 s LEU 64 Ca 0.08 -1.24 0.05 0.00 -1.03 0.00 0.00 54.13 51.99 1dx5 s LEU 64 Cb 0.14 -0.42 -0.01 0.00 0.03 0.00 0.00 46.19 45.94 1dx5 s LEU 64 CO 0.68 -0.47 -0.17 -0.76 0.23 0.00 0.00 176.35 175.85 1dx5 s LEU 65 N -3.39 1.97 -0.31 1.79 1.43 0.56 -4.76 118.68 115.97 1dx5 s LEU 65 Ca 0.30 -0.33 -0.11 0.00 -1.03 0.00 0.00 54.13 52.96 1dx5 s LEU 65 Cb 0.06 -0.94 -0.02 0.00 0.03 0.00 0.00 46.19 45.32 1dx5 s LEU 65 CO 0.11 0.18 0.18 -0.69 0.23 0.00 0.00 176.35 176.37 1dx5 s VAL 66 N -0.18 4.93 -0.31 -1.59 1.01 -1.07 -0.50 120.40 122.69 1dx5 s VAL 66 Ca 0.01 -0.22 -0.05 0.00 0.00 0.00 0.00 61.98 61.73 1dx5 s VAL 66 Cb -0.09 -3.47 0.03 0.00 0.00 0.00 0.00 36.38 32.85 1dx5 s VAL 66 CO 0.01 0.10 0.06 -0.13 0.00 0.00 0.00 175.10 175.13 1dx5 s ARG 67 N 1.68 2.70 0.10 2.72 0.52 -0.31 -0.55 118.95 125.80 1dx5 s ARG 67 Ca 0.06 -1.11 0.05 0.00 -0.52 0.00 0.00 55.73 54.21 1dx5 s ARG 67 Cb -0.17 -3.32 -0.04 0.00 0.52 0.00 0.00 34.95 31.94 1dx5 s ARG 67 CO 0.08 -0.58 0.01 0.42 0.02 0.00 0.00 175.30 175.25 1dx5 s ILE 68 N 1.38 4.02 -0.01 1.52 1.01 -0.01 -1.27 121.20 127.84 1dx5 s ILE 68 Ca -0.01 -1.02 0.00 0.00 0.00 0.00 0.00 60.65 59.61 1dx5 s ILE 68 Cb -0.19 -2.93 0.00 0.00 0.01 0.00 0.00 42.46 39.35 1dx5 s ILE 68 CO 0.01 0.09 0.00 0.61 0.00 0.00 0.00 174.94 175.65 1dx5 n GLY 69 N 0.47 0.41 3.87 6.18 0.00 -1.25 -0.40 105.19 114.47 1dx5 n GLY 69 Ca -0.11 -0.83 -0.30 0.00 0.00 0.00 0.00 46.02 44.78 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 -1.52 3.78 0.04 1.61 1.02 -1.26 -4.19 119.74 119.22 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 -2.30 0.00 0.00 -0.52 0.00 0.00 37.83 35.01 1dx5 s LYS 70 CO 0.00 -0.16 0.00 1.58 -0.92 0.00 0.00 175.35 175.85 1dx5 n HIS 71 N -1.61 -0.19 -2.06 3.18 -0.00 -1.26 -4.95 115.22 108.33 1dx5 n HIS 71 Ca 0.04 0.03 -0.40 0.00 -0.00 0.00 0.00 57.72 57.39 1dx5 n HIS 71 Cb 0.54 0.18 -0.01 0.00 -0.00 0.00 0.00 29.99 30.70 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 -4.86 6.50 0.13 0.26 0.15 -1.26 -0.66 113.70 113.96 1dx5 s SER 72 Ca 0.00 2.70 -0.10 0.00 0.70 0.00 0.00 55.95 59.25 1dx5 s SER 72 Cb 0.00 -2.65 -0.08 0.00 -1.71 0.00 0.00 66.02 61.58 1dx5 s SER 72 CO 0.00 -0.72 1.38 -0.09 1.20 0.00 0.00 173.24 175.01 1dx5 h ARG 73 N 2.99 0.79 0.00 5.44 2.43 -1.37 -3.39 114.38 121.27 1dx5 h ARG 73 Ca -0.49 -0.56 -0.38 0.00 -0.81 0.00 0.00 59.98 57.74 1dx5 h ARG 73 Cb 1.24 0.09 -0.07 0.00 -0.42 0.00 0.00 29.97 30.81 1dx5 h ARG 73 CO 0.64 1.18 -2.41 0.25 -1.51 0.00 0.00 179.97 178.12 1dx5 n THR 74 N -3.97 1.46 -2.10 0.20 -2.24 -1.26 -5.00 114.28 101.37 1dx5 n THR 74 Ca -0.05 -0.69 -0.39 0.00 -2.27 0.00 0.00 64.05 60.65 1dx5 n THR 74 Cb 0.67 -1.05 -0.00 0.00 -2.10 0.00 0.00 70.33 67.85 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 -2.51 3.90 -0.64 -0.78 3.52 -1.26 -4.94 118.95 116.24 1dx5 s ARG 75 Ca -0.24 2.06 -0.22 0.00 -0.13 0.00 0.00 55.73 57.20 1dx5 s ARG 75 Cb 0.08 -2.67 0.07 0.00 -1.56 0.00 0.00 34.95 30.87 1dx5 s ARG 75 CO 0.70 -0.52 0.93 -0.47 -0.81 0.00 0.00 175.30 175.13 1dx5 s TYR 76 N -1.32 2.72 -1.30 5.12 5.04 -1.26 -4.87 117.35 121.48 1dx5 s TYR 76 Ca 0.59 -0.54 -0.16 0.00 -2.44 0.00 0.00 57.07 54.53 1dx5 s TYR 76 Cb -0.36 -4.23 -0.01 0.00 0.35 0.00 0.00 41.96 37.71 1dx5 s TYR 76 CO 0.45 -1.58 2.19 0.39 -1.34 0.00 0.00 175.55 175.67 1dx5 n GLU 77 N 7.53 2.56 -1.61 4.97 1.02 -1.26 -4.96 120.64 128.89 1dx5 n GLU 77 Ca -0.04 -2.39 -0.49 0.00 -0.02 0.00 0.00 57.16 54.22 1dx5 n GLU 77 Cb 0.45 -3.17 -0.04 0.00 -0.02 0.00 0.00 31.44 28.66 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 6.18 1.42 -0.79 3.49 0.63 -1.26 -0.39 116.66 125.94 1dx5 n ARG 77 Ca 0.52 0.51 0.00 0.00 -0.92 0.00 0.00 57.85 57.96 1dx5 n ARG 77 Cb 0.38 -2.10 0.00 0.00 0.45 0.00 0.00 32.46 31.19 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 2.32 -1.04 0.01 6.15 4.05 -1.26 -4.70 115.26 120.79 1dx5 n ASN 78 Ca 0.16 0.00 -0.02 0.00 0.45 0.00 0.00 54.58 55.17 1dx5 n ASN 78 Cb 0.25 -1.54 -0.01 0.00 1.23 0.00 0.00 39.78 39.71 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 1.02 -2.23 -1.44 5.41 -0.44 -5.04 119.36 114.53 1dx5 n ILE 79 Ca 0.00 0.29 -0.32 0.00 1.00 0.00 0.00 62.75 63.73 1dx5 n ILE 79 Cb 0.06 -1.64 -0.02 0.00 -0.71 0.00 0.00 39.64 37.33 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 -1.96 3.82 -0.02 0.38 -1.05 0.48 -4.77 118.70 115.58 1dx5 s GLU 80 Ca -0.06 0.86 0.04 0.00 -0.15 0.00 0.00 54.97 55.66 1dx5 s GLU 80 Cb 0.01 -2.13 -0.01 0.00 -0.44 0.00 0.00 34.13 31.56 1dx5 s GLU 80 CO 0.09 -0.37 -0.14 0.15 0.95 0.00 0.00 175.26 175.94 1dx5 s LYS 81 N -4.46 1.22 -0.20 -4.83 3.01 0.47 -4.81 119.74 110.14 1dx5 s LYS 81 Ca 0.57 -0.49 -0.09 0.00 -1.01 0.00 0.00 55.97 54.95 1dx5 s LYS 81 Cb -0.10 -1.14 -0.05 0.00 -1.01 0.00 0.00 37.83 35.53 1dx5 s LYS 81 CO 0.39 0.26 0.11 0.42 0.51 0.00 0.00 175.35 177.05 1dx5 s ILE 82 N -0.19 5.25 -0.02 2.17 1.01 -1.26 -0.83 121.20 127.34 1dx5 s ILE 82 Ca 0.03 0.13 0.07 0.00 0.00 0.00 0.00 60.65 60.88 1dx5 s ILE 82 Cb -0.07 -3.39 -0.02 0.00 0.01 0.00 0.00 42.46 38.99 1dx5 s ILE 82 CO 0.00 0.45 -0.23 -0.44 0.00 0.00 0.00 174.94 174.72 1dx5 s SER 83 N 0.36 3.33 0.09 3.58 0.01 0.29 -4.98 113.70 116.37 1dx5 s SER 83 Ca 0.07 -0.41 -0.15 0.00 1.31 0.00 0.00 55.95 56.76 1dx5 s SER 83 Cb -0.11 -0.47 -0.06 0.00 0.21 0.00 0.00 66.02 65.58 1dx5 s SER 83 CO -0.01 0.32 0.51 -0.04 0.41 0.00 0.00 173.24 174.42 1dx5 s MET 84 N -0.75 4.01 -0.05 12.44 -1.94 -1.26 -2.59 119.30 129.16 1dx5 s MET 84 Ca 0.11 0.51 -0.28 0.00 -1.71 0.00 0.00 55.69 54.32 1dx5 s MET 84 Cb -0.10 -3.09 -0.03 0.00 2.01 0.00 0.00 34.83 33.62 1dx5 s MET 84 CO -0.00 0.58 0.90 -0.51 -0.01 0.00 0.00 175.02 175.99 1dx5 s LEU 85 N -1.51 4.32 -0.18 -0.03 1.43 -1.26 -1.02 118.68 120.42 1dx5 s LEU 85 Ca 0.32 1.48 -0.19 0.00 -1.03 0.00 0.00 54.13 54.70 1dx5 s LEU 85 Cb -0.17 -3.42 -0.22 0.00 0.03 0.00 0.00 46.19 42.42 1dx5 s LEU 85 CO 0.18 -0.27 0.31 -0.08 0.23 0.00 0.00 176.35 176.71 1dx5 h GLU 86 N 6.90 0.07 -2.30 1.70 4.81 -0.99 -3.44 114.58 121.34 1dx5 h GLU 86 Ca -0.38 -0.13 -0.07 0.00 -0.13 0.00 0.00 59.36 58.65 1dx5 h GLU 86 Cb 1.19 0.05 -0.22 0.00 0.63 0.00 0.00 28.75 30.40 1dx5 h GLU 86 CO 0.78 1.06 -0.02 0.21 -0.73 0.00 0.00 179.01 180.31 1dx5 s LYS 87 N -2.40 0.69 -0.18 1.92 2.47 -1.11 -5.00 119.74 116.12 1dx5 s LYS 87 Ca -0.26 0.84 -0.09 0.00 -1.56 0.00 0.00 55.97 54.90 1dx5 s LYS 87 Cb 0.05 0.32 -0.05 0.00 -1.46 0.00 0.00 37.83 36.70 1dx5 s LYS 87 CO 0.65 -0.09 0.11 0.42 0.16 0.00 0.00 175.35 176.60 1dx5 s ILE 88 N 0.38 5.21 -0.33 5.43 1.01 -1.26 -0.93 121.20 130.71 1dx5 s ILE 88 Ca -0.01 0.12 0.03 0.00 0.00 0.00 0.00 60.65 60.79 1dx5 s ILE 88 Cb -0.04 -3.36 0.10 0.00 0.01 0.00 0.00 42.46 39.17 1dx5 s ILE 88 CO -0.00 0.47 0.05 -0.31 0.00 0.00 0.00 174.94 175.15 1dx5 s TYR 89 N 0.18 3.34 0.01 3.97 2.02 0.19 -4.98 117.35 122.09 1dx5 s TYR 89 Ca 0.07 -2.73 -0.20 0.00 -0.37 0.00 0.00 57.07 53.84 1dx5 s TYR 89 Cb -0.11 -2.66 -0.06 0.00 -0.40 0.00 0.00 41.96 38.73 1dx5 s TYR 89 CO -0.01 -0.93 0.58 0.42 -1.57 0.00 0.00 175.55 174.04 1dx5 s ILE 90 N 1.05 4.88 0.02 2.71 1.01 -1.26 -0.33 121.20 129.28 1dx5 s ILE 90 Ca 0.10 1.21 -0.34 0.00 0.00 0.00 0.00 60.65 61.62 1dx5 s ILE 90 Cb -0.19 -3.91 -0.13 0.00 0.01 0.00 0.00 42.46 38.24 1dx5 s ILE 90 CO -0.11 0.45 1.72 1.57 0.00 0.00 0.00 174.94 178.57 1dx5 n HIS 91 N 2.49 2.26 0.13 3.97 -0.00 -0.95 -4.85 115.22 118.26 1dx5 n HIS 91 Ca -0.08 0.16 0.17 0.00 -0.00 0.00 0.00 57.72 57.96 1dx5 n HIS 91 Cb 0.51 -2.59 0.73 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 7.53 0.00 -0.51 1.57 0.13 -1.94 -1.92 132.00 136.86 1dx5 h PRO 92 Ca -0.47 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.60 1dx5 h PRO 92 Cb 1.27 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.36 1dx5 h PRO 92 CO 0.92 0.00 0.06 0.54 -0.23 0.00 0.00 178.00 179.29 1dx5 n ARG 93 N -4.17 3.87 -1.71 0.86 1.74 -1.26 -4.96 116.66 111.03 1dx5 n ARG 93 Ca 0.04 -3.06 -0.42 0.00 -0.77 0.00 0.00 57.85 53.64 1dx5 n ARG 93 Cb 0.40 -2.11 -0.03 0.00 -1.02 0.00 0.00 32.46 29.70 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 -2.87 1.36 -1.21 -1.55 5.04 -0.72 -4.75 117.35 112.64 1dx5 s TYR 94 Ca 0.51 -0.24 -0.11 0.00 -2.44 0.00 0.00 57.07 54.79 1dx5 s TYR 94 Cb 0.40 -4.17 0.19 0.00 0.35 0.00 0.00 41.96 38.74 1dx5 s TYR 94 CO 0.12 -5.14 1.55 -1.71 -1.34 0.00 0.00 175.55 169.03 1dx5 n ASN 95 N 8.07 5.31 0.16 4.32 5.15 0.09 -4.74 115.26 133.62 1dx5 n ASN 95 Ca 0.21 -3.06 0.13 0.00 -0.60 0.00 0.00 54.58 51.26 1dx5 n ASN 95 Cb 0.42 -1.50 0.42 0.00 -0.53 0.00 0.00 39.78 38.59 1dx5 n ASN 95 CO 0.00 0.00 0.00 4.11 1.40 0.00 0.00 177.26 182.77 1dx5 h TRP 96 N 6.49 0.00 -0.16 1.20 5.08 -1.91 0.54 115.95 127.19 1dx5 h TRP 96 Ca 0.32 0.00 -0.04 0.00 1.08 0.00 0.00 58.89 60.25 1dx5 h TRP 96 Cb 0.77 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.92 1dx5 h TRP 96 CO 1.10 0.00 -0.07 -0.09 -1.28 0.00 0.00 178.44 178.10 1dx5 h ARG 97 N 0.00 0.24 0.00 0.12 9.65 -1.99 -3.45 114.38 118.96 1dx5 h ARG 97 Ca 0.00 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 1dx5 h ARG 97 Cb 0.67 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.21 1dx5 h ARG 97 CO 0.00 0.33 0.00 -1.91 2.80 0.00 0.00 179.97 181.19 1dx5 n GLU 97 N -4.32 0.00 0.17 0.20 2.13 -1.20 -5.01 120.64 112.60 1dx5 n GLU 97 Ca -0.01 0.00 0.10 0.00 0.66 0.00 0.00 57.16 57.92 1dx5 n GLU 97 Cb 0.23 0.00 0.09 0.00 0.27 0.00 0.00 31.44 32.03 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 -1.03 4.31 -0.26 -1.86 -3.48 115.58 113.26 1dx5 h ASN 98 Ca 0.00 0.00 -0.17 0.00 -0.56 0.00 0.00 56.30 55.57 1dx5 h ASN 98 Cb 0.00 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.24 1dx5 h ASN 98 CO 0.00 0.07 -0.20 0.18 -1.06 0.00 0.00 177.43 176.42 1dx5 n LEU 99 N -2.97 -1.23 -4.77 1.61 4.32 0.19 -4.97 117.00 109.18 1dx5 n LEU 99 Ca 0.02 0.03 -0.40 0.00 -0.02 0.00 0.00 56.01 55.64 1dx5 n LEU 99 Cb 0.57 -1.46 -0.01 0.00 -1.62 0.00 0.00 43.42 40.90 1dx5 n LEU 99 CO 0.37 -0.15 1.00 -0.62 -1.22 0.00 0.00 177.39 176.77 1dx5 s ASP 100 N -2.68 6.51 -1.22 -1.43 2.15 -1.22 -2.93 116.67 115.84 1dx5 s ASP 100 Ca 0.00 2.75 -0.01 0.00 0.43 0.00 0.00 52.55 55.72 1dx5 s ASP 100 Cb 0.00 -2.65 0.00 0.00 -0.30 0.00 0.00 42.92 39.97 1dx5 s ASP 100 CO 0.00 -0.73 1.02 0.54 -0.17 0.00 0.00 175.17 175.84 1dx5 n ARG 101 N 0.47 -6.80 -2.59 4.34 1.74 -1.26 -0.73 116.66 111.83 1dx5 n ARG 101 Ca 0.02 0.84 -0.43 0.00 -0.77 0.00 0.00 57.85 57.51 1dx5 n ARG 101 Cb 0.42 -5.86 -0.00 0.00 -1.02 0.00 0.00 32.46 25.99 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 -4.22 6.83 -0.11 0.55 2.15 -1.15 -4.35 116.67 116.37 1dx5 s ASP 102 Ca 0.08 -2.41 -0.18 0.00 0.43 0.00 0.00 52.55 50.47 1dx5 s ASP 102 Cb -0.04 -2.57 0.04 0.00 -0.30 0.00 0.00 42.92 40.06 1dx5 s ASP 102 CO 0.73 -1.17 0.46 -0.51 -0.17 0.00 0.00 175.17 174.51 1dx5 s ILE 103 N 4.17 0.02 -0.03 4.11 2.07 -1.26 -3.71 121.20 126.56 1dx5 s ILE 103 Ca 0.53 -0.13 -0.11 0.00 -1.41 0.00 0.00 60.65 59.52 1dx5 s ILE 103 Cb 0.03 -0.71 0.02 0.00 0.13 0.00 0.00 42.46 41.94 1dx5 s ILE 103 CO 0.07 -0.07 0.25 0.00 -1.91 0.00 0.00 174.94 173.28 1dx5 s ALA 104 N -0.42 -0.63 0.03 1.50 0.00 -0.45 -2.25 121.76 119.54 1dx5 s ALA 104 Ca -0.06 0.30 0.05 0.00 0.00 0.00 0.00 51.96 52.26 1dx5 s ALA 104 Cb -0.03 -0.04 -0.03 0.00 0.00 0.00 0.00 23.12 23.01 1dx5 s ALA 104 CO 0.03 -0.21 -0.13 -0.51 0.00 0.00 0.00 175.76 174.93 1dx5 s LEU 105 N -0.99 2.84 -0.13 0.00 1.43 0.55 -1.46 118.68 120.93 1dx5 s LEU 105 Ca -0.11 -0.31 -0.00 0.00 -1.03 0.00 0.00 54.13 52.68 1dx5 s LEU 105 Cb -0.05 -1.65 0.03 0.00 0.03 0.00 0.00 46.19 44.55 1dx5 s LEU 105 CO 0.03 0.27 -0.07 -0.04 0.23 0.00 0.00 176.35 176.76 1dx5 s MET 106 N -1.44 1.53 -0.12 1.70 -1.94 0.15 0.56 119.30 119.74 1dx5 s MET 106 Ca 0.16 -0.36 -0.20 0.00 -1.71 0.00 0.00 55.69 53.58 1dx5 s MET 106 Cb -0.11 -1.76 -0.04 0.00 2.01 0.00 0.00 34.83 34.93 1dx5 s MET 106 CO 0.06 -0.33 0.55 0.21 -0.01 0.00 0.00 175.02 175.51 1dx5 s LYS 107 N 1.67 4.34 0.23 2.03 2.20 -0.11 -1.13 119.74 128.99 1dx5 s LYS 107 Ca 0.03 0.57 -0.19 0.00 -0.36 0.00 0.00 55.97 56.02 1dx5 s LYS 107 Cb -0.14 -3.46 -0.08 0.00 -1.51 0.00 0.00 37.83 32.64 1dx5 s LYS 107 CO -0.08 0.08 0.73 -0.51 -0.36 0.00 0.00 175.35 175.21 1dx5 s LEU 108 N 0.85 4.32 0.27 5.43 1.43 0.18 -0.40 118.68 130.77 1dx5 s LEU 108 Ca 0.29 1.42 -0.04 0.00 -1.03 0.00 0.00 54.13 54.78 1dx5 s LEU 108 Cb -0.16 -3.64 0.37 0.00 0.03 0.00 0.00 46.19 42.79 1dx5 s LEU 108 CO 0.12 0.01 1.94 0.11 0.23 0.00 0.00 176.35 178.76 1dx5 h LYS 109 N 3.31 1.19 -5.30 1.70 1.57 -1.36 -3.43 116.57 114.26 1dx5 h LYS 109 Ca -0.48 -0.07 -0.40 0.00 -1.87 0.00 0.00 60.65 57.83 1dx5 h LYS 109 Cb 1.19 -0.27 -0.20 0.00 0.08 0.00 0.00 32.23 33.03 1dx5 h LYS 109 CO 0.65 0.79 -0.76 0.15 -0.57 0.00 0.00 179.45 179.71 1dx5 s LYS 110 N -6.02 0.89 0.17 3.15 -0.14 -1.26 -5.01 119.74 111.51 1dx5 s LYS 110 Ca -0.12 -1.08 -0.30 0.00 -1.36 0.00 0.00 55.97 53.10 1dx5 s LYS 110 Cb 0.18 -0.80 -0.08 0.00 -1.68 0.00 0.00 37.83 35.45 1dx5 s LYS 110 CO 0.81 0.16 1.31 -1.25 -0.76 0.00 0.00 175.35 175.62 1dx5 s PRO 111 N -2.22 4.39 0.43 -1.68 0.04 -1.26 -4.82 135.00 129.88 1dx5 s PRO 111 Ca 0.03 2.02 -0.23 0.00 0.04 0.00 0.00 61.00 62.85 1dx5 s PRO 111 Cb -0.07 -3.22 -0.08 0.00 0.04 0.00 0.00 34.50 31.16 1dx5 s PRO 111 CO 0.02 -0.28 1.10 0.14 0.04 0.00 0.00 177.00 178.03 1dx5 s VAL 112 N 0.39 3.44 -0.20 -0.36 -7.23 0.90 -5.00 120.40 112.34 1dx5 s VAL 112 Ca 0.58 1.08 -0.24 0.00 -1.81 0.00 0.00 61.98 61.59 1dx5 s VAL 112 Cb -0.36 -3.54 -0.01 0.00 0.56 0.00 0.00 36.38 33.03 1dx5 s VAL 112 CO 0.36 -0.02 0.79 0.00 -0.31 0.00 0.00 175.10 175.92 1dx5 s ALA 113 N -1.62 3.56 0.62 1.32 0.00 -1.26 -4.88 121.76 119.49 1dx5 s ALA 113 Ca 0.61 -0.07 -0.16 0.00 0.00 0.00 0.00 51.96 52.34 1dx5 s ALA 113 Cb -0.25 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.66 1dx5 s ALA 113 CO 0.30 -0.71 1.09 -0.06 0.00 0.00 0.00 175.76 176.39 1dx5 s PHE 114 N 2.30 2.76 0.00 0.00 0.08 -1.26 -4.80 117.98 117.05 1dx5 s PHE 114 Ca 0.35 1.54 0.00 0.00 0.12 0.00 0.00 56.93 58.94 1dx5 s PHE 114 Cb -0.16 -3.12 0.00 0.00 -0.57 0.00 0.00 43.02 39.17 1dx5 s PHE 114 CO 0.11 -1.47 0.00 -1.13 -0.10 0.00 0.00 175.22 172.63 1dx5 n SER 115 N -2.16 0.00 0.25 1.36 3.41 0.23 -4.92 113.62 111.79 1dx5 n SER 115 Ca 0.10 -0.71 0.13 0.00 -0.26 0.00 0.00 58.87 58.12 1dx5 n SER 115 Cb 0.52 0.00 0.63 0.00 -0.26 0.00 0.00 64.21 65.10 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 -3.04 116.42 118.76 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 0.14 -0.92 -1.22 -1.72 0.00 0.00 179.24 175.53 1dx5 n TYR 117 N -3.42 0.00 -4.12 4.55 4.01 -1.26 -4.66 117.16 112.26 1dx5 n TYR 117 Ca -0.01 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.44 1dx5 n TYR 117 Cb 0.32 -0.09 -0.16 0.00 -0.31 0.00 0.00 39.34 39.10 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 -2.48 1.56 -0.29 -0.72 1.01 -1.15 -3.95 121.20 115.17 1dx5 s ILE 118 Ca 0.02 -0.64 -0.16 0.00 0.00 0.00 0.00 60.65 59.88 1dx5 s ILE 118 Cb 0.10 -1.46 0.17 0.00 0.01 0.00 0.00 42.46 41.29 1dx5 s ILE 118 CO 0.57 0.46 1.10 -2.28 0.00 0.00 0.00 174.94 174.79 1dx5 s HIS 119 N 1.38 -0.38 0.48 3.97 2.46 -0.92 -0.60 115.29 121.67 1dx5 s HIS 119 Ca 0.02 0.74 -0.24 0.00 0.47 0.00 0.00 55.06 56.05 1dx5 s HIS 119 Cb -0.13 0.23 -0.07 0.00 -0.13 0.00 0.00 32.58 32.48 1dx5 s HIS 119 CO -0.09 -0.19 1.35 -1.25 -2.47 0.00 0.00 174.74 172.09 1dx5 s PRO 120 N 1.45 3.51 0.33 2.88 0.04 -1.26 -2.31 135.00 139.64 1dx5 s PRO 120 Ca -0.07 2.22 -0.04 0.00 0.04 0.00 0.00 61.00 63.15 1dx5 s PRO 120 Cb -0.03 -2.48 -0.05 0.00 0.04 0.00 0.00 34.50 31.98 1dx5 s PRO 120 CO -0.14 -0.89 0.59 0.54 0.04 0.00 0.00 177.00 177.15 1dx5 s VAL 121 N -1.30 5.01 0.44 -0.36 0.11 -0.71 -4.91 120.40 118.69 1dx5 s VAL 121 Ca 0.65 0.02 -0.14 0.00 -2.93 0.00 0.00 61.98 59.57 1dx5 s VAL 121 Cb -0.40 -3.77 -0.08 0.00 -1.53 0.00 0.00 36.38 30.61 1dx5 s VAL 121 CO 0.49 -0.44 0.87 0.00 -3.33 0.00 0.00 175.10 172.69 1dx5 s LEU 123 N -3.79 3.75 0.48 0.00 1.43 -1.26 -0.73 118.68 118.55 1dx5 s LEU 123 Ca 0.55 0.16 -0.24 0.00 -1.03 0.00 0.00 54.13 53.57 1dx5 s LEU 123 Cb -0.10 -1.90 -0.07 0.00 0.03 0.00 0.00 46.19 44.15 1dx5 s LEU 123 CO 0.28 0.31 1.34 -2.16 0.23 0.00 0.00 176.35 176.36 1dx5 s PRO 124 N -0.46 3.54 0.25 1.29 0.04 -1.26 -4.93 135.00 133.48 1dx5 s PRO 124 Ca 0.09 2.21 0.04 0.00 0.04 0.00 0.00 61.00 63.38 1dx5 s PRO 124 Cb -0.12 -2.49 0.04 0.00 0.04 0.00 0.00 34.50 31.97 1dx5 s PRO 124 CO 0.02 -0.86 0.32 -0.40 0.04 0.00 0.00 177.00 176.12 1dx5 n ASP 125 N -0.49 1.07 -0.10 6.66 5.68 -1.26 -4.84 116.55 123.27 1dx5 n ASP 125 Ca 0.07 -1.70 -0.06 0.00 -0.50 0.00 0.00 54.79 52.60 1dx5 n ASP 125 Cb 0.44 -0.16 0.02 0.00 -1.14 0.00 0.00 41.12 40.28 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 0.16 -0.35 0.11 2.43 -1.98 -3.02 114.38 111.73 1dx5 h ARG 126 Ca -0.12 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 58.99 1dx5 h ARG 126 Cb 0.55 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.05 1dx5 h ARG 126 CO 0.18 0.10 0.03 0.93 -1.51 0.00 0.00 179.97 179.70 1dx5 h GLU 127 N 0.16 0.60 -0.42 0.20 3.07 -2.04 -1.85 114.58 114.29 1dx5 h GLU 127 Ca 0.17 -0.18 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1dx5 h GLU 127 Cb 0.21 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.06 1dx5 h GLU 127 CO -0.24 0.70 0.00 2.41 -1.40 0.00 0.00 179.01 180.47 1dx5 n THR 128 N -4.54 0.00 0.00 1.13 -1.04 -1.14 -1.18 114.28 107.51 1dx5 n THR 128 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1dx5 n THR 128 Cb 0.25 -0.11 0.00 0.00 -1.82 0.00 0.00 70.33 68.65 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 0.60 0.00 -0.10 2.41 0.00 -0.70 -1.02 120.51 121.70 1dx5 n ALA 129 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 1dx5 n ALA 129 Cb 0.00 0.00 -0.03 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 0.93 0.23 0.00 0.02 -1.42 -3.38 113.55 109.93 1dx5 h SER 129 Ca 0.00 -0.48 -0.35 0.00 -0.84 0.00 0.00 61.79 60.12 1dx5 h SER 129 Cb 0.00 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.26 1dx5 h SER 129 CO 0.00 1.22 -1.86 -0.07 -1.14 0.00 0.00 176.83 174.98 1dx5 h LEU 129 N 0.65 0.39 -6.73 5.07 4.07 -1.31 -3.42 115.31 114.02 1dx5 h LEU 129 Ca 0.05 -0.76 -0.63 0.00 0.08 0.00 0.00 57.88 56.61 1dx5 h LEU 129 Cb 0.98 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.59 1dx5 h LEU 129 CO 0.09 1.67 2.39 0.18 -1.08 0.00 0.00 178.44 181.70 1dx5 n LEU 130 N -3.43 4.98 -4.00 1.67 4.77 -1.26 -4.85 117.00 114.88 1dx5 n LEU 130 Ca -0.27 -3.49 -0.15 0.00 -0.03 0.00 0.00 56.01 52.07 1dx5 n LEU 130 Cb 1.05 -1.47 -0.13 0.00 -2.33 0.00 0.00 43.42 40.54 1dx5 n LEU 130 CO 0.46 -0.02 -0.41 -1.10 -1.33 0.00 0.00 177.39 174.99 1dx5 s GLN 131 N 4.51 0.50 0.26 3.23 -0.21 -1.26 -4.94 119.66 121.75 1dx5 s GLN 131 Ca 0.55 -0.39 -0.30 0.00 0.02 0.00 0.00 55.36 55.24 1dx5 s GLN 131 Cb 0.11 -0.42 -0.14 0.00 1.00 0.00 0.00 33.01 33.56 1dx5 s GLN 131 CO 0.05 0.11 1.27 0.00 -2.12 0.00 0.00 175.29 174.59 1dx5 n ALA 132 N 2.45 0.61 0.00 6.09 0.00 -1.26 -1.58 120.51 126.82 1dx5 n ALA 132 Ca -0.16 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1dx5 n ALA 132 Cb 0.57 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.84 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 1.64 2.88 3.74 0.00 0.00 0.60 -4.92 105.19 109.13 1dx5 n GLY 133 Ca 0.10 -0.48 -0.41 0.00 0.00 0.00 0.00 46.02 45.23 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 -1.53 3.12 0.01 1.61 1.51 -0.62 -4.61 117.35 116.85 1dx5 s TYR 134 Ca 0.00 1.07 -0.16 0.00 -1.01 0.00 0.00 57.07 56.97 1dx5 s TYR 134 Cb 0.00 -3.74 -0.06 0.00 -0.11 0.00 0.00 41.96 38.05 1dx5 s TYR 134 CO 0.00 -2.41 0.45 0.15 -1.11 0.00 0.00 175.55 172.63 1dx5 s LYS 135 N -0.14 4.00 0.44 -0.62 1.02 -1.26 -0.12 119.74 123.06 1dx5 s LYS 135 Ca 0.59 0.50 0.00 0.00 0.02 0.00 0.00 55.97 57.08 1dx5 s LYS 135 Cb -0.40 -3.23 -0.00 0.00 -0.52 0.00 0.00 37.83 33.68 1dx5 s LYS 135 CO 0.40 0.66 0.00 0.41 -0.92 0.00 0.00 175.35 175.90 1dx5 n GLY 136 N 1.84 3.66 2.99 -3.33 0.00 0.59 -4.84 105.19 106.10 1dx5 n GLY 136 Ca -0.13 -2.35 -0.20 0.00 0.00 0.00 0.00 46.02 43.34 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 -3.57 0.90 -0.00 1.61 3.52 0.18 -0.94 118.95 120.65 1dx5 s ARG 137 Ca 0.00 -0.29 0.07 0.00 -0.13 0.00 0.00 55.73 55.39 1dx5 s ARG 137 Cb 0.00 -0.85 -0.02 0.00 -1.56 0.00 0.00 34.95 32.52 1dx5 s ARG 137 CO 0.00 0.11 -0.23 0.08 -0.81 0.00 0.00 175.30 174.45 1dx5 s VAL 138 N 0.18 1.85 0.08 7.11 1.01 -0.41 -0.04 120.40 130.17 1dx5 s VAL 138 Ca -0.03 -1.05 0.04 0.00 0.00 0.00 0.00 61.98 60.93 1dx5 s VAL 138 Cb -0.08 -1.55 -0.03 0.00 0.00 0.00 0.00 36.38 34.72 1dx5 s VAL 138 CO 0.00 0.47 -0.10 0.42 0.00 0.00 0.00 175.10 175.89 1dx5 s THR 139 N -0.60 0.88 0.00 3.92 -4.23 -1.24 -1.29 115.64 113.08 1dx5 s THR 139 Ca 0.09 -1.49 0.00 0.00 -1.18 0.00 0.00 61.69 59.11 1dx5 s THR 139 Cb -0.09 -1.19 0.00 0.00 1.34 0.00 0.00 72.50 72.56 1dx5 s THR 139 CO -0.00 -0.49 0.00 0.61 -0.54 0.00 0.00 174.62 174.20 1dx5 n GLY 140 N 0.81 1.16 0.96 3.99 0.00 -0.67 -4.53 105.19 106.91 1dx5 n GLY 140 Ca -0.18 -0.88 0.08 0.00 0.00 0.00 0.00 46.02 45.04 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 -0.39 0.88 -0.73 1.61 8.01 -1.26 -1.57 117.44 124.00 1dx5 n TRP 141 Ca 0.00 -0.66 -0.13 0.00 -1.31 0.00 0.00 57.50 55.40 1dx5 n TRP 141 Cb 0.00 -0.18 0.11 0.00 -2.01 0.00 0.00 31.31 29.23 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 0.30 -2.61 3.74 6.99 0.00 -1.26 -4.58 105.19 107.79 1dx5 n GLY 142 Ca 0.18 -1.46 -0.42 0.00 0.00 0.00 0.00 46.02 44.32 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 3.33 -0.01 1.61 3.02 0.26 -3.30 115.26 116.35 1dx5 n ASN 143 Ca 0.07 1.21 0.14 0.00 -0.03 0.00 0.00 54.58 55.97 1dx5 n ASN 143 Cb 0.26 -1.56 0.60 0.00 -0.61 0.00 0.00 39.78 38.46 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 0.53 0.10 -3.63 3.41 4.77 0.21 -1.70 117.00 120.69 1dx5 n LEU 144 Ca 0.03 0.36 -0.10 0.00 -0.03 0.00 0.00 56.01 56.26 1dx5 n LEU 144 Cb 0.38 -0.40 -0.04 0.00 -2.33 0.00 0.00 43.42 41.03 1dx5 n LEU 144 CO 0.63 0.02 0.24 -0.54 -1.33 0.00 0.00 177.39 176.41 1dx5 s LYS 145 N -2.87 1.20 0.53 3.23 1.02 -1.26 -4.35 119.74 117.24 1dx5 s LYS 145 Ca 0.18 -0.72 0.30 0.00 0.02 0.00 0.00 55.97 55.75 1dx5 s LYS 145 Cb 0.19 0.51 1.61 0.00 -0.52 0.00 0.00 37.83 39.62 1dx5 s LYS 145 CO 0.53 -0.50 1.89 1.49 -0.92 0.00 0.00 175.35 177.85 1dx5 h GLU 146 N 2.25 0.00 0.00 1.68 4.81 -1.90 -3.46 114.58 117.96 1dx5 h GLU 146 Ca -0.32 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1dx5 h GLU 146 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 1dx5 h GLU 146 CO 0.42 0.00 0.00 0.25 -0.73 0.00 0.00 179.01 178.95 1dx5 n THR 147 N -2.65 0.00 -3.41 0.32 -2.24 -1.26 -4.82 114.28 100.22 1dx5 n THR 147 Ca -0.02 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.64 1dx5 n THR 147 Cb 0.20 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.41 1dx5 n THR 147 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 1dx5 n TRP 148 N 13.96 -0.40 -2.31 4.78 4.27 -1.26 -4.59 117.44 131.90 1dx5 n TRP 148 Ca 0.00 0.11 0.00 0.00 -3.89 0.00 0.00 57.50 53.72 1dx5 n TRP 148 Cb 0.00 -0.85 0.00 0.00 -1.36 0.00 0.00 31.31 29.10 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 -2.15 0.00 -3.26 -1.67 5.66 -1.26 -5.12 114.28 106.48 1dx5 n THR 149 Ca -0.07 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.54 1dx5 n THR 149 Cb 0.19 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 68.92 1dx5 n THR 149 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1dx5 s ALA 149 N -1.00 3.49 -0.29 1.79 0.00 -1.26 -5.05 121.76 119.44 1dx5 s ALA 149 Ca 0.00 -0.06 -0.22 0.00 0.00 0.00 0.00 51.96 51.68 1dx5 s ALA 149 Cb 0.00 -2.69 0.14 0.00 0.00 0.00 0.00 23.12 20.57 1dx5 s ALA 149 CO 0.00 0.13 1.08 1.21 0.00 0.00 0.00 175.76 178.18 1dx5 s ASN 149 N 0.05 -0.39 -0.42 0.00 3.04 -1.26 -4.95 114.94 111.00 1dx5 s ASN 149 Ca 0.29 0.71 -0.22 0.00 0.04 0.00 0.00 52.86 53.68 1dx5 s ASN 149 Cb -0.17 0.87 0.02 0.00 -1.54 0.00 0.00 41.25 40.43 1dx5 s ASN 149 CO 0.15 -0.12 0.74 -0.69 -3.04 0.00 0.00 177.10 174.14 1dx5 s VAL 149 N 0.57 4.72 0.03 -5.21 1.01 -1.26 -4.98 120.40 115.27 1dx5 s VAL 149 Ca -0.00 0.47 -0.28 0.00 0.00 0.00 0.00 61.98 62.17 1dx5 s VAL 149 Cb -0.04 -4.26 0.10 0.00 0.00 0.00 0.00 36.38 32.18 1dx5 s VAL 149 CO -0.10 -0.61 1.23 -0.83 0.00 0.00 0.00 175.10 174.79 1dx5 s GLY 149 N 2.03 -0.19 0.00 4.51 0.00 -1.26 -5.01 107.32 107.40 1dx5 s GLY 149 Ca 0.28 0.20 0.22 0.00 0.00 0.00 0.00 44.72 45.42 1dx5 s GLY 149 CO 0.20 2.91 1.71 0.28 0.00 0.00 0.00 173.10 178.21 1dx5 n LYS 149 N -0.71 1.36 0.00 2.90 5.02 -1.26 -4.96 118.16 120.51 1dx5 n LYS 149 Ca -0.02 -0.53 0.00 0.00 -2.02 0.00 0.00 58.31 55.74 1dx5 n LYS 149 Cb 0.60 -1.38 0.00 0.00 -0.02 0.00 0.00 35.03 34.24 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 0.99 1.23 3.59 0.72 0.00 -1.26 -4.66 105.19 105.80 1dx5 n GLY 150 Ca 0.17 0.40 -0.33 0.00 0.00 0.00 0.00 46.02 46.26 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 2.63 0.68 1.61 -0.21 -1.26 -0.62 119.66 122.49 1dx5 s GLN 151 Ca 0.00 -0.65 -0.11 0.00 0.02 0.00 0.00 55.36 54.62 1dx5 s GLN 151 Cb 0.00 -2.54 0.00 0.00 1.00 0.00 0.00 33.01 31.48 1dx5 s GLN 151 CO 0.00 0.63 1.06 -1.25 -2.12 0.00 0.00 175.29 173.60 1dx5 s PRO 152 N -1.16 3.02 0.17 2.91 0.04 -1.26 -4.96 135.00 133.76 1dx5 s PRO 152 Ca 0.15 0.94 0.22 0.00 0.04 0.00 0.00 61.00 62.35 1dx5 s PRO 152 Cb -0.11 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.39 1dx5 s PRO 152 CO 0.05 -1.03 0.98 -1.13 0.04 0.00 0.00 177.00 175.91 1dx5 n SER 153 N -3.05 0.81 -4.09 6.66 3.41 -1.26 -4.68 113.62 111.43 1dx5 n SER 153 Ca 0.07 0.32 -0.10 0.00 -0.26 0.00 0.00 58.87 58.90 1dx5 n SER 153 Cb 0.54 0.49 -0.11 0.00 -0.26 0.00 0.00 64.21 64.87 1dx5 n SER 153 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1dx5 s VAL 154 N -3.31 0.44 0.11 -3.33 1.01 -1.26 -1.07 120.40 112.98 1dx5 s VAL 154 Ca -0.01 -1.47 -0.35 0.00 0.00 0.00 0.00 61.98 60.14 1dx5 s VAL 154 Cb 0.10 -1.07 -0.17 0.00 0.00 0.00 0.00 36.38 35.24 1dx5 s VAL 154 CO 0.80 -0.69 1.23 -0.11 0.00 0.00 0.00 175.10 176.33 1dx5 n LEU 155 N 0.74 1.36 -4.88 3.92 7.94 0.17 -4.82 117.00 121.43 1dx5 n LEU 155 Ca -0.18 1.13 -0.30 0.00 -1.11 0.00 0.00 56.01 55.55 1dx5 n LEU 155 Cb 0.58 -1.16 -0.05 0.00 0.53 0.00 0.00 43.42 43.32 1dx5 n LEU 155 CO 0.25 -1.27 -0.17 -1.10 -1.11 0.00 0.00 177.39 173.98 1dx5 s GLN 156 N 0.10 3.28 -0.00 1.96 -1.52 -0.61 -0.77 119.66 122.10 1dx5 s GLN 156 Ca 0.81 -0.54 0.01 0.00 -1.95 0.00 0.00 55.36 53.69 1dx5 s GLN 156 Cb -0.95 -2.94 -0.00 0.00 -0.22 0.00 0.00 33.01 28.90 1dx5 s GLN 156 CO 0.50 0.58 -0.03 0.54 -0.25 0.00 0.00 175.29 176.63 1dx5 s VAL 157 N -1.52 0.26 -0.03 1.09 0.11 0.04 -1.68 120.40 118.67 1dx5 s VAL 157 Ca 0.33 -0.13 -0.04 0.00 -2.93 0.00 0.00 61.98 59.21 1dx5 s VAL 157 Cb -0.12 -0.23 0.01 0.00 -1.53 0.00 0.00 36.38 34.51 1dx5 s VAL 157 CO 0.26 0.08 0.10 0.54 -3.33 0.00 0.00 175.10 172.75 1dx5 s VAL 158 N -0.04 0.02 -0.29 2.04 0.11 -0.42 -1.38 120.40 120.44 1dx5 s VAL 158 Ca 0.01 -0.14 -0.11 0.00 -2.93 0.00 0.00 61.98 58.81 1dx5 s VAL 158 Cb -0.02 -0.19 -0.04 0.00 -1.53 0.00 0.00 36.38 34.61 1dx5 s VAL 158 CO -0.00 -0.08 0.18 0.20 -3.33 0.00 0.00 175.10 172.08 1dx5 s ASN 159 N -0.21 5.89 -0.04 3.54 0.01 -1.26 -1.29 114.94 121.58 1dx5 s ASN 159 Ca -0.03 -0.16 0.04 0.00 -0.71 0.00 0.00 52.86 52.00 1dx5 s ASN 159 Cb -0.02 -2.09 -0.00 0.00 0.41 0.00 0.00 41.25 39.54 1dx5 s ASN 159 CO 0.00 -0.10 -0.17 -0.76 -1.51 0.00 0.00 177.10 174.56 1dx5 s LEU 160 N 1.72 1.93 0.27 0.60 1.43 -0.12 -4.93 118.68 119.59 1dx5 s LEU 160 Ca 0.07 -0.34 -0.24 0.00 -1.03 0.00 0.00 54.13 52.58 1dx5 s LEU 160 Cb -0.16 -0.95 -0.09 0.00 0.03 0.00 0.00 46.19 45.02 1dx5 s LEU 160 CO 0.10 0.16 0.86 -2.16 0.23 0.00 0.00 176.35 175.54 1dx5 s PRO 161 N -0.02 4.50 0.36 1.29 0.04 -1.26 -0.30 135.00 139.61 1dx5 s PRO 161 Ca -0.02 1.18 -0.27 0.00 0.04 0.00 0.00 61.00 61.93 1dx5 s PRO 161 Cb -0.11 -2.90 -0.09 0.00 0.04 0.00 0.00 34.50 31.44 1dx5 s PRO 161 CO 0.02 0.36 1.19 0.42 0.04 0.00 0.00 177.00 179.03 1dx5 s ILE 162 N -1.51 3.10 -0.03 0.56 1.01 0.82 -1.00 121.20 124.15 1dx5 s ILE 162 Ca 0.46 1.00 0.01 0.00 0.00 0.00 0.00 60.65 62.11 1dx5 s ILE 162 Cb -0.19 -3.59 -0.03 0.00 0.01 0.00 0.00 42.46 38.66 1dx5 s ILE 162 CO 0.24 0.16 -0.02 -0.69 0.00 0.00 0.00 174.94 174.63 1dx5 s VAL 163 N -1.30 4.05 0.41 2.92 1.01 -0.91 -0.29 120.40 126.29 1dx5 s VAL 163 Ca 0.53 -0.54 -0.27 0.00 0.00 0.00 0.00 61.98 61.71 1dx5 s VAL 163 Cb -0.33 -2.76 -0.09 0.00 0.00 0.00 0.00 36.38 33.19 1dx5 s VAL 163 CO 0.43 0.46 1.42 -1.83 0.00 0.00 0.00 175.10 175.57 1dx5 s GLU 164 N -1.30 3.91 0.26 2.72 1.03 -1.26 -4.65 118.70 119.41 1dx5 s GLU 164 Ca 0.17 2.42 -0.03 0.00 0.03 0.00 0.00 54.97 57.56 1dx5 s GLU 164 Cb -0.11 -2.80 0.54 0.00 -0.80 0.00 0.00 34.13 30.96 1dx5 s GLU 164 CO 0.07 -0.64 1.67 0.00 -1.33 0.00 0.00 175.26 175.03 1dx5 h ARG 165 N 2.67 0.24 -0.24 -4.83 3.08 -1.98 -2.11 114.38 111.20 1dx5 h ARG 165 Ca -0.51 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 59.48 1dx5 h ARG 165 Cb 1.25 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.23 1dx5 h ARG 165 CO 0.63 0.16 -0.06 -1.00 -1.07 0.00 0.00 179.97 178.62 1dx5 h PRO 166 N 0.25 0.38 -0.25 0.04 0.13 -1.99 -0.64 132.00 129.92 1dx5 h PRO 166 Ca 0.46 -0.08 -0.14 0.00 -0.87 0.00 0.00 66.00 65.37 1dx5 h PRO 166 Cb 0.84 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 31.90 1dx5 h PRO 166 CO -0.57 0.46 -0.41 0.28 -0.23 0.00 0.00 178.00 177.53 1dx5 h VAL 167 N 0.36 1.30 -0.39 1.56 2.07 -1.76 -1.44 116.25 117.95 1dx5 h VAL 167 Ca 0.08 -1.58 -0.07 0.00 0.82 0.00 0.00 66.70 65.95 1dx5 h VAL 167 Cb 0.35 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.65 1dx5 h VAL 167 CO 0.02 0.50 -0.01 0.00 0.02 0.00 0.00 177.57 178.10 1dx5 h LYS 169 N 0.52 0.66 0.00 0.00 3.64 -0.96 -2.90 116.57 117.53 1dx5 h LYS 169 Ca 0.11 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1dx5 h LYS 169 Cb 0.49 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1dx5 h LYS 169 CO 0.02 0.44 0.00 -0.25 -2.27 0.00 0.00 179.45 177.39 1dx5 n ASP 170 N -4.74 0.37 0.11 4.20 8.00 -0.56 -3.33 116.55 120.60 1dx5 n ASP 170 Ca 0.02 0.55 0.13 0.00 0.71 0.00 0.00 54.79 56.20 1dx5 n ASP 170 Cb 0.02 -0.64 0.35 0.00 -0.02 0.00 0.00 41.12 40.83 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 -5.31 -2.24 4.64 -1.26 -3.47 113.55 105.91 1dx5 h SER 171 Ca 0.00 -0.03 -0.14 0.00 -0.47 0.00 0.00 61.79 61.15 1dx5 h SER 171 Cb 0.50 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.45 1dx5 h SER 171 CO 0.00 0.02 -0.63 0.28 -0.87 0.00 0.00 176.83 175.63 1dx5 s THR 172 N -3.12 0.16 -1.66 2.95 -1.32 -1.21 -4.82 115.64 106.62 1dx5 s THR 172 Ca 0.10 -1.79 0.23 0.00 -1.21 0.00 0.00 61.69 59.02 1dx5 s THR 172 Cb 0.12 -1.75 0.01 0.00 -1.51 0.00 0.00 72.50 69.37 1dx5 s THR 172 CO 0.62 -0.71 1.20 0.54 -2.21 0.00 0.00 174.62 174.05 1dx5 n ARG 173 N -0.00 0.76 -2.66 7.08 1.74 -1.26 -4.91 116.66 117.40 1dx5 n ARG 173 Ca -0.10 -0.58 -0.41 0.00 -0.77 0.00 0.00 57.85 56.00 1dx5 n ARG 173 Cb 0.62 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.53 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 -2.64 4.07 0.13 0.55 1.01 -1.26 -4.99 121.20 118.06 1dx5 s ILE 174 Ca 0.17 1.91 -0.31 0.00 0.00 0.00 0.00 60.65 62.42 1dx5 s ILE 174 Cb 0.18 -4.22 -0.09 0.00 0.01 0.00 0.00 42.46 38.34 1dx5 s ILE 174 CO 0.63 0.39 1.47 -0.60 0.00 0.00 0.00 174.94 176.83 1dx5 s ARG 175 N -0.73 4.27 -0.19 2.79 3.52 -1.26 -5.00 118.95 122.35 1dx5 s ARG 175 Ca 0.45 2.19 -0.08 0.00 -0.13 0.00 0.00 55.73 58.15 1dx5 s ARG 175 Cb -0.27 -3.25 -0.04 0.00 -1.56 0.00 0.00 34.95 29.83 1dx5 s ARG 175 CO 0.33 -0.52 0.09 0.42 -0.81 0.00 0.00 175.30 174.81 1dx5 s ILE 176 N 1.27 5.06 0.44 4.11 -1.09 -1.26 -4.91 121.20 124.82 1dx5 s ILE 176 Ca 0.67 0.06 0.08 0.00 -2.23 0.00 0.00 60.65 59.23 1dx5 s ILE 176 Cb -0.39 -3.29 0.01 0.00 -1.58 0.00 0.00 42.46 37.20 1dx5 s ILE 176 CO 0.31 0.45 0.50 0.42 -1.23 0.00 0.00 174.94 175.39 1dx5 s THR 177 N 0.34 2.68 -1.01 2.92 -4.23 -1.26 -5.00 115.64 110.07 1dx5 s THR 177 Ca 0.05 -1.18 0.21 0.00 -1.18 0.00 0.00 61.69 59.60 1dx5 s THR 177 Cb -0.12 -2.86 0.18 0.00 1.34 0.00 0.00 72.50 71.05 1dx5 s THR 177 CO -0.01 0.00 1.68 0.47 -0.54 0.00 0.00 174.62 176.22 1dx5 n ASP 178 N -1.75 0.00 -0.42 3.99 9.92 -1.26 -2.43 116.55 124.59 1dx5 n ASP 178 Ca 0.06 0.48 0.03 0.00 -0.53 0.00 0.00 54.79 54.83 1dx5 n ASP 178 Cb 0.61 -0.49 0.08 0.00 -0.64 0.00 0.00 41.12 40.68 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 -1.49 1.19 -3.91 -2.24 3.02 -1.26 -4.82 115.26 105.74 1dx5 n ASN 179 Ca 0.05 -2.04 -0.10 0.00 -0.03 0.00 0.00 54.58 52.47 1dx5 n ASN 179 Cb 0.25 -0.19 -0.09 0.00 -0.61 0.00 0.00 39.78 39.13 1dx5 n ASN 179 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dx5 s MET 180 N -1.70 0.60 0.06 3.52 0.23 -1.02 -0.87 119.30 120.12 1dx5 s MET 180 Ca 0.13 -0.71 -0.03 0.00 -1.03 0.00 0.00 55.69 54.04 1dx5 s MET 180 Cb 0.07 0.24 -0.03 0.00 -1.53 0.00 0.00 34.83 33.58 1dx5 s MET 180 CO 0.08 -0.15 0.04 -0.59 -2.03 0.00 0.00 175.02 172.36 1dx5 s PHE 181 N -2.52 0.38 0.19 3.16 -0.12 -0.64 -4.81 117.98 113.63 1dx5 s PHE 181 Ca -0.06 -0.86 0.11 0.00 -0.05 0.00 0.00 56.93 56.08 1dx5 s PHE 181 Cb -0.02 -0.27 -0.04 0.00 -0.63 0.00 0.00 43.02 42.06 1dx5 s PHE 181 CO -0.04 -0.41 -0.23 0.00 -0.05 0.00 0.00 175.22 174.50 1dx5 s ALA 183 N -1.64 0.34 0.00 0.00 0.00 -0.37 -2.15 121.76 117.94 1dx5 s ALA 183 Ca 0.21 -1.08 0.00 0.00 0.00 0.00 0.00 51.96 51.09 1dx5 s ALA 183 Cb -0.08 0.61 0.00 0.00 0.00 0.00 0.00 23.12 23.65 1dx5 s ALA 183 CO 0.10 -0.49 0.00 0.41 0.00 0.00 0.00 175.76 175.78 1dx5 n GLY 184 N -0.05 3.55 3.83 0.00 0.00 -0.17 -2.11 105.19 110.24 1dx5 n GLY 184 Ca -0.10 -1.78 -0.32 0.00 0.00 0.00 0.00 46.02 43.81 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 -2.28 3.37 0.29 1.61 2.02 -1.26 -4.57 117.35 116.53 1dx5 s TYR 184 Ca 0.00 1.51 -0.07 0.00 -0.37 0.00 0.00 57.07 58.14 1dx5 s TYR 184 Cb 0.00 -2.83 -0.06 0.00 -0.40 0.00 0.00 41.96 38.67 1dx5 s TYR 184 CO 0.00 -0.37 0.58 0.15 -1.57 0.00 0.00 175.55 174.33 1dx5 s LYS 185 N -3.83 3.69 0.37 -0.62 1.02 -1.26 -4.83 119.74 114.27 1dx5 s LYS 185 Ca 0.60 0.12 0.17 0.00 0.02 0.00 0.00 55.97 56.88 1dx5 s LYS 185 Cb -0.10 -2.62 1.09 0.00 -0.52 0.00 0.00 37.83 35.68 1dx5 s LYS 185 CO 0.27 0.21 1.71 -1.35 -0.92 0.00 0.00 175.35 175.27 1dx5 h PRO 186 N 1.84 0.36 0.00 -1.68 0.11 -1.96 0.02 132.00 130.70 1dx5 h PRO 186 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1dx5 h PRO 186 Cb 1.18 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1dx5 h PRO 186 CO 0.67 0.24 0.00 -0.25 -0.21 0.00 0.00 178.00 178.45 1dx5 n ASP 186 N -4.83 0.00 0.15 -2.05 8.00 -1.26 -3.19 116.55 113.37 1dx5 n ASP 186 Ca 0.29 -0.13 0.12 0.00 0.71 0.00 0.00 54.79 55.78 1dx5 n ASP 186 Cb 0.96 -0.27 0.10 0.00 -0.02 0.00 0.00 41.12 41.89 1dx5 n ASP 186 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1dx5 h GLU 186 N 0.00 0.00 0.00 -1.24 5.08 -1.37 -3.48 114.58 113.58 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 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 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 1.16 1.58 3.74 -3.84 0.00 -1.19 -4.94 105.19 101.69 1dx5 n GLY 186 Ca 0.02 -0.05 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 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 2.79 0.00 1.61 1.02 -1.26 -5.03 119.74 118.87 1dx5 s LYS 186 Ca 0.00 2.01 0.00 0.00 0.02 0.00 0.00 55.97 58.00 1dx5 s LYS 186 Cb 0.00 -1.94 0.00 0.00 -0.52 0.00 0.00 37.83 35.37 1dx5 s LYS 186 CO 0.00 -1.40 0.00 2.89 -0.92 0.00 0.00 175.35 175.92 1dx5 n ARG 187 N -1.65 0.30 0.00 1.68 1.85 -1.26 -4.70 116.66 112.88 1dx5 n ARG 187 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.99 1dx5 n ARG 187 Cb 0.48 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.89 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 0.69 4.43 3.61 2.89 0.00 -1.26 -4.91 105.19 110.64 1dx5 n GLY 188 Ca 0.00 -1.41 -0.02 0.00 0.00 0.00 0.00 46.02 44.60 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 -0.08 0.65 1.61 2.15 -0.76 -4.64 116.67 115.60 1dx5 s ASP 189 Ca 0.00 -0.04 -0.07 0.00 0.43 0.00 0.00 52.55 52.87 1dx5 s ASP 189 Cb 0.00 0.11 0.03 0.00 -0.30 0.00 0.00 42.92 42.75 1dx5 s ASP 189 CO 0.00 -0.18 0.97 0.00 -0.17 0.00 0.00 175.17 175.79 1dx5 s ALA 190 N -2.30 3.17 0.19 3.66 0.00 -1.26 -0.16 121.76 125.06 1dx5 s ALA 190 Ca 0.12 -0.71 -0.04 0.00 0.00 0.00 0.00 51.96 51.33 1dx5 s ALA 190 Cb 0.01 -2.68 0.02 0.00 0.00 0.00 0.00 23.12 20.47 1dx5 s ALA 190 CO -0.04 -1.03 0.32 0.00 0.00 0.00 0.00 175.76 175.01 1dx5 n GLU 192 N -0.30 1.26 0.00 0.00 2.13 -1.26 -1.02 120.64 121.46 1dx5 n GLU 192 Ca -0.02 0.46 0.00 0.00 0.66 0.00 0.00 57.16 58.26 1dx5 n GLU 192 Cb 0.31 -2.12 0.00 0.00 0.27 0.00 0.00 31.44 29.90 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 2.74 2.01 0.07 8.31 0.00 -1.26 -0.58 105.19 116.48 1dx5 n GLY 193 Ca 0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.33 1dx5 n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1dx5 n ASP 194 N 0.00 0.69 -4.60 1.61 8.00 -0.18 -3.70 116.55 118.36 1dx5 n ASP 194 Ca 0.00 0.19 -0.42 0.00 0.71 0.00 0.00 54.79 55.27 1dx5 n ASP 194 Cb 0.00 -0.04 0.01 0.00 -0.02 0.00 0.00 41.12 41.07 1dx5 n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1dx5 n SER 195 N -2.08 1.21 0.00 -2.24 7.64 -1.26 -1.51 113.62 115.38 1dx5 n SER 195 Ca 0.04 1.06 0.00 0.00 1.01 0.00 0.00 58.87 60.98 1dx5 n SER 195 Cb 0.43 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.29 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 1.21 3.15 3.75 0.23 0.00 -0.60 -0.08 105.19 112.85 1dx5 n GLY 196 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.79 2.05 0.23 -0.02 0.00 -0.57 -3.04 107.32 104.19 1dx5 s GLY 197 Ca 0.00 0.55 -0.16 0.00 0.00 0.00 0.00 44.72 45.11 1dx5 s GLY 197 CO 0.00 0.91 0.66 2.56 0.00 0.00 0.00 173.10 177.23 1dx5 s PRO 198 N -4.27 4.05 -0.42 2.90 0.04 -1.26 -1.00 135.00 135.04 1dx5 s PRO 198 Ca 0.67 0.64 -0.06 0.00 0.04 0.00 0.00 61.00 62.28 1dx5 s PRO 198 Cb -0.21 -2.74 0.10 0.00 0.04 0.00 0.00 34.50 31.69 1dx5 s PRO 198 CO 0.46 0.34 0.24 0.12 0.04 0.00 0.00 177.00 178.20 1dx5 s PHE 199 N -1.68 3.44 0.16 0.56 2.19 -0.41 -3.61 117.98 118.64 1dx5 s PHE 199 Ca 0.45 -1.95 0.05 0.00 0.33 0.00 0.00 56.93 55.81 1dx5 s PHE 199 Cb -0.14 -3.11 -0.04 0.00 -1.31 0.00 0.00 43.02 38.43 1dx5 s PHE 199 CO 0.20 -0.92 0.12 0.14 1.83 0.00 0.00 175.22 176.58 1dx5 s VAL 200 N 1.29 4.42 -0.03 3.12 -7.23 0.94 -1.08 120.40 121.83 1dx5 s VAL 200 Ca 0.05 -1.09 0.02 0.00 -1.81 0.00 0.00 61.98 59.14 1dx5 s VAL 200 Cb -0.23 -3.24 0.01 0.00 0.56 0.00 0.00 36.38 33.47 1dx5 s VAL 200 CO -0.01 -0.09 -0.06 -0.04 -0.31 0.00 0.00 175.10 174.58 1dx5 s MET 201 N -3.04 0.79 -0.22 4.82 -1.94 -0.30 0.50 119.30 119.90 1dx5 s MET 201 Ca 0.30 -0.20 -0.20 0.00 -1.71 0.00 0.00 55.69 53.89 1dx5 s MET 201 Cb -0.10 -0.76 -0.03 0.00 2.01 0.00 0.00 34.83 35.95 1dx5 s MET 201 CO 0.23 0.04 0.58 0.21 -0.01 0.00 0.00 175.02 176.07 1dx5 s LYS 202 N 0.39 4.16 -0.04 2.03 2.20 -1.26 -0.73 119.74 126.48 1dx5 s LYS 202 Ca -0.05 0.50 -0.30 0.00 -0.36 0.00 0.00 55.97 55.76 1dx5 s LYS 202 Cb -0.09 -3.60 -0.05 0.00 -1.51 0.00 0.00 37.83 32.58 1dx5 s LYS 202 CO 0.00 -0.27 1.44 0.45 -0.36 0.00 0.00 175.35 176.61 1dx5 s SER 203 N 1.30 6.82 0.14 1.43 0.15 0.93 -4.89 113.70 119.59 1dx5 s SER 203 Ca 0.26 2.07 0.20 0.00 0.70 0.00 0.00 55.95 59.18 1dx5 s SER 203 Cb -0.16 -2.55 0.83 0.00 -1.71 0.00 0.00 66.02 62.44 1dx5 s SER 203 CO 0.09 -0.78 1.62 -0.81 1.20 0.00 0.00 173.24 174.56 1dx5 n PRO 204 N 6.04 0.11 -0.05 5.44 -0.04 -1.26 -0.39 135.00 144.84 1dx5 n PRO 204 Ca 0.14 0.33 -0.02 0.00 -0.04 0.00 0.00 63.50 63.92 1dx5 n PRO 204 Cb 0.44 -1.70 -0.01 0.00 -0.04 0.00 0.00 33.50 32.18 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 -0.28 0.54 0.04 -1.96 -3.41 116.94 111.86 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 0.33 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.48 1dx5 h PHE 204 CO 0.00 0.00 0.00 0.27 -0.60 0.00 0.00 178.31 177.98 1dx5 n ASN 204 N -4.46 2.78 -0.47 2.17 2.04 -1.24 -4.99 115.26 111.09 1dx5 n ASN 204 Ca -0.03 -1.85 -0.06 0.00 -0.44 0.00 0.00 54.58 52.20 1dx5 n ASN 204 Cb 0.11 -0.18 -0.03 0.00 -2.53 0.00 0.00 39.78 37.15 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 0.75 -5.33 -4.90 0.53 4.13 0.48 -5.00 115.26 105.92 1dx5 n ASN 205 Ca 0.12 0.15 -0.30 0.00 1.68 0.00 0.00 54.58 56.24 1dx5 n ASN 205 Cb 0.42 -3.38 -0.04 0.00 -1.54 0.00 0.00 39.78 35.25 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 -2.30 3.64 -0.00 3.52 0.52 -1.26 -4.71 118.95 118.36 1dx5 s ARG 206 Ca 0.00 -0.03 -0.16 0.00 -0.52 0.00 0.00 55.73 55.02 1dx5 s ARG 206 Cb 0.00 -2.73 -0.06 0.00 0.52 0.00 0.00 34.95 32.68 1dx5 s ARG 206 CO 0.00 0.33 0.45 -1.58 0.02 0.00 0.00 175.30 174.52 1dx5 s TRP 207 N -1.89 3.71 -0.01 -0.53 0.52 -1.26 -0.05 118.94 119.44 1dx5 s TRP 207 Ca 0.43 1.03 0.05 0.00 0.02 0.00 0.00 56.10 57.63 1dx5 s TRP 207 Cb -0.11 -2.36 -0.01 0.00 -1.15 0.00 0.00 33.47 29.83 1dx5 s TRP 207 CO 0.27 0.56 -0.16 0.71 0.02 0.00 0.00 176.95 178.35 1dx5 s TYR 208 N -0.83 1.47 -0.57 -1.98 1.51 0.09 -2.45 117.35 114.59 1dx5 s TYR 208 Ca 0.25 -0.28 -0.22 0.00 -1.01 0.00 0.00 57.07 55.80 1dx5 s TYR 208 Cb -0.17 -0.94 0.05 0.00 -0.11 0.00 0.00 41.96 40.79 1dx5 s TYR 208 CO 0.14 -0.02 0.87 -1.14 -1.11 0.00 0.00 175.55 174.29 1dx5 s GLN 209 N -0.42 3.22 0.18 -0.62 0.74 0.09 -1.15 119.66 121.71 1dx5 s GLN 209 Ca 0.06 -0.57 0.18 0.00 0.05 0.00 0.00 55.36 55.08 1dx5 s GLN 209 Cb -0.06 -4.11 -0.01 0.00 1.10 0.00 0.00 33.01 29.92 1dx5 s GLN 209 CO -0.01 -1.51 1.11 0.52 -0.55 0.00 0.00 175.29 174.85 1dx5 h MET 210 N 9.30 0.00 -3.75 1.67 2.86 -1.44 -3.39 114.93 120.18 1dx5 h MET 210 Ca -0.27 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.29 1dx5 h MET 210 Cb 1.08 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.64 1dx5 h MET 210 CO 1.08 0.26 -0.17 0.20 1.06 0.00 0.00 176.91 179.34 1dx5 s GLY 211 N -4.56 0.63 -0.07 8.32 0.00 -0.97 -1.91 107.32 108.76 1dx5 s GLY 211 Ca 0.00 -0.96 0.03 0.00 0.00 0.00 0.00 44.72 43.79 1dx5 s GLY 211 CO 0.78 -0.71 -0.15 -0.42 0.00 0.00 0.00 173.10 172.60 1dx5 s ILE 212 N -4.03 1.35 -0.04 0.90 1.01 -0.80 -1.29 121.20 118.30 1dx5 s ILE 212 Ca 0.24 -0.61 -0.30 0.00 0.00 0.00 0.00 60.65 59.98 1dx5 s ILE 212 Cb 0.00 -1.21 -0.08 0.00 0.01 0.00 0.00 42.46 41.18 1dx5 s ILE 212 CO 0.09 0.40 2.04 0.52 0.00 0.00 0.00 174.94 178.00 1dx5 n VAL 213 N 3.68 0.65 -0.00 2.92 0.31 -0.17 -0.60 118.33 125.12 1dx5 n VAL 213 Ca -0.22 -0.22 -0.02 0.00 -0.01 0.00 0.00 64.34 63.87 1dx5 n VAL 213 Cb 0.52 -2.37 -0.01 0.00 -0.91 0.00 0.00 33.84 31.08 1dx5 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1dx5 n SER 214 N 8.62 1.00 -3.19 4.52 2.88 -0.93 -1.55 113.62 124.97 1dx5 n SER 214 Ca 0.23 0.15 -0.10 0.00 -1.33 0.00 0.00 58.87 57.82 1dx5 n SER 214 Cb 0.41 -0.40 -0.00 0.00 -0.75 0.00 0.00 64.21 63.47 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 -1.94 0.33 -0.02 0.66 1.48 -0.83 -4.95 118.94 113.66 1dx5 s TRP 215 Ca -0.08 -0.85 -0.24 0.00 -1.06 0.00 0.00 56.10 53.87 1dx5 s TRP 215 Cb 0.01 0.55 0.08 0.00 -1.16 0.00 0.00 33.47 32.95 1dx5 s TRP 215 CO 0.11 -1.39 1.09 0.41 -4.06 0.00 0.00 176.95 173.12 1dx5 n GLY 216 N -0.52 0.27 2.91 3.67 0.00 -1.26 -0.14 105.19 110.12 1dx5 n GLY 216 Ca -0.05 -1.01 -0.30 0.00 0.00 0.00 0.00 46.02 44.65 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 -2.01 1.30 2.39 1.61 2.02 -1.26 -5.03 118.70 117.72 1dx5 s GLU 217 Ca 0.26 -1.34 0.00 0.00 0.02 0.00 0.00 54.97 53.90 1dx5 s GLU 217 Cb -0.01 -2.63 0.00 0.00 0.10 0.00 0.00 34.13 31.59 1dx5 s GLU 217 CO -0.01 -0.84 0.00 0.41 0.02 0.00 0.00 175.26 174.84 1dx5 n GLY 219 N 4.57 -0.94 3.17 -1.39 0.00 -1.26 -4.79 105.19 104.55 1dx5 n GLY 219 Ca -0.03 -1.20 -0.10 0.00 0.00 0.00 0.00 46.02 44.69 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 5.28 -6.02 -4.88 0.00 2.03 -1.26 -4.54 116.55 107.15 1dx5 n ASP 221 Ca -0.09 -0.38 -0.29 0.00 0.52 0.00 0.00 54.79 54.54 1dx5 n ASP 221 Cb 0.50 -4.75 -0.01 0.00 -0.72 0.00 0.00 41.12 36.14 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 -5.92 3.66 0.09 -0.67 0.52 -1.26 -4.93 118.95 110.44 1dx5 s ARG 221 Ca 0.41 0.47 -0.30 0.00 -0.52 0.00 0.00 55.73 55.79 1dx5 s ARG 221 Cb -0.18 -2.29 -0.06 0.00 0.52 0.00 0.00 34.95 32.93 1dx5 s ARG 221 CO 0.51 -0.24 1.17 -0.51 0.02 0.00 0.00 175.30 176.25 1dx5 s ASP 222 N -3.74 7.13 0.00 0.23 1.01 -1.26 -2.80 116.67 117.23 1dx5 s ASP 222 Ca 0.51 2.02 0.00 0.00 0.71 0.00 0.00 52.55 55.79 1dx5 s ASP 222 Cb -0.10 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.24 1dx5 s ASP 222 CO 0.42 -0.41 0.00 0.61 0.21 0.00 0.00 175.17 176.00 1dx5 n GLY 223 N 2.93 0.89 3.64 0.21 0.00 -1.26 -5.03 105.19 106.56 1dx5 n GLY 223 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.26 2.30 -0.01 1.61 -0.14 -1.12 -4.68 119.74 117.44 1dx5 s LYS 224 Ca 0.00 -1.21 -0.02 0.00 -1.36 0.00 0.00 55.97 53.38 1dx5 s LYS 224 Cb 0.00 -2.27 -0.00 0.00 -1.68 0.00 0.00 37.83 33.88 1dx5 s LYS 224 CO 0.00 0.43 0.04 0.71 -0.76 0.00 0.00 175.35 175.77 1dx5 s TYR 225 N -1.84 0.05 0.30 3.18 2.02 -1.26 -4.73 117.35 115.07 1dx5 s TYR 225 Ca 0.27 -0.09 -0.29 0.00 -0.37 0.00 0.00 57.07 56.59 1dx5 s TYR 225 Cb -0.09 -0.05 -0.10 0.00 -0.40 0.00 0.00 41.96 41.32 1dx5 s TYR 225 CO 0.18 -0.11 1.23 0.20 -1.57 0.00 0.00 175.55 175.48 1dx5 s GLY 226 N -0.60 2.96 -0.14 0.71 0.00 -0.89 -4.77 107.32 104.59 1dx5 s GLY 226 Ca -0.07 1.12 -0.05 0.00 0.00 0.00 0.00 44.72 45.72 1dx5 s GLY 226 CO -0.00 1.79 0.05 -1.36 0.00 0.00 0.00 173.10 173.58 1dx5 s PHE 227 N -1.00 3.28 0.10 1.90 0.40 0.81 -1.23 117.98 122.24 1dx5 s PHE 227 Ca 0.48 0.18 0.10 0.00 -0.60 0.00 0.00 56.93 57.10 1dx5 s PHE 227 Cb -0.37 -1.95 -0.04 0.00 0.51 0.00 0.00 43.02 41.18 1dx5 s PHE 227 CO 0.47 0.37 -0.25 0.71 0.70 0.00 0.00 175.22 177.22 1dx5 s TYR 228 N -0.34 2.18 -0.11 0.36 1.51 1.00 -1.97 117.35 119.98 1dx5 s TYR 228 Ca 0.08 -0.39 -0.30 0.00 -1.01 0.00 0.00 57.07 55.46 1dx5 s TYR 228 Cb -0.12 -1.22 -0.02 0.00 -0.11 0.00 0.00 41.96 40.50 1dx5 s TYR 228 CO 0.02 0.26 1.17 0.99 -1.11 0.00 0.00 175.55 176.87 1dx5 s THR 229 N -1.01 4.40 -0.55 -0.71 2.01 0.23 -1.62 115.64 118.38 1dx5 s THR 229 Ca 0.12 1.70 -0.27 0.00 0.31 0.00 0.00 61.69 63.55 1dx5 s THR 229 Cb -0.10 -4.09 -0.01 0.00 0.01 0.00 0.00 72.50 68.31 1dx5 s THR 229 CO 0.05 -0.06 1.71 -2.28 -0.69 0.00 0.00 174.62 173.35 1dx5 s HIS 230 N 2.62 1.88 0.13 4.92 2.46 -0.05 -1.91 115.29 125.34 1dx5 s HIS 230 Ca 0.53 0.64 -0.17 0.00 0.47 0.00 0.00 55.06 56.52 1dx5 s HIS 230 Cb -0.22 -4.20 -0.03 0.00 -0.13 0.00 0.00 32.58 28.01 1dx5 s HIS 230 CO 0.18 -2.33 1.73 0.28 -2.47 0.00 0.00 174.74 172.13 1dx5 h VAL 231 N 6.70 1.13 -0.63 0.89 2.07 -1.68 -3.12 116.25 121.61 1dx5 h VAL 231 Ca -0.28 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 66.90 1dx5 h VAL 231 Cb 1.14 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 1dx5 h VAL 231 CO 1.18 0.14 0.40 0.15 0.02 0.00 0.00 177.57 179.46 1dx5 h PHE 232 N 0.41 0.81 -0.40 1.57 3.57 -1.86 -1.16 116.94 119.87 1dx5 h PHE 232 Ca 0.12 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.73 1dx5 h PHE 232 Cb 0.06 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.51 1dx5 h PHE 232 CO -0.03 0.53 0.29 0.00 -2.23 0.00 0.00 178.31 176.87 1dx5 h ARG 233 N 0.86 0.08 -0.41 1.11 2.47 -1.91 -0.70 114.38 115.88 1dx5 h ARG 233 Ca 0.23 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.95 1dx5 h ARG 233 Cb -0.07 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.24 1dx5 h ARG 233 CO -0.05 0.05 0.00 1.28 0.56 0.00 0.00 179.97 181.81 1dx5 n LEU 234 N -4.44 3.26 -0.03 3.04 7.99 -0.94 -4.61 117.00 121.28 1dx5 n LEU 234 Ca 0.06 -1.68 0.12 0.00 -0.01 0.00 0.00 56.01 54.50 1dx5 n LEU 234 Cb 0.43 -0.27 0.53 0.00 -0.11 0.00 0.00 43.42 44.00 1dx5 n LEU 234 CO 0.36 0.75 1.17 0.50 -1.51 0.00 0.00 177.39 178.66 1dx5 h LYS 235 N 3.53 0.32 -0.40 3.23 3.64 0.13 -1.67 116.57 125.34 1dx5 h LYS 235 Ca 0.00 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1dx5 h LYS 235 Cb 0.86 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.59 1dx5 h LYS 235 CO 0.00 0.21 0.26 -0.22 -2.27 0.00 0.00 179.45 177.43 1dx5 h LYS 236 N 0.33 0.51 -0.61 1.90 3.64 -1.81 0.49 116.57 121.01 1dx5 h LYS 236 Ca 0.23 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.49 1dx5 h LYS 236 Cb 0.50 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 1dx5 h LYS 236 CO -0.05 0.34 0.02 2.35 -2.27 0.00 0.00 179.45 179.83 1dx5 h TRP 237 N 0.53 1.15 0.05 1.91 7.01 -1.67 -0.60 115.95 124.32 1dx5 h TRP 237 Ca 0.15 -0.19 0.01 0.00 2.11 0.00 0.00 58.89 60.97 1dx5 h TRP 237 Cb -0.04 -0.30 -0.01 0.00 -2.10 0.00 0.00 29.16 26.71 1dx5 h TRP 237 CO -0.06 1.01 -0.09 0.82 -2.79 0.00 0.00 178.44 177.33 1dx5 h ILE 238 N 0.96 0.79 -0.09 2.65 2.04 -0.88 -2.14 117.51 120.84 1dx5 h ILE 238 Ca 0.17 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.00 1dx5 h ILE 238 Cb 0.54 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 1dx5 h ILE 238 CO 0.03 0.00 -0.12 1.56 0.00 0.00 0.00 178.15 179.62 1dx5 h GLN 239 N -0.17 0.14 0.10 2.37 4.20 -0.77 -2.60 115.11 118.37 1dx5 h GLN 239 Ca 0.02 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 1dx5 h GLN 239 Cb 0.19 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1dx5 h GLN 239 CO -0.05 0.27 -0.05 -0.22 -0.67 0.00 0.00 178.83 178.11 1dx5 h LYS 240 N 0.14 -0.13 -0.10 1.46 3.64 -0.63 -1.91 116.57 119.04 1dx5 h LYS 240 Ca 0.03 0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.30 1dx5 h LYS 240 Cb 0.30 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1dx5 h LYS 240 CO 0.02 0.19 -0.47 -0.39 -2.27 0.00 0.00 179.45 176.53 1dx5 h VAL 241 N -0.46 1.33 -0.24 2.00 -1.51 -1.36 -0.95 116.25 115.06 1dx5 h VAL 241 Ca -0.01 -1.67 -0.14 0.00 -1.23 0.00 0.00 66.70 63.64 1dx5 h VAL 241 Cb 0.38 1.78 -0.01 0.00 -2.13 0.00 0.00 31.29 31.32 1dx5 h VAL 241 CO 0.02 0.50 -0.43 0.40 -1.23 0.00 0.00 177.57 176.83 1dx5 h ILE 242 N 0.20 1.30 -0.00 7.19 2.04 -1.50 0.33 117.51 127.06 1dx5 h ILE 242 Ca 0.01 -1.62 -0.18 0.00 1.00 0.00 0.00 64.86 64.07 1dx5 h ILE 242 Cb 0.91 1.58 0.01 0.00 -0.74 0.00 0.00 36.82 38.59 1dx5 h ILE 242 CO 0.07 0.51 -0.72 0.44 0.00 0.00 0.00 178.15 178.46 1dx5 h ASP 243 N 0.49 0.64 0.04 1.72 3.32 -1.21 -2.06 116.42 119.35 1dx5 h ASP 243 Ca 0.04 -0.75 -0.00 0.00 0.02 0.00 0.00 57.03 56.33 1dx5 h ASP 243 Cb 0.95 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.31 1dx5 h ASP 243 CO 0.09 1.31 -0.02 -0.61 -1.72 0.00 0.00 179.24 178.28 1dx5 h GLN 244 N 0.04 -0.05 -0.71 3.56 4.15 -1.18 -3.19 115.11 117.73 1dx5 h GLN 244 Ca -0.09 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.33 1dx5 h GLN 244 Cb 1.41 0.01 0.00 0.00 0.21 0.00 0.00 27.48 29.11 1dx5 h GLN 244 CO 0.14 0.36 0.00 1.19 -1.93 0.00 0.00 178.83 178.59 1dx5 n PHE 245 N -4.92 0.98 -0.88 3.99 3.72 0.10 -5.03 117.46 115.43 1dx5 n PHE 245 Ca -0.08 -0.35 0.07 0.00 -0.05 0.00 0.00 57.45 57.04 1dx5 n PHE 245 Cb 0.23 -0.26 -0.04 0.00 -0.94 0.00 0.00 39.48 38.47 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 0.47 -3.23 0.68 1.37 0.00 -0.78 -4.97 105.19 98.74 1dx5 n GLY 246 Ca 0.14 -1.16 0.13 0.00 0.00 0.00 0.00 46.02 45.14 1dx5 n GLY 246 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50