#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1de4 s SER 5 N 0.00 5.32 0.35 2.89 1.04 -1.26 -3.78 113.70 118.26 1de4 s SER 5 Ca 0.00 0.15 0.07 0.00 0.48 0.00 0.00 55.95 56.66 1de4 s SER 5 Cb 0.00 -1.55 -0.02 0.00 0.10 0.00 0.00 66.02 64.55 1de4 s SER 5 CO 0.00 0.36 0.38 -1.00 0.98 0.00 0.00 173.24 173.96 1de4 s HIS 6 N -0.78 2.96 -0.02 5.02 3.76 -0.32 -4.92 115.29 120.99 1de4 s HIS 6 Ca 0.12 -0.29 -0.14 0.00 -0.15 0.00 0.00 55.06 54.60 1de4 s HIS 6 Cb -0.12 -1.93 0.02 0.00 1.11 0.00 0.00 32.58 31.67 1de4 s HIS 6 CO 0.02 0.06 0.30 -1.54 -0.85 0.00 0.00 174.74 172.74 1de4 s SER 7 N -4.09 -0.19 -0.05 1.40 1.04 -1.26 -0.84 113.70 109.71 1de4 s SER 7 Ca 0.44 0.11 0.02 0.00 0.48 0.00 0.00 55.95 57.00 1de4 s SER 7 Cb -0.07 0.33 0.01 0.00 0.10 0.00 0.00 66.02 66.39 1de4 s SER 7 CO 0.29 -0.42 -0.10 -0.22 0.98 0.00 0.00 173.24 173.77 1de4 s LEU 8 N -1.22 1.63 -0.16 2.42 2.96 -0.83 0.12 118.68 123.60 1de4 s LEU 8 Ca -0.13 -0.22 -0.26 0.00 -0.22 0.00 0.00 54.13 53.30 1de4 s LEU 8 Cb -0.05 -0.65 0.06 0.00 0.50 0.00 0.00 46.19 46.05 1de4 s LEU 8 CO 0.04 0.03 0.65 -1.38 -1.32 0.00 0.00 176.35 174.37 1de4 s HIS 9 N 0.54 -0.67 0.09 5.38 -3.43 -0.26 -0.93 115.29 116.01 1de4 s HIS 9 Ca -0.10 1.44 0.06 0.00 -0.80 0.00 0.00 55.06 55.66 1de4 s HIS 9 Cb -0.13 0.31 -0.04 0.00 -1.43 0.00 0.00 32.58 31.29 1de4 s HIS 9 CO 0.02 -0.46 -0.08 0.71 -2.00 0.00 0.00 174.74 172.93 1de4 s TYR 10 N -0.37 2.79 -0.06 0.38 1.51 0.10 -1.03 117.35 120.68 1de4 s TYR 10 Ca -0.05 -0.12 0.05 0.00 -1.01 0.00 0.00 57.07 55.94 1de4 s TYR 10 Cb -0.03 -1.47 -0.01 0.00 -0.11 0.00 0.00 41.96 40.34 1de4 s TYR 10 CO 0.05 0.42 -0.22 -0.51 -1.11 0.00 0.00 175.55 174.18 1de4 s LEU 11 N -2.09 2.01 0.02 -1.29 1.02 0.41 -2.01 118.68 116.76 1de4 s LEU 11 Ca 0.21 -0.46 0.06 0.00 0.02 0.00 0.00 54.13 53.96 1de4 s LEU 11 Cb -0.11 -1.23 -0.02 0.00 0.02 0.00 0.00 46.19 44.85 1de4 s LEU 11 CO 0.13 0.21 -0.17 -0.36 0.02 0.00 0.00 176.35 176.18 1de4 s PHE 12 N -0.06 1.53 -0.13 0.29 0.40 0.48 -0.27 117.98 120.22 1de4 s PHE 12 Ca -0.05 -0.33 -0.06 0.00 -0.60 0.00 0.00 56.93 55.90 1de4 s PHE 12 Cb -0.13 -0.94 0.06 0.00 0.51 0.00 0.00 43.02 42.51 1de4 s PHE 12 CO 0.03 0.03 0.29 0.00 0.70 0.00 0.00 175.22 176.27 1de4 s MET 13 N -0.83 0.22 0.05 0.44 0.23 -0.85 -1.14 119.30 117.43 1de4 s MET 13 Ca 0.06 0.69 0.01 0.00 -1.03 0.00 0.00 55.69 55.41 1de4 s MET 13 Cb -0.08 -0.04 -0.03 0.00 -1.53 0.00 0.00 34.83 33.16 1de4 s MET 13 CO 0.01 -0.21 -0.05 0.20 -2.03 0.00 0.00 175.02 172.93 1de4 s GLY 14 N 1.80 0.47 0.03 3.16 0.00 -0.01 -2.42 107.32 110.36 1de4 s GLY 14 Ca -0.05 -0.93 0.06 0.00 0.00 0.00 0.00 44.72 43.80 1de4 s GLY 14 CO -0.10 -1.01 -0.18 0.00 0.00 0.00 0.00 173.10 171.81 1de4 s ALA 15 N -2.43 1.53 0.00 3.20 0.00 -1.26 -1.43 121.76 121.37 1de4 s ALA 15 Ca -0.04 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 50.99 1de4 s ALA 15 Cb -0.03 -0.30 0.00 0.00 0.00 0.00 0.00 23.12 22.79 1de4 s ALA 15 CO -0.03 0.34 0.09 -1.13 0.00 0.00 0.00 175.76 175.02 1de4 n SER 16 N 2.03 0.00 -0.26 0.00 3.41 -0.78 -4.40 113.62 113.60 1de4 n SER 16 Ca -0.17 0.09 0.12 0.00 -0.26 0.00 0.00 58.87 58.65 1de4 n SER 16 Cb 0.54 0.00 0.23 0.00 -0.26 0.00 0.00 64.21 64.72 1de4 n SER 16 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1de4 n GLU 17 N -0.31 -0.06 -2.67 4.33 2.13 -1.26 -4.40 120.64 118.39 1de4 n GLU 17 Ca 0.00 1.14 -0.42 0.00 0.66 0.00 0.00 57.16 58.54 1de4 n GLU 17 Cb 0.00 -1.82 -0.03 0.00 0.27 0.00 0.00 31.44 29.86 1de4 n GLU 17 CO 0.00 0.00 0.00 1.14 -0.41 0.00 0.00 177.13 177.86 1de4 s GLN 18 N -5.67 4.50 0.00 5.31 0.00 -1.26 -4.92 119.66 117.62 1de4 s GLN 18 Ca -0.10 1.45 0.00 0.00 -0.00 0.00 0.00 55.36 56.71 1de4 s GLN 18 Cb 0.23 -3.48 0.00 0.00 0.00 0.00 0.00 33.01 29.76 1de4 s GLN 18 CO 0.60 -0.16 0.00 -0.25 0.00 0.00 0.00 175.29 175.48 1de4 n ASP 19 N 4.26 0.00 0.00 12.60 8.00 -1.26 -4.81 116.55 135.34 1de4 n ASP 19 Ca 0.07 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.57 1de4 n ASP 19 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.60 1de4 n ASP 19 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1de4 n LEU 20 N 0.00 0.00 -2.77 0.64 -0.00 -1.26 -5.05 117.00 108.56 1de4 n LEU 20 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 56.01 55.92 1de4 n LEU 20 Cb 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 43.42 43.46 1de4 n LEU 20 CO 0.00 0.10 0.17 0.61 -0.00 0.00 0.00 177.39 178.28 1de4 n GLY 21 N 0.00 0.18 0.04 -3.96 0.00 -1.26 -5.16 105.19 95.03 1de4 n GLY 21 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1de4 n GLY 21 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1de4 n LEU 22 N 1.63 0.00 -2.57 0.99 -0.00 -1.26 -4.92 117.00 110.87 1de4 n LEU 22 Ca 0.10 0.00 -0.05 0.00 -0.00 0.00 0.00 56.01 56.06 1de4 n LEU 22 Cb 0.62 -0.52 -0.04 0.00 -0.00 0.00 0.00 43.42 43.48 1de4 n LEU 22 CO 0.05 0.00 -0.66 -0.24 -0.00 0.00 0.00 177.39 176.54 1de4 n SER 23 N -3.98 -1.56 -0.56 1.45 2.88 -1.26 -4.95 113.62 105.64 1de4 n SER 23 Ca 0.00 1.43 0.06 0.00 -1.33 0.00 0.00 58.87 59.03 1de4 n SER 23 Cb 0.45 -5.29 0.11 0.00 -0.75 0.00 0.00 64.21 58.72 1de4 n SER 23 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1de4 n LEU 24 N 1.75 2.50 -4.69 2.46 4.77 -1.26 -5.03 117.00 117.51 1de4 n LEU 24 Ca -0.38 -1.56 -0.29 0.00 -0.03 0.00 0.00 56.01 53.75 1de4 n LEU 24 Cb 0.58 -0.13 -0.08 0.00 -2.33 0.00 0.00 43.42 41.46 1de4 n LEU 24 CO 0.35 0.57 -0.33 -0.36 -1.33 0.00 0.00 177.39 176.30 1de4 s PHE 25 N -0.97 2.95 0.14 -1.77 0.40 -1.26 -4.01 117.98 113.45 1de4 s PHE 25 Ca 0.19 -0.06 0.09 0.00 -0.60 0.00 0.00 56.93 56.54 1de4 s PHE 25 Cb 0.11 -1.49 -0.04 0.00 0.51 0.00 0.00 43.02 42.11 1de4 s PHE 25 CO 0.15 0.49 -0.14 -1.21 0.70 0.00 0.00 175.22 175.21 1de4 s GLU 26 N -2.54 1.92 0.07 0.44 2.02 -1.02 -4.76 118.70 114.83 1de4 s GLU 26 Ca 0.26 -1.19 0.00 0.00 0.02 0.00 0.00 54.97 54.06 1de4 s GLU 26 Cb -0.11 -2.15 -0.04 0.00 0.10 0.00 0.00 34.13 31.93 1de4 s GLU 26 CO 0.19 0.47 -0.05 0.00 0.02 0.00 0.00 175.26 175.89 1de4 s ALA 27 N -1.35 0.69 -0.04 5.21 0.00 -0.17 -2.00 121.76 124.11 1de4 s ALA 27 Ca 0.21 -1.21 0.02 0.00 0.00 0.00 0.00 51.96 50.98 1de4 s ALA 27 Cb -0.10 0.20 0.01 0.00 0.00 0.00 0.00 23.12 23.23 1de4 s ALA 27 CO 0.12 -0.28 -0.10 -0.51 0.00 0.00 0.00 175.76 175.00 1de4 s LEU 28 N -2.82 1.70 -0.15 0.00 1.43 0.63 -1.27 118.68 118.19 1de4 s LEU 28 Ca 0.07 -0.21 -0.03 0.00 -1.03 0.00 0.00 54.13 52.93 1de4 s LEU 28 Cb 0.05 -0.62 -0.02 0.00 0.03 0.00 0.00 46.19 45.62 1de4 s LEU 28 CO -0.07 0.05 -0.07 -0.83 0.23 0.00 0.00 176.35 175.67 1de4 s GLY 29 N 0.37 1.66 -0.06 -3.19 0.00 -0.40 -0.44 107.32 105.25 1de4 s GLY 29 Ca -0.07 -0.87 0.03 0.00 0.00 0.00 0.00 44.72 43.81 1de4 s GLY 29 CO 0.01 -0.07 -0.13 -0.19 0.00 0.00 0.00 173.10 172.72 1de4 s TYR 30 N 0.44 1.53 -0.19 1.90 1.51 -0.20 -0.44 117.35 121.91 1de4 s TYR 30 Ca -0.06 -0.55 -0.00 0.00 -1.01 0.00 0.00 57.07 55.45 1de4 s TYR 30 Cb -0.15 -1.10 0.01 0.00 -0.11 0.00 0.00 41.96 40.61 1de4 s TYR 30 CO 0.03 -0.27 -0.15 0.54 -1.11 0.00 0.00 175.55 174.60 1de4 s VAL 31 N 0.56 2.55 -1.37 0.71 0.11 -0.92 -1.10 120.40 120.94 1de4 s VAL 31 Ca -0.13 -0.78 -0.00 0.00 -2.93 0.00 0.00 61.98 58.13 1de4 s VAL 31 Cb -0.15 -2.10 -0.00 0.00 -1.53 0.00 0.00 36.38 32.59 1de4 s VAL 31 CO 0.04 0.50 0.50 0.47 -3.33 0.00 0.00 175.10 173.28 1de4 n ASP 32 N 4.55 -0.57 -3.44 3.54 8.00 0.33 -0.86 116.55 128.11 1de4 n ASP 32 Ca -0.20 -0.95 -0.25 0.00 0.71 0.00 0.00 54.79 54.10 1de4 n ASP 32 Cb 0.51 -3.35 0.02 0.00 -0.02 0.00 0.00 41.12 38.27 1de4 n ASP 32 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1de4 n ASP 33 N -3.01 -4.71 -3.91 -2.24 8.00 -1.26 -4.95 116.55 104.47 1de4 n ASP 33 Ca -0.31 -0.48 -0.30 0.00 0.71 0.00 0.00 54.79 54.41 1de4 n ASP 33 Cb 0.68 -3.82 -0.15 0.00 -0.02 0.00 0.00 41.12 37.81 1de4 n ASP 33 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1de4 s GLN 34 N -6.12 1.37 -0.11 -1.24 -1.52 -0.04 -5.05 119.66 106.96 1de4 s GLN 34 Ca 0.46 -1.26 -0.34 0.00 -1.95 0.00 0.00 55.36 52.27 1de4 s GLN 34 Cb -0.23 -2.62 -0.11 0.00 -0.22 0.00 0.00 33.01 29.83 1de4 s GLN 34 CO 0.56 -0.79 1.92 -0.11 -0.25 0.00 0.00 175.29 176.63 1de4 n LEU 35 N 4.60 3.41 0.00 2.90 0.00 -1.26 -2.16 117.00 124.49 1de4 n LEU 35 Ca -0.05 0.91 0.00 0.00 0.00 0.00 0.00 56.01 56.86 1de4 n LEU 35 Cb 0.43 -1.38 0.00 0.00 0.00 0.00 0.00 43.42 42.47 1de4 n LEU 35 CO 0.17 -0.10 -0.15 2.22 0.00 0.00 0.00 177.39 179.53 1de4 n PHE 36 N 7.10 0.00 -3.71 1.96 1.16 0.42 -4.42 117.46 119.97 1de4 n PHE 36 Ca 0.24 0.00 -0.14 0.00 -1.87 0.00 0.00 57.45 55.68 1de4 n PHE 36 Cb 0.30 0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 38.09 1de4 n PHE 36 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 1de4 s VAL 37 N -1.29 0.05 -0.09 1.97 0.11 -1.21 -1.67 120.40 118.27 1de4 s VAL 37 Ca 0.00 -0.42 -0.03 0.00 -2.93 0.00 0.00 61.98 58.59 1de4 s VAL 37 Cb 0.00 -0.75 0.05 0.00 -1.53 0.00 0.00 36.38 34.14 1de4 s VAL 37 CO 0.00 -0.23 0.17 0.12 -3.33 0.00 0.00 175.10 171.83 1de4 s PHE 38 N -1.60 -0.19 -0.42 1.54 5.36 -0.35 -1.28 117.98 121.04 1de4 s PHE 38 Ca -0.11 0.62 -0.16 0.00 -0.96 0.00 0.00 56.93 56.33 1de4 s PHE 38 Cb -0.03 -0.25 0.03 0.00 -0.34 0.00 0.00 43.02 42.42 1de4 s PHE 38 CO 0.03 -0.29 0.34 -0.47 -1.46 0.00 0.00 175.22 173.38 1de4 s TYR 39 N 2.30 3.23 0.68 10.12 5.04 -0.40 -1.92 117.35 136.41 1de4 s TYR 39 Ca 0.03 -0.60 -0.03 0.00 -2.44 0.00 0.00 57.07 54.03 1de4 s TYR 39 Cb -0.12 -2.74 0.08 0.00 0.35 0.00 0.00 41.96 39.53 1de4 s TYR 39 CO -0.06 -0.65 0.96 0.16 -1.34 0.00 0.00 175.55 174.63 1de4 s ASP 40 N 1.85 4.69 -0.05 4.32 3.84 -1.15 -0.99 116.67 129.17 1de4 s ASP 40 Ca 0.06 0.08 -0.00 0.00 -0.00 0.00 0.00 52.55 52.69 1de4 s ASP 40 Cb -0.19 -0.68 -0.00 0.00 -1.38 0.00 0.00 42.92 40.67 1de4 s ASP 40 CO 0.10 -1.62 0.02 0.45 -0.00 0.00 0.00 175.17 174.11 1de4 h HIS 41 N -0.46 -0.01 -3.08 2.11 3.86 -1.92 -3.39 115.15 112.25 1de4 h HIS 41 Ca -0.42 -0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.26 1de4 h HIS 41 Cb 1.29 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.78 1de4 h HIS 41 CO 0.08 -0.01 0.65 -1.21 0.86 0.00 0.00 177.93 178.31 1de4 s GLU 42 N -1.32 4.37 -1.01 2.45 8.01 -1.26 -3.39 118.70 126.56 1de4 s GLU 42 Ca -0.00 1.95 -0.07 0.00 0.01 0.00 0.00 54.97 56.85 1de4 s GLU 42 Cb 0.00 -3.29 -0.05 0.00 -4.31 0.00 0.00 34.13 26.48 1de4 s GLU 42 CO 0.00 -0.36 0.86 -1.13 0.01 0.00 0.00 175.26 174.64 1de4 n SER 43 N 3.93 -6.61 -3.20 -0.19 3.41 -1.26 -4.56 113.62 105.15 1de4 n SER 43 Ca 0.10 -0.66 0.00 0.00 -0.26 0.00 0.00 58.87 58.05 1de4 n SER 43 Cb 0.44 -4.87 0.00 0.00 -0.26 0.00 0.00 64.21 59.52 1de4 n SER 43 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1de4 n ARG 44 N -3.13 0.00 -4.25 4.33 5.12 -1.22 -4.81 116.66 112.70 1de4 n ARG 44 Ca -0.07 0.00 -0.17 0.00 -1.93 0.00 0.00 57.85 55.68 1de4 n ARG 44 Cb 0.60 -0.80 -0.11 0.00 -1.16 0.00 0.00 32.46 30.99 1de4 n ARG 44 CO 0.00 0.00 0.00 -0.98 -1.93 0.00 0.00 177.63 174.72 1de4 s ARG 45 N 3.28 1.06 -0.62 5.56 1.70 -1.26 -4.96 118.95 123.71 1de4 s ARG 45 Ca 0.00 -1.31 -0.16 0.00 -0.47 0.00 0.00 55.73 53.79 1de4 s ARG 45 Cb 0.00 -0.88 0.14 0.00 -0.57 0.00 0.00 34.95 33.64 1de4 s ARG 45 CO 0.00 0.16 0.61 0.08 -1.08 0.00 0.00 175.30 175.07 1de4 s VAL 46 N -2.41 5.19 0.19 4.99 1.01 -1.26 -2.93 120.40 125.17 1de4 s VAL 46 Ca 0.11 -1.58 -0.04 0.00 0.00 0.00 0.00 61.98 60.47 1de4 s VAL 46 Cb -0.03 -4.41 -0.05 0.00 0.00 0.00 0.00 36.38 31.89 1de4 s VAL 46 CO 0.03 -0.97 0.42 -1.61 0.00 0.00 0.00 175.10 172.97 1de4 s GLU 47 N 1.58 3.62 0.57 2.72 2.02 -0.81 -4.91 118.70 123.50 1de4 s GLU 47 Ca 0.08 -0.09 -0.06 0.00 0.02 0.00 0.00 54.97 54.93 1de4 s GLU 47 Cb -0.24 -2.79 0.00 0.00 0.10 0.00 0.00 34.13 31.19 1de4 s GLU 47 CO 0.01 0.40 0.89 -1.25 0.02 0.00 0.00 175.26 175.32 1de4 s PRO 48 N -2.94 3.03 -0.04 0.39 0.04 -1.26 -1.21 135.00 133.01 1de4 s PRO 48 Ca 0.42 0.04 0.01 0.00 0.04 0.00 0.00 61.00 61.51 1de4 s PRO 48 Cb -0.12 -2.28 0.02 0.00 0.04 0.00 0.00 34.50 32.16 1de4 s PRO 48 CO 0.26 -0.62 -0.02 1.03 0.04 0.00 0.00 177.00 177.69 1de4 s ARG 49 N -4.96 0.55 0.00 4.56 1.81 -0.67 -4.81 118.95 115.44 1de4 s ARG 49 Ca 0.53 -0.02 0.00 0.00 -1.72 0.00 0.00 55.73 54.52 1de4 s ARG 49 Cb -0.10 -0.65 0.00 0.00 -0.45 0.00 0.00 34.95 33.75 1de4 s ARG 49 CO 0.45 -0.10 0.00 2.41 -0.68 0.00 0.00 175.30 177.38 1de4 n THR 50 N 4.07 -0.97 -0.04 0.02 -1.04 -1.26 -4.18 114.28 110.88 1de4 n THR 50 Ca -0.26 0.00 0.09 0.00 -2.04 0.00 0.00 64.05 61.84 1de4 n THR 50 Cb 0.51 -0.97 0.48 0.00 -1.82 0.00 0.00 70.33 68.53 1de4 n THR 50 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1de4 h PRO 51 N 0.00 0.44 0.00 -2.82 0.13 -1.96 -2.80 132.00 124.98 1de4 h PRO 51 Ca 0.00 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 1de4 h PRO 51 Cb 0.00 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.03 1de4 h PRO 51 CO 0.00 0.29 0.00 -2.67 -0.23 0.00 0.00 178.00 175.39 1de4 n TRP 52 N -4.47 0.60 -0.10 1.56 4.27 -1.26 -2.81 117.44 115.22 1de4 n TRP 52 Ca 0.07 0.25 -0.13 0.00 -3.89 0.00 0.00 57.50 53.80 1de4 n TRP 52 Cb 0.24 -0.91 -0.12 0.00 -1.36 0.00 0.00 31.31 29.16 1de4 n TRP 52 CO 0.00 0.00 0.00 1.33 -2.29 0.00 0.00 177.69 176.73 1de4 n VAL 53 N -2.06 1.27 0.81 -1.67 0.24 -1.07 -2.62 118.33 113.23 1de4 n VAL 53 Ca 0.02 -0.60 0.00 0.00 -2.04 0.00 0.00 64.34 61.71 1de4 n VAL 53 Cb 0.17 -0.99 0.00 0.00 -1.47 0.00 0.00 33.84 31.55 1de4 n VAL 53 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1de4 n SER 54 N -2.96 0.74 0.10 -1.34 2.88 -1.13 -2.65 113.62 109.28 1de4 n SER 54 Ca -0.36 -1.56 0.00 0.00 -1.33 0.00 0.00 58.87 55.62 1de4 n SER 54 Cb 0.99 -0.37 0.00 0.00 -0.75 0.00 0.00 64.21 64.08 1de4 n SER 54 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1de4 n SER 55 N 0.08 -1.40 0.21 -3.46 3.41 -1.19 -4.94 113.62 106.33 1de4 n SER 55 Ca 0.00 0.39 0.07 0.00 -0.26 0.00 0.00 58.87 59.07 1de4 n SER 55 Cb 0.19 1.49 0.46 0.00 -0.26 0.00 0.00 64.21 66.10 1de4 n SER 55 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1de4 h ARG 56 N 0.00 0.00 -6.18 4.33 3.08 -1.61 -3.43 114.38 110.56 1de4 h ARG 56 Ca 0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.49 1de4 h ARG 56 Cb 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 1de4 h ARG 56 CO 0.00 0.29 0.92 0.42 -1.07 0.00 0.00 179.97 180.53 1de4 s ILE 57 N -3.93 4.13 0.77 2.04 1.01 -1.08 -4.99 121.20 119.15 1de4 s ILE 57 Ca -0.01 1.38 -0.14 0.00 0.00 0.00 0.00 60.65 61.88 1de4 s ILE 57 Cb 0.12 -3.89 0.06 0.00 0.01 0.00 0.00 42.46 38.77 1de4 s ILE 57 CO 0.66 -0.11 1.19 -0.94 0.00 0.00 0.00 174.94 175.74 1de4 s SER 58 N 2.20 3.96 0.48 3.58 1.04 -1.26 -4.83 113.70 118.86 1de4 s SER 58 Ca 0.58 2.30 0.13 0.00 0.48 0.00 0.00 55.95 59.45 1de4 s SER 58 Cb -0.24 -2.58 1.12 0.00 0.10 0.00 0.00 66.02 64.41 1de4 s SER 58 CO 0.18 -2.42 2.10 -1.28 0.98 0.00 0.00 173.24 172.81 1de4 h SER 59 N -0.65 0.19 0.56 7.02 0.87 -1.95 -2.12 113.55 117.46 1de4 h SER 59 Ca -0.47 -0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.06 1de4 h SER 59 Cb 1.29 -0.05 0.01 0.00 -0.44 0.00 0.00 62.40 63.21 1de4 h SER 59 CO 0.48 0.13 -0.27 -0.61 -0.53 0.00 0.00 176.83 176.04 1de4 h GLN 60 N 0.22 -0.72 -0.97 2.24 4.15 -2.01 -2.82 115.11 115.19 1de4 h GLN 60 Ca 0.08 0.05 0.22 0.00 0.77 0.00 0.00 58.65 59.76 1de4 h GLN 60 Cb 0.04 0.16 -0.09 0.00 0.21 0.00 0.00 27.48 27.81 1de4 h GLN 60 CO -0.02 -0.48 0.62 0.52 -1.93 0.00 0.00 178.83 177.55 1de4 h MET 61 N -0.93 0.50 -0.35 1.69 2.86 -1.88 0.10 114.93 116.92 1de4 h MET 61 Ca -0.08 -0.03 -0.08 0.00 -2.06 0.00 0.00 59.70 57.45 1de4 h MET 61 Cb 0.57 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 32.10 1de4 h MET 61 CO 0.13 0.33 -0.13 2.35 1.06 0.00 0.00 176.91 180.65 1de4 h TRP 62 N 0.52 0.68 0.18 -0.22 2.91 -1.38 -0.90 115.95 117.73 1de4 h TRP 62 Ca 0.54 -0.12 -0.01 0.00 1.13 0.00 0.00 58.89 60.43 1de4 h TRP 62 Cb 1.18 -0.18 0.00 0.00 -0.51 0.00 0.00 29.16 29.65 1de4 h TRP 62 CO -0.00 0.73 -0.09 1.25 -1.03 0.00 0.00 178.44 179.30 1de4 h LEU 63 N 0.57 -0.20 -0.73 0.65 5.85 -0.72 0.20 115.31 120.93 1de4 h LEU 63 Ca 0.10 -0.11 0.12 0.00 0.84 0.00 0.00 57.88 58.84 1de4 h LEU 63 Cb 0.56 0.05 -0.09 0.00 0.37 0.00 0.00 40.66 41.55 1de4 h LEU 63 CO 0.04 -0.02 0.31 1.56 -0.34 0.00 0.00 178.44 179.99 1de4 h GLN 64 N -0.38 0.47 -0.19 1.25 1.08 -1.27 -0.32 115.11 115.75 1de4 h GLN 64 Ca -0.02 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.13 1de4 h GLN 64 Cb 0.30 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.61 1de4 h GLN 64 CO 0.04 0.31 0.06 1.25 -0.95 0.00 0.00 178.83 179.54 1de4 h LEU 65 N 0.48 0.28 -0.32 1.46 5.85 -0.76 -1.02 115.31 121.28 1de4 h LEU 65 Ca 0.39 -0.20 0.03 0.00 0.84 0.00 0.00 57.88 58.93 1de4 h LEU 65 Cb 0.54 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 1de4 h LEU 65 CO -0.36 0.41 0.14 0.28 -0.34 0.00 0.00 178.44 178.57 1de4 h SER 66 N 0.14 0.20 -0.10 1.25 0.02 0.32 -1.80 113.55 113.58 1de4 h SER 66 Ca 0.06 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 1de4 h SER 66 Cb 0.23 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 62.75 1de4 h SER 66 CO -0.00 0.15 0.04 1.56 -1.14 0.00 0.00 176.83 177.44 1de4 h GLN 67 N 0.30 0.14 -0.94 3.45 4.20 -1.00 -0.81 115.11 120.45 1de4 h GLN 67 Ca 0.14 -0.03 0.12 0.00 0.06 0.00 0.00 58.65 58.94 1de4 h GLN 67 Cb 0.07 -0.02 -0.08 0.00 0.30 0.00 0.00 27.48 27.75 1de4 h GLN 67 CO -0.11 0.26 0.60 0.77 -0.67 0.00 0.00 178.83 179.67 1de4 h SER 68 N -0.00 0.82 -0.13 1.46 0.02 -0.99 0.42 113.55 115.15 1de4 h SER 68 Ca 0.03 0.04 -0.08 0.00 -0.84 0.00 0.00 61.79 60.94 1de4 h SER 68 Cb 0.17 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.58 1de4 h SER 68 CO -0.00 0.44 -0.22 -0.07 -1.14 0.00 0.00 176.83 175.84 1de4 h LEU 69 N 0.88 0.42 -0.92 5.07 3.38 -1.02 -0.42 115.31 122.71 1de4 h LEU 69 Ca 0.46 -0.55 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 1de4 h LEU 69 Cb 0.53 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1de4 h LEU 69 CO -0.23 0.88 0.17 0.11 0.09 0.00 0.00 178.44 179.46 1de4 h LYS 70 N -0.04 0.96 0.42 1.13 1.57 -0.54 -0.53 116.57 119.54 1de4 h LYS 70 Ca 0.01 -0.20 -0.02 0.00 -1.87 0.00 0.00 60.65 58.57 1de4 h LYS 70 Cb 0.80 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.98 1de4 h LYS 70 CO 0.05 0.84 -0.20 0.78 -0.57 0.00 0.00 179.45 180.35 1de4 h GLY 71 N 1.03 -0.58 0.83 3.86 0.00 -0.11 -1.96 103.07 106.13 1de4 h GLY 71 Ca 0.20 0.22 0.12 0.00 0.00 0.00 0.00 47.33 47.87 1de4 h GLY 71 CO -0.00 -0.21 0.48 1.49 0.00 0.00 0.00 176.54 178.29 1de4 h TRP 72 N -0.63 0.56 0.66 5.60 6.55 -0.85 0.15 115.95 127.97 1de4 h TRP 72 Ca -0.06 0.02 -0.03 0.00 0.95 0.00 0.00 58.89 59.77 1de4 h TRP 72 Cb 0.47 -0.18 -0.01 0.00 -0.86 0.00 0.00 29.16 28.58 1de4 h TRP 72 CO -0.03 0.24 -0.47 0.22 -1.05 0.00 0.00 178.44 177.35 1de4 h ASP 73 N 0.50 -1.22 -0.37 -3.49 1.82 -0.56 0.15 116.42 113.26 1de4 h ASP 73 Ca 0.34 0.08 0.06 0.00 -0.39 0.00 0.00 57.03 57.12 1de4 h ASP 73 Cb 0.65 0.37 -0.05 0.00 0.68 0.00 0.00 39.33 40.98 1de4 h ASP 73 CO -0.11 -0.69 0.04 0.45 -1.61 0.00 0.00 179.24 177.32 1de4 h HIS 74 N -1.08 0.06 -0.67 0.28 3.86 -0.47 0.22 115.15 117.35 1de4 h HIS 74 Ca -0.08 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 1de4 h HIS 74 Cb 0.89 0.03 -0.03 0.00 1.06 0.00 0.00 27.41 29.36 1de4 h HIS 74 CO -0.15 -0.02 0.42 1.98 0.86 0.00 0.00 177.93 181.02 1de4 h MET 75 N 0.15 0.89 -0.00 2.45 1.85 -0.60 -2.29 114.93 117.38 1de4 h MET 75 Ca 0.18 -0.07 -0.15 0.00 -0.61 0.00 0.00 59.70 59.05 1de4 h MET 75 Cb 0.23 -0.19 -0.02 0.00 0.43 0.00 0.00 31.60 32.05 1de4 h MET 75 CO -0.26 0.61 -0.70 0.74 -0.40 0.00 0.00 176.91 176.90 1de4 h PHE 76 N 0.91 0.03 -0.77 1.39 0.05 -0.29 -2.47 116.94 115.79 1de4 h PHE 76 Ca 0.24 -0.01 -0.02 0.00 3.82 0.00 0.00 57.97 62.00 1de4 h PHE 76 Cb -0.07 -0.00 -0.04 0.00 2.00 0.00 0.00 35.95 37.84 1de4 h PHE 76 CO -0.02 0.72 0.39 1.15 -0.18 0.00 0.00 178.31 180.37 1de4 h THR 77 N 0.01 1.23 0.13 -1.55 2.02 -0.13 0.18 112.91 114.81 1de4 h THR 77 Ca -0.01 -0.62 -0.01 0.00 0.77 0.00 0.00 66.41 66.55 1de4 h THR 77 Cb 1.24 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 1de4 h THR 77 CO 0.09 0.27 -0.06 0.58 0.37 0.00 0.00 175.52 176.77 1de4 h VAL 78 N 1.08 1.01 -0.92 3.16 2.07 -1.27 -2.18 116.25 119.20 1de4 h VAL 78 Ca 0.27 -0.65 0.12 0.00 0.82 0.00 0.00 66.70 67.25 1de4 h VAL 78 Cb 0.07 1.42 -0.08 0.00 -1.52 0.00 0.00 31.29 31.17 1de4 h VAL 78 CO -0.04 0.15 0.55 0.44 0.02 0.00 0.00 177.57 178.70 1de4 h ASP 79 N -0.49 0.78 -0.09 0.57 3.32 -1.03 0.90 116.42 120.38 1de4 h ASP 79 Ca -0.02 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 1de4 h ASP 79 Cb 0.39 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 1de4 h ASP 79 CO 0.03 0.41 0.05 0.15 -1.72 0.00 0.00 179.24 178.16 1de4 h PHE 80 N 0.87 0.11 -0.61 4.55 3.57 -0.60 0.15 116.94 124.99 1de4 h PHE 80 Ca 0.46 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.99 1de4 h PHE 80 Cb 0.48 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.15 1de4 h PHE 80 CO -0.03 0.11 0.38 -1.49 -2.23 0.00 0.00 178.31 175.05 1de4 h TRP 81 N 0.08 0.72 0.41 0.41 6.55 -0.57 -0.17 115.95 123.38 1de4 h TRP 81 Ca 0.03 0.02 -0.01 0.00 0.95 0.00 0.00 58.89 59.88 1de4 h TRP 81 Cb 0.03 -0.24 -0.01 0.00 -0.86 0.00 0.00 29.16 28.08 1de4 h TRP 81 CO -0.06 0.42 -0.33 1.15 -1.05 0.00 0.00 178.44 178.57 1de4 h THR 82 N 0.76 0.32 -0.55 1.49 2.02 -0.42 -1.81 112.91 114.73 1de4 h THR 82 Ca 0.24 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.45 1de4 h THR 82 Cb -0.00 0.32 -0.04 0.00 -1.74 0.00 0.00 68.15 66.69 1de4 h THR 82 CO -0.09 0.00 0.33 0.40 0.37 0.00 0.00 175.52 176.53 1de4 h ILE 83 N -0.74 1.05 -0.19 3.11 2.04 -0.46 -1.13 117.51 121.20 1de4 h ILE 83 Ca -0.04 -0.22 0.03 0.00 1.00 0.00 0.00 64.86 65.63 1de4 h ILE 83 Cb 0.64 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 1de4 h ILE 83 CO -0.01 0.12 -0.02 0.24 0.00 0.00 0.00 178.15 178.48 1de4 h MET 84 N 0.66 0.04 -0.48 2.37 2.86 -0.91 -2.28 114.93 117.18 1de4 h MET 84 Ca 0.22 -0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.87 1de4 h MET 84 Cb 0.03 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.66 1de4 h MET 84 CO -0.10 0.02 0.32 1.49 1.06 0.00 0.00 176.91 179.70 1de4 h GLU 85 N 0.04 0.63 0.00 1.72 4.22 -0.93 -0.12 114.58 120.14 1de4 h GLU 85 Ca 0.09 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.49 1de4 h GLU 85 Cb 0.12 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.23 1de4 h GLU 85 CO -0.17 0.42 0.00 0.09 -2.18 0.00 0.00 179.01 177.17 1de4 n ASN 86 N -4.46 0.00 -0.06 1.04 3.02 -0.46 -1.51 115.26 112.82 1de4 n ASN 86 Ca 0.04 -1.14 0.01 0.00 -0.03 0.00 0.00 54.58 53.46 1de4 n ASN 86 Cb 0.06 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.24 1de4 n ASN 86 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1de4 n HIS 87 N -0.81 0.01 -1.93 3.10 8.25 -0.22 -4.95 115.22 118.67 1de4 n HIS 87 Ca 0.13 -0.11 -0.19 0.00 -0.26 0.00 0.00 57.72 57.29 1de4 n HIS 87 Cb 0.06 -0.01 -0.05 0.00 1.12 0.00 0.00 29.99 31.11 1de4 n HIS 87 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1de4 n ASN 88 N -0.01 -5.32 -4.85 0.41 3.02 -0.57 -4.97 115.26 102.96 1de4 n ASN 88 Ca 0.01 0.23 -0.34 0.00 -0.03 0.00 0.00 54.58 54.45 1de4 n ASN 88 Cb 0.09 -4.43 -0.06 0.00 -0.61 0.00 0.00 39.78 34.77 1de4 n ASN 88 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1de4 s HIS 89 N -2.81 3.54 0.15 3.10 3.76 -0.25 -4.90 115.29 117.87 1de4 s HIS 89 Ca 0.00 1.05 0.00 0.00 -0.15 0.00 0.00 55.06 55.96 1de4 s HIS 89 Cb 0.00 -2.37 0.00 0.00 1.11 0.00 0.00 32.58 31.32 1de4 s HIS 89 CO 0.00 0.35 0.00 -1.13 -0.85 0.00 0.00 174.74 173.11 1de4 n SER 90 N 0.42 -1.33 -0.05 1.40 3.41 -1.26 -4.12 113.62 112.09 1de4 n SER 90 Ca -0.03 0.42 0.00 0.00 -0.26 0.00 0.00 58.87 59.00 1de4 n SER 90 Cb 0.52 1.47 0.00 0.00 -0.26 0.00 0.00 64.21 65.94 1de4 n SER 90 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1de4 n LYS 91 N -2.72 0.78 -4.16 4.33 5.02 -1.26 -4.74 118.16 115.42 1de4 n LYS 91 Ca 0.00 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.06 1de4 n LYS 91 Cb 0.00 -1.04 -0.05 0.00 -0.02 0.00 0.00 35.03 33.92 1de4 n LYS 91 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1de4 s GLU 92 N -1.90 2.76 -0.26 1.97 0.41 -1.26 -5.10 118.70 115.32 1de4 s GLU 92 Ca 0.00 -1.12 -0.08 0.00 -0.41 0.00 0.00 54.97 53.36 1de4 s GLU 92 Cb 0.00 -2.48 -0.03 0.00 -1.78 0.00 0.00 34.13 29.85 1de4 s GLU 92 CO 0.00 0.40 0.09 -1.12 -0.49 0.00 0.00 175.26 174.15 1de4 s SER 93 N -3.69 5.27 0.34 -0.19 0.01 -1.26 -4.42 113.70 109.76 1de4 s SER 93 Ca 0.32 -0.24 0.02 0.00 1.31 0.00 0.00 55.95 57.36 1de4 s SER 93 Cb -0.08 -1.95 -0.01 0.00 0.21 0.00 0.00 66.02 64.19 1de4 s SER 93 CO 0.23 -0.06 0.08 1.41 0.41 0.00 0.00 173.24 175.31 1de4 n HIS 94 N 4.94 0.36 -3.88 2.43 8.25 -1.26 -4.96 115.22 121.10 1de4 n HIS 94 Ca -0.16 -2.01 -0.11 0.00 -0.26 0.00 0.00 57.72 55.18 1de4 n HIS 94 Cb 0.51 -0.08 -0.12 0.00 1.12 0.00 0.00 29.99 31.42 1de4 n HIS 94 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1de4 s THR 95 N -2.64 0.05 -0.02 1.59 -4.23 -1.26 -1.87 115.64 107.25 1de4 s THR 95 Ca 0.11 -0.43 0.04 0.00 -1.18 0.00 0.00 61.69 60.23 1de4 s THR 95 Cb 0.01 -0.27 -0.01 0.00 1.34 0.00 0.00 72.50 73.57 1de4 s THR 95 CO 0.08 -0.23 -0.14 -0.22 -0.54 0.00 0.00 174.62 173.57 1de4 s LEU 96 N -0.75 1.95 0.01 4.79 2.96 -0.51 0.29 118.68 127.42 1de4 s LEU 96 Ca -0.08 -0.26 0.02 0.00 -0.22 0.00 0.00 54.13 53.58 1de4 s LEU 96 Cb -0.05 -0.74 -0.01 0.00 0.50 0.00 0.00 46.19 45.88 1de4 s LEU 96 CO 0.00 0.15 -0.06 -1.10 -1.32 0.00 0.00 176.35 174.02 1de4 s GLN 97 N -0.15 0.45 0.01 1.98 -0.21 -0.13 -0.83 119.66 120.78 1de4 s GLN 97 Ca 0.02 -0.40 0.02 0.00 0.02 0.00 0.00 55.36 55.01 1de4 s GLN 97 Cb -0.07 -0.34 -0.01 0.00 1.00 0.00 0.00 33.01 33.59 1de4 s GLN 97 CO 0.00 0.08 -0.06 0.08 -2.12 0.00 0.00 175.29 173.28 1de4 s VAL 98 N -0.62 0.43 -0.05 1.09 1.01 -0.29 0.54 120.40 122.52 1de4 s VAL 98 Ca -0.03 -0.39 0.01 0.00 0.00 0.00 0.00 61.98 61.58 1de4 s VAL 98 Cb -0.05 -0.40 0.02 0.00 0.00 0.00 0.00 36.38 35.95 1de4 s VAL 98 CO 0.00 0.02 -0.07 -0.51 0.00 0.00 0.00 175.10 174.54 1de4 s ILE 99 N -0.37 0.70 -0.05 2.22 2.07 -0.78 -0.39 121.20 124.60 1de4 s ILE 99 Ca -0.00 -0.22 -0.12 0.00 -1.41 0.00 0.00 60.65 58.89 1de4 s ILE 99 Cb -0.04 -0.69 0.02 0.00 0.13 0.00 0.00 42.46 41.89 1de4 s ILE 99 CO -0.00 0.26 0.29 -1.48 -1.91 0.00 0.00 174.94 172.09 1de4 s LEU 100 N 0.82 0.93 0.00 8.50 0.05 -0.85 -0.31 118.68 127.81 1de4 s LEU 100 Ca -0.13 0.24 0.00 0.00 0.05 0.00 0.00 54.13 54.29 1de4 s LEU 100 Cb -0.15 1.12 0.00 0.00 -2.05 0.00 0.00 46.19 45.11 1de4 s LEU 100 CO 0.01 -0.32 0.00 0.61 -0.55 0.00 0.00 176.35 176.10 1de4 n GLY 101 N 1.87 -1.37 3.09 -3.48 0.00 -0.47 0.01 105.19 104.84 1de4 n GLY 101 Ca -0.19 -0.97 -0.11 0.00 0.00 0.00 0.00 46.02 44.75 1de4 n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1de4 s GLU 103 N -2.61 1.84 -0.24 0.00 2.12 0.10 -1.97 118.70 117.95 1de4 s GLU 103 Ca -0.01 -0.41 -0.10 0.00 0.36 0.00 0.00 54.97 54.81 1de4 s GLU 103 Cb -0.03 -1.84 -0.05 0.00 0.26 0.00 0.00 34.13 32.47 1de4 s GLU 103 CO -0.03 -0.27 0.15 1.41 -0.54 0.00 0.00 175.26 175.98 1de4 s MET 104 N 1.61 4.06 0.68 4.30 -2.45 -0.02 -1.39 119.30 126.09 1de4 s MET 104 Ca 0.04 -0.28 -0.07 0.00 -1.25 0.00 0.00 55.69 54.14 1de4 s MET 104 Cb -0.13 -3.51 0.05 0.00 1.25 0.00 0.00 34.83 32.49 1de4 s MET 104 CO -0.09 0.08 1.00 -0.65 1.05 0.00 0.00 175.02 176.41 1de4 s GLN 105 N 1.01 2.41 0.24 4.11 -1.52 0.01 -1.18 119.66 124.75 1de4 s GLN 105 Ca 0.07 -0.12 -0.06 0.00 -1.95 0.00 0.00 55.36 53.31 1de4 s GLN 105 Cb -0.13 -2.17 0.45 0.00 -0.22 0.00 0.00 33.01 30.93 1de4 s GLN 105 CO 0.04 -1.11 1.67 1.05 -0.25 0.00 0.00 175.29 176.69 1de4 h GLU 106 N -0.53 0.22 0.00 2.91 9.09 -1.89 0.67 114.58 125.05 1de4 h GLU 106 Ca -0.45 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 58.95 1de4 h GLU 106 Cb 1.30 -0.05 0.00 0.00 -1.65 0.00 0.00 28.75 28.35 1de4 h GLU 106 CO 0.61 0.14 0.00 -0.40 0.05 0.00 0.00 179.01 179.41 1de4 n ASP 107 N -5.20 0.00 0.00 3.06 5.75 -1.26 -4.84 116.55 114.06 1de4 n ASP 107 Ca 0.14 -1.15 0.00 0.00 -0.01 0.00 0.00 54.79 53.77 1de4 n ASP 107 Cb 0.46 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.55 1de4 n ASP 107 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1de4 n ASN 108 N -0.61 0.00 -4.72 -1.12 4.13 0.23 -5.01 115.26 108.16 1de4 n ASN 108 Ca 0.03 0.00 -0.37 0.00 1.68 0.00 0.00 54.58 55.92 1de4 n ASN 108 Cb 0.02 -0.22 0.07 0.00 -1.54 0.00 0.00 39.78 38.11 1de4 n ASN 108 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1de4 n SER 109 N 0.00 2.02 -4.33 6.41 3.41 -1.26 -4.56 113.62 115.32 1de4 n SER 109 Ca 0.00 0.83 -0.26 0.00 -0.26 0.00 0.00 58.87 59.18 1de4 n SER 109 Cb 0.00 -1.55 -0.13 0.00 -0.26 0.00 0.00 64.21 62.27 1de4 n SER 109 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1de4 s THR 110 N -1.39 1.95 -0.07 6.66 2.01 -1.26 -0.81 115.64 122.73 1de4 s THR 110 Ca 0.83 -1.68 0.03 0.00 0.31 0.00 0.00 61.69 61.17 1de4 s THR 110 Cb -0.38 -1.77 0.01 0.00 0.01 0.00 0.00 72.50 70.37 1de4 s THR 110 CO 0.40 -0.03 -0.15 -0.70 -0.69 0.00 0.00 174.62 173.45 1de4 s GLU 111 N -2.08 1.97 0.24 4.92 2.56 -0.48 -4.96 118.70 120.87 1de4 s GLU 111 Ca 0.11 -0.52 0.10 0.00 0.00 0.00 0.00 54.97 54.66 1de4 s GLU 111 Cb -0.10 -1.59 -0.05 0.00 2.00 0.00 0.00 34.13 34.40 1de4 s GLU 111 CO 0.05 0.08 -0.12 0.20 -0.56 0.00 0.00 175.26 174.91 1de4 s GLY 112 N 0.53 1.76 0.03 -1.50 0.00 -1.26 0.01 107.32 106.89 1de4 s GLY 112 Ca -0.14 -1.69 -0.13 0.00 0.00 0.00 0.00 44.72 42.76 1de4 s GLY 112 CO 0.05 -1.74 0.29 -2.52 0.00 0.00 0.00 173.10 169.17 1de4 s TYR 113 N -2.16 -0.10 -0.25 1.90 1.13 -0.11 -4.94 117.35 112.83 1de4 s TYR 113 Ca 0.28 -0.00 -0.05 0.00 -1.41 0.00 0.00 57.07 55.89 1de4 s TYR 113 Cb -0.07 0.07 0.13 0.00 -1.10 0.00 0.00 41.96 41.00 1de4 s TYR 113 CO 0.16 -0.46 0.49 -0.46 -2.51 0.00 0.00 175.55 172.76 1de4 s TRP 114 N -2.24 -1.07 0.04 -3.49 -0.11 -1.25 -1.36 118.94 109.45 1de4 s TRP 114 Ca -0.07 1.54 0.04 0.00 1.22 0.00 0.00 56.10 58.83 1de4 s TRP 114 Cb -0.02 0.38 -0.02 0.00 -1.50 0.00 0.00 33.47 32.31 1de4 s TRP 114 CO -0.02 -0.66 -0.13 0.15 -4.62 0.00 0.00 176.95 171.68 1de4 s LYS 115 N 2.70 0.85 -0.08 5.86 1.02 0.57 -1.13 119.74 129.53 1de4 s LYS 115 Ca 0.06 -0.72 0.03 0.00 0.02 0.00 0.00 55.97 55.35 1de4 s LYS 115 Cb -0.13 -0.83 -0.02 0.00 -0.52 0.00 0.00 37.83 36.33 1de4 s LYS 115 CO -0.16 0.20 -0.16 0.71 -0.92 0.00 0.00 175.35 175.02 1de4 s TYR 116 N -0.87 2.70 -0.25 3.18 1.51 -0.07 -1.87 117.35 121.69 1de4 s TYR 116 Ca 0.00 -0.43 0.02 0.00 -1.01 0.00 0.00 57.07 55.65 1de4 s TYR 116 Cb -0.08 -1.71 0.06 0.00 -0.11 0.00 0.00 41.96 40.13 1de4 s TYR 116 CO 0.01 -0.03 -0.08 0.20 -1.11 0.00 0.00 175.55 174.55 1de4 s GLY 117 N -0.24 1.47 -0.17 0.71 0.00 0.19 -1.70 107.32 107.59 1de4 s GLY 117 Ca 0.01 -1.57 -0.16 0.00 0.00 0.00 0.00 44.72 43.00 1de4 s GLY 117 CO 0.03 0.79 0.42 -0.47 0.00 0.00 0.00 173.10 173.86 1de4 s TYR 118 N 1.25 3.43 -1.66 1.90 5.04 -0.70 -0.95 117.35 125.67 1de4 s TYR 118 Ca -0.07 0.72 -0.15 0.00 -2.44 0.00 0.00 57.07 55.13 1de4 s TYR 118 Cb -0.19 -2.51 0.13 0.00 0.35 0.00 0.00 41.96 39.73 1de4 s TYR 118 CO -0.06 0.09 0.69 -0.25 -1.34 0.00 0.00 175.55 174.68 1de4 n ASP 119 N 4.08 -2.62 -0.14 4.32 8.00 0.14 -1.39 116.55 128.95 1de4 n ASP 119 Ca -0.08 -1.03 -0.02 0.00 0.71 0.00 0.00 54.79 54.37 1de4 n ASP 119 Cb 0.51 -2.71 -0.01 0.00 -0.02 0.00 0.00 41.12 38.90 1de4 n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1de4 n GLY 120 N -1.52 0.53 3.01 0.44 0.00 -1.26 -4.98 105.19 101.41 1de4 n GLY 120 Ca 0.00 -0.81 -0.10 0.00 0.00 0.00 0.00 46.02 45.11 1de4 n GLY 120 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1de4 s GLN 121 N -1.84 0.32 0.12 1.61 -0.21 -0.48 -5.11 119.66 114.07 1de4 s GLN 121 Ca 0.00 -0.46 -0.35 0.00 0.02 0.00 0.00 55.36 54.57 1de4 s GLN 121 Cb 0.00 0.12 -0.16 0.00 1.00 0.00 0.00 33.01 33.97 1de4 s GLN 121 CO 0.00 -0.06 1.32 -0.25 -2.12 0.00 0.00 175.29 174.18 1de4 n ASP 122 N 1.77 1.75 0.07 5.90 9.92 -1.26 -1.72 116.55 132.98 1de4 n ASP 122 Ca -0.22 1.12 0.00 0.00 -0.53 0.00 0.00 54.79 55.16 1de4 n ASP 122 Cb 0.56 -1.23 0.00 0.00 -0.64 0.00 0.00 41.12 39.81 1de4 n ASP 122 CO 0.00 0.00 0.00 1.57 0.13 0.00 0.00 177.20 178.90 1de4 n HIS 123 N 2.35 -0.54 -4.02 1.24 -0.00 -0.69 -4.56 115.22 109.01 1de4 n HIS 123 Ca 0.17 0.10 -0.16 0.00 0.46 0.00 0.00 57.72 58.29 1de4 n HIS 123 Cb 0.22 0.13 -0.15 0.00 -0.12 0.00 0.00 29.99 30.06 1de4 n HIS 123 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 1de4 s LEU 124 N -6.91 1.65 -0.17 0.27 1.43 -1.17 0.18 118.68 113.95 1de4 s LEU 124 Ca 0.00 -0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.06 1de4 s LEU 124 Cb 0.00 -0.21 0.02 0.00 0.03 0.00 0.00 46.19 46.03 1de4 s LEU 124 CO 0.00 -0.02 -0.18 -0.70 0.23 0.00 0.00 176.35 175.68 1de4 s GLU 125 N 0.40 2.74 0.13 1.70 2.12 -1.00 -0.89 118.70 123.90 1de4 s GLU 125 Ca -0.04 -0.74 -0.30 0.00 0.36 0.00 0.00 54.97 54.24 1de4 s GLU 125 Cb -0.07 -2.42 -0.07 0.00 0.26 0.00 0.00 34.13 31.83 1de4 s GLU 125 CO -0.01 -0.22 1.26 0.12 -0.54 0.00 0.00 175.26 175.86 1de4 s PHE 126 N 1.36 3.37 -0.47 5.30 5.36 -0.28 -1.84 117.98 130.77 1de4 s PHE 126 Ca 0.05 1.25 0.00 0.00 -0.96 0.00 0.00 56.93 57.27 1de4 s PHE 126 Cb -0.13 -3.51 0.12 0.00 -0.34 0.00 0.00 43.02 39.17 1de4 s PHE 126 CO -0.12 -1.58 0.23 0.00 -1.46 0.00 0.00 175.22 172.29 1de4 h PRO 128 N 7.36 0.50 0.00 0.00 0.11 -1.92 -1.98 132.00 136.07 1de4 h PRO 128 Ca -0.07 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.01 1de4 h PRO 128 Cb 0.98 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.98 1de4 h PRO 128 CO 0.65 0.33 0.00 -0.25 -0.21 0.00 0.00 178.00 178.53 1de4 n ASP 129 N -4.94 0.03 -0.04 -2.05 8.00 -1.26 -2.60 116.55 113.70 1de4 n ASP 129 Ca 0.13 0.51 0.00 0.00 0.71 0.00 0.00 54.79 56.14 1de4 n ASP 129 Cb 0.35 -0.52 0.01 0.00 -0.02 0.00 0.00 41.12 40.94 1de4 n ASP 129 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1de4 n THR 130 N -1.54 0.44 -4.14 -3.53 -2.24 -1.00 -5.02 114.28 97.26 1de4 n THR 130 Ca 0.02 -0.46 -0.35 0.00 -2.27 0.00 0.00 64.05 60.99 1de4 n THR 130 Cb 0.10 0.73 -0.03 0.00 -2.10 0.00 0.00 70.33 69.03 1de4 n THR 130 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1de4 n LEU 131 N -0.24 -1.42 0.00 3.22 4.77 -0.78 -4.91 117.00 117.64 1de4 n LEU 131 Ca 0.01 -0.93 -0.10 0.00 -0.03 0.00 0.00 56.01 54.95 1de4 n LEU 131 Cb 0.43 -1.94 -0.04 0.00 -2.33 0.00 0.00 43.42 39.55 1de4 n LEU 131 CO 0.00 0.22 -0.04 -0.90 -1.33 0.00 0.00 177.39 175.34 1de4 n ASP 132 N -2.52 -0.39 -4.30 -1.43 5.68 -1.13 -4.81 116.55 107.65 1de4 n ASP 132 Ca 0.08 -2.13 -0.20 0.00 -0.50 0.00 0.00 54.79 52.04 1de4 n ASP 132 Cb 0.49 0.89 -0.11 0.00 -1.14 0.00 0.00 41.12 41.25 1de4 n ASP 132 CO 0.00 0.00 0.00 0.26 -1.33 0.00 0.00 177.20 176.13 1de4 s TRP 133 N -2.77 1.67 -0.20 2.11 0.51 -1.26 -0.80 118.94 118.19 1de4 s TRP 133 Ca 0.20 -0.51 -0.01 0.00 -2.12 0.00 0.00 56.10 53.66 1de4 s TRP 133 Cb 0.01 -0.84 0.01 0.00 -0.81 0.00 0.00 33.47 31.84 1de4 s TRP 133 CO 0.14 0.27 -0.12 -0.98 -0.51 0.00 0.00 176.95 175.76 1de4 s ARG 134 N -2.87 3.15 -0.03 4.98 1.70 -0.77 -4.94 118.95 120.18 1de4 s ARG 134 Ca 0.14 -0.75 -0.30 0.00 -0.47 0.00 0.00 55.73 54.36 1de4 s ARG 134 Cb -0.05 -2.80 -0.04 0.00 -0.57 0.00 0.00 34.95 31.49 1de4 s ARG 134 CO 0.05 -0.22 1.20 0.00 -1.08 0.00 0.00 175.30 175.25 1de4 s ALA 135 N 1.38 3.46 -0.70 7.88 0.00 -1.26 -2.39 121.76 130.13 1de4 s ALA 135 Ca 0.05 0.67 0.25 0.00 0.00 0.00 0.00 51.96 52.94 1de4 s ALA 135 Cb -0.14 -3.49 0.90 0.00 0.00 0.00 0.00 23.12 20.38 1de4 s ALA 135 CO -0.08 -0.67 1.76 0.00 0.00 0.00 0.00 175.76 176.77 1de4 n ALA 136 N 4.86 2.08 -3.31 0.00 0.00 0.13 -4.85 120.51 119.42 1de4 n ALA 136 Ca 0.10 -0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.42 1de4 n ALA 136 Cb 0.46 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.44 1de4 n ALA 136 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1de4 s GLU 137 N -3.15 1.17 0.25 0.00 -1.05 -1.26 -4.95 118.70 109.71 1de4 s GLU 137 Ca 0.09 -0.43 -0.05 0.00 -0.15 0.00 0.00 54.97 54.43 1de4 s GLU 137 Cb 0.12 0.53 0.49 0.00 -0.44 0.00 0.00 34.13 34.83 1de4 s GLU 137 CO 0.52 -0.48 1.67 -1.35 0.95 0.00 0.00 175.26 176.57 1de4 h PRO 138 N 2.30 0.22 0.00 -4.83 0.11 -1.98 -0.87 132.00 126.95 1de4 h PRO 138 Ca -0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1de4 h PRO 138 Cb 1.27 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1de4 h PRO 138 CO 0.41 0.14 0.00 0.54 -0.21 0.00 0.00 178.00 178.88 1de4 n ARG 139 N -5.21 0.13 0.05 1.05 1.74 -1.26 -1.71 116.66 111.45 1de4 n ARG 139 Ca 0.15 0.19 0.11 0.00 -0.77 0.00 0.00 57.85 57.53 1de4 n ARG 139 Cb 0.49 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.38 1de4 n ARG 139 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1de4 n ALA 140 N -1.25 2.79 -0.19 7.54 0.00 -0.33 -4.37 120.51 124.69 1de4 n ALA 140 Ca 0.04 -0.36 0.09 0.00 0.00 0.00 0.00 53.44 53.21 1de4 n ALA 140 Cb 0.06 -0.96 0.39 0.00 0.00 0.00 0.00 19.45 18.94 1de4 n ALA 140 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 1de4 h TRP 141 N 0.00 0.71 0.41 0.00 4.06 -1.41 -1.12 115.95 118.60 1de4 h TRP 141 Ca 0.00 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 60.96 1de4 h TRP 141 Cb 0.95 -0.23 -0.02 0.00 -1.00 0.00 0.00 29.16 28.85 1de4 h TRP 141 CO 0.00 0.34 -0.43 -1.35 -3.56 0.00 0.00 178.44 173.43 1de4 h PRO 142 N 0.66 -0.84 -0.85 0.49 0.11 -1.78 -1.17 132.00 128.63 1de4 h PRO 142 Ca 0.34 0.06 0.07 0.00 0.11 0.00 0.00 66.00 66.58 1de4 h PRO 142 Cb 0.45 0.19 -0.06 0.00 0.11 0.00 0.00 31.00 31.70 1de4 h PRO 142 CO -0.12 -0.56 0.55 1.15 -0.21 0.00 0.00 178.00 178.81 1de4 h THR 143 N -0.87 1.05 0.11 -1.15 2.02 -1.78 0.09 112.91 112.38 1de4 h THR 143 Ca -0.04 -0.32 0.02 0.00 0.77 0.00 0.00 66.41 66.84 1de4 h THR 143 Cb 0.77 0.03 -0.04 0.00 -1.74 0.00 0.00 68.15 67.17 1de4 h THR 143 CO -0.08 0.17 -0.33 0.50 0.37 0.00 0.00 175.52 176.15 1de4 h LYS 144 N 0.94 -0.53 -0.10 6.66 3.64 -0.56 -1.58 116.57 125.04 1de4 h LYS 144 Ca 0.37 0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.78 1de4 h LYS 144 Cb 0.23 0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1de4 h LYS 144 CO -0.13 -0.35 0.04 -0.07 -2.27 0.00 0.00 179.45 176.67 1de4 h LEU 145 N -0.55 0.13 -1.45 5.20 3.38 -0.53 -2.12 115.31 119.37 1de4 h LEU 145 Ca 0.03 -0.14 0.21 0.00 0.09 0.00 0.00 57.88 58.07 1de4 h LEU 145 Cb 0.59 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.23 1de4 h LEU 145 CO -0.20 0.23 0.61 -0.08 0.09 0.00 0.00 178.44 179.09 1de4 h GLU 146 N 0.02 0.43 0.03 1.13 4.81 -0.78 -0.20 114.58 120.02 1de4 h GLU 146 Ca 0.03 -0.03 -0.24 0.00 -0.13 0.00 0.00 59.36 59.00 1de4 h GLU 146 Cb 0.14 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.40 1de4 h GLU 146 CO -0.00 0.28 -1.16 -1.49 -0.73 0.00 0.00 179.01 175.91 1de4 h TRP 147 N 0.44 0.11 0.00 0.92 4.06 -1.04 -3.32 115.95 117.11 1de4 h TRP 147 Ca 0.49 -0.08 0.00 0.00 2.06 0.00 0.00 58.89 61.37 1de4 h TRP 147 Cb 1.18 -0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.34 1de4 h TRP 147 CO -0.00 1.07 0.00 0.39 -3.56 0.00 0.00 178.44 176.34 1de4 n GLU 148 N -3.35 0.17 0.01 0.49 1.02 -0.14 -3.24 120.64 115.60 1de4 n GLU 148 Ca -0.04 0.18 -0.18 0.00 -0.02 0.00 0.00 57.16 57.10 1de4 n GLU 148 Cb 0.97 -1.71 -0.11 0.00 -0.02 0.00 0.00 31.44 30.56 1de4 n GLU 148 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1de4 h ARG 149 N 0.00 0.37 -0.75 3.49 2.47 -1.50 -3.30 114.38 115.16 1de4 h ARG 149 Ca 0.00 -0.42 0.17 0.00 -1.26 0.00 0.00 59.98 58.47 1de4 h ARG 149 Cb 0.61 0.13 -0.12 0.00 -1.65 0.00 0.00 29.97 28.94 1de4 h ARG 149 CO 0.00 1.10 0.12 1.25 0.56 0.00 0.00 179.97 183.00 1de4 h HIS 150 N -0.17 0.16 0.00 3.04 2.76 -1.68 -3.45 115.15 115.80 1de4 h HIS 150 Ca -0.08 0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.14 1de4 h HIS 150 Cb 1.33 0.05 0.00 0.00 1.55 0.00 0.00 27.41 30.33 1de4 h HIS 150 CO 0.16 -0.16 0.00 1.63 -1.30 0.00 0.00 177.93 178.26 1de4 n LYS 151 N -5.23 0.00 0.30 5.26 4.76 -1.24 -4.68 118.16 117.33 1de4 n LYS 151 Ca 0.14 0.00 -0.16 0.00 -2.87 0.00 0.00 58.31 55.42 1de4 n LYS 151 Cb 0.48 -0.20 -0.08 0.00 -1.84 0.00 0.00 35.03 33.39 1de4 n LYS 151 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 1de4 h ILE 152 N 0.00 0.39 -0.97 -0.18 2.04 -1.88 -3.17 117.51 113.75 1de4 h ILE 152 Ca 0.00 -0.21 0.12 0.00 1.00 0.00 0.00 64.86 65.77 1de4 h ILE 152 Cb 0.00 0.47 -0.14 0.00 -0.74 0.00 0.00 36.82 36.42 1de4 h ILE 152 CO 0.00 0.03 -0.47 -1.14 0.00 0.00 0.00 178.15 176.57 1de4 n ARG 153 N -5.37 -0.33 -0.04 2.37 0.63 -1.26 -1.33 116.66 111.34 1de4 n ARG 153 Ca -0.12 1.48 -0.08 0.00 -0.92 0.00 0.00 57.85 58.20 1de4 n ARG 153 Cb 0.33 -2.18 -0.03 0.00 0.45 0.00 0.00 32.46 31.04 1de4 n ARG 153 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1de4 h ALA 154 N 0.91 0.14 -0.93 5.13 0.00 -1.86 -0.13 119.26 122.52 1de4 h ALA 154 Ca 0.25 0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.28 1de4 h ALA 154 Cb 0.49 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.36 1de4 h ALA 154 CO -0.94 -0.47 0.61 0.00 0.00 0.00 0.00 179.25 178.46 1de4 h ARG 155 N 0.02 1.08 0.08 0.00 3.08 -1.20 -0.39 114.38 117.05 1de4 h ARG 155 Ca 0.09 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 1de4 h ARG 155 Cb 0.14 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 29.95 1de4 h ARG 155 CO -0.19 0.71 -0.04 1.96 -1.07 0.00 0.00 179.97 181.34 1de4 h GLN 156 N 1.11 -0.11 -0.87 0.04 4.20 -0.60 -1.25 115.11 117.62 1de4 h GLN 156 Ca 0.39 0.01 0.12 0.00 0.06 0.00 0.00 58.65 59.22 1de4 h GLN 156 Cb 0.12 0.02 -0.08 0.00 0.30 0.00 0.00 27.48 27.84 1de4 h GLN 156 CO -0.14 0.24 0.50 -0.91 -0.67 0.00 0.00 178.83 177.85 1de4 h ASN 157 N -0.47 0.69 -0.29 1.46 -0.26 -0.61 -0.89 115.58 115.21 1de4 h ASN 157 Ca -0.01 0.06 -0.03 0.00 -0.56 0.00 0.00 56.30 55.76 1de4 h ASN 157 Cb 0.40 -0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 37.58 1de4 h ASN 157 CO 0.02 0.36 0.05 -0.09 -1.06 0.00 0.00 177.43 176.71 1de4 h ARG 158 N 0.78 0.48 -0.77 0.81 2.43 -0.98 -2.09 114.38 115.03 1de4 h ARG 158 Ca 0.44 -0.12 0.12 0.00 -0.81 0.00 0.00 59.98 59.60 1de4 h ARG 158 Cb 0.48 -0.06 -0.08 0.00 -0.42 0.00 0.00 29.97 29.89 1de4 h ARG 158 CO -0.29 0.58 0.38 0.00 -1.51 0.00 0.00 179.97 179.13 1de4 h ALA 159 N 0.88 1.10 0.25 2.80 0.00 -0.15 0.33 119.26 124.48 1de4 h ALA 159 Ca 0.09 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1de4 h ALA 159 Cb 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1de4 h ALA 159 CO 0.00 -0.07 -0.12 -0.92 0.00 0.00 0.00 179.25 178.14 1de4 h TYR 160 N 0.60 -0.31 -0.69 0.00 3.20 -0.89 0.90 116.97 119.79 1de4 h TYR 160 Ca 0.40 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.25 1de4 h TYR 160 Cb 0.50 0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.84 1de4 h TYR 160 CO -0.11 -0.09 0.37 -0.07 -1.64 0.00 0.00 178.16 176.63 1de4 h LEU 161 N -0.48 0.87 0.01 2.82 3.38 -0.83 0.81 115.31 121.89 1de4 h LEU 161 Ca -0.03 -0.10 -0.21 0.00 0.09 0.00 0.00 57.88 57.62 1de4 h LEU 161 Cb 0.36 -0.22 0.02 0.00 0.09 0.00 0.00 40.66 40.91 1de4 h LEU 161 CO 0.06 0.72 -0.84 -0.33 0.09 0.00 0.00 178.44 178.14 1de4 h GLU 162 N 0.95 0.55 0.00 1.13 5.08 -0.33 -3.38 114.58 118.59 1de4 h GLU 162 Ca 0.24 -0.61 0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1de4 h GLU 162 Cb 0.05 0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1de4 h GLU 162 CO -0.04 1.23 -0.10 -2.13 -1.00 0.00 0.00 179.01 176.97 1de4 n ARG 163 N -4.03 0.05 0.38 2.33 0.63 0.31 -4.68 116.66 111.65 1de4 n ARG 163 Ca -0.11 0.02 -0.16 0.00 -0.92 0.00 0.00 57.85 56.68 1de4 n ARG 163 Cb 0.79 -0.59 -0.08 0.00 0.45 0.00 0.00 32.46 33.02 1de4 n ARG 163 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1de4 h ASP 164 N -0.10 -0.99 -0.83 6.15 3.32 -1.45 -3.00 116.42 119.51 1de4 h ASP 164 Ca 0.00 0.05 0.08 0.00 0.02 0.00 0.00 57.03 57.18 1de4 h ASP 164 Cb 0.10 0.28 -0.11 0.00 0.22 0.00 0.00 39.33 39.82 1de4 h ASP 164 CO 0.00 -0.63 -0.57 0.00 -1.72 0.00 0.00 179.24 176.31 1de4 h PRO 166 N -0.11 0.24 -0.37 0.00 0.11 -1.74 -0.47 132.00 129.67 1de4 h PRO 166 Ca 0.14 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 66.28 1de4 h PRO 166 Cb 0.47 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 31.49 1de4 h PRO 166 CO -0.84 0.16 0.14 0.00 -0.21 0.00 0.00 178.00 177.24 1de4 h ALA 167 N 1.52 0.43 0.00 -0.75 0.00 -0.80 -1.76 119.26 117.91 1de4 h ALA 167 Ca 0.34 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.24 1de4 h ALA 167 Cb 0.53 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1de4 h ALA 167 CO -0.44 -0.25 -0.26 0.37 0.00 0.00 0.00 179.25 178.66 1de4 h GLN 168 N 0.29 0.00 -0.39 0.00 4.15 -0.07 -2.50 115.11 116.58 1de4 h GLN 168 Ca 0.17 0.00 -0.13 0.00 0.77 0.00 0.00 58.65 59.46 1de4 h GLN 168 Cb 0.14 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.82 1de4 h GLN 168 CO -0.16 0.26 -0.25 1.25 -1.93 0.00 0.00 178.83 177.99 1de4 h LEU 169 N 0.00 0.91 0.38 -2.39 5.85 -0.36 -2.34 115.31 117.36 1de4 h LEU 169 Ca -0.00 -0.43 -0.00 0.00 0.84 0.00 0.00 57.88 58.29 1de4 h LEU 169 Cb 0.66 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1de4 h LEU 169 CO 0.03 1.14 -0.37 1.56 -0.34 0.00 0.00 178.44 180.46 1de4 h GLN 170 N 0.68 -0.75 -0.84 1.25 1.08 -0.92 -0.86 115.11 114.75 1de4 h GLN 170 Ca 0.08 0.05 0.17 0.00 -1.45 0.00 0.00 58.65 57.50 1de4 h GLN 170 Cb 0.83 0.17 -0.10 0.00 -0.05 0.00 0.00 27.48 28.32 1de4 h GLN 170 CO 0.07 -0.50 0.38 1.96 -0.95 0.00 0.00 178.83 179.79 1de4 h GLN 171 N -0.77 0.48 -0.12 1.46 4.20 -1.45 -0.20 115.11 118.70 1de4 h GLN 171 Ca -0.03 -0.03 -0.09 0.00 0.06 0.00 0.00 58.65 58.57 1de4 h GLN 171 Cb 0.69 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 1de4 h GLN 171 CO -0.06 0.32 -0.31 -0.07 -0.67 0.00 0.00 178.83 178.03 1de4 h LEU 172 N 0.49 0.24 0.31 1.46 3.38 -0.96 -2.23 115.31 118.00 1de4 h LEU 172 Ca 0.48 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.35 1de4 h LEU 172 Cb 0.78 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1de4 h LEU 172 CO -0.43 0.55 -0.15 -0.07 0.09 0.00 0.00 178.44 178.43 1de4 h LEU 173 N 0.21 -0.35 -0.83 1.67 3.38 0.38 -1.85 115.31 117.92 1de4 h LEU 173 Ca 0.03 -0.16 0.17 0.00 0.09 0.00 0.00 57.88 58.01 1de4 h LEU 173 Cb 0.66 0.09 -0.10 0.00 0.09 0.00 0.00 40.66 41.40 1de4 h LEU 173 CO 0.05 0.12 0.38 -0.33 0.09 0.00 0.00 178.44 178.75 1de4 h GLU 174 N -0.98 0.48 0.00 1.13 5.08 -1.43 1.08 114.58 119.93 1de4 h GLU 174 Ca -0.04 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1de4 h GLU 174 Cb 0.49 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1de4 h GLU 174 CO 0.07 0.32 0.00 -0.11 -1.00 0.00 0.00 179.01 178.28 1de4 n LEU 175 N -4.97 0.59 -0.10 1.33 7.94 -0.84 -3.34 117.00 117.61 1de4 n LEU 175 Ca 0.18 0.68 -0.12 0.00 -1.11 0.00 0.00 56.01 55.63 1de4 n LEU 175 Cb 0.50 -0.63 -0.13 0.00 0.53 0.00 0.00 43.42 43.69 1de4 n LEU 175 CO 0.17 -0.64 -1.16 0.61 -1.11 0.00 0.00 177.39 175.26 1de4 n GLY 176 N -0.36 -0.66 1.97 -3.96 0.00 0.35 -4.91 105.19 97.62 1de4 n GLY 176 Ca 0.01 -0.24 -0.21 0.00 0.00 0.00 0.00 46.02 45.58 1de4 n GLY 176 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1de4 n ARG 177 N -2.88 0.00 0.00 1.61 1.85 -0.06 -1.70 116.66 115.48 1de4 n ARG 177 Ca -0.34 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.51 1de4 n ARG 177 Cb 1.03 -0.80 0.00 0.00 -1.05 0.00 0.00 32.46 31.64 1de4 n ARG 177 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1de4 n GLY 178 N 3.58 3.03 0.00 2.89 0.00 -1.26 -4.91 105.19 108.52 1de4 n GLY 178 Ca 0.37 -0.45 0.05 0.00 0.00 0.00 0.00 46.02 45.99 1de4 n GLY 178 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1de4 n VAL 179 N 0.00 0.00 -0.04 1.61 0.31 -0.69 -3.88 118.33 115.64 1de4 n VAL 179 Ca 0.00 -0.27 -0.09 0.00 -0.01 0.00 0.00 64.34 63.97 1de4 n VAL 179 Cb 0.00 0.96 -0.14 0.00 -0.91 0.00 0.00 33.84 33.74 1de4 n VAL 179 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1de4 n LEU 180 N -1.26 0.72 -0.88 7.52 7.94 -1.17 -4.02 117.00 125.84 1de4 n LEU 180 Ca 0.02 0.32 0.09 0.00 -1.11 0.00 0.00 56.01 55.32 1de4 n LEU 180 Cb 0.16 0.21 0.17 0.00 0.53 0.00 0.00 43.42 44.49 1de4 n LEU 180 CO 0.20 0.42 0.63 -0.90 -1.11 0.00 0.00 177.39 176.63 1de4 n ASP 181 N -2.99 3.04 -4.55 1.96 5.75 -1.26 -4.88 116.55 113.61 1de4 n ASP 181 Ca -0.21 -1.88 -0.35 0.00 -0.01 0.00 0.00 54.79 52.34 1de4 n ASP 181 Cb 1.08 -0.21 -0.04 0.00 -1.03 0.00 0.00 41.12 40.92 1de4 n ASP 181 CO 0.00 0.00 0.00 -1.58 -0.11 0.00 0.00 177.20 175.51 1de4 s GLN 182 N -1.20 2.82 -0.21 0.11 2.00 -1.25 -4.96 119.66 116.96 1de4 s GLN 182 Ca 0.30 -0.08 -0.13 0.00 -2.00 0.00 0.00 55.36 53.44 1de4 s GLN 182 Cb 0.17 -4.73 -0.04 0.00 0.80 0.00 0.00 33.01 29.21 1de4 s GLN 182 CO 0.24 -2.80 0.29 1.14 -0.50 0.00 0.00 175.29 173.66 1de4 s GLN 183 N 6.54 4.15 -0.18 1.67 -2.07 -1.26 -4.84 119.66 123.66 1de4 s GLN 183 Ca 0.60 -0.00 -0.07 0.00 -1.82 0.00 0.00 55.36 54.07 1de4 s GLN 183 Cb -0.08 -3.52 -0.04 0.00 -1.09 0.00 0.00 33.01 28.28 1de4 s GLN 183 CO 0.08 0.04 0.05 0.54 -1.32 0.00 0.00 175.29 174.68 1de4 s VAL 184 N 1.09 4.63 0.70 3.63 0.11 -0.36 -4.83 120.40 125.37 1de4 s VAL 184 Ca 0.14 -0.09 -0.14 0.00 -2.93 0.00 0.00 61.98 58.96 1de4 s VAL 184 Cb -0.14 -3.08 0.02 0.00 -1.53 0.00 0.00 36.38 31.65 1de4 s VAL 184 CO 0.06 0.46 1.13 -2.16 -3.33 0.00 0.00 175.10 171.25 1de4 s PRO 185 N 0.44 2.49 0.36 1.54 0.04 -1.25 -2.05 135.00 136.56 1de4 s PRO 185 Ca 0.02 1.44 -0.19 0.00 0.04 0.00 0.00 61.00 62.31 1de4 s PRO 185 Cb -0.13 -1.91 -0.10 0.00 0.04 0.00 0.00 34.50 32.41 1de4 s PRO 185 CO 0.01 -1.50 0.84 -1.25 0.04 0.00 0.00 177.00 175.13 1de4 s PRO 186 N -4.21 4.15 -0.83 0.56 0.04 -1.26 -4.58 135.00 128.87 1de4 s PRO 186 Ca 0.67 0.91 -0.13 0.00 0.04 0.00 0.00 61.00 62.50 1de4 s PRO 186 Cb -0.22 -2.39 0.22 0.00 0.04 0.00 0.00 34.50 32.15 1de4 s PRO 186 CO 0.45 0.11 0.77 -1.17 0.04 0.00 0.00 177.00 177.20 1de4 s LEU 187 N -2.91 6.60 0.18 -3.56 2.96 -0.45 -4.83 118.68 116.67 1de4 s LEU 187 Ca 0.56 -2.79 -0.30 0.00 -0.22 0.00 0.00 54.13 51.38 1de4 s LEU 187 Cb -0.11 -2.18 -0.08 0.00 0.50 0.00 0.00 46.19 44.32 1de4 s LEU 187 CO 0.16 -0.53 1.20 -0.69 -1.32 0.00 0.00 176.35 175.17 1de4 s VAL 188 N 0.02 3.60 -0.20 1.68 1.01 -1.26 -1.53 120.40 123.72 1de4 s VAL 188 Ca 0.19 1.33 -0.04 0.00 0.00 0.00 0.00 61.98 63.46 1de4 s VAL 188 Cb -0.11 -3.85 0.09 0.00 0.00 0.00 0.00 36.38 32.51 1de4 s VAL 188 CO -0.09 0.20 0.18 -0.54 0.00 0.00 0.00 175.10 174.86 1de4 s LYS 189 N -0.14 0.16 -0.27 2.72 1.02 0.50 -4.97 119.74 118.75 1de4 s LYS 189 Ca 0.53 0.07 -0.26 0.00 0.02 0.00 0.00 55.97 56.33 1de4 s LYS 189 Cb -0.32 -1.38 0.00 0.00 -0.52 0.00 0.00 37.83 35.61 1de4 s LYS 189 CO 0.36 -0.69 0.89 0.08 -0.92 0.00 0.00 175.35 175.07 1de4 s VAL 190 N 2.26 4.74 0.09 3.17 1.01 -1.26 -2.01 120.40 128.40 1de4 s VAL 190 Ca 0.06 1.55 0.00 0.00 0.00 0.00 0.00 61.98 63.59 1de4 s VAL 190 Cb -0.16 -4.21 0.00 0.00 0.00 0.00 0.00 36.38 32.02 1de4 s VAL 190 CO -0.13 -0.22 0.03 1.07 0.00 0.00 0.00 175.10 175.85 1de4 n THR 191 N 5.46 0.00 -3.63 3.92 5.66 0.14 -4.48 114.28 121.35 1de4 n THR 191 Ca 0.07 -0.40 0.02 0.00 -3.05 0.00 0.00 64.05 60.69 1de4 n THR 191 Cb 0.47 -0.11 -0.06 0.00 -1.55 0.00 0.00 70.33 69.08 1de4 n THR 191 CO 0.00 0.00 0.00 -1.38 -3.05 0.00 0.00 175.07 170.64 1de4 s HIS 192 N -0.99 -0.16 -0.18 1.09 -3.43 -1.26 -1.98 115.29 108.38 1de4 s HIS 192 Ca 0.02 0.32 -0.09 0.00 -0.80 0.00 0.00 55.06 54.50 1de4 s HIS 192 Cb -0.00 0.10 -0.05 0.00 -1.43 0.00 0.00 32.58 31.20 1de4 s HIS 192 CO 0.01 -0.08 0.12 -1.58 -2.00 0.00 0.00 174.74 171.22 1de4 s HIS 193 N 1.13 3.43 0.08 0.38 2.46 0.42 -4.95 115.29 118.24 1de4 s HIS 193 Ca -0.08 0.34 0.08 0.00 0.47 0.00 0.00 55.06 55.87 1de4 s HIS 193 Cb -0.02 -2.11 -0.04 0.00 -0.13 0.00 0.00 32.58 30.28 1de4 s HIS 193 CO -0.11 0.36 -0.17 0.08 -2.47 0.00 0.00 174.74 172.44 1de4 s VAL 194 N 0.10 2.91 0.21 0.89 1.01 -1.26 -0.03 120.40 124.23 1de4 s VAL 194 Ca 0.09 -1.31 -0.13 0.00 0.00 0.00 0.00 61.98 60.63 1de4 s VAL 194 Cb -0.11 -2.29 0.00 0.00 0.00 0.00 0.00 36.38 33.98 1de4 s VAL 194 CO -0.01 0.22 0.44 0.42 0.00 0.00 0.00 175.10 176.17 1de4 s THR 195 N -1.05 0.02 0.18 3.92 -4.23 -0.83 -5.01 115.64 108.64 1de4 s THR 195 Ca 0.17 -1.25 -0.11 0.00 -1.18 0.00 0.00 61.69 59.32 1de4 s THR 195 Cb -0.11 -1.96 0.09 0.00 1.34 0.00 0.00 72.50 71.86 1de4 s THR 195 CO 0.08 -0.11 1.72 0.77 -0.54 0.00 0.00 174.62 176.55 1de4 h SER 196 N 2.32 0.89 -0.21 3.99 4.64 -2.03 -3.09 113.55 120.07 1de4 h SER 196 Ca -0.28 -0.19 0.03 0.00 -0.47 0.00 0.00 61.79 60.88 1de4 h SER 196 Cb 1.25 -0.23 -0.05 0.00 -0.31 0.00 0.00 62.40 63.05 1de4 h SER 196 CO 0.39 0.84 -0.37 0.28 -0.87 0.00 0.00 176.83 177.10 1de4 h SER 197 N 0.89 -1.23 -5.37 4.97 0.02 -2.02 -3.46 113.55 107.36 1de4 h SER 197 Ca 0.21 0.16 0.18 0.00 -0.84 0.00 0.00 61.79 61.49 1de4 h SER 197 Cb 0.25 0.49 -0.07 0.00 0.14 0.00 0.00 62.40 63.21 1de4 h SER 197 CO -0.01 -0.29 0.52 0.54 -1.14 0.00 0.00 176.83 176.45 1de4 s VAL 198 N -4.80 0.00 -0.19 2.27 0.11 -1.17 -4.72 120.40 111.90 1de4 s VAL 198 Ca -0.10 -0.63 -0.03 0.00 -2.93 0.00 0.00 61.98 58.29 1de4 s VAL 198 Cb 0.05 -2.16 -0.01 0.00 -1.53 0.00 0.00 36.38 32.73 1de4 s VAL 198 CO 0.41 0.00 -0.08 -0.89 -3.33 0.00 0.00 175.10 171.22 1de4 s THR 199 N -3.02 3.23 -0.19 5.04 2.01 -0.88 -1.97 115.64 119.86 1de4 s THR 199 Ca 0.14 -0.56 -0.10 0.00 0.31 0.00 0.00 61.69 61.48 1de4 s THR 199 Cb -0.01 -2.43 -0.05 0.00 0.01 0.00 0.00 72.50 70.02 1de4 s THR 199 CO 0.03 0.46 0.15 -0.89 -0.69 0.00 0.00 174.62 173.68 1de4 s THR 200 N 1.09 5.40 -0.17 -0.82 2.01 0.96 -1.18 115.64 122.94 1de4 s THR 200 Ca 0.01 0.24 -0.06 0.00 0.31 0.00 0.00 61.69 62.18 1de4 s THR 200 Cb -0.15 -3.49 -0.04 0.00 0.01 0.00 0.00 72.50 68.84 1de4 s THR 200 CO -0.01 0.45 0.05 -0.76 -0.69 0.00 0.00 174.62 173.66 1de4 s LEU 201 N 0.25 3.78 -0.19 4.42 1.43 0.79 -0.44 118.68 128.72 1de4 s LEU 201 Ca 0.10 0.09 0.01 0.00 -1.03 0.00 0.00 54.13 53.30 1de4 s LEU 201 Cb -0.11 -1.94 0.03 0.00 0.03 0.00 0.00 46.19 44.20 1de4 s LEU 201 CO -0.01 0.21 -0.16 -0.60 0.23 0.00 0.00 176.35 176.03 1de4 s ARG 202 N 0.15 2.57 -0.47 1.70 3.52 -0.84 -1.55 118.95 124.03 1de4 s ARG 202 Ca 0.04 -0.87 -0.09 0.00 -0.13 0.00 0.00 55.73 54.68 1de4 s ARG 202 Cb -0.12 -2.51 0.12 0.00 -1.56 0.00 0.00 34.95 30.87 1de4 s ARG 202 CO 0.01 -0.31 0.34 0.00 -0.81 0.00 0.00 175.30 174.52 1de4 s ARG 204 N 1.35 4.18 -0.42 0.00 0.52 -0.85 -2.63 118.95 121.10 1de4 s ARG 204 Ca 0.06 0.20 -0.12 0.00 -0.52 0.00 0.00 55.73 55.35 1de4 s ARG 204 Cb -0.26 -3.38 0.05 0.00 0.52 0.00 0.00 34.95 31.88 1de4 s ARG 204 CO -0.01 0.32 0.29 0.00 0.02 0.00 0.00 175.30 175.92 1de4 s ALA 205 N 0.18 3.39 0.39 2.13 0.00 0.76 -0.37 121.76 128.24 1de4 s ALA 205 Ca 0.19 -1.96 -0.02 0.00 0.00 0.00 0.00 51.96 50.17 1de4 s ALA 205 Cb -0.14 -2.79 -0.04 0.00 0.00 0.00 0.00 23.12 20.15 1de4 s ALA 205 CO 0.07 -1.57 0.64 -0.51 0.00 0.00 0.00 175.76 174.38 1de4 s LEU 206 N 1.56 3.88 -0.11 0.00 1.43 -0.58 -2.01 118.68 122.85 1de4 s LEU 206 Ca 0.03 0.67 -0.00 0.00 -1.03 0.00 0.00 54.13 53.79 1de4 s LEU 206 Cb -0.22 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.45 1de4 s LEU 206 CO 0.06 -0.39 0.07 0.59 0.23 0.00 0.00 176.35 176.91 1de4 n ASN 207 N -1.85 -0.59 -4.70 2.29 3.02 -1.09 -1.34 115.26 111.01 1de4 n ASN 207 Ca -0.02 -0.12 -0.32 0.00 -0.03 0.00 0.00 54.58 54.08 1de4 n ASN 207 Cb 0.55 -0.20 -0.08 0.00 -0.61 0.00 0.00 39.78 39.45 1de4 n ASN 207 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 1de4 s TYR 208 N -2.27 1.95 -0.29 3.10 -0.85 -0.62 -4.70 117.35 113.68 1de4 s TYR 208 Ca 0.00 -0.94 -0.25 0.00 -0.52 0.00 0.00 57.07 55.37 1de4 s TYR 208 Cb -0.00 -1.60 0.14 0.00 0.38 0.00 0.00 41.96 40.87 1de4 s TYR 208 CO 0.11 0.22 1.11 -0.47 -1.52 0.00 0.00 175.55 175.01 1de4 s TYR 209 N -2.88 -0.39 0.00 -3.49 6.14 -0.87 -1.07 117.35 114.79 1de4 s TYR 209 Ca 0.11 0.95 0.00 0.00 0.64 0.00 0.00 57.07 58.77 1de4 s TYR 209 Cb 0.03 0.39 0.00 0.00 0.42 0.00 0.00 41.96 42.79 1de4 s TYR 209 CO 0.06 -0.19 0.00 -0.35 0.64 0.00 0.00 175.55 175.71 1de4 n PRO 210 N 2.13 2.08 -0.01 4.97 -0.04 -1.26 -1.22 135.00 141.65 1de4 n PRO 210 Ca -0.12 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.23 1de4 n PRO 210 Cb 0.56 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.88 1de4 n PRO 210 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1de4 h GLN 211 N 0.00 0.05 -6.61 0.54 4.20 -1.96 -3.45 115.11 107.87 1de4 h GLN 211 Ca 0.00 -0.08 -0.52 0.00 0.06 0.00 0.00 58.65 58.10 1de4 h GLN 211 Cb 0.00 0.03 0.05 0.00 0.30 0.00 0.00 27.48 27.86 1de4 h GLN 211 CO 0.00 0.64 0.96 1.21 -0.67 0.00 0.00 178.83 180.97 1de4 s ASN 212 N -6.28 6.49 0.08 1.46 3.84 -1.26 -4.97 114.94 114.29 1de4 s ASN 212 Ca -0.07 2.73 -0.26 0.00 0.21 0.00 0.00 52.86 55.47 1de4 s ASN 212 Cb 0.08 -2.59 0.08 0.00 -0.55 0.00 0.00 41.25 38.27 1de4 s ASN 212 CO 0.82 -0.90 0.70 -0.51 -2.79 0.00 0.00 177.10 174.41 1de4 s ILE 213 N 1.35 0.00 -0.14 -5.21 2.07 -1.26 -4.75 121.20 113.27 1de4 s ILE 213 Ca 0.73 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.99 1de4 s ILE 213 Cb -0.46 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.14 1de4 s ILE 213 CO 0.32 0.00 -0.20 -0.89 -1.91 0.00 0.00 174.94 172.26 1de4 s THR 214 N -3.12 1.91 -0.13 4.00 2.01 0.11 -5.00 115.64 115.42 1de4 s THR 214 Ca 0.00 -0.88 -0.01 0.00 0.31 0.00 0.00 61.69 61.11 1de4 s THR 214 Cb -0.01 -1.70 0.04 0.00 0.01 0.00 0.00 72.50 70.84 1de4 s THR 214 CO -0.08 0.52 -0.03 -0.04 -0.69 0.00 0.00 174.62 174.30 1de4 s MET 215 N 0.92 1.09 0.00 4.92 -1.94 -1.26 -1.17 119.30 121.86 1de4 s MET 215 Ca -0.05 -0.28 -0.03 0.00 -1.71 0.00 0.00 55.69 53.62 1de4 s MET 215 Cb -0.15 -1.66 -0.01 0.00 2.01 0.00 0.00 34.83 35.02 1de4 s MET 215 CO -0.03 -0.40 0.04 -1.59 -0.01 0.00 0.00 175.02 173.03 1de4 s LYS 216 N 1.78 0.32 0.37 2.03 -2.85 -0.85 -4.67 119.74 115.87 1de4 s LYS 216 Ca 0.02 -0.40 -0.17 0.00 -1.00 0.00 0.00 55.97 54.43 1de4 s LYS 216 Cb -0.14 0.12 -0.09 0.00 -2.06 0.00 0.00 37.83 35.66 1de4 s LYS 216 CO -0.07 -0.06 0.82 -1.58 0.10 0.00 0.00 175.35 174.56 1de4 s TRP 217 N -1.12 3.36 -0.21 1.78 0.52 -1.26 -0.80 118.94 121.20 1de4 s TRP 217 Ca -0.12 1.35 0.00 0.00 0.02 0.00 0.00 56.10 57.35 1de4 s TRP 217 Cb -0.07 -2.65 0.05 0.00 -1.15 0.00 0.00 33.47 29.65 1de4 s TRP 217 CO 0.00 -0.01 -0.07 -0.51 0.02 0.00 0.00 176.95 176.38 1de4 s LEU 218 N -3.17 2.24 -0.22 2.99 1.43 0.17 -3.59 118.68 118.53 1de4 s LEU 218 Ca 0.57 -0.97 -0.21 0.00 -1.03 0.00 0.00 54.13 52.49 1de4 s LEU 218 Cb -0.10 -1.13 -0.02 0.00 0.03 0.00 0.00 46.19 44.98 1de4 s LEU 218 CO 0.18 -0.20 0.66 -0.75 0.23 0.00 0.00 176.35 176.47 1de4 s LYS 219 N 1.46 4.18 -1.48 1.70 2.20 -0.06 0.17 119.74 127.91 1de4 s LYS 219 Ca -0.03 0.65 -0.12 0.00 -0.36 0.00 0.00 55.97 56.11 1de4 s LYS 219 Cb -0.17 -3.61 0.06 0.00 -1.51 0.00 0.00 37.83 32.60 1de4 s LYS 219 CO -0.07 -0.33 1.00 -0.25 -0.36 0.00 0.00 175.35 175.34 1de4 n ASP 220 N 5.39 -5.30 -2.07 1.43 8.00 0.98 -0.69 116.55 124.28 1de4 n ASP 220 Ca -0.00 -0.67 -0.19 0.00 0.71 0.00 0.00 54.79 54.64 1de4 n ASP 220 Cb 0.49 -4.21 -0.02 0.00 -0.02 0.00 0.00 41.12 37.36 1de4 n ASP 220 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1de4 n LYS 221 N -4.71 -1.49 -4.29 -1.24 5.02 -1.25 -5.00 118.16 105.20 1de4 n LYS 221 Ca 0.03 0.95 -0.19 0.00 -2.02 0.00 0.00 58.31 57.07 1de4 n LYS 221 Cb 0.54 -5.47 -0.11 0.00 -0.02 0.00 0.00 35.03 29.97 1de4 n LYS 221 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1de4 s GLN 222 N -4.78 1.17 -0.25 1.97 -1.52 0.13 -5.07 119.66 111.31 1de4 s GLN 222 Ca 0.00 -1.39 -0.29 0.00 -1.95 0.00 0.00 55.36 51.73 1de4 s GLN 222 Cb 0.00 -1.06 -0.01 0.00 -0.22 0.00 0.00 33.01 31.73 1de4 s GLN 222 CO 0.00 0.20 1.31 -1.25 -0.25 0.00 0.00 175.29 175.30 1de4 s PRO 223 N -3.04 4.02 0.94 2.91 0.04 -1.26 -0.88 135.00 137.73 1de4 s PRO 223 Ca 0.15 1.42 -0.14 0.00 0.04 0.00 0.00 61.00 62.47 1de4 s PRO 223 Cb -0.03 -3.85 0.20 0.00 0.04 0.00 0.00 34.50 30.85 1de4 s PRO 223 CO 0.05 -0.99 1.29 -1.64 0.04 0.00 0.00 177.00 175.75 1de4 s MET 224 N 3.97 0.69 0.23 4.56 -1.94 -1.24 -4.92 119.30 120.65 1de4 s MET 224 Ca 0.57 -0.55 -0.09 0.00 -1.71 0.00 0.00 55.69 53.91 1de4 s MET 224 Cb -0.19 -1.91 -0.07 0.00 2.01 0.00 0.00 34.83 34.67 1de4 s MET 224 CO 0.21 -2.34 0.54 0.16 -0.01 0.00 0.00 175.02 173.58 1de4 s ASP 225 N -4.89 6.62 0.61 3.03 -4.77 -1.26 -4.96 116.67 111.04 1de4 s ASP 225 Ca 0.74 0.91 0.32 0.00 -3.30 0.00 0.00 52.55 51.21 1de4 s ASP 225 Cb -0.03 -2.22 1.85 0.00 -1.09 0.00 0.00 42.92 41.43 1de4 s ASP 225 CO 0.52 -0.07 2.20 0.00 0.70 0.00 0.00 175.17 178.52 1de4 h ALA 226 N 2.54 1.54 0.00 2.11 0.00 -1.97 -1.21 119.26 122.27 1de4 h ALA 226 Ca -0.47 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.40 1de4 h ALA 226 Cb 1.17 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1de4 h ALA 226 CO 0.69 -0.13 -0.19 -0.22 0.00 0.00 0.00 179.25 179.40 1de4 h LYS 227 N 0.00 0.00 -0.51 0.00 3.64 -2.00 -3.14 116.57 114.56 1de4 h LYS 227 Ca 0.03 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.36 1de4 h LYS 227 Cb 0.22 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 1de4 h LYS 227 CO -0.00 0.19 0.09 0.93 -2.27 0.00 0.00 179.45 178.39 1de4 h GLU 228 N 0.00 0.81 -5.26 1.90 4.39 -1.61 -3.45 114.58 111.36 1de4 h GLU 228 Ca -0.00 -0.18 -0.41 0.00 0.34 0.00 0.00 59.36 59.11 1de4 h GLU 228 Cb 0.47 -0.11 -0.14 0.00 -0.10 0.00 0.00 28.75 28.87 1de4 h GLU 228 CO 0.02 0.76 -0.68 -0.59 -1.16 0.00 0.00 179.01 177.36 1de4 s PHE 229 N -5.14 1.62 0.66 4.33 -0.12 -1.19 -4.89 117.98 113.25 1de4 s PHE 229 Ca -0.10 -0.78 -0.11 0.00 -0.05 0.00 0.00 56.93 55.89 1de4 s PHE 229 Cb 0.15 -0.89 -0.02 0.00 -0.63 0.00 0.00 43.02 41.64 1de4 s PHE 229 CO 0.80 0.12 1.05 -1.21 -0.05 0.00 0.00 175.22 175.93 1de4 s GLU 230 N -3.77 3.27 0.76 1.99 8.01 -1.26 -4.91 118.70 122.79 1de4 s GLU 230 Ca 0.25 0.78 -0.13 0.00 0.01 0.00 0.00 54.97 55.88 1de4 s GLU 230 Cb 0.04 -2.04 0.06 0.00 -4.31 0.00 0.00 34.13 27.87 1de4 s GLU 230 CO 0.08 -0.81 1.16 -1.25 0.01 0.00 0.00 175.26 174.44 1de4 s PRO 231 N -5.16 2.05 0.28 0.39 0.04 -1.26 -4.81 135.00 126.53 1de4 s PRO 231 Ca 0.56 1.55 -0.29 0.00 0.04 0.00 0.00 61.00 62.86 1de4 s PRO 231 Cb -0.12 -1.84 -0.14 0.00 0.04 0.00 0.00 34.50 32.44 1de4 s PRO 231 CO 0.54 -1.86 1.13 0.36 0.04 0.00 0.00 177.00 177.22 1de4 n LYS 232 N -3.11 1.56 -3.48 4.56 -0.00 -1.26 -4.92 118.16 111.51 1de4 n LYS 232 Ca 0.12 0.55 -0.42 0.00 -0.00 0.00 0.00 58.31 58.55 1de4 n LYS 232 Cb 0.51 -2.01 -0.04 0.00 -0.00 0.00 0.00 35.03 33.49 1de4 n LYS 232 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1de4 s ASP 233 N -0.33 6.30 0.01 -5.58 3.68 -1.05 -4.96 116.67 114.74 1de4 s ASP 233 Ca 0.61 -2.98 -0.30 0.00 2.13 0.00 0.00 52.55 52.01 1de4 s ASP 233 Cb -0.69 -2.07 -0.05 0.00 -1.45 0.00 0.00 42.92 38.66 1de4 s ASP 233 CO 0.58 -0.43 1.29 -0.69 0.13 0.00 0.00 175.17 176.05 1de4 s VAL 234 N -0.27 3.91 0.27 1.11 1.01 -1.26 -3.41 120.40 121.75 1de4 s VAL 234 Ca 0.20 1.31 0.10 0.00 0.00 0.00 0.00 61.98 63.59 1de4 s VAL 234 Cb -0.13 -3.84 -0.05 0.00 0.00 0.00 0.00 36.38 32.36 1de4 s VAL 234 CO -0.08 0.03 -0.15 -0.76 0.00 0.00 0.00 175.10 174.14 1de4 s LEU 235 N 1.89 2.59 0.07 3.92 1.43 0.47 -4.99 118.68 124.06 1de4 s LEU 235 Ca 0.60 -1.07 0.05 0.00 -1.03 0.00 0.00 54.13 52.68 1de4 s LEU 235 Cb -0.30 -0.92 -0.04 0.00 0.03 0.00 0.00 46.19 44.97 1de4 s LEU 235 CO 0.26 -0.09 -0.05 -2.16 0.23 0.00 0.00 176.35 174.54 1de4 s PRO 236 N -3.58 2.43 -0.01 1.29 0.04 -1.26 -2.06 135.00 131.84 1de4 s PRO 236 Ca 0.28 -0.86 0.02 0.00 0.04 0.00 0.00 61.00 60.48 1de4 s PRO 236 Cb -0.02 -2.46 -0.03 0.00 0.04 0.00 0.00 34.50 32.02 1de4 s PRO 236 CO 0.13 0.55 -0.03 -0.80 0.04 0.00 0.00 177.00 176.88 1de4 s ASN 237 N -2.03 4.90 -0.11 6.66 0.01 -0.10 -4.94 114.94 119.32 1de4 s ASN 237 Ca 0.22 -0.06 -0.02 0.00 -0.71 0.00 0.00 52.86 52.29 1de4 s ASN 237 Cb -0.11 -1.23 -0.09 0.00 0.41 0.00 0.00 41.25 40.23 1de4 s ASN 237 CO 0.14 0.29 1.65 0.61 -1.51 0.00 0.00 177.10 178.28 1de4 n GLY 238 N 1.54 1.88 1.58 0.66 0.00 -1.26 -3.11 105.19 106.47 1de4 n GLY 238 Ca -0.15 -0.46 -0.03 0.00 0.00 0.00 0.00 46.02 45.38 1de4 n GLY 238 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1de4 n ASP 239 N 3.12 -0.83 -0.12 1.61 5.75 -1.26 -5.00 116.55 119.82 1de4 n ASP 239 Ca 0.18 -1.58 -0.02 0.00 -0.01 0.00 0.00 54.79 53.36 1de4 n ASP 239 Cb 0.29 0.33 -0.01 0.00 -1.03 0.00 0.00 41.12 40.71 1de4 n ASP 239 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1de4 n GLY 240 N -0.54 0.24 3.52 6.12 0.00 -1.18 -4.97 105.19 108.39 1de4 n GLY 240 Ca -0.15 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.55 1de4 n GLY 240 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1de4 s THR 241 N -1.32 3.00 0.40 2.61 -4.23 -1.26 -4.82 115.64 110.03 1de4 s THR 241 Ca 0.00 -1.43 0.06 0.00 -1.18 0.00 0.00 61.69 59.14 1de4 s THR 241 Cb 0.00 -2.39 -0.07 0.00 1.34 0.00 0.00 72.50 71.39 1de4 s THR 241 CO 0.00 0.11 0.02 -0.31 -0.54 0.00 0.00 174.62 173.90 1de4 s TYR 242 N -1.16 2.32 -0.16 3.99 1.51 -0.23 -0.93 117.35 122.70 1de4 s TYR 242 Ca 0.19 -0.77 -0.14 0.00 -1.01 0.00 0.00 57.07 55.34 1de4 s TYR 242 Cb -0.11 -1.65 0.04 0.00 -0.11 0.00 0.00 41.96 40.14 1de4 s TYR 242 CO 0.11 0.32 0.41 1.14 -1.11 0.00 0.00 175.55 176.42 1de4 s GLN 243 N -3.76 0.47 0.03 -0.62 -2.07 -0.88 -1.58 119.66 111.24 1de4 s GLN 243 Ca 0.32 0.60 0.01 0.00 -1.82 0.00 0.00 55.36 54.47 1de4 s GLN 243 Cb 0.09 0.20 -0.02 0.00 -1.09 0.00 0.00 33.01 32.18 1de4 s GLN 243 CO 0.16 -0.07 -0.06 0.20 -1.32 0.00 0.00 175.29 174.20 1de4 s GLY 244 N 0.39 0.40 0.05 2.60 0.00 -0.85 -0.40 107.32 109.52 1de4 s GLY 244 Ca -0.01 -0.67 0.00 0.00 0.00 0.00 0.00 44.72 44.04 1de4 s GLY 244 CO -0.01 -0.72 -0.05 0.66 0.00 0.00 0.00 173.10 172.98 1de4 s TRP 245 N -1.30 0.57 -0.02 1.90 -2.14 -1.22 -0.17 118.94 116.56 1de4 s TRP 245 Ca -0.11 -0.82 0.03 0.00 2.66 0.00 0.00 56.10 57.86 1de4 s TRP 245 Cb -0.09 -0.38 -0.00 0.00 -3.10 0.00 0.00 33.47 29.90 1de4 s TRP 245 CO -0.00 -0.24 -0.11 0.96 -2.66 0.00 0.00 176.95 174.90 1de4 s ILE 246 N -2.89 0.92 0.12 0.66 -4.36 -1.08 -2.54 121.20 112.02 1de4 s ILE 246 Ca 0.00 -0.46 0.06 0.00 -0.26 0.00 0.00 60.65 59.99 1de4 s ILE 246 Cb 0.00 -0.79 -0.04 0.00 1.25 0.00 0.00 42.46 42.88 1de4 s ILE 246 CO -0.05 0.27 -0.00 -0.89 0.24 0.00 0.00 174.94 174.51 1de4 s THR 247 N -0.01 3.90 -0.13 8.37 2.01 -1.26 -1.95 115.64 126.56 1de4 s THR 247 Ca -0.00 -1.13 -0.06 0.00 0.31 0.00 0.00 61.69 60.81 1de4 s THR 247 Cb -0.07 -2.88 0.06 0.00 0.01 0.00 0.00 72.50 69.61 1de4 s THR 247 CO 0.00 0.05 0.30 -0.22 -0.69 0.00 0.00 174.62 174.06 1de4 s LEU 248 N -2.49 -0.04 -0.11 4.42 2.96 -0.59 -4.50 118.68 118.32 1de4 s LEU 248 Ca 0.26 0.66 -0.16 0.00 -0.22 0.00 0.00 54.13 54.67 1de4 s LEU 248 Cb -0.11 0.88 -0.05 0.00 0.50 0.00 0.00 46.19 47.42 1de4 s LEU 248 CO 0.18 -0.20 0.38 0.00 -1.32 0.00 0.00 176.35 175.39 1de4 s ALA 249 N 1.85 3.57 0.02 5.97 0.00 -1.26 -0.14 121.76 131.76 1de4 s ALA 249 Ca -0.05 -0.31 0.00 0.00 0.00 0.00 0.00 51.96 51.60 1de4 s ALA 249 Cb -0.11 -2.48 -0.02 0.00 0.00 0.00 0.00 23.12 20.51 1de4 s ALA 249 CO -0.10 0.14 -0.03 0.14 0.00 0.00 0.00 175.76 175.91 1de4 s VAL 250 N 0.22 0.11 -0.35 0.00 -7.23 -0.33 -5.00 120.40 107.83 1de4 s VAL 250 Ca 0.21 -0.81 -0.42 0.00 -1.81 0.00 0.00 61.98 59.16 1de4 s VAL 250 Cb -0.14 -0.24 -0.17 0.00 0.56 0.00 0.00 36.38 36.39 1de4 s VAL 250 CO 0.08 -0.44 1.74 -2.65 -0.31 0.00 0.00 175.10 173.52 1de4 n PRO 251 N 1.77 0.82 -1.33 4.82 -0.02 -1.26 -2.07 135.00 137.73 1de4 n PRO 251 Ca -0.23 0.30 -0.54 0.00 -2.02 0.00 0.00 63.50 61.02 1de4 n PRO 251 Cb 0.56 -1.95 -0.13 0.00 -0.02 0.00 0.00 33.50 31.96 1de4 n PRO 251 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1de4 n PRO 252 N 5.21 0.00 0.00 0.52 -0.02 -1.26 -1.06 135.00 138.39 1de4 n PRO 252 Ca 0.29 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1de4 n PRO 252 Cb 0.08 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 1de4 n PRO 252 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1de4 n GLY 253 N 7.17 1.53 0.06 -1.23 0.00 -1.26 -4.96 105.19 106.50 1de4 n GLY 253 Ca 0.59 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1de4 n GLY 253 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1de4 n GLU 254 N 0.00 1.03 0.00 1.61 1.02 -0.22 -4.60 120.64 119.48 1de4 n GLU 254 Ca 0.00 -0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 1de4 n GLU 254 Cb 0.00 -1.04 0.00 0.00 -0.02 0.00 0.00 31.44 30.38 1de4 n GLU 254 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1de4 n GLU 255 N -0.43 0.00 0.26 3.49 4.71 -1.26 -0.25 120.64 127.16 1de4 n GLU 255 Ca 0.00 0.36 0.02 0.00 -0.01 0.00 0.00 57.16 57.53 1de4 n GLU 255 Cb 0.03 -0.68 0.12 0.00 -1.01 0.00 0.00 31.44 29.90 1de4 n GLU 255 CO 0.00 0.00 0.00 -0.56 0.09 0.00 0.00 177.13 176.66 1de4 h GLN 256 N 0.00 0.00 0.00 3.49 -0.00 -1.97 -0.63 115.11 116.00 1de4 h GLN 256 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1de4 h GLN 256 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.48 1de4 h GLN 256 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 178.83 179.37 1de4 n ARG 257 N -2.25 0.14 -4.91 0.06 1.74 0.66 -4.74 116.66 107.35 1de4 n ARG 257 Ca -0.00 0.36 -0.33 0.00 -0.77 0.00 0.00 57.85 57.11 1de4 n ARG 257 Cb 0.79 -1.76 -0.14 0.00 -1.02 0.00 0.00 32.46 30.34 1de4 n ARG 257 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1de4 s TYR 258 N -3.21 2.69 0.36 -1.55 1.51 -0.25 -0.02 117.35 116.88 1de4 s TYR 258 Ca 0.05 -0.31 0.08 0.00 -1.01 0.00 0.00 57.07 55.89 1de4 s TYR 258 Cb 0.10 -1.66 -0.07 0.00 -0.11 0.00 0.00 41.96 40.21 1de4 s TYR 258 CO 0.37 0.07 -0.06 0.95 -1.11 0.00 0.00 175.55 175.77 1de4 s THR 259 N -0.47 2.09 -0.16 -0.71 -4.23 0.13 -4.84 115.64 107.45 1de4 s THR 259 Ca 0.06 -2.13 0.02 0.00 -1.18 0.00 0.00 61.69 58.45 1de4 s THR 259 Cb -0.12 -2.74 0.01 0.00 1.34 0.00 0.00 72.50 70.99 1de4 s THR 259 CO 0.02 -0.14 -0.20 0.00 -0.54 0.00 0.00 174.62 173.75 1de4 s GLN 261 N 0.97 3.74 -0.29 0.00 0.74 0.02 -0.33 119.66 124.50 1de4 s GLN 261 Ca -0.03 -0.45 0.03 0.00 0.05 0.00 0.00 55.36 54.97 1de4 s GLN 261 Cb -0.15 -3.28 0.08 0.00 1.10 0.00 0.00 33.01 30.76 1de4 s GLN 261 CO -0.05 -0.05 -0.04 0.08 -0.55 0.00 0.00 175.29 174.68 1de4 s VAL 262 N 1.23 2.24 0.01 1.34 1.01 0.97 -2.00 120.40 125.20 1de4 s VAL 262 Ca 0.05 -1.91 -0.16 0.00 0.00 0.00 0.00 61.98 59.95 1de4 s VAL 262 Cb -0.14 -2.46 -0.06 0.00 0.00 0.00 0.00 36.38 33.72 1de4 s VAL 262 CO 0.03 -0.26 0.45 -1.61 0.00 0.00 0.00 175.10 173.71 1de4 s GLU 263 N 1.03 4.01 -0.28 2.72 2.02 -0.32 -2.53 118.70 125.35 1de4 s GLU 263 Ca -0.01 0.49 -0.22 0.00 0.02 0.00 0.00 54.97 55.24 1de4 s GLU 263 Cb -0.20 -3.24 0.09 0.00 0.10 0.00 0.00 34.13 30.89 1de4 s GLU 263 CO -0.06 0.64 0.82 -1.58 0.02 0.00 0.00 175.26 175.10 1de4 s HIS 264 N -0.97 -0.74 0.63 1.61 2.46 -1.26 -0.71 115.29 116.31 1de4 s HIS 264 Ca 0.25 1.70 0.33 0.00 0.47 0.00 0.00 55.06 57.81 1de4 s HIS 264 Cb -0.17 0.37 1.84 0.00 -0.13 0.00 0.00 32.58 34.49 1de4 s HIS 264 CO 0.14 -0.36 2.12 -1.00 -2.47 0.00 0.00 174.74 173.17 1de4 h PRO 265 N 5.27 0.00 -0.00 2.88 0.13 -1.97 0.57 132.00 138.88 1de4 h PRO 265 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1de4 h PRO 265 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1de4 h PRO 265 CO 0.10 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.28 1de4 n GLY 266 N -1.28 -0.98 3.05 1.56 0.00 -1.26 -4.73 105.19 101.55 1de4 n GLY 266 Ca -0.00 -0.03 -0.19 0.00 0.00 0.00 0.00 46.02 45.80 1de4 n GLY 266 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1de4 s LEU 267 N -1.11 2.05 0.00 0.99 1.43 0.19 -3.97 118.68 118.27 1de4 s LEU 267 Ca 0.05 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.92 1de4 s LEU 267 Cb 0.03 -0.50 0.00 0.00 0.03 0.00 0.00 46.19 45.75 1de4 s LEU 267 CO 0.04 0.09 0.69 0.47 0.23 0.00 0.00 176.35 177.87 1de4 n ASP 268 N 2.63 0.00 -4.74 2.29 8.00 -1.26 -4.75 116.55 118.73 1de4 n ASP 268 Ca -0.15 0.79 -0.30 0.00 0.71 0.00 0.00 54.79 55.84 1de4 n ASP 268 Cb 0.56 -0.42 -0.07 0.00 -0.02 0.00 0.00 41.12 41.17 1de4 n ASP 268 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1de4 s GLN 269 N -2.21 2.74 -0.13 -1.24 1.11 -1.26 -5.04 119.66 113.63 1de4 s GLN 269 Ca 0.00 -0.75 -0.37 0.00 0.01 0.00 0.00 55.36 54.25 1de4 s GLN 269 Cb 0.00 -2.65 -0.14 0.00 -1.01 0.00 0.00 33.01 29.21 1de4 s GLN 269 CO 0.00 0.56 1.73 -0.35 0.01 0.00 0.00 175.29 177.24 1de4 n PRO 270 N 0.54 1.61 -2.75 2.91 -0.04 -1.26 -4.93 135.00 131.07 1de4 n PRO 270 Ca -0.10 0.59 -0.42 0.00 -0.04 0.00 0.00 63.50 63.54 1de4 n PRO 270 Cb 0.52 -2.33 -0.03 0.00 -0.04 0.00 0.00 33.50 31.61 1de4 n PRO 270 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1de4 s LEU 271 N 3.12 4.39 -0.21 1.53 2.96 -1.05 -4.89 118.68 124.53 1de4 s LEU 271 Ca 0.93 1.64 -0.00 0.00 -0.22 0.00 0.00 54.13 56.47 1de4 s LEU 271 Cb -0.89 -3.52 0.02 0.00 0.50 0.00 0.00 46.19 42.31 1de4 s LEU 271 CO 0.56 -0.20 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.62 1de4 s ILE 272 N 0.78 2.44 0.05 6.68 1.01 -1.26 -0.02 121.20 130.88 1de4 s ILE 272 Ca 0.49 -0.97 0.02 0.00 0.00 0.00 0.00 60.65 60.19 1de4 s ILE 272 Cb -0.21 -2.14 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 1de4 s ILE 272 CO 0.27 0.38 0.07 -0.69 0.00 0.00 0.00 174.94 174.98 1de4 s VAL 273 N 1.30 4.53 -0.00 2.92 1.01 0.55 -4.93 120.40 125.78 1de4 s VAL 273 Ca 0.02 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.34 1de4 s VAL 273 Cb -0.15 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.09 1de4 s VAL 273 CO -0.09 0.21 -0.01 0.27 0.00 0.00 0.00 175.10 175.48 1de4 s ILE 274 N -1.31 0.08 -2.35 2.22 -4.36 -1.26 -1.21 121.20 113.01 1de4 s ILE 274 Ca 0.27 -0.04 0.29 0.00 -0.26 0.00 0.00 60.65 60.91 1de4 s ILE 274 Cb -0.12 -0.08 0.66 0.00 1.25 0.00 0.00 42.46 44.17 1de4 s ILE 274 CO 0.19 0.03 1.89 -2.67 0.24 0.00 0.00 174.94 174.62