#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 5.35 -1.65 1.39 1.01 0.90 -4.23 120.40 123.17 1dx5 s VAL 17 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.39 1dx5 s VAL 17 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.85 1dx5 s VAL 17 CO 0.00 0.51 0.00 -0.62 0.00 0.00 0.00 175.10 174.99 1dx5 n GLU 18 N 2.73 -1.31 -0.68 2.72 -0.58 -1.26 -1.93 120.64 120.32 1dx5 n GLU 18 Ca -0.16 0.96 0.00 0.00 -0.42 0.00 0.00 57.16 57.55 1dx5 n GLU 18 Cb 0.53 -5.33 0.00 0.00 -0.57 0.00 0.00 31.44 26.07 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 -0.94 1.48 3.27 0.62 0.00 -1.26 -4.70 105.19 103.66 1dx5 n GLY 19 Ca -0.19 -2.04 -0.16 0.00 0.00 0.00 0.00 46.02 43.63 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 0.93 0.03 1.61 1.04 -0.25 -4.90 113.70 111.16 1dx5 s SER 20 Ca 0.00 -1.47 -0.30 0.00 0.48 0.00 0.00 55.95 54.66 1dx5 s SER 20 Cb 0.00 0.34 -0.07 0.00 0.10 0.00 0.00 66.02 66.39 1dx5 s SER 20 CO 0.00 -0.84 1.58 -1.81 0.98 0.00 0.00 173.24 173.14 1dx5 s ASP 21 N -3.28 6.69 0.54 7.02 1.11 -1.26 -0.91 116.67 126.58 1dx5 s ASP 21 Ca 0.38 2.33 -0.20 0.00 0.18 0.00 0.00 52.55 55.24 1dx5 s ASP 21 Cb 0.06 -2.56 -0.06 0.00 1.07 0.00 0.00 42.92 41.44 1dx5 s ASP 21 CO 0.15 -0.84 1.14 0.00 1.18 0.00 0.00 175.17 176.80 1dx5 s ALA 22 N 2.80 2.71 0.60 5.23 0.00 -0.17 -4.85 121.76 128.07 1dx5 s ALA 22 Ca 0.71 0.86 -0.09 0.00 0.00 0.00 0.00 51.96 53.44 1dx5 s ALA 22 Cb -0.36 -3.37 -0.02 0.00 0.00 0.00 0.00 23.12 19.37 1dx5 s ALA 22 CO 0.30 -0.80 0.96 -1.21 0.00 0.00 0.00 175.76 175.00 1dx5 s GLU 23 N -3.23 3.31 0.21 0.00 2.02 -1.26 -4.91 118.70 114.84 1dx5 s GLU 23 Ca 0.72 0.41 -0.31 0.00 0.02 0.00 0.00 54.97 55.82 1dx5 s GLU 23 Cb -0.25 -2.18 -0.10 0.00 0.10 0.00 0.00 34.13 31.70 1dx5 s GLU 23 CO 0.28 -0.59 1.53 0.42 0.02 0.00 0.00 175.26 176.92 1dx5 s ILE 24 N -3.07 2.56 -0.01 -1.63 -1.09 -1.26 -2.35 121.20 114.35 1dx5 s ILE 24 Ca 0.53 0.43 0.00 0.00 -2.23 0.00 0.00 60.65 59.39 1dx5 s ILE 24 Cb -0.11 -3.28 0.00 0.00 -1.58 0.00 0.00 42.46 37.50 1dx5 s ILE 24 CO 0.50 0.05 0.00 0.61 -1.23 0.00 0.00 174.94 174.87 1dx5 n GLY 25 N 3.00 0.33 0.17 6.18 0.00 -1.26 -4.91 105.19 108.70 1dx5 n GLY 25 Ca 0.11 -0.01 -0.02 0.00 0.00 0.00 0.00 46.02 46.10 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 0.64 0.14 -2.21 1.61 -1.53 -1.83 -3.37 114.93 108.40 1dx5 h MET 26 Ca -0.00 -0.08 -0.58 0.00 -3.44 0.00 0.00 59.70 55.60 1dx5 h MET 26 Cb 0.35 0.00 -0.39 0.00 -0.55 0.00 0.00 31.60 31.02 1dx5 h MET 26 CO 0.00 0.61 -1.02 0.43 0.14 0.00 0.00 176.91 177.07 1dx5 n SER 27 N -3.95 -0.01 0.14 1.39 7.64 -1.26 -4.97 113.62 112.60 1dx5 n SER 27 Ca -0.02 -2.56 0.10 0.00 1.01 0.00 0.00 58.87 57.41 1dx5 n SER 27 Cb 0.53 -0.60 0.52 0.00 -1.01 0.00 0.00 64.21 63.65 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 2.12 0.14 0.01 1.43 -0.02 -1.26 -1.62 135.00 135.79 1dx5 n PRO 28 Ca 0.26 0.57 0.11 0.00 -2.02 0.00 0.00 63.50 62.42 1dx5 n PRO 28 Cb 0.50 -1.90 0.11 0.00 -0.02 0.00 0.00 33.50 32.19 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 -2.19 0.08 -1.86 6.00 2.14 -1.03 -2.08 117.44 118.51 1dx5 n TRP 29 Ca -0.00 0.02 -0.42 0.00 2.07 0.00 0.00 57.50 59.17 1dx5 n TRP 29 Cb 0.08 -0.25 -0.03 0.00 -0.81 0.00 0.00 31.31 30.30 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 -3.05 4.17 0.07 -2.67 2.00 -0.64 -0.58 119.66 118.96 1dx5 s GLN 30 Ca 0.08 2.39 0.06 0.00 -2.00 0.00 0.00 55.36 55.90 1dx5 s GLN 30 Cb 0.16 -3.92 -0.04 0.00 0.80 0.00 0.00 33.01 30.01 1dx5 s GLN 30 CO 0.76 -0.86 -0.12 0.08 -0.50 0.00 0.00 175.29 174.65 1dx5 s VAL 31 N 3.75 3.21 -0.23 1.34 1.01 -0.36 -4.14 120.40 124.98 1dx5 s VAL 31 Ca 0.79 -1.16 -0.03 0.00 0.00 0.00 0.00 61.98 61.57 1dx5 s VAL 31 Cb -0.39 -2.44 0.01 0.00 0.00 0.00 0.00 36.38 33.56 1dx5 s VAL 31 CO 0.35 0.23 -0.05 -0.32 0.00 0.00 0.00 175.10 175.31 1dx5 s MET 32 N -1.82 3.16 -0.22 2.72 1.75 -0.14 -1.27 119.30 123.49 1dx5 s MET 32 Ca 0.18 -0.77 -0.23 0.00 -1.25 0.00 0.00 55.69 53.63 1dx5 s MET 32 Cb -0.11 -3.01 -0.02 0.00 2.84 0.00 0.00 34.83 34.54 1dx5 s MET 32 CO 0.10 -0.28 0.74 -0.51 -0.65 0.00 0.00 175.02 174.41 1dx5 s LEU 33 N 1.42 4.11 -0.18 4.11 1.43 0.16 -1.17 118.68 128.57 1dx5 s LEU 33 Ca 0.04 0.95 -0.01 0.00 -1.03 0.00 0.00 54.13 54.08 1dx5 s LEU 33 Cb -0.15 -3.05 0.01 0.00 0.03 0.00 0.00 46.19 43.02 1dx5 s LEU 33 CO -0.04 -0.40 -0.14 0.12 0.23 0.00 0.00 176.35 176.13 1dx5 s PHE 34 N 2.37 2.83 0.16 0.29 5.36 0.41 -0.98 117.98 128.43 1dx5 s PHE 34 Ca 0.32 -1.26 -0.30 0.00 -0.96 0.00 0.00 56.93 54.73 1dx5 s PHE 34 Cb -0.16 -1.96 -0.07 0.00 -0.34 0.00 0.00 43.02 40.48 1dx5 s PHE 34 CO 0.09 -0.64 1.14 0.50 -1.46 0.00 0.00 175.22 174.86 1dx5 s ARG 35 N 1.21 4.55 0.08 10.12 3.52 0.23 -0.10 118.95 138.55 1dx5 s ARG 35 Ca 0.02 1.76 -0.12 0.00 -0.13 0.00 0.00 55.73 57.27 1dx5 s ARG 35 Cb -0.14 -3.28 -0.24 0.00 -1.56 0.00 0.00 34.95 29.73 1dx5 s ARG 35 CO -0.06 -0.01 1.17 0.87 -0.81 0.00 0.00 175.30 176.45 1dx5 h LYS 36 N 5.36 0.59 -2.91 5.12 1.57 -1.44 -2.66 116.57 122.20 1dx5 h LYS 36 Ca -0.44 -0.72 -0.49 0.00 -1.87 0.00 0.00 60.65 57.13 1dx5 h LYS 36 Cb 1.21 0.23 -0.40 0.00 0.08 0.00 0.00 32.23 33.35 1dx5 h LYS 36 CO 0.74 1.31 -0.76 0.45 -0.57 0.00 0.00 179.45 180.62 1dx5 s SER 36 N -7.31 2.83 0.86 0.86 0.15 -1.26 -3.20 113.70 106.63 1dx5 s SER 36 Ca -0.09 -0.90 -0.12 0.00 0.70 0.00 0.00 55.95 55.55 1dx5 s SER 36 Cb 0.07 -0.26 0.11 0.00 -1.71 0.00 0.00 66.02 64.22 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 2.13 1.58 -0.61 5.44 0.04 -1.26 -5.04 135.00 137.27 1dx5 s PRO 37 Ca 0.05 0.69 -0.27 0.00 0.04 0.00 0.00 61.00 61.51 1dx5 s PRO 37 Cb -0.16 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.53 1dx5 s PRO 37 CO -0.22 -1.98 1.55 -0.65 0.04 0.00 0.00 177.00 175.74 1dx5 s GLN 38 N -5.06 3.04 0.08 4.56 -1.52 -1.19 -4.63 119.66 114.94 1dx5 s GLN 38 Ca 0.62 0.37 -0.26 0.00 -1.95 0.00 0.00 55.36 54.15 1dx5 s GLN 38 Cb -0.16 -4.23 0.08 0.00 -0.22 0.00 0.00 33.01 28.48 1dx5 s GLN 38 CO 0.55 -2.27 0.70 -1.83 -0.25 0.00 0.00 175.29 172.20 1dx5 s GLU 39 N 6.11 1.10 0.24 2.91 -1.05 -1.00 -5.00 118.70 122.00 1dx5 s GLU 39 Ca 0.54 -0.32 -0.31 0.00 -0.15 0.00 0.00 54.97 54.73 1dx5 s GLU 39 Cb -0.11 0.51 -0.11 0.00 -0.44 0.00 0.00 34.13 33.98 1dx5 s GLU 39 CO 0.21 -0.46 1.60 -1.17 0.95 0.00 0.00 175.26 176.38 1dx5 s LEU 40 N -2.45 4.36 -0.23 1.83 2.96 -1.26 -0.60 118.68 123.29 1dx5 s LEU 40 Ca 0.01 2.81 -0.14 0.00 -0.22 0.00 0.00 54.13 56.59 1dx5 s LEU 40 Cb -0.01 -3.62 -0.10 0.00 0.50 0.00 0.00 46.19 42.97 1dx5 s LEU 40 CO -0.09 -0.88 -0.33 -0.11 -1.32 0.00 0.00 176.35 173.62 1dx5 n LEU 41 N 3.04 1.83 -3.82 -0.68 7.94 -0.15 -4.79 117.00 120.37 1dx5 n LEU 41 Ca 0.11 0.31 -0.03 0.00 -1.11 0.00 0.00 56.01 55.30 1dx5 n LEU 41 Cb 0.37 -0.74 0.01 0.00 0.53 0.00 0.00 43.42 43.59 1dx5 n LEU 41 CO 0.63 0.32 0.81 0.00 -1.11 0.00 0.00 177.39 178.04 1dx5 s GLY 43 N -3.23 1.75 0.14 0.00 0.00 0.93 -0.67 107.32 106.25 1dx5 s GLY 43 Ca 0.18 -1.87 -0.17 0.00 0.00 0.00 0.00 44.72 42.86 1dx5 s GLY 43 CO 0.03 -1.32 0.81 0.00 0.00 0.00 0.00 173.10 172.62 1dx5 n ALA 44 N -2.69 -2.11 -2.97 3.20 0.00 -0.39 -3.88 120.51 111.67 1dx5 n ALA 44 Ca 0.16 -0.78 -0.10 0.00 0.00 0.00 0.00 53.44 52.71 1dx5 n ALA 44 Cb 0.61 0.43 -0.11 0.00 0.00 0.00 0.00 19.45 20.37 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 -2.90 0.16 -0.33 0.00 1.04 0.07 -1.22 113.70 110.52 1dx5 s SER 45 Ca 0.18 -0.35 -0.19 0.00 0.48 0.00 0.00 55.95 56.06 1dx5 s SER 45 Cb -0.02 0.10 -0.00 0.00 0.10 0.00 0.00 66.02 66.19 1dx5 s SER 45 CO 0.04 -0.24 0.59 -0.22 0.98 0.00 0.00 173.24 174.38 1dx5 s LEU 46 N -1.14 4.24 0.00 2.42 0.20 0.26 -0.30 118.68 124.36 1dx5 s LEU 46 Ca -0.12 0.19 0.12 0.00 0.69 0.00 0.00 54.13 55.00 1dx5 s LEU 46 Cb -0.08 -2.72 -0.01 0.00 -0.43 0.00 0.00 46.19 42.95 1dx5 s LEU 46 CO -0.01 -0.51 0.69 2.30 -0.29 0.00 0.00 176.35 178.54 1dx5 n ILE 47 N 5.46 0.00 -3.89 6.68 -5.35 -0.82 -1.67 119.36 119.77 1dx5 n ILE 47 Ca -0.03 -0.36 -0.03 0.00 -0.27 0.00 0.00 62.75 62.07 1dx5 n ILE 47 Cb 0.49 1.13 0.02 0.00 -1.74 0.00 0.00 39.64 39.54 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 -1.59 0.00 0.00 7.28 1.04 -1.21 -4.78 113.70 114.44 1dx5 s SER 48 Ca 0.10 -0.63 0.19 0.00 0.48 0.00 0.00 55.95 56.08 1dx5 s SER 48 Cb 0.10 0.47 0.85 0.00 0.10 0.00 0.00 66.02 67.54 1dx5 s SER 48 CO 0.32 -0.93 1.59 -0.90 0.98 0.00 0.00 173.24 174.29 1dx5 n ASP 49 N -1.20 0.00 0.00 7.02 5.75 -1.26 -3.64 116.55 123.22 1dx5 n ASP 49 Ca -0.02 0.31 0.00 0.00 -0.01 0.00 0.00 54.79 55.07 1dx5 n ASP 49 Cb 0.59 -0.42 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 1dx5 n ASP 49 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1dx5 n ARG 50 N -1.42 0.41 -5.24 0.11 1.74 -1.26 -0.17 116.66 110.83 1dx5 n ARG 50 Ca 0.06 -0.11 -0.30 0.00 -0.77 0.00 0.00 57.85 56.72 1dx5 n ARG 50 Cb 0.19 -0.51 -0.16 0.00 -1.02 0.00 0.00 32.46 30.95 1dx5 n ARG 50 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1dx5 s TRP 51 N -0.09 2.28 -0.04 -1.55 0.52 -1.24 -0.79 118.94 118.03 1dx5 s TRP 51 Ca 0.00 -0.53 0.05 0.00 0.02 0.00 0.00 56.10 55.64 1dx5 s TRP 51 Cb 0.00 -1.48 -0.01 0.00 -1.15 0.00 0.00 33.47 30.83 1dx5 s TRP 51 CO 0.00 -0.11 -0.19 0.08 0.02 0.00 0.00 176.95 176.76 1dx5 s VAL 52 N -0.41 1.54 -0.05 4.03 1.01 -0.56 -1.95 120.40 124.01 1dx5 s VAL 52 Ca 0.04 -0.79 -0.01 0.00 0.00 0.00 0.00 61.98 61.23 1dx5 s VAL 52 Cb -0.11 -1.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.93 1dx5 s VAL 52 CO 0.01 0.44 0.01 -0.22 0.00 0.00 0.00 175.10 175.34 1dx5 s LEU 53 N -0.08 3.59 0.00 3.92 2.96 0.59 -0.95 118.68 128.70 1dx5 s LEU 53 Ca -0.02 0.09 -0.03 0.00 -0.22 0.00 0.00 54.13 53.96 1dx5 s LEU 53 Cb -0.11 -1.93 0.01 0.00 0.50 0.00 0.00 46.19 44.66 1dx5 s LEU 53 CO 0.02 0.33 0.25 1.07 -1.32 0.00 0.00 176.35 176.70 1dx5 n THR 54 N 1.78 0.00 -3.58 3.68 5.66 -0.36 -0.75 114.28 120.71 1dx5 n THR 54 Ca -0.17 -0.61 -0.37 0.00 -3.05 0.00 0.00 64.05 59.86 1dx5 n THR 54 Cb 0.53 0.44 -0.06 0.00 -1.55 0.00 0.00 70.33 69.69 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 -1.82 3.74 0.26 1.79 0.00 -1.26 -1.22 121.76 123.23 1dx5 s ALA 55 Ca 0.10 -0.33 -0.01 0.00 0.00 0.00 0.00 51.96 51.72 1dx5 s ALA 55 Cb -0.01 -2.29 0.33 0.00 0.00 0.00 0.00 23.12 21.15 1dx5 s ALA 55 CO 0.07 0.53 1.72 0.00 0.00 0.00 0.00 175.76 178.08 1dx5 h ALA 56 N 4.48 1.05 0.00 0.00 0.00 -1.72 -3.01 119.26 120.06 1dx5 h ALA 56 Ca -0.51 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.08 1dx5 h ALA 56 Cb 1.21 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1dx5 h ALA 56 CO 0.62 0.58 0.00 -2.39 0.00 0.00 0.00 179.25 178.06 1dx5 n HIS 57 N -4.16 0.65 0.11 0.00 1.44 -1.26 -0.37 115.22 111.64 1dx5 n HIS 57 Ca 0.01 0.28 -0.03 0.00 -2.01 0.00 0.00 57.72 55.98 1dx5 n HIS 57 Cb 0.37 -0.96 0.08 0.00 0.12 0.00 0.00 29.99 29.60 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 -3.64 0.00 -3.71 0.00 4.77 -0.69 -4.87 117.00 108.87 1dx5 n LEU 59 Ca -0.01 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.80 1dx5 n LEU 59 Cb 0.71 0.29 -0.17 0.00 -2.33 0.00 0.00 43.42 41.93 1dx5 n LEU 59 CO 0.43 0.29 -0.31 -0.22 -1.33 0.00 0.00 177.39 176.25 1dx5 s LEU 60 N -4.87 0.45 0.21 2.23 2.96 0.50 -1.06 118.68 119.10 1dx5 s LEU 60 Ca -0.07 0.14 -0.22 0.00 -0.22 0.00 0.00 54.13 53.76 1dx5 s LEU 60 Cb 0.05 0.02 0.05 0.00 0.50 0.00 0.00 46.19 46.81 1dx5 s LEU 60 CO 0.60 -0.20 0.68 -0.47 -1.32 0.00 0.00 176.35 175.63 1dx5 s TYR 60 N 1.74 -0.36 0.00 5.38 5.04 0.04 -4.11 117.35 125.09 1dx5 s TYR 60 Ca -0.01 0.03 0.00 0.00 -2.44 0.00 0.00 57.07 54.65 1dx5 s TYR 60 Cb -0.12 0.63 0.00 0.00 0.35 0.00 0.00 41.96 42.82 1dx5 s TYR 60 CO -0.04 -1.02 0.00 -2.30 -1.34 0.00 0.00 175.55 170.85 1dx5 n PRO 60 N -0.42 0.00 -0.56 4.97 -0.02 -1.26 -1.51 135.00 136.20 1dx5 n PRO 60 Ca -0.10 0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.45 1dx5 n PRO 60 Cb 0.62 0.00 0.31 0.00 -0.02 0.00 0.00 33.50 34.41 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 1.34 -3.85 6.00 8.01 -1.26 -4.92 117.44 122.76 1dx5 n TRP 60 Ca 0.00 -0.52 -0.26 0.00 -1.31 0.00 0.00 57.50 55.42 1dx5 n TRP 60 Cb 0.00 -0.25 0.02 0.00 -2.01 0.00 0.00 31.31 29.06 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 0.85 -2.27 -4.48 -0.99 9.92 -1.11 -4.96 116.55 113.51 1dx5 n ASP 60 Ca 0.22 -0.85 -0.37 0.00 -0.53 0.00 0.00 54.79 53.25 1dx5 n ASP 60 Cb 0.81 -3.74 -0.12 0.00 -0.64 0.00 0.00 41.12 37.43 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 -6.34 3.64 -0.34 -1.24 2.20 -0.57 -5.01 119.74 112.09 1dx5 s LYS 60 Ca 0.25 -0.50 0.04 0.00 -0.36 0.00 0.00 55.97 55.40 1dx5 s LYS 60 Cb -0.13 -3.46 0.17 0.00 -1.51 0.00 0.00 37.83 32.90 1dx5 s LYS 60 CO 0.84 -0.24 0.47 1.21 -0.36 0.00 0.00 175.35 177.26 1dx5 s ASN 60 N 1.65 -0.06 0.05 1.43 2.47 -1.24 -0.78 114.94 118.47 1dx5 s ASN 60 Ca 0.06 -0.72 -0.25 0.00 0.42 0.00 0.00 52.86 52.37 1dx5 s ASN 60 Cb -0.16 1.26 -0.06 0.00 -1.45 0.00 0.00 41.25 40.84 1dx5 s ASN 60 CO 0.06 -0.28 0.77 -0.36 -3.72 0.00 0.00 177.10 173.57 1dx5 s PHE 60 N 2.13 3.75 0.54 0.43 0.08 -0.22 -5.03 117.98 119.67 1dx5 s PHE 60 Ca 0.13 1.49 0.08 0.00 0.12 0.00 0.00 56.93 58.75 1dx5 s PHE 60 Cb -0.11 -2.82 0.06 0.00 -0.57 0.00 0.00 43.02 39.58 1dx5 s PHE 60 CO -0.18 0.29 0.66 0.96 -0.10 0.00 0.00 175.22 176.85 1dx5 s ILE 60 N -0.14 2.13 0.22 0.64 -4.36 -1.26 -4.92 121.20 113.51 1dx5 s ILE 60 Ca 0.38 -1.13 -0.07 0.00 -0.26 0.00 0.00 60.65 59.57 1dx5 s ILE 60 Cb -0.21 -2.27 0.17 0.00 1.25 0.00 0.00 42.46 41.41 1dx5 s ILE 60 CO 0.23 0.00 1.76 -0.33 0.24 0.00 0.00 174.94 176.84 1dx5 h GLU 61 N 0.40 0.50 0.00 0.37 4.39 -1.95 -2.61 114.58 115.69 1dx5 h GLU 61 Ca -0.33 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.34 1dx5 h GLU 61 Cb 1.29 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 1dx5 h GLU 61 CO 0.46 0.33 0.00 0.09 -1.16 0.00 0.00 179.01 178.73 1dx5 n ASN 62 N -4.92 0.00 0.05 1.42 3.02 -1.26 -3.36 115.26 110.20 1dx5 n ASN 62 Ca 0.11 -0.72 0.11 0.00 -0.03 0.00 0.00 54.58 54.06 1dx5 n ASN 62 Cb 0.30 -0.04 0.04 0.00 -0.61 0.00 0.00 39.78 39.47 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 -1.04 0.66 -4.44 6.41 8.00 -0.98 -4.93 116.55 120.22 1dx5 n ASP 63 Ca 0.19 0.03 -0.21 0.00 0.71 0.00 0.00 54.79 55.51 1dx5 n ASP 63 Cb 0.11 0.61 -0.11 0.00 -0.02 0.00 0.00 41.12 41.71 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 -4.41 2.25 -0.02 0.64 1.43 -1.21 -1.15 118.68 116.20 1dx5 s LEU 64 Ca 0.03 -1.33 0.04 0.00 -1.03 0.00 0.00 54.13 51.83 1dx5 s LEU 64 Cb 0.13 -0.42 -0.01 0.00 0.03 0.00 0.00 46.19 45.92 1dx5 s LEU 64 CO 0.78 -0.55 -0.14 -0.76 0.23 0.00 0.00 176.35 175.90 1dx5 s LEU 65 N -3.47 1.97 -0.34 1.79 1.43 0.85 -4.78 118.68 116.13 1dx5 s LEU 65 Ca 0.35 -0.27 -0.13 0.00 -1.03 0.00 0.00 54.13 53.05 1dx5 s LEU 65 Cb 0.08 -0.78 -0.02 0.00 0.03 0.00 0.00 46.19 45.50 1dx5 s LEU 65 CO 0.14 0.16 0.23 -0.69 0.23 0.00 0.00 176.35 176.43 1dx5 s VAL 66 N -0.19 5.22 -0.32 -1.59 1.01 -1.12 -0.44 120.40 122.97 1dx5 s VAL 66 Ca 0.02 -0.24 -0.05 0.00 0.00 0.00 0.00 61.98 61.71 1dx5 s VAL 66 Cb -0.07 -3.68 0.03 0.00 0.00 0.00 0.00 36.38 32.66 1dx5 s VAL 66 CO 0.00 -0.00 0.07 -0.13 0.00 0.00 0.00 175.10 175.04 1dx5 s ARG 67 N 1.71 2.68 0.06 2.72 0.52 -0.31 -1.00 118.95 125.34 1dx5 s ARG 67 Ca 0.06 -1.12 0.05 0.00 -0.52 0.00 0.00 55.73 54.19 1dx5 s ARG 67 Cb -0.17 -3.37 -0.04 0.00 0.52 0.00 0.00 34.95 31.89 1dx5 s ARG 67 CO 0.10 -0.60 -0.06 0.42 0.02 0.00 0.00 175.30 175.18 1dx5 s ILE 68 N 1.39 3.68 0.00 1.52 1.01 -0.15 -0.96 121.20 127.69 1dx5 s ILE 68 Ca -0.01 -0.99 0.00 0.00 0.00 0.00 0.00 60.65 59.64 1dx5 s ILE 68 Cb -0.19 -2.68 0.00 0.00 0.01 0.00 0.00 42.46 39.60 1dx5 s ILE 68 CO 0.02 0.22 0.00 0.61 0.00 0.00 0.00 174.94 175.79 1dx5 n GLY 69 N 0.98 0.57 3.84 6.18 0.00 -1.25 -0.06 105.19 115.45 1dx5 n GLY 69 Ca -0.13 -0.35 -0.32 0.00 0.00 0.00 0.00 46.02 45.21 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 -0.77 4.04 0.10 1.61 1.02 -1.26 -4.13 119.74 120.35 1dx5 s LYS 70 Ca 0.00 0.87 0.00 0.00 0.02 0.00 0.00 55.97 56.86 1dx5 s LYS 70 Cb 0.00 -2.27 0.00 0.00 -0.52 0.00 0.00 37.83 35.04 1dx5 s LYS 70 CO 0.00 -0.03 0.00 1.58 -0.92 0.00 0.00 175.35 175.98 1dx5 n HIS 71 N -0.86 -0.50 -2.13 3.18 -0.00 -1.26 -4.96 115.22 108.68 1dx5 n HIS 71 Ca 0.05 0.09 -0.39 0.00 -0.00 0.00 0.00 57.72 57.47 1dx5 n HIS 71 Cb 0.54 0.17 -0.01 0.00 -0.00 0.00 0.00 29.99 30.69 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 -5.34 6.37 0.09 0.26 0.15 -1.26 -0.97 113.70 113.01 1dx5 s SER 72 Ca 0.00 2.55 -0.13 0.00 0.70 0.00 0.00 55.95 59.07 1dx5 s SER 72 Cb 0.00 -2.63 -0.18 0.00 -1.71 0.00 0.00 66.02 61.50 1dx5 s SER 72 CO 0.00 -0.80 1.25 -0.09 1.20 0.00 0.00 173.24 174.80 1dx5 h ARG 73 N 2.65 0.73 0.01 5.44 2.43 -1.31 -3.40 114.38 120.93 1dx5 h ARG 73 Ca -0.49 -0.69 -0.38 0.00 -0.81 0.00 0.00 59.98 57.61 1dx5 h ARG 73 Cb 1.24 0.17 -0.07 0.00 -0.42 0.00 0.00 29.97 30.90 1dx5 h ARG 73 CO 0.62 1.28 -2.39 0.25 -1.51 0.00 0.00 179.97 178.23 1dx5 n THR 74 N -3.88 1.47 -2.26 0.20 -2.24 -1.26 -5.00 114.28 101.31 1dx5 n THR 74 Ca -0.09 -0.71 -0.39 0.00 -2.27 0.00 0.00 64.05 60.59 1dx5 n THR 74 Cb 0.82 -1.02 -0.02 0.00 -2.10 0.00 0.00 70.33 68.01 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 4.22 -0.66 -0.78 3.52 -1.26 -4.96 118.95 116.51 1dx5 s ARG 75 Ca -0.23 1.96 -0.24 0.00 -0.13 0.00 0.00 55.73 57.09 1dx5 s ARG 75 Cb 0.08 -2.87 0.06 0.00 -1.56 0.00 0.00 34.95 30.66 1dx5 s ARG 75 CO 0.71 -0.21 1.03 -0.47 -0.81 0.00 0.00 175.30 175.55 1dx5 s TYR 76 N -1.29 2.60 -1.36 5.12 5.04 -1.26 -4.85 117.35 121.36 1dx5 s TYR 76 Ca 0.53 -0.38 -0.16 0.00 -2.44 0.00 0.00 57.07 54.62 1dx5 s TYR 76 Cb -0.34 -4.34 0.03 0.00 0.35 0.00 0.00 41.96 37.66 1dx5 s TYR 76 CO 0.44 -1.71 2.04 0.39 -1.34 0.00 0.00 175.55 175.37 1dx5 n GLU 77 N 8.05 2.84 -1.62 4.97 1.02 -1.26 -4.96 120.64 129.68 1dx5 n GLU 77 Ca -0.02 -2.77 -0.49 0.00 -0.02 0.00 0.00 57.16 53.87 1dx5 n GLU 77 Cb 0.46 -3.35 -0.05 0.00 -0.02 0.00 0.00 31.44 28.49 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 6.96 1.54 -0.78 3.49 0.63 -1.26 -0.43 116.66 126.81 1dx5 n ARG 77 Ca 0.51 0.55 0.00 0.00 -0.92 0.00 0.00 57.85 57.99 1dx5 n ARG 77 Cb 0.42 -2.22 0.00 0.00 0.45 0.00 0.00 32.46 31.10 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 2.73 -0.97 -0.00 6.15 4.05 -1.26 -4.70 115.26 121.26 1dx5 n ASN 78 Ca 0.17 0.00 -0.04 0.00 0.45 0.00 0.00 54.58 55.16 1dx5 n ASN 78 Cb 0.24 -1.57 -0.01 0.00 1.23 0.00 0.00 39.78 39.67 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 -2.09 1.12 -2.16 -1.44 5.41 -0.56 -5.04 119.36 114.61 1dx5 n ILE 79 Ca 0.00 0.23 -0.30 0.00 1.00 0.00 0.00 62.75 63.68 1dx5 n ILE 79 Cb 0.06 -1.77 0.01 0.00 -0.71 0.00 0.00 39.64 37.23 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 -2.24 3.55 -0.01 0.38 -1.05 0.42 -4.74 118.70 115.01 1dx5 s GLU 80 Ca -0.09 0.53 0.02 0.00 -0.15 0.00 0.00 54.97 55.27 1dx5 s GLU 80 Cb 0.02 -2.19 -0.00 0.00 -0.44 0.00 0.00 34.13 31.52 1dx5 s GLU 80 CO 0.13 -0.45 -0.05 0.15 0.95 0.00 0.00 175.26 175.99 1dx5 s LYS 81 N -5.02 0.49 -0.20 -4.83 3.01 0.91 -4.82 119.74 109.27 1dx5 s LYS 81 Ca 0.52 -0.18 -0.09 0.00 -1.01 0.00 0.00 55.97 55.21 1dx5 s LYS 81 Cb -0.11 -0.48 -0.05 0.00 -1.01 0.00 0.00 37.83 36.18 1dx5 s LYS 81 CO 0.50 0.09 0.11 0.42 0.51 0.00 0.00 175.35 176.99 1dx5 s ILE 82 N 0.01 5.23 -0.05 2.17 1.01 -1.26 -0.97 121.20 127.34 1dx5 s ILE 82 Ca 0.00 0.13 0.07 0.00 0.00 0.00 0.00 60.65 60.85 1dx5 s ILE 82 Cb -0.04 -3.39 -0.01 0.00 0.01 0.00 0.00 42.46 39.03 1dx5 s ILE 82 CO -0.00 0.43 -0.25 -0.44 0.00 0.00 0.00 174.94 174.68 1dx5 s SER 83 N 0.45 3.04 0.29 3.58 0.01 -0.17 -4.99 113.70 115.92 1dx5 s SER 83 Ca 0.07 -0.50 -0.18 0.00 1.31 0.00 0.00 55.95 56.65 1dx5 s SER 83 Cb -0.12 -0.68 -0.09 0.00 0.21 0.00 0.00 66.02 65.35 1dx5 s SER 83 CO -0.01 0.27 0.76 -0.04 0.41 0.00 0.00 173.24 174.63 1dx5 s MET 84 N -0.30 4.15 -0.19 12.44 -1.94 -1.26 -2.77 119.30 129.42 1dx5 s MET 84 Ca 0.01 0.82 -0.24 0.00 -1.71 0.00 0.00 55.69 54.57 1dx5 s MET 84 Cb -0.12 -2.60 -0.02 0.00 2.01 0.00 0.00 34.83 34.10 1dx5 s MET 84 CO 0.02 0.24 0.76 -0.51 -0.01 0.00 0.00 175.02 175.52 1dx5 s LEU 85 N -2.56 4.14 -0.11 -0.03 1.43 -1.26 -1.04 118.68 119.25 1dx5 s LEU 85 Ca 0.50 1.03 -0.20 0.00 -1.03 0.00 0.00 54.13 54.43 1dx5 s LEU 85 Cb -0.13 -3.10 -0.27 0.00 0.03 0.00 0.00 46.19 42.72 1dx5 s LEU 85 CO 0.19 -0.38 0.61 -0.08 0.23 0.00 0.00 176.35 176.92 1dx5 h GLU 86 N 7.46 0.18 -2.11 1.70 4.81 -0.68 -3.44 114.58 122.50 1dx5 h GLU 86 Ca -0.29 -0.30 -0.05 0.00 -0.13 0.00 0.00 59.36 58.59 1dx5 h GLU 86 Cb 1.13 0.11 -0.22 0.00 0.63 0.00 0.00 28.75 30.41 1dx5 h GLU 86 CO 0.82 1.15 0.06 0.21 -0.73 0.00 0.00 179.01 180.51 1dx5 s LYS 87 N -2.41 0.77 -0.18 1.92 2.47 -1.09 -4.99 119.74 116.23 1dx5 s LYS 87 Ca -0.20 0.97 -0.10 0.00 -1.56 0.00 0.00 55.97 55.08 1dx5 s LYS 87 Cb 0.03 0.34 -0.05 0.00 -1.46 0.00 0.00 37.83 36.69 1dx5 s LYS 87 CO 0.74 -0.10 0.14 0.42 0.16 0.00 0.00 175.35 176.71 1dx5 s ILE 88 N 0.54 5.42 -0.33 5.43 1.01 -1.26 -0.50 121.20 131.50 1dx5 s ILE 88 Ca -0.01 0.21 0.03 0.00 0.00 0.00 0.00 60.65 60.87 1dx5 s ILE 88 Cb -0.05 -3.46 0.10 0.00 0.01 0.00 0.00 42.46 39.06 1dx5 s ILE 88 CO -0.02 0.47 0.05 -0.31 0.00 0.00 0.00 174.94 175.13 1dx5 s TYR 89 N 0.13 3.40 0.07 3.97 2.02 0.22 -4.99 117.35 122.17 1dx5 s TYR 89 Ca 0.09 -2.77 -0.18 0.00 -0.37 0.00 0.00 57.07 53.85 1dx5 s TYR 89 Cb -0.11 -2.69 -0.07 0.00 -0.40 0.00 0.00 41.96 38.69 1dx5 s TYR 89 CO -0.01 -0.93 0.54 0.42 -1.57 0.00 0.00 175.55 174.00 1dx5 s ILE 90 N 1.03 4.80 0.03 2.71 1.01 -1.26 -0.32 121.20 129.20 1dx5 s ILE 90 Ca 0.10 1.09 -0.33 0.00 0.00 0.00 0.00 60.65 61.52 1dx5 s ILE 90 Cb -0.19 -3.84 -0.12 0.00 0.01 0.00 0.00 42.46 38.32 1dx5 s ILE 90 CO -0.11 0.51 1.81 1.57 0.00 0.00 0.00 174.94 178.72 1dx5 n HIS 91 N 1.59 2.40 -0.01 3.97 -0.00 -0.99 -4.85 115.22 117.32 1dx5 n HIS 91 Ca -0.10 -0.02 0.16 0.00 -0.00 0.00 0.00 57.72 57.76 1dx5 n HIS 91 Cb 0.51 -2.67 0.61 0.00 -0.00 0.00 0.00 29.99 28.45 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 8.47 0.15 -0.82 1.57 0.13 -1.94 -2.05 132.00 137.51 1dx5 h PRO 92 Ca -0.47 -0.01 -0.43 0.00 -0.87 0.00 0.00 66.00 64.21 1dx5 h PRO 92 Cb 1.25 -0.03 -0.26 0.00 0.13 0.00 0.00 31.00 32.09 1dx5 h PRO 92 CO 0.93 0.10 0.45 0.54 -0.23 0.00 0.00 178.00 179.80 1dx5 n ARG 93 N -4.43 2.15 -2.12 0.86 1.74 -1.26 -4.95 116.66 108.64 1dx5 n ARG 93 Ca 0.09 -3.08 -0.43 0.00 -0.77 0.00 0.00 57.85 53.66 1dx5 n ARG 93 Cb 0.47 -2.09 -0.03 0.00 -1.02 0.00 0.00 32.46 29.80 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 -3.30 2.11 -1.32 -1.55 5.04 -0.77 -4.73 117.35 112.82 1dx5 s TYR 94 Ca 0.54 0.57 -0.13 0.00 -2.44 0.00 0.00 57.07 55.61 1dx5 s TYR 94 Cb 0.46 -4.00 0.12 0.00 0.35 0.00 0.00 41.96 38.89 1dx5 s TYR 94 CO 0.08 -2.86 1.88 -1.71 -1.34 0.00 0.00 175.55 171.59 1dx5 n ASN 95 N 8.58 4.75 0.20 4.32 2.85 -0.42 -4.71 115.26 130.84 1dx5 n ASN 95 Ca 0.19 -2.99 0.14 0.00 -0.11 0.00 0.00 54.58 51.82 1dx5 n ASN 95 Cb 0.45 -1.58 0.51 0.00 1.24 0.00 0.00 39.78 40.40 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 6.31 0.00 -0.44 1.20 5.08 -1.91 0.31 115.95 126.50 1dx5 h TRP 96 Ca 0.44 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 60.38 1dx5 h TRP 96 Cb 0.71 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.85 1dx5 h TRP 96 CO 1.31 0.00 0.14 -0.09 -1.28 0.00 0.00 178.44 178.52 1dx5 h ARG 97 N 0.00 0.64 0.00 0.12 9.65 -1.99 -3.44 114.38 119.36 1dx5 h ARG 97 Ca 0.00 -0.10 0.00 0.00 -1.10 0.00 0.00 59.98 58.78 1dx5 h ARG 97 Cb 0.58 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 29.05 1dx5 h ARG 97 CO 0.00 0.56 0.00 -1.91 2.80 0.00 0.00 179.97 181.42 1dx5 n GLU 97 N -4.34 0.00 0.19 0.20 2.13 -1.19 -5.01 120.64 112.63 1dx5 n GLU 97 Ca 0.03 0.00 0.08 0.00 0.66 0.00 0.00 57.16 57.93 1dx5 n GLU 97 Cb 0.18 0.00 0.23 0.00 0.27 0.00 0.00 31.44 32.11 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 -0.38 4.31 -0.26 -1.87 -3.47 115.58 113.91 1dx5 h ASN 98 Ca 0.00 0.00 -0.09 0.00 -0.56 0.00 0.00 56.30 55.65 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 0.25 -0.10 0.18 -1.06 0.00 0.00 177.43 176.70 1dx5 n LEU 99 N -3.22 -0.67 -4.75 1.61 4.32 0.11 -4.98 117.00 109.42 1dx5 n LEU 99 Ca 0.02 0.07 -0.40 0.00 -0.02 0.00 0.00 56.01 55.67 1dx5 n LEU 99 Cb 0.57 -1.02 0.01 0.00 -1.62 0.00 0.00 43.42 41.36 1dx5 n LEU 99 CO 0.36 -0.16 1.04 -0.67 -1.22 0.00 0.00 177.39 176.73 1dx5 n ASP 100 N 1.22 3.21 -3.52 -1.43 2.03 -1.23 -2.69 116.55 114.14 1dx5 n ASP 100 Ca -0.05 1.13 -0.19 0.00 0.52 0.00 0.00 54.79 56.20 1dx5 n ASP 100 Cb 0.30 -1.58 0.07 0.00 -0.72 0.00 0.00 41.12 39.19 1dx5 n ASP 100 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1dx5 n ARG 101 N -0.06 -6.36 -2.60 -0.67 1.74 -1.26 -1.30 116.66 106.16 1dx5 n ARG 101 Ca 0.05 0.79 -0.43 0.00 -0.77 0.00 0.00 57.85 57.49 1dx5 n ARG 101 Cb 0.41 -5.70 -0.01 0.00 -1.02 0.00 0.00 32.46 26.13 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 -4.21 6.77 -0.09 0.55 2.15 -1.09 -4.42 116.67 116.32 1dx5 s ASP 102 Ca 0.09 -2.25 -0.21 0.00 0.43 0.00 0.00 52.55 50.60 1dx5 s ASP 102 Cb -0.04 -2.57 0.05 0.00 -0.30 0.00 0.00 42.92 40.06 1dx5 s ASP 102 CO 0.75 -1.22 0.51 -0.51 -0.17 0.00 0.00 175.17 174.53 1dx5 s ILE 103 N 4.23 0.02 -0.02 4.11 2.07 -1.26 -3.95 121.20 126.39 1dx5 s ILE 103 Ca 0.51 -0.15 -0.17 0.00 -1.41 0.00 0.00 60.65 59.43 1dx5 s ILE 103 Cb 0.03 -0.78 0.03 0.00 0.13 0.00 0.00 42.46 41.86 1dx5 s ILE 103 CO 0.03 -0.09 0.36 0.00 -1.91 0.00 0.00 174.94 173.34 1dx5 s ALA 104 N -0.71 -0.92 0.09 1.50 0.00 -0.36 -2.34 121.76 119.02 1dx5 s ALA 104 Ca -0.08 0.49 0.08 0.00 0.00 0.00 0.00 51.96 52.44 1dx5 s ALA 104 Cb -0.03 0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.09 1dx5 s ALA 104 CO 0.05 -0.27 -0.16 -0.51 0.00 0.00 0.00 175.76 174.87 1dx5 s LEU 105 N -1.24 2.77 -0.09 0.00 1.43 0.56 -1.22 118.68 120.90 1dx5 s LEU 105 Ca -0.13 -0.47 -0.00 0.00 -1.03 0.00 0.00 54.13 52.50 1dx5 s LEU 105 Cb -0.04 -1.61 0.02 0.00 0.03 0.00 0.00 46.19 44.59 1dx5 s LEU 105 CO 0.05 0.20 -0.05 -0.04 0.23 0.00 0.00 176.35 176.73 1dx5 s MET 106 N -1.96 1.19 -0.12 1.70 -1.94 -0.13 0.70 119.30 118.73 1dx5 s MET 106 Ca 0.18 -0.15 -0.17 0.00 -1.71 0.00 0.00 55.69 53.84 1dx5 s MET 106 Cb -0.11 -1.29 -0.04 0.00 2.01 0.00 0.00 34.83 35.40 1dx5 s MET 106 CO 0.10 -0.22 0.44 0.21 -0.01 0.00 0.00 175.02 175.54 1dx5 s LYS 107 N 1.55 4.31 0.18 2.03 2.20 0.34 -1.50 119.74 128.85 1dx5 s LYS 107 Ca 0.00 0.39 -0.20 0.00 -0.36 0.00 0.00 55.97 55.80 1dx5 s LYS 107 Cb -0.13 -3.42 -0.08 0.00 -1.51 0.00 0.00 37.83 32.69 1dx5 s LYS 107 CO -0.05 0.20 0.69 -0.51 -0.36 0.00 0.00 175.35 175.32 1dx5 s LEU 108 N 0.51 4.41 0.33 5.43 1.43 0.03 0.00 118.68 130.82 1dx5 s LEU 108 Ca 0.24 1.40 0.03 0.00 -1.03 0.00 0.00 54.13 54.77 1dx5 s LEU 108 Cb -0.15 -3.40 0.62 0.00 0.03 0.00 0.00 46.19 43.30 1dx5 s LEU 108 CO 0.09 0.11 1.94 0.11 0.23 0.00 0.00 176.35 178.83 1dx5 h LYS 109 N 3.75 0.88 -4.89 1.70 1.57 -1.37 -3.42 116.57 114.78 1dx5 h LYS 109 Ca -0.48 -0.05 -0.31 0.00 -1.87 0.00 0.00 60.65 57.94 1dx5 h LYS 109 Cb 1.20 -0.20 -0.18 0.00 0.08 0.00 0.00 32.23 33.13 1dx5 h LYS 109 CO 0.65 0.58 -0.73 0.15 -0.57 0.00 0.00 179.45 179.53 1dx5 s LYS 110 N -5.79 0.81 0.23 3.15 -0.14 -1.26 -5.00 119.74 111.73 1dx5 s LYS 110 Ca -0.11 -1.13 -0.30 0.00 -1.36 0.00 0.00 55.97 53.08 1dx5 s LYS 110 Cb 0.19 -0.48 -0.09 0.00 -1.68 0.00 0.00 37.83 35.78 1dx5 s LYS 110 CO 0.78 0.07 1.28 -1.25 -0.76 0.00 0.00 175.35 175.47 1dx5 s PRO 111 N -2.74 4.42 0.33 -1.68 0.04 -1.26 -4.82 135.00 129.28 1dx5 s PRO 111 Ca 0.04 2.04 -0.26 0.00 0.04 0.00 0.00 61.00 62.86 1dx5 s PRO 111 Cb -0.03 -3.18 -0.10 0.00 0.04 0.00 0.00 34.50 31.24 1dx5 s PRO 111 CO -0.00 -0.18 0.99 0.14 0.04 0.00 0.00 177.00 177.99 1dx5 s VAL 112 N -0.24 3.98 -0.21 -0.36 -7.23 0.76 -5.01 120.40 112.08 1dx5 s VAL 112 Ca 0.54 1.69 -0.27 0.00 -1.81 0.00 0.00 61.98 62.13 1dx5 s VAL 112 Cb -0.36 -3.95 -0.00 0.00 0.56 0.00 0.00 36.38 32.62 1dx5 s VAL 112 CO 0.41 0.17 0.92 0.00 -0.31 0.00 0.00 175.10 176.29 1dx5 s ALA 113 N -1.52 3.62 0.63 1.32 0.00 -1.26 -4.87 121.76 119.66 1dx5 s ALA 113 Ca 0.50 0.05 -0.16 0.00 0.00 0.00 0.00 51.96 52.36 1dx5 s ALA 113 Cb -0.22 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.51 1dx5 s ALA 113 CO 0.28 -0.88 1.11 -0.06 0.00 0.00 0.00 175.76 176.20 1dx5 s PHE 114 N 2.75 2.67 0.04 0.00 0.08 -1.26 -4.84 117.98 117.43 1dx5 s PHE 114 Ca 0.40 1.55 -0.03 0.00 0.12 0.00 0.00 56.93 58.96 1dx5 s PHE 114 Cb -0.16 -3.17 0.01 0.00 -0.57 0.00 0.00 43.02 39.13 1dx5 s PHE 114 CO 0.09 -1.60 0.15 -1.13 -0.10 0.00 0.00 175.22 172.63 1dx5 n SER 115 N -2.16 -0.31 0.28 1.36 3.41 0.04 -4.93 113.62 111.32 1dx5 n SER 115 Ca 0.10 -1.18 0.16 0.00 -0.26 0.00 0.00 58.87 57.69 1dx5 n SER 115 Cb 0.52 0.50 0.83 0.00 -0.26 0.00 0.00 64.21 65.80 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 0.31 0.00 0.00 4.04 3.32 -1.98 -2.77 116.42 119.35 1dx5 h ASP 116 Ca -0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1dx5 h ASP 116 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 1dx5 h ASP 116 CO 0.06 0.07 -0.75 -1.22 -1.72 0.00 0.00 179.24 175.68 1dx5 n TYR 117 N -3.43 0.00 -4.07 4.55 4.01 -1.26 -4.66 117.16 112.29 1dx5 n TYR 117 Ca -0.02 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.46 1dx5 n TYR 117 Cb 0.21 -0.01 -0.17 0.00 -0.31 0.00 0.00 39.34 39.06 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 -2.45 1.07 -0.29 -0.72 1.01 -1.04 -3.92 121.20 114.85 1dx5 s ILE 118 Ca 0.05 -0.35 -0.18 0.00 0.00 0.00 0.00 60.65 60.18 1dx5 s ILE 118 Cb 0.11 -1.06 0.17 0.00 0.01 0.00 0.00 42.46 41.70 1dx5 s ILE 118 CO 0.62 0.37 1.14 -2.28 0.00 0.00 0.00 174.94 174.80 1dx5 s HIS 119 N 1.45 -0.31 0.44 3.97 2.46 -0.88 -0.78 115.29 121.63 1dx5 s HIS 119 Ca 0.00 0.64 -0.24 0.00 0.47 0.00 0.00 55.06 55.93 1dx5 s HIS 119 Cb -0.13 0.24 -0.08 0.00 -0.13 0.00 0.00 32.58 32.48 1dx5 s HIS 119 CO -0.06 -0.15 1.21 -1.25 -2.47 0.00 0.00 174.74 172.02 1dx5 s PRO 120 N 0.97 3.84 0.45 2.88 0.04 -1.26 -2.46 135.00 139.46 1dx5 s PRO 120 Ca -0.06 1.91 -0.05 0.00 0.04 0.00 0.00 61.00 62.85 1dx5 s PRO 120 Cb -0.03 -2.55 -0.04 0.00 0.04 0.00 0.00 34.50 31.92 1dx5 s PRO 120 CO -0.12 -0.52 0.75 0.54 0.04 0.00 0.00 177.00 177.68 1dx5 s VAL 121 N -1.42 4.93 0.40 -0.36 0.11 -0.67 -4.92 120.40 118.47 1dx5 s VAL 121 Ca 0.61 0.13 -0.09 0.00 -2.93 0.00 0.00 61.98 59.70 1dx5 s VAL 121 Cb -0.32 -3.85 -0.06 0.00 -1.53 0.00 0.00 36.38 30.62 1dx5 s VAL 121 CO 0.40 -0.78 0.74 0.00 -3.33 0.00 0.00 175.10 172.13 1dx5 s LEU 123 N -3.96 3.71 0.56 0.00 1.43 -1.26 -0.78 118.68 118.38 1dx5 s LEU 123 Ca 0.50 0.15 -0.20 0.00 -1.03 0.00 0.00 54.13 53.54 1dx5 s LEU 123 Cb -0.10 -1.88 -0.04 0.00 0.03 0.00 0.00 46.19 44.19 1dx5 s LEU 123 CO 0.33 0.32 1.25 -2.16 0.23 0.00 0.00 176.35 176.32 1dx5 s PRO 124 N -0.50 3.11 0.43 1.29 0.04 -1.26 -4.93 135.00 133.17 1dx5 s PRO 124 Ca 0.09 1.96 0.06 0.00 0.04 0.00 0.00 61.00 63.16 1dx5 s PRO 124 Cb -0.12 -2.09 0.06 0.00 0.04 0.00 0.00 34.50 32.39 1dx5 s PRO 124 CO 0.02 -1.13 0.52 -0.40 0.04 0.00 0.00 177.00 176.05 1dx5 n ASP 125 N -1.28 1.78 -0.14 6.66 5.68 -1.26 -4.85 116.55 123.14 1dx5 n ASP 125 Ca 0.12 -2.22 -0.03 0.00 -0.50 0.00 0.00 54.79 52.15 1dx5 n ASP 125 Cb 0.48 -0.24 0.05 0.00 -1.14 0.00 0.00 41.12 40.27 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 0.21 -0.39 0.11 2.43 -1.98 -2.96 114.38 111.80 1dx5 h ARG 126 Ca -0.22 -0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 58.83 1dx5 h ARG 126 Cb 0.94 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.43 1dx5 h ARG 126 CO 0.32 0.14 -0.17 0.93 -1.51 0.00 0.00 179.97 179.68 1dx5 h GLU 127 N 0.21 0.81 -0.46 0.20 3.07 -2.04 -1.92 114.58 114.46 1dx5 h GLU 127 Ca 0.23 -0.34 0.00 0.00 -0.50 0.00 0.00 59.36 58.74 1dx5 h GLU 127 Cb 0.29 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.17 1dx5 h GLU 127 CO -0.30 0.97 0.00 2.41 -1.40 0.00 0.00 179.01 180.69 1dx5 n THR 128 N -4.27 0.02 0.00 1.13 -1.04 -1.12 -1.11 114.28 107.89 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 0.41 -0.15 0.00 0.00 -1.82 0.00 0.00 70.33 68.77 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 0.55 0.00 -0.06 2.41 0.00 -0.72 -0.95 120.51 121.73 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 0.03 0.00 -0.06 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 0.46 0.29 0.00 0.02 -1.39 -3.38 113.55 109.55 1dx5 h SER 129 Ca 0.00 -0.47 -0.34 0.00 -0.84 0.00 0.00 61.79 60.14 1dx5 h SER 129 Cb 0.00 -0.13 0.01 0.00 0.14 0.00 0.00 62.40 62.42 1dx5 h SER 129 CO 0.00 0.84 -1.62 -0.07 -1.14 0.00 0.00 176.83 174.84 1dx5 h LEU 129 N 0.09 0.61 -6.67 5.07 4.07 -1.28 -3.41 115.31 113.79 1dx5 h LEU 129 Ca 0.03 -0.82 -0.64 0.00 0.08 0.00 0.00 57.88 56.54 1dx5 h LEU 129 Cb 0.70 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 42.24 1dx5 h LEU 129 CO 0.04 1.67 2.43 0.18 -1.08 0.00 0.00 178.44 181.69 1dx5 n LEU 130 N -3.59 5.03 -4.04 1.67 4.77 -1.26 -4.82 117.00 114.77 1dx5 n LEU 130 Ca -0.20 -3.49 -0.17 0.00 -0.03 0.00 0.00 56.01 52.12 1dx5 n LEU 130 Cb 1.07 -1.46 -0.14 0.00 -2.33 0.00 0.00 43.42 40.57 1dx5 n LEU 130 CO 0.54 0.03 -0.43 -1.10 -1.33 0.00 0.00 177.39 175.10 1dx5 s GLN 131 N 4.46 0.65 0.25 3.23 -0.21 -1.26 -4.93 119.66 121.85 1dx5 s GLN 131 Ca 0.55 -0.46 -0.31 0.00 0.02 0.00 0.00 55.36 55.16 1dx5 s GLN 131 Cb 0.11 -0.60 -0.13 0.00 1.00 0.00 0.00 33.01 33.39 1dx5 s GLN 131 CO 0.04 0.15 1.35 0.00 -2.12 0.00 0.00 175.29 174.72 1dx5 n ALA 132 N 2.41 0.92 0.00 6.09 0.00 -1.26 -1.72 120.51 126.95 1dx5 n ALA 132 Ca -0.16 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.69 1dx5 n ALA 132 Cb 0.56 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.77 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 1.89 2.99 3.73 0.00 0.00 0.11 -4.92 105.19 108.99 1dx5 n GLY 133 Ca 0.11 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.22 3.24 0.07 1.61 1.51 -0.70 -4.60 117.35 116.26 1dx5 s TYR 134 Ca 0.00 1.14 -0.16 0.00 -1.01 0.00 0.00 57.07 57.04 1dx5 s TYR 134 Cb 0.00 -3.63 -0.06 0.00 -0.11 0.00 0.00 41.96 38.15 1dx5 s TYR 134 CO 0.00 -2.05 0.49 0.15 -1.11 0.00 0.00 175.55 173.03 1dx5 s LYS 135 N 0.24 4.01 0.40 -0.62 1.02 -1.26 -0.07 119.74 123.46 1dx5 s LYS 135 Ca 0.59 0.51 0.00 0.00 0.02 0.00 0.00 55.97 57.09 1dx5 s LYS 135 Cb -0.37 -3.13 0.00 0.00 -0.52 0.00 0.00 37.83 33.81 1dx5 s LYS 135 CO 0.36 0.61 0.02 0.41 -0.92 0.00 0.00 175.35 175.83 1dx5 n GLY 136 N 1.45 3.65 2.90 -3.33 0.00 0.40 -4.83 105.19 105.44 1dx5 n GLY 136 Ca -0.10 -2.33 -0.19 0.00 0.00 0.00 0.00 46.02 43.39 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 -3.46 0.75 -0.03 1.61 3.52 0.82 -0.82 118.95 121.33 1dx5 s ARG 137 Ca 0.01 -0.11 0.06 0.00 -0.13 0.00 0.00 55.73 55.57 1dx5 s ARG 137 Cb -0.00 -0.76 -0.02 0.00 -1.56 0.00 0.00 34.95 32.61 1dx5 s ARG 137 CO 0.01 -0.05 -0.22 0.08 -0.81 0.00 0.00 175.30 174.31 1dx5 s VAL 138 N 0.76 2.38 0.07 7.11 1.01 -0.43 -0.17 120.40 131.13 1dx5 s VAL 138 Ca -0.10 -0.98 0.05 0.00 0.00 0.00 0.00 61.98 60.95 1dx5 s VAL 138 Cb -0.13 -1.87 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 1dx5 s VAL 138 CO 0.00 0.58 -0.13 0.42 0.00 0.00 0.00 175.10 175.97 1dx5 s THR 139 N -0.60 1.04 0.00 3.92 -4.23 -1.24 -1.35 115.64 113.17 1dx5 s THR 139 Ca 0.09 -1.26 0.00 0.00 -1.18 0.00 0.00 61.69 59.34 1dx5 s THR 139 Cb -0.11 -1.01 0.00 0.00 1.34 0.00 0.00 72.50 72.73 1dx5 s THR 139 CO -0.00 -0.24 0.00 0.61 -0.54 0.00 0.00 174.62 174.45 1dx5 n GLY 140 N 1.33 0.78 0.97 3.99 0.00 -0.72 -4.51 105.19 107.02 1dx5 n GLY 140 Ca -0.21 -0.83 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 -0.20 1.03 -0.81 1.61 8.01 -1.26 -1.34 117.44 124.47 1dx5 n TRP 141 Ca 0.00 -0.90 -0.05 0.00 -1.31 0.00 0.00 57.50 55.24 1dx5 n TRP 141 Cb 0.00 -0.34 0.04 0.00 -2.01 0.00 0.00 31.31 29.01 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 -0.47 -2.03 3.78 6.99 0.00 -1.26 -4.61 105.19 107.59 1dx5 n GLY 142 Ca 0.22 -1.54 -0.41 0.00 0.00 0.00 0.00 46.02 44.30 1dx5 n GLY 142 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dx5 s ASN 143 N -1.99 6.41 0.44 1.61 0.01 0.45 -3.36 114.94 118.51 1dx5 s ASN 143 Ca 0.13 2.99 0.24 0.00 -0.71 0.00 0.00 52.86 55.52 1dx5 s ASN 143 Cb -0.01 -2.66 0.47 0.00 0.41 0.00 0.00 41.25 39.46 1dx5 s ASN 143 CO 0.10 -0.83 1.66 -0.07 -1.51 0.00 0.00 177.10 176.45 1dx5 h LEU 144 N 3.14 0.00 -8.21 0.60 3.38 -1.10 -1.47 115.31 111.65 1dx5 h LEU 144 Ca -0.50 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.34 1dx5 h LEU 144 Cb 1.24 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.86 1dx5 h LEU 144 CO 0.65 0.00 -0.40 -0.54 0.09 0.00 0.00 178.44 178.24 1dx5 s LYS 145 N -3.25 1.14 0.57 1.13 1.02 -1.26 -4.21 119.74 114.87 1dx5 s LYS 145 Ca 0.07 -1.27 0.34 0.00 0.02 0.00 0.00 55.97 55.13 1dx5 s LYS 145 Cb 0.06 0.35 1.88 0.00 -0.52 0.00 0.00 37.83 39.59 1dx5 s LYS 145 CO 0.65 -0.40 2.05 1.49 -0.92 0.00 0.00 175.35 178.22 1dx5 h GLU 146 N 2.59 0.00 0.00 1.68 4.81 -1.90 -3.47 114.58 118.30 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 1.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1dx5 h GLU 146 CO 0.50 0.00 0.00 0.25 -0.73 0.00 0.00 179.01 179.03 1dx5 n THR 147 N -2.78 0.00 -4.24 0.32 -2.24 -1.26 -4.86 114.28 99.22 1dx5 n THR 147 Ca -0.02 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.44 1dx5 n THR 147 Cb 0.14 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.28 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 0.48 -1.15 0.00 4.78 4.27 -1.26 -4.71 117.44 119.84 1dx5 n TRP 148 Ca 0.00 0.59 0.00 0.00 -3.89 0.00 0.00 57.50 54.20 1dx5 n TRP 148 Cb 0.00 -2.35 0.00 0.00 -1.36 0.00 0.00 31.31 27.60 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 -4.19 0.00 -3.79 -1.67 5.66 -1.26 -5.12 114.28 103.91 1dx5 n THR 149 Ca -0.18 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.46 1dx5 n THR 149 Cb 0.58 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.27 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 3.50 -0.29 1.79 0.00 -1.26 -5.07 121.76 119.43 1dx5 s ALA 149 Ca 0.00 -0.86 -0.21 0.00 0.00 0.00 0.00 51.96 50.90 1dx5 s ALA 149 Cb 0.00 -2.15 0.13 0.00 0.00 0.00 0.00 23.12 21.10 1dx5 s ALA 149 CO 0.00 -0.08 1.01 1.21 0.00 0.00 0.00 175.76 177.90 1dx5 s ASN 149 N 0.85 -0.48 -0.49 0.00 3.04 -1.26 -4.99 114.94 111.60 1dx5 s ASN 149 Ca 0.06 0.85 -0.25 0.00 0.04 0.00 0.00 52.86 53.56 1dx5 s ASN 149 Cb -0.13 1.01 0.03 0.00 -1.54 0.00 0.00 41.25 40.62 1dx5 s ASN 149 CO 0.03 -0.14 0.93 -0.69 -3.04 0.00 0.00 177.10 174.18 1dx5 s VAL 149 N 0.74 4.45 0.10 -5.21 1.01 -1.26 -4.98 120.40 115.25 1dx5 s VAL 149 Ca -0.02 0.59 -0.26 0.00 0.00 0.00 0.00 61.98 62.29 1dx5 s VAL 149 Cb -0.04 -4.46 0.09 0.00 0.00 0.00 0.00 36.38 31.96 1dx5 s VAL 149 CO -0.11 -0.92 1.11 -0.83 0.00 0.00 0.00 175.10 174.35 1dx5 s GLY 149 N 2.43 -0.19 0.00 4.51 0.00 -1.26 -5.01 107.32 107.80 1dx5 s GLY 149 Ca 0.35 0.16 0.29 0.00 0.00 0.00 0.00 44.72 45.52 1dx5 s GLY 149 CO 0.24 1.17 1.94 0.28 0.00 0.00 0.00 173.10 176.74 1dx5 n LYS 149 N -0.58 0.31 0.00 2.90 5.02 -1.26 -4.95 118.16 119.60 1dx5 n LYS 149 Ca -0.05 -0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 1dx5 n LYS 149 Cb 0.61 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.12 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 1.36 1.95 3.56 0.72 0.00 -1.26 -4.76 105.19 106.76 1dx5 n GLY 150 Ca 0.11 0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.97 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 2.59 0.60 1.61 -0.21 -1.26 -0.73 119.66 122.26 1dx5 s GLN 151 Ca 0.00 -0.66 -0.14 0.00 0.02 0.00 0.00 55.36 54.57 1dx5 s GLN 151 Cb 0.00 -2.49 -0.04 0.00 1.00 0.00 0.00 33.01 31.48 1dx5 s GLN 151 CO 0.00 0.63 1.04 -1.25 -2.12 0.00 0.00 175.29 173.59 1dx5 s PRO 152 N -1.02 3.40 0.17 2.91 0.04 -1.26 -4.96 135.00 134.27 1dx5 s PRO 152 Ca 0.14 1.05 0.18 0.00 0.04 0.00 0.00 61.00 62.41 1dx5 s PRO 152 Cb -0.11 -2.05 -0.03 0.00 0.04 0.00 0.00 34.50 32.35 1dx5 s PRO 152 CO 0.03 -0.73 1.06 0.66 0.04 0.00 0.00 177.00 178.06 1dx5 h SER 153 N 0.22 0.00 -4.58 6.66 4.64 -1.97 -3.43 113.55 115.09 1dx5 h SER 153 Ca -0.46 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 60.59 1dx5 h SER 153 Cb 1.21 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.12 1dx5 h SER 153 CO 0.59 0.38 -0.72 -0.69 -0.87 0.00 0.00 176.83 175.51 1dx5 s VAL 154 N -3.06 0.74 0.15 0.95 1.01 -1.26 -0.93 120.40 117.99 1dx5 s VAL 154 Ca -0.00 -1.56 -0.34 0.00 0.00 0.00 0.00 61.98 60.08 1dx5 s VAL 154 Cb 0.08 -1.23 -0.16 0.00 0.00 0.00 0.00 36.38 35.08 1dx5 s VAL 154 CO 0.78 -0.60 1.28 -0.11 0.00 0.00 0.00 175.10 176.45 1dx5 n LEU 155 N 0.65 1.85 -4.87 3.92 7.94 -0.14 -4.83 117.00 121.53 1dx5 n LEU 155 Ca -0.17 1.13 -0.28 0.00 -1.11 0.00 0.00 56.01 55.58 1dx5 n LEU 155 Cb 0.58 -1.25 -0.05 0.00 0.53 0.00 0.00 43.42 43.23 1dx5 n LEU 155 CO 0.26 -1.06 -0.18 -1.10 -1.11 0.00 0.00 177.39 174.20 1dx5 s GLN 156 N -0.02 3.19 -0.00 1.96 -1.52 -0.45 -1.00 119.66 121.82 1dx5 s GLN 156 Ca 0.77 -0.64 0.02 0.00 -1.95 0.00 0.00 55.36 53.56 1dx5 s GLN 156 Cb -0.85 -2.86 -0.01 0.00 -0.22 0.00 0.00 33.01 29.08 1dx5 s GLN 156 CO 0.49 0.55 -0.05 0.54 -0.25 0.00 0.00 175.29 176.57 1dx5 s VAL 157 N -1.60 0.41 -0.05 1.09 0.11 -0.09 -1.76 120.40 118.53 1dx5 s VAL 157 Ca 0.33 -0.28 -0.05 0.00 -2.93 0.00 0.00 61.98 59.05 1dx5 s VAL 157 Cb -0.12 -0.36 0.01 0.00 -1.53 0.00 0.00 36.38 34.38 1dx5 s VAL 157 CO 0.26 0.08 0.13 0.54 -3.33 0.00 0.00 175.10 172.78 1dx5 s VAL 158 N -0.21 0.00 -0.26 2.04 0.11 -0.46 -1.08 120.40 120.54 1dx5 s VAL 158 Ca 0.01 -0.02 -0.12 0.00 -2.93 0.00 0.00 61.98 58.92 1dx5 s VAL 158 Cb -0.03 -0.20 -0.05 0.00 -1.53 0.00 0.00 36.38 34.58 1dx5 s VAL 158 CO -0.00 -0.01 0.21 0.20 -3.33 0.00 0.00 175.10 172.17 1dx5 s ASN 159 N 0.02 6.10 -0.04 3.54 0.01 -1.26 -1.31 114.94 122.00 1dx5 s ASN 159 Ca -0.01 0.10 0.02 0.00 -0.71 0.00 0.00 52.86 52.26 1dx5 s ASN 159 Cb -0.01 -2.13 0.01 0.00 0.41 0.00 0.00 41.25 39.53 1dx5 s ASN 159 CO 0.00 -0.03 -0.10 -0.76 -1.51 0.00 0.00 177.10 174.71 1dx5 s LEU 160 N 1.52 1.66 0.29 0.60 1.43 -0.00 -4.93 118.68 119.24 1dx5 s LEU 160 Ca 0.09 -0.22 -0.28 0.00 -1.03 0.00 0.00 54.13 52.68 1dx5 s LEU 160 Cb -0.15 -0.65 -0.09 0.00 0.03 0.00 0.00 46.19 45.33 1dx5 s LEU 160 CO 0.08 0.04 1.00 -2.16 0.23 0.00 0.00 176.35 175.54 1dx5 s PRO 161 N 0.47 4.66 0.38 1.29 0.04 -1.26 -0.45 135.00 140.13 1dx5 s PRO 161 Ca -0.09 1.55 -0.26 0.00 0.04 0.00 0.00 61.00 62.24 1dx5 s PRO 161 Cb -0.12 -3.07 -0.09 0.00 0.04 0.00 0.00 34.50 31.26 1dx5 s PRO 161 CO 0.02 0.31 1.23 0.42 0.04 0.00 0.00 177.00 179.01 1dx5 s ILE 162 N -1.32 2.95 -0.06 0.56 1.01 0.91 -1.15 121.20 124.10 1dx5 s ILE 162 Ca 0.46 0.85 0.01 0.00 0.00 0.00 0.00 60.65 61.96 1dx5 s ILE 162 Cb -0.26 -3.50 -0.03 0.00 0.01 0.00 0.00 42.46 38.68 1dx5 s ILE 162 CO 0.32 0.12 -0.05 -0.69 0.00 0.00 0.00 174.94 174.65 1dx5 s VAL 163 N -1.30 3.86 0.44 2.92 1.01 -0.97 0.07 120.40 126.42 1dx5 s VAL 163 Ca 0.55 -0.47 -0.26 0.00 0.00 0.00 0.00 61.98 61.80 1dx5 s VAL 163 Cb -0.34 -2.61 -0.09 0.00 0.00 0.00 0.00 36.38 33.34 1dx5 s VAL 163 CO 0.44 0.57 1.45 -1.83 0.00 0.00 0.00 175.10 175.73 1dx5 s GLU 164 N -0.94 3.77 0.29 2.72 1.03 -1.26 -4.61 118.70 119.70 1dx5 s GLU 164 Ca 0.14 2.48 0.03 0.00 0.03 0.00 0.00 54.97 57.64 1dx5 s GLU 164 Cb -0.11 -2.72 0.71 0.00 -0.80 0.00 0.00 34.13 31.20 1dx5 s GLU 164 CO 0.03 -0.77 1.68 0.00 -1.33 0.00 0.00 175.26 174.87 1dx5 h ARG 165 N 2.46 0.32 -0.23 -4.83 3.08 -1.98 -1.94 114.38 111.27 1dx5 h ARG 165 Ca -0.51 -0.02 -0.09 0.00 0.07 0.00 0.00 59.98 59.43 1dx5 h ARG 165 Cb 1.26 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 31.22 1dx5 h ARG 165 CO 0.62 0.21 -0.24 -1.00 -1.07 0.00 0.00 179.97 178.49 1dx5 h PRO 166 N 0.33 0.42 -0.11 0.04 0.13 -1.99 -0.93 132.00 129.90 1dx5 h PRO 166 Ca 0.55 -0.15 -0.12 0.00 -0.87 0.00 0.00 66.00 65.41 1dx5 h PRO 166 Cb 1.05 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.14 1dx5 h PRO 166 CO -0.56 0.64 -0.44 0.28 -0.23 0.00 0.00 178.00 177.68 1dx5 h VAL 167 N 0.38 1.32 -0.15 1.56 2.07 -1.74 -1.33 116.25 118.36 1dx5 h VAL 167 Ca 0.06 -1.61 -0.05 0.00 0.82 0.00 0.00 66.70 65.92 1dx5 h VAL 167 Cb 0.63 1.73 -0.00 0.00 -1.52 0.00 0.00 31.29 32.13 1dx5 h VAL 167 CO 0.05 0.48 -0.11 0.00 0.02 0.00 0.00 177.57 178.01 1dx5 h LYS 169 N -0.01 1.01 0.00 0.00 3.64 -1.06 -2.88 116.57 117.27 1dx5 h LYS 169 Ca 0.03 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1dx5 h LYS 169 Cb 0.61 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1dx5 h LYS 169 CO 0.03 0.69 0.00 -0.25 -2.27 0.00 0.00 179.45 177.65 1dx5 n ASP 170 N -4.53 0.48 0.07 4.20 8.00 -0.51 -3.30 116.55 120.96 1dx5 n ASP 170 Ca 0.07 0.56 0.13 0.00 0.71 0.00 0.00 54.79 56.27 1dx5 n ASP 170 Cb 0.03 -0.68 0.47 0.00 -0.02 0.00 0.00 41.12 40.92 1dx5 n ASP 170 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1dx5 n SER 171 N -1.97 0.53 -4.01 -2.24 3.41 -1.07 -4.89 113.62 103.38 1dx5 n SER 171 Ca 0.05 0.53 -0.08 0.00 -0.26 0.00 0.00 58.87 59.11 1dx5 n SER 171 Cb 0.35 -0.66 -0.09 0.00 -0.26 0.00 0.00 64.21 63.55 1dx5 n SER 171 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1dx5 s THR 172 N -3.07 0.15 -0.81 6.66 -1.32 -1.21 -4.84 115.64 111.21 1dx5 s THR 172 Ca 0.12 -1.56 0.23 0.00 -1.21 0.00 0.00 61.69 59.26 1dx5 s THR 172 Cb 0.15 -1.61 -0.12 0.00 -1.51 0.00 0.00 72.50 69.41 1dx5 s THR 172 CO 0.58 -0.69 1.08 0.54 -2.21 0.00 0.00 174.62 173.92 1dx5 n ARG 173 N -0.03 0.14 -2.36 7.08 1.74 -1.26 -4.91 116.66 117.05 1dx5 n ARG 173 Ca -0.12 -0.01 -0.40 0.00 -0.77 0.00 0.00 57.85 56.55 1dx5 n ARG 173 Cb 0.62 -1.54 -0.04 0.00 -1.02 0.00 0.00 32.46 30.49 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 -3.10 3.25 0.10 0.55 1.01 -1.26 -4.98 121.20 116.78 1dx5 s ILE 174 Ca 0.07 1.26 -0.31 0.00 0.00 0.00 0.00 60.65 61.67 1dx5 s ILE 174 Cb 0.16 -3.80 -0.07 0.00 0.01 0.00 0.00 42.46 38.75 1dx5 s ILE 174 CO 0.80 0.30 1.36 -0.60 0.00 0.00 0.00 174.94 176.80 1dx5 s ARG 175 N -1.51 4.34 -0.19 2.79 3.52 -1.26 -5.01 118.95 121.62 1dx5 s ARG 175 Ca 0.46 2.02 -0.08 0.00 -0.13 0.00 0.00 55.73 58.00 1dx5 s ARG 175 Cb -0.34 -3.28 -0.04 0.00 -1.56 0.00 0.00 34.95 29.72 1dx5 s ARG 175 CO 0.44 -0.42 0.09 0.42 -0.81 0.00 0.00 175.30 175.03 1dx5 s ILE 176 N 1.16 5.03 0.43 4.11 -1.09 -1.26 -4.88 121.20 124.70 1dx5 s ILE 176 Ca 0.64 0.05 0.08 0.00 -2.23 0.00 0.00 60.65 59.18 1dx5 s ILE 176 Cb -0.35 -3.27 -0.01 0.00 -1.58 0.00 0.00 42.46 37.24 1dx5 s ILE 176 CO 0.30 0.46 0.39 0.42 -1.23 0.00 0.00 174.94 175.27 1dx5 s THR 177 N 0.32 2.53 -0.65 2.92 -4.23 -1.26 -5.00 115.64 110.27 1dx5 s THR 177 Ca 0.05 -1.36 0.21 0.00 -1.18 0.00 0.00 61.69 59.41 1dx5 s THR 177 Cb -0.12 -2.89 0.21 0.00 1.34 0.00 0.00 72.50 71.05 1dx5 s THR 177 CO -0.01 0.00 1.64 0.47 -0.54 0.00 0.00 174.62 176.19 1dx5 n ASP 178 N -1.58 0.47 -0.22 3.99 9.92 -1.26 -2.12 116.55 125.75 1dx5 n ASP 178 Ca 0.03 0.61 0.04 0.00 -0.53 0.00 0.00 54.79 54.95 1dx5 n ASP 178 Cb 0.62 -0.71 0.18 0.00 -0.64 0.00 0.00 41.12 40.56 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 -2.01 0.63 -4.08 -2.24 3.02 -1.26 -4.83 115.26 104.49 1dx5 n ASN 179 Ca 0.03 -1.87 -0.08 0.00 -0.03 0.00 0.00 54.58 52.63 1dx5 n ASN 179 Cb 0.22 -0.07 -0.10 0.00 -0.61 0.00 0.00 39.78 39.22 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 -1.86 0.60 0.06 3.52 1.00 -0.90 -0.10 119.30 121.62 1dx5 s MET 180 Ca 0.14 -1.12 -0.08 0.00 0.00 0.00 0.00 55.69 54.63 1dx5 s MET 180 Cb 0.07 0.10 -0.01 0.00 0.00 0.00 0.00 34.83 35.00 1dx5 s MET 180 CO 0.10 -0.08 0.16 -0.59 0.00 0.00 0.00 175.02 174.61 1dx5 s PHE 181 N -3.37 0.17 0.21 -0.03 -0.12 -0.80 -4.81 117.98 109.23 1dx5 s PHE 181 Ca 0.03 -0.53 0.11 0.00 -0.05 0.00 0.00 56.93 56.49 1dx5 s PHE 181 Cb 0.04 -0.09 -0.05 0.00 -0.63 0.00 0.00 43.02 42.29 1dx5 s PHE 181 CO -0.07 -0.47 -0.22 0.00 -0.05 0.00 0.00 175.22 174.40 1dx5 s ALA 183 N -1.88 0.19 0.00 0.00 0.00 -0.53 -2.29 121.76 117.25 1dx5 s ALA 183 Ca 0.23 -0.99 0.00 0.00 0.00 0.00 0.00 51.96 51.20 1dx5 s ALA 183 Cb -0.07 0.77 0.00 0.00 0.00 0.00 0.00 23.12 23.81 1dx5 s ALA 183 CO 0.11 -0.57 0.00 0.41 0.00 0.00 0.00 175.76 175.71 1dx5 n GLY 184 N -0.14 3.04 3.86 0.00 0.00 -0.30 -2.15 105.19 109.51 1dx5 n GLY 184 Ca -0.09 -1.90 -0.31 0.00 0.00 0.00 0.00 46.02 43.73 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 -2.06 3.49 0.35 1.61 2.02 -1.26 -4.48 117.35 117.02 1dx5 s TYR 184 Ca 0.00 1.21 -0.04 0.00 -0.37 0.00 0.00 57.07 57.87 1dx5 s TYR 184 Cb 0.00 -2.59 -0.05 0.00 -0.40 0.00 0.00 41.96 38.92 1dx5 s TYR 184 CO 0.00 -0.28 0.61 0.15 -1.57 0.00 0.00 175.55 174.46 1dx5 s LYS 185 N -4.15 3.59 0.37 -0.62 1.02 -1.26 -4.86 119.74 113.83 1dx5 s LYS 185 Ca 0.54 -0.00 0.14 0.00 0.02 0.00 0.00 55.97 56.67 1dx5 s LYS 185 Cb -0.10 -2.58 0.99 0.00 -0.52 0.00 0.00 37.83 35.62 1dx5 s LYS 185 CO 0.35 0.10 1.78 -1.35 -0.92 0.00 0.00 175.35 175.32 1dx5 h PRO 186 N 1.16 0.49 0.00 -1.68 0.11 -1.96 -0.69 132.00 129.44 1dx5 h PRO 186 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1dx5 h PRO 186 Cb 1.20 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1dx5 h PRO 186 CO 0.64 0.33 0.00 -0.25 -0.21 0.00 0.00 178.00 178.51 1dx5 n ASP 186 N -4.66 0.00 0.11 -2.05 8.00 -1.26 -3.15 116.55 113.54 1dx5 n ASP 186 Ca 0.24 -0.09 0.12 0.00 0.71 0.00 0.00 54.79 55.77 1dx5 n ASP 186 Cb 0.75 -0.30 0.18 0.00 -0.02 0.00 0.00 41.12 41.73 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 -1.50 -3.48 114.58 113.44 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 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 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 1.25 1.38 3.67 -3.84 0.00 -1.19 -4.93 105.19 101.53 1dx5 n GLY 186 Ca 0.03 -0.02 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1dx5 n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dx5 n LYS 186 N 0.00 0.98 -2.04 1.61 5.02 -1.26 -5.02 118.16 117.44 1dx5 n LYS 186 Ca 0.00 0.38 -0.00 0.00 -2.02 0.00 0.00 58.31 56.67 1dx5 n LYS 186 Cb 0.00 -2.34 -0.00 0.00 -0.02 0.00 0.00 35.03 32.67 1dx5 n LYS 186 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 1dx5 n ARG 187 N -1.46 0.11 0.00 1.97 1.85 -1.26 -4.68 116.66 113.19 1dx5 n ARG 187 Ca 0.15 -0.07 0.00 0.00 -1.00 0.00 0.00 57.85 56.93 1dx5 n ARG 187 Cb 0.48 0.05 0.00 0.00 -1.05 0.00 0.00 32.46 31.94 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 0.24 4.45 3.63 2.89 0.00 -1.26 -4.90 105.19 110.23 1dx5 n GLY 188 Ca 0.00 -1.45 -0.02 0.00 0.00 0.00 0.00 46.02 44.54 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 -0.04 0.84 1.61 2.15 -0.81 -4.65 116.67 115.76 1dx5 s ASP 189 Ca 0.00 -0.00 -0.12 0.00 0.43 0.00 0.00 52.55 52.86 1dx5 s ASP 189 Cb 0.00 0.04 0.12 0.00 -0.30 0.00 0.00 42.92 42.78 1dx5 s ASP 189 CO 0.00 -0.06 1.18 0.00 -0.17 0.00 0.00 175.17 176.12 1dx5 s ALA 190 N -2.11 2.68 0.01 3.66 0.00 -1.26 -0.07 121.76 124.67 1dx5 s ALA 190 Ca 0.11 -0.97 -0.00 0.00 0.00 0.00 0.00 51.96 51.10 1dx5 s ALA 190 Cb -0.01 -2.76 0.00 0.00 0.00 0.00 0.00 23.12 20.36 1dx5 s ALA 190 CO -0.03 -1.85 0.01 0.00 0.00 0.00 0.00 175.76 173.89 1dx5 n GLU 192 N -0.01 2.03 0.00 0.00 2.13 -1.26 -1.50 120.64 122.03 1dx5 n GLU 192 Ca -0.00 0.73 0.00 0.00 0.66 0.00 0.00 57.16 58.55 1dx5 n GLU 192 Cb 0.01 -2.49 0.00 0.00 0.27 0.00 0.00 31.44 29.23 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 3.41 1.33 0.08 8.31 0.00 -1.26 -0.41 105.19 116.65 1dx5 n GLY 193 Ca 0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.32 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 -2.54 1.61 3.32 -1.62 -3.32 116.42 113.88 1dx5 h ASP 194 Ca 0.00 -0.15 -0.60 0.00 0.02 0.00 0.00 57.03 56.30 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 0.08 -0.19 -1.20 -1.72 0.00 0.00 179.24 176.20 1dx5 n SER 195 N -2.30 -0.08 0.00 6.45 7.64 -1.26 -1.02 113.62 123.05 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 0.47 -1.20 0.00 0.00 -1.01 0.00 0.00 64.21 62.48 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 1.57 3.09 3.71 0.23 0.00 -0.68 -0.05 105.19 113.06 1dx5 n GLY 196 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.60 2.14 0.10 -0.02 0.00 -0.19 -3.12 107.32 104.62 1dx5 s GLY 197 Ca 0.00 0.78 -0.16 0.00 0.00 0.00 0.00 44.72 45.33 1dx5 s GLY 197 CO 0.00 1.19 0.54 2.56 0.00 0.00 0.00 173.10 177.39 1dx5 s PRO 198 N -4.16 4.06 -0.42 2.90 0.04 -1.26 -0.83 135.00 135.32 1dx5 s PRO 198 Ca 0.72 0.58 -0.11 0.00 0.04 0.00 0.00 61.00 62.24 1dx5 s PRO 198 Cb -0.27 -3.09 0.07 0.00 0.04 0.00 0.00 34.50 31.25 1dx5 s PRO 198 CO 0.49 0.57 0.28 0.12 0.04 0.00 0.00 177.00 178.50 1dx5 s PHE 199 N -1.28 3.31 0.19 0.56 2.19 0.33 -3.67 117.98 119.61 1dx5 s PHE 199 Ca 0.33 -1.36 0.07 0.00 0.33 0.00 0.00 56.93 56.30 1dx5 s PHE 199 Cb -0.17 -2.94 -0.04 0.00 -1.31 0.00 0.00 43.02 38.56 1dx5 s PHE 199 CO 0.18 -0.82 0.06 0.14 1.83 0.00 0.00 175.22 176.62 1dx5 s VAL 200 N 1.48 4.02 -0.01 3.12 -7.23 0.76 -0.83 120.40 121.70 1dx5 s VAL 200 Ca 0.03 -1.35 0.01 0.00 -1.81 0.00 0.00 61.98 58.86 1dx5 s VAL 200 Cb -0.23 -3.06 0.00 0.00 0.56 0.00 0.00 36.38 33.66 1dx5 s VAL 200 CO 0.03 -0.15 -0.05 -0.04 -0.31 0.00 0.00 175.10 174.58 1dx5 s MET 201 N -3.14 0.50 -0.26 4.82 -1.94 0.01 -0.13 119.30 119.15 1dx5 s MET 201 Ca 0.29 -0.14 -0.18 0.00 -1.71 0.00 0.00 55.69 53.95 1dx5 s MET 201 Cb -0.09 -0.51 -0.02 0.00 2.01 0.00 0.00 34.83 36.22 1dx5 s MET 201 CO 0.21 0.05 0.54 0.21 -0.01 0.00 0.00 175.02 176.02 1dx5 s LYS 202 N 0.21 4.06 0.07 2.03 2.20 -1.26 -0.64 119.74 126.40 1dx5 s LYS 202 Ca -0.02 0.35 -0.31 0.00 -0.36 0.00 0.00 55.97 55.63 1dx5 s LYS 202 Cb -0.06 -3.66 -0.08 0.00 -1.51 0.00 0.00 37.83 32.52 1dx5 s LYS 202 CO -0.00 -0.38 1.54 0.45 -0.36 0.00 0.00 175.35 176.59 1dx5 s SER 203 N 1.54 6.70 0.00 1.43 0.15 0.36 -4.88 113.70 119.01 1dx5 s SER 203 Ca 0.22 2.38 0.24 0.00 0.70 0.00 0.00 55.95 59.49 1dx5 s SER 203 Cb -0.16 -2.57 1.14 0.00 -1.71 0.00 0.00 66.02 62.73 1dx5 s SER 203 CO 0.09 -0.80 1.78 -0.81 1.20 0.00 0.00 173.24 174.70 1dx5 n PRO 204 N 5.12 0.23 -0.07 5.44 -0.04 -1.26 -1.08 135.00 143.33 1dx5 n PRO 204 Ca 0.14 0.07 -0.05 0.00 -0.04 0.00 0.00 63.50 63.63 1dx5 n PRO 204 Cb 0.41 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.36 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 -0.30 0.54 0.04 -1.96 -3.42 116.94 111.84 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 0.28 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.43 1dx5 h PHE 204 CO 0.00 0.06 0.00 0.27 -0.60 0.00 0.00 178.31 178.04 1dx5 n ASN 204 N -4.63 2.89 0.00 2.17 2.04 -1.25 -4.98 115.26 111.49 1dx5 n ASN 204 Ca -0.07 -1.86 0.00 0.00 -0.44 0.00 0.00 54.58 52.21 1dx5 n ASN 204 Cb 0.25 -0.20 0.00 0.00 -2.53 0.00 0.00 39.78 37.30 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 0.89 -5.39 -4.88 0.53 4.13 -0.25 -4.99 115.26 105.30 1dx5 n ASN 205 Ca 0.13 0.00 -0.31 0.00 1.68 0.00 0.00 54.58 56.08 1dx5 n ASN 205 Cb 0.45 -3.00 -0.05 0.00 -1.54 0.00 0.00 39.78 35.64 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 -1.66 3.77 0.01 3.52 0.52 -1.26 -4.71 118.95 119.14 1dx5 s ARG 206 Ca 0.00 0.24 -0.20 0.00 -0.52 0.00 0.00 55.73 55.25 1dx5 s ARG 206 Cb 0.00 -2.62 -0.06 0.00 0.52 0.00 0.00 34.95 32.79 1dx5 s ARG 206 CO 0.00 0.27 0.58 -1.58 0.02 0.00 0.00 175.30 174.58 1dx5 s TRP 207 N -1.92 3.71 -0.03 -0.53 0.52 -1.26 -0.49 118.94 118.95 1dx5 s TRP 207 Ca 0.47 1.19 0.05 0.00 0.02 0.00 0.00 56.10 57.84 1dx5 s TRP 207 Cb -0.11 -2.57 -0.01 0.00 -1.15 0.00 0.00 33.47 29.63 1dx5 s TRP 207 CO 0.24 0.41 -0.19 0.71 0.02 0.00 0.00 176.95 178.14 1dx5 s TYR 208 N -0.41 1.77 -0.61 -1.98 1.51 0.19 -2.24 117.35 115.58 1dx5 s TYR 208 Ca 0.30 -0.41 -0.23 0.00 -1.01 0.00 0.00 57.07 55.72 1dx5 s TYR 208 Cb -0.18 -1.16 0.06 0.00 -0.11 0.00 0.00 41.96 40.56 1dx5 s TYR 208 CO 0.17 -0.09 0.95 -1.14 -1.11 0.00 0.00 175.55 174.34 1dx5 s GLN 209 N -0.28 3.21 0.19 -0.62 0.74 0.04 -0.81 119.66 122.13 1dx5 s GLN 209 Ca 0.03 -0.56 0.17 0.00 0.05 0.00 0.00 55.36 55.06 1dx5 s GLN 209 Cb -0.09 -4.14 -0.01 0.00 1.10 0.00 0.00 33.01 29.86 1dx5 s GLN 209 CO 0.00 -1.66 1.13 0.52 -0.55 0.00 0.00 175.29 174.73 1dx5 h MET 210 N 9.46 0.00 -3.77 1.67 2.86 -1.31 -3.39 114.93 120.44 1dx5 h MET 210 Ca -0.28 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.28 1dx5 h MET 210 Cb 1.07 0.00 -0.11 0.00 0.06 0.00 0.00 31.60 32.62 1dx5 h MET 210 CO 1.14 0.30 -0.21 0.20 1.06 0.00 0.00 176.91 179.39 1dx5 s GLY 211 N -4.57 0.52 -0.09 8.32 0.00 -0.85 -2.33 107.32 108.32 1dx5 s GLY 211 Ca 0.01 -0.87 0.03 0.00 0.00 0.00 0.00 44.72 43.88 1dx5 s GLY 211 CO 0.78 -0.72 -0.18 -0.42 0.00 0.00 0.00 173.10 172.55 1dx5 s ILE 212 N -4.00 1.64 -0.07 0.90 1.01 -0.83 -0.51 121.20 119.35 1dx5 s ILE 212 Ca 0.21 -0.77 -0.33 0.00 0.00 0.00 0.00 60.65 59.76 1dx5 s ILE 212 Cb 0.01 -1.45 -0.11 0.00 0.01 0.00 0.00 42.46 40.93 1dx5 s ILE 212 CO 0.05 0.47 1.94 0.52 0.00 0.00 0.00 174.94 177.92 1dx5 n VAL 213 N 3.76 0.62 0.00 2.92 0.31 -0.01 -0.83 118.33 125.10 1dx5 n VAL 213 Ca -0.20 -0.14 -0.02 0.00 -0.01 0.00 0.00 64.34 63.97 1dx5 n VAL 213 Cb 0.52 -2.04 -0.01 0.00 -0.91 0.00 0.00 33.84 31.40 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 7.28 1.00 -3.38 4.52 2.88 -0.79 -1.69 113.62 123.44 1dx5 n SER 214 Ca 0.23 0.15 -0.09 0.00 -1.33 0.00 0.00 58.87 57.82 1dx5 n SER 214 Cb 0.33 -0.39 -0.01 0.00 -0.75 0.00 0.00 64.21 63.40 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 0.23 0.02 0.66 1.48 -0.79 -4.96 118.94 113.63 1dx5 s TRP 215 Ca -0.07 -0.73 -0.23 0.00 -1.06 0.00 0.00 56.10 54.01 1dx5 s TRP 215 Cb 0.01 0.56 0.08 0.00 -1.16 0.00 0.00 33.47 32.96 1dx5 s TRP 215 CO 0.10 -1.33 1.07 0.41 -4.06 0.00 0.00 176.95 173.14 1dx5 n GLY 216 N -0.50 0.35 2.94 3.67 0.00 -1.26 0.14 105.19 110.54 1dx5 n GLY 216 Ca -0.05 -1.04 -0.31 0.00 0.00 0.00 0.00 46.02 44.63 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 1.48 2.79 1.61 2.02 -1.26 -5.02 118.70 118.29 1dx5 s GLU 217 Ca 0.25 -1.33 0.00 0.00 0.02 0.00 0.00 54.97 53.91 1dx5 s GLU 217 Cb -0.01 -2.71 0.00 0.00 0.10 0.00 0.00 34.13 31.51 1dx5 s GLU 217 CO 0.01 -0.78 0.00 0.41 0.02 0.00 0.00 175.26 174.92 1dx5 n GLY 219 N 4.54 -0.43 3.21 -1.39 0.00 -1.26 -4.78 105.19 105.09 1dx5 n GLY 219 Ca -0.05 -1.08 -0.10 0.00 0.00 0.00 0.00 46.02 44.79 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 5.26 -5.63 -4.86 0.00 2.03 -1.26 -4.62 116.55 107.47 1dx5 n ASP 221 Ca -0.10 -0.22 -0.31 0.00 0.52 0.00 0.00 54.79 54.69 1dx5 n ASP 221 Cb 0.50 -4.49 -0.03 0.00 -0.72 0.00 0.00 41.12 36.38 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 -5.46 3.81 0.14 -0.67 0.52 -1.26 -4.93 118.95 111.10 1dx5 s ARG 221 Ca 0.22 0.65 -0.30 0.00 -0.52 0.00 0.00 55.73 55.78 1dx5 s ARG 221 Cb -0.10 -2.27 -0.07 0.00 0.52 0.00 0.00 34.95 33.02 1dx5 s ARG 221 CO 0.28 -0.17 1.24 -0.51 0.02 0.00 0.00 175.30 176.16 1dx5 s ASP 222 N -3.26 7.02 0.00 0.23 1.01 -1.26 -2.52 116.67 117.89 1dx5 s ASP 222 Ca 0.54 2.20 0.00 0.00 0.71 0.00 0.00 52.55 56.00 1dx5 s ASP 222 Cb -0.10 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.23 1dx5 s ASP 222 CO 0.34 -0.46 0.00 0.61 0.21 0.00 0.00 175.17 175.87 1dx5 n GLY 223 N 2.71 1.13 3.62 0.21 0.00 -1.26 -5.03 105.19 106.57 1dx5 n GLY 223 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.30 2.26 0.01 1.61 -0.14 -1.05 -4.71 119.74 117.42 1dx5 s LYS 224 Ca 0.00 -1.09 0.01 0.00 -1.36 0.00 0.00 55.97 53.53 1dx5 s LYS 224 Cb 0.00 -2.32 -0.01 0.00 -1.68 0.00 0.00 37.83 33.82 1dx5 s LYS 224 CO 0.00 0.47 -0.04 0.71 -0.76 0.00 0.00 175.35 175.74 1dx5 s TYR 225 N -1.53 0.34 0.34 3.18 2.02 -1.26 -4.70 117.35 115.74 1dx5 s TYR 225 Ca 0.25 -0.22 -0.27 0.00 -0.37 0.00 0.00 57.07 56.45 1dx5 s TYR 225 Cb -0.10 -0.22 -0.09 0.00 -0.40 0.00 0.00 41.96 41.15 1dx5 s TYR 225 CO 0.16 -0.05 1.17 0.20 -1.57 0.00 0.00 175.55 175.47 1dx5 s GLY 226 N -0.61 2.96 -0.09 0.71 0.00 -0.91 -4.74 107.32 104.64 1dx5 s GLY 226 Ca -0.04 1.01 -0.02 0.00 0.00 0.00 0.00 44.72 45.66 1dx5 s GLY 226 CO -0.00 1.58 0.01 -1.36 0.00 0.00 0.00 173.10 173.33 1dx5 s PHE 227 N -1.27 3.18 0.10 1.90 0.40 0.12 -1.45 117.98 120.97 1dx5 s PHE 227 Ca 0.51 0.20 0.07 0.00 -0.60 0.00 0.00 56.93 57.11 1dx5 s PHE 227 Cb -0.33 -1.80 -0.03 0.00 0.51 0.00 0.00 43.02 41.36 1dx5 s PHE 227 CO 0.43 0.47 -0.19 0.71 0.70 0.00 0.00 175.22 177.34 1dx5 s TYR 228 N -0.85 1.63 -0.11 0.36 1.51 0.17 -1.89 117.35 118.17 1dx5 s TYR 228 Ca 0.13 -0.44 -0.30 0.00 -1.01 0.00 0.00 57.07 55.46 1dx5 s TYR 228 Cb -0.11 -0.89 -0.02 0.00 -0.11 0.00 0.00 41.96 40.83 1dx5 s TYR 228 CO 0.02 0.17 1.13 0.99 -1.11 0.00 0.00 175.55 176.75 1dx5 s THR 229 N -1.29 4.48 -0.62 -0.71 2.01 -0.01 -1.90 115.64 117.60 1dx5 s THR 229 Ca 0.05 1.78 -0.27 0.00 0.31 0.00 0.00 61.69 63.57 1dx5 s THR 229 Cb -0.09 -4.15 -0.01 0.00 0.01 0.00 0.00 72.50 68.26 1dx5 s THR 229 CO 0.04 -0.04 1.71 -2.28 -0.69 0.00 0.00 174.62 173.36 1dx5 s HIS 230 N 2.45 1.84 0.10 4.92 2.46 0.86 -1.96 115.29 125.96 1dx5 s HIS 230 Ca 0.52 0.59 -0.23 0.00 0.47 0.00 0.00 55.06 56.41 1dx5 s HIS 230 Cb -0.21 -4.22 -0.10 0.00 -0.13 0.00 0.00 32.58 27.91 1dx5 s HIS 230 CO 0.18 -2.26 1.71 0.28 -2.47 0.00 0.00 174.74 172.17 1dx5 h VAL 231 N 6.68 0.85 -1.01 0.89 2.07 -1.76 -3.03 116.25 120.93 1dx5 h VAL 231 Ca -0.27 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.31 1dx5 h VAL 231 Cb 1.13 0.85 -0.07 0.00 -1.52 0.00 0.00 31.29 31.69 1dx5 h VAL 231 CO 1.22 0.00 0.65 0.15 0.02 0.00 0.00 177.57 179.61 1dx5 h PHE 232 N -0.09 1.22 0.00 1.57 3.57 -1.86 -0.66 116.94 120.68 1dx5 h PHE 232 Ca 0.03 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 1dx5 h PHE 232 Cb 0.13 -0.40 -0.00 0.00 2.79 0.00 0.00 35.95 38.47 1dx5 h PHE 232 CO -0.14 0.65 -0.05 0.00 -2.23 0.00 0.00 178.31 176.54 1dx5 h ARG 233 N 1.21 0.00 -0.43 1.11 2.47 -1.89 -1.92 114.38 114.93 1dx5 h ARG 233 Ca 0.43 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.15 1dx5 h ARG 233 Cb 0.13 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.45 1dx5 h ARG 233 CO -0.16 0.05 0.00 1.28 0.56 0.00 0.00 179.97 181.70 1dx5 n LEU 234 N -4.14 3.18 0.29 3.04 7.99 -0.68 -4.60 117.00 122.09 1dx5 n LEU 234 Ca -0.03 -1.85 0.15 0.00 -0.01 0.00 0.00 56.01 54.28 1dx5 n LEU 234 Cb 0.14 -0.28 0.90 0.00 -0.11 0.00 0.00 43.42 44.06 1dx5 n LEU 234 CO 0.32 0.77 1.09 0.50 -1.51 0.00 0.00 177.39 178.56 1dx5 h LYS 235 N 2.95 0.00 -0.40 3.23 3.64 -0.31 -2.20 116.57 123.47 1dx5 h LYS 235 Ca 0.00 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.24 1dx5 h LYS 235 Cb 0.81 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.62 1dx5 h LYS 235 CO 0.00 0.03 -0.29 -0.22 -2.27 0.00 0.00 179.45 176.70 1dx5 h LYS 236 N 0.00 0.91 -0.23 1.90 3.64 -1.81 -1.91 116.57 119.07 1dx5 h LYS 236 Ca -0.00 -0.44 -0.20 0.00 -1.27 0.00 0.00 60.65 58.75 1dx5 h LYS 236 Cb 0.09 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1dx5 h LYS 236 CO 0.00 1.09 -0.64 2.35 -2.27 0.00 0.00 179.45 179.99 1dx5 h TRP 237 N 0.73 1.04 0.20 1.91 7.01 -1.76 -2.34 115.95 122.73 1dx5 h TRP 237 Ca 0.08 -0.41 0.01 0.00 2.11 0.00 0.00 58.89 60.68 1dx5 h TRP 237 Cb 0.87 -0.18 -0.03 0.00 -2.10 0.00 0.00 29.16 27.72 1dx5 h TRP 237 CO 0.06 1.23 -0.28 0.82 -2.79 0.00 0.00 178.44 177.48 1dx5 h ILE 238 N 0.60 0.41 -0.61 2.65 2.04 -1.31 -2.20 117.51 119.08 1dx5 h ILE 238 Ca -0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 1dx5 h ILE 238 Cb 1.25 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 1dx5 h ILE 238 CO 0.13 0.00 0.35 1.56 0.00 0.00 0.00 178.15 180.20 1dx5 h GLN 239 N -0.54 0.83 0.07 2.37 4.20 -1.40 -2.29 115.11 118.36 1dx5 h GLN 239 Ca 0.01 -0.08 -0.00 0.00 0.06 0.00 0.00 58.65 58.64 1dx5 h GLN 239 Cb 0.53 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.13 1dx5 h GLN 239 CO -0.11 0.60 -0.04 -0.22 -0.67 0.00 0.00 178.83 178.39 1dx5 h LYS 240 N 0.84 -0.09 -0.07 1.46 3.64 -1.10 -0.14 116.57 121.11 1dx5 h LYS 240 Ca 0.22 0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.48 1dx5 h LYS 240 Cb -0.01 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 1dx5 h LYS 240 CO -0.04 0.00 -0.54 -0.39 -2.27 0.00 0.00 179.45 176.21 1dx5 h VAL 241 N -0.17 1.37 -0.36 2.00 -1.51 -1.29 -0.97 116.25 115.32 1dx5 h VAL 241 Ca -0.01 -1.84 -0.13 0.00 -1.23 0.00 0.00 66.70 63.48 1dx5 h VAL 241 Cb 0.14 1.92 -0.01 0.00 -2.13 0.00 0.00 31.29 31.21 1dx5 h VAL 241 CO 0.02 0.54 -0.31 0.40 -1.23 0.00 0.00 177.57 176.99 1dx5 h ILE 242 N 0.15 1.28 -0.05 7.19 2.04 -1.31 0.68 117.51 127.49 1dx5 h ILE 242 Ca 0.00 -1.46 -0.23 0.00 1.00 0.00 0.00 64.86 64.17 1dx5 h ILE 242 Cb 1.01 1.33 0.01 0.00 -0.74 0.00 0.00 36.82 38.42 1dx5 h ILE 242 CO 0.08 0.48 -0.91 0.44 0.00 0.00 0.00 178.15 178.24 1dx5 h ASP 243 N 0.67 0.76 -0.09 1.72 3.32 -0.87 -2.53 116.42 119.39 1dx5 h ASP 243 Ca 0.07 -0.56 -0.10 0.00 0.02 0.00 0.00 57.03 56.46 1dx5 h ASP 243 Cb 0.85 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.17 1dx5 h ASP 243 CO 0.07 1.36 -0.33 -0.61 -1.72 0.00 0.00 179.24 178.01 1dx5 h GLN 244 N 0.37 0.39 -0.70 3.56 4.15 -1.14 -3.28 115.11 118.45 1dx5 h GLN 244 Ca -0.08 -0.29 0.00 0.00 0.77 0.00 0.00 58.65 59.04 1dx5 h GLN 244 Cb 1.54 0.05 0.00 0.00 0.21 0.00 0.00 27.48 29.29 1dx5 h GLN 244 CO 0.17 0.92 0.00 1.19 -1.93 0.00 0.00 178.83 179.18 1dx5 n PHE 245 N -4.40 1.48 -0.34 3.99 3.72 0.23 -5.04 117.46 117.09 1dx5 n PHE 245 Ca -0.08 -0.51 0.03 0.00 -0.05 0.00 0.00 57.45 56.84 1dx5 n PHE 245 Cb 0.50 -0.39 -0.02 0.00 -0.94 0.00 0.00 39.48 38.63 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 0.45 -2.87 0.08 1.37 0.00 -0.95 -4.98 105.19 98.29 1dx5 n GLY 246 Ca 0.20 -1.32 0.16 0.00 0.00 0.00 0.00 46.02 45.06 1dx5 n GLY 246 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50