#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1duy s SER 2 N 0.00 5.63 0.09 1.61 0.01 -1.26 -3.78 113.70 115.99 1duy s SER 2 Ca 0.00 1.74 -0.04 0.00 1.31 0.00 0.00 55.95 58.96 1duy s SER 2 Cb 0.00 -2.52 -0.02 0.00 0.21 0.00 0.00 66.02 63.69 1duy s SER 2 CO 0.00 -1.27 0.08 -1.00 0.41 0.00 0.00 173.24 171.46 1duy s HIS 3 N -2.68 0.45 0.13 2.43 3.76 -0.85 -4.95 115.29 113.57 1duy s HIS 3 Ca 0.61 -0.91 -0.10 0.00 -0.15 0.00 0.00 55.06 54.51 1duy s HIS 3 Cb -0.15 -0.27 0.00 0.00 1.11 0.00 0.00 32.58 33.27 1duy s HIS 3 CO 0.44 -0.49 0.28 -1.54 -0.85 0.00 0.00 174.74 172.58 1duy s SER 4 N -2.93 0.01 -0.03 1.40 1.04 -1.26 -0.37 113.70 111.57 1duy s SER 4 Ca 0.10 -0.67 0.01 0.00 0.48 0.00 0.00 55.95 55.87 1duy s SER 4 Cb 0.06 0.41 0.02 0.00 0.10 0.00 0.00 66.02 66.61 1duy s SER 4 CO -0.08 -0.83 -0.03 -0.32 0.98 0.00 0.00 173.24 172.97 1duy s MET 5 N -3.89 0.50 -0.00 4.02 1.75 -0.46 -0.60 119.30 120.61 1duy s MET 5 Ca 0.09 -0.04 -0.15 0.00 -1.25 0.00 0.00 55.69 54.34 1duy s MET 5 Cb 0.03 -0.58 0.02 0.00 2.84 0.00 0.00 34.83 37.15 1duy s MET 5 CO -0.07 -0.06 0.31 1.03 -0.65 0.00 0.00 175.02 175.58 1duy s ARG 6 N 0.73 0.70 -0.05 4.11 0.52 -0.42 -1.55 118.95 123.00 1duy s ARG 6 Ca -0.08 -0.24 0.06 0.00 -0.52 0.00 0.00 55.73 54.94 1duy s ARG 6 Cb -0.11 0.31 -0.01 0.00 0.52 0.00 0.00 34.95 35.65 1duy s ARG 6 CO -0.01 -0.20 -0.22 0.71 0.02 0.00 0.00 175.30 175.60 1duy s TYR 7 N -1.55 2.16 -0.06 -0.53 2.02 -0.29 -0.65 117.35 118.46 1duy s TYR 7 Ca -0.12 -0.60 0.05 0.00 -0.37 0.00 0.00 57.07 56.03 1duy s TYR 7 Cb -0.04 -1.42 -0.00 0.00 -0.40 0.00 0.00 41.96 40.09 1duy s TYR 7 CO 0.03 -0.17 -0.21 -0.06 -1.57 0.00 0.00 175.55 173.57 1duy s PHE 8 N -0.16 2.06 -0.08 2.71 0.08 -0.06 -2.39 117.98 120.15 1duy s PHE 8 Ca -0.02 -0.65 0.02 0.00 0.12 0.00 0.00 56.93 56.40 1duy s PHE 8 Cb -0.12 -1.38 0.02 0.00 -0.57 0.00 0.00 43.02 40.97 1duy s PHE 8 CO 0.03 -0.22 -0.11 -0.06 -0.10 0.00 0.00 175.22 174.75 1duy s PHE 9 N 0.04 1.49 -0.11 0.36 0.08 -0.08 -1.14 117.98 118.62 1duy s PHE 9 Ca -0.06 -0.61 0.01 0.00 0.12 0.00 0.00 56.93 56.39 1duy s PHE 9 Cb -0.13 -1.12 0.02 0.00 -0.57 0.00 0.00 43.02 41.21 1duy s PHE 9 CO 0.04 -0.35 -0.11 0.99 -0.10 0.00 0.00 175.22 175.70 1duy s THR 10 N 0.94 1.19 -0.10 0.64 2.01 0.61 -1.46 115.64 119.46 1duy s THR 10 Ca -0.09 -0.42 0.03 0.00 0.31 0.00 0.00 61.69 61.51 1duy s THR 10 Cb -0.15 -1.14 0.01 0.00 0.01 0.00 0.00 72.50 71.22 1duy s THR 10 CO 0.00 0.39 -0.20 -0.55 -0.69 0.00 0.00 174.62 173.57 1duy s SER 11 N 1.35 2.73 -0.10 3.53 0.15 -0.07 -1.16 113.70 120.13 1duy s SER 11 Ca -0.01 -0.49 0.01 0.00 0.70 0.00 0.00 55.95 56.15 1duy s SER 11 Cb -0.14 -1.25 0.02 0.00 -1.71 0.00 0.00 66.02 62.94 1duy s SER 11 CO -0.05 0.10 -0.10 -0.69 1.20 0.00 0.00 173.24 173.70 1duy s VAL 12 N 0.56 1.14 0.29 4.45 1.01 -0.39 -1.42 120.40 126.05 1duy s VAL 12 Ca -0.15 -0.41 -0.28 0.00 0.00 0.00 0.00 61.98 61.14 1duy s VAL 12 Cb -0.17 -1.10 -0.09 0.00 0.00 0.00 0.00 36.38 35.02 1duy s VAL 12 CO 0.05 0.38 1.01 -0.94 0.00 0.00 0.00 175.10 175.60 1duy s SER 13 N 1.28 7.36 -0.60 3.32 1.04 -0.85 -0.69 113.70 124.56 1duy s SER 13 Ca -0.02 2.06 0.05 0.00 0.48 0.00 0.00 55.95 58.52 1duy s SER 13 Cb -0.14 -2.61 0.20 0.00 0.10 0.00 0.00 66.02 63.57 1duy s SER 13 CO -0.04 -0.06 0.54 0.54 0.98 0.00 0.00 173.24 175.20 1duy n ARG 14 N 1.05 1.59 -1.67 4.02 1.74 -1.26 -4.17 116.66 117.95 1duy n ARG 14 Ca -0.00 -4.15 -0.54 0.00 -0.77 0.00 0.00 57.85 52.39 1duy n ARG 14 Cb 0.47 -2.04 -0.06 0.00 -1.02 0.00 0.00 32.46 29.81 1duy n ARG 14 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1duy n PRO 15 N 1.75 1.31 0.00 5.56 -0.02 -1.26 -0.23 135.00 142.11 1duy n PRO 15 Ca 0.25 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 1duy n PRO 15 Cb 0.41 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 1duy n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1duy n GLY 16 N 3.68 2.76 1.87 -1.23 0.00 -1.26 -4.78 105.19 106.22 1duy n GLY 16 Ca 0.23 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.19 1duy n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1duy n ARG 17 N -0.92 3.32 0.00 1.61 1.74 0.68 -5.05 116.66 118.03 1duy n ARG 17 Ca 0.00 -2.65 0.00 0.00 -0.77 0.00 0.00 57.85 54.43 1duy n ARG 17 Cb 0.00 -2.09 0.00 0.00 -1.02 0.00 0.00 32.46 29.35 1duy n ARG 17 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1duy n GLY 18 N -0.13 -1.30 3.76 -0.13 0.00 -1.16 -4.93 105.19 101.30 1duy n GLY 18 Ca 0.37 -1.72 -0.36 0.00 0.00 0.00 0.00 46.02 44.31 1duy n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1duy s GLU 19 N 0.00 3.20 0.49 1.61 0.41 -1.26 -4.47 118.70 118.68 1duy s GLU 19 Ca 0.00 1.79 -0.23 0.00 -0.41 0.00 0.00 54.97 56.12 1duy s GLU 19 Cb 0.00 -2.04 -0.06 0.00 -1.78 0.00 0.00 34.13 30.24 1duy s GLU 19 CO 0.00 -1.01 1.30 -1.25 -0.49 0.00 0.00 175.26 173.80 1duy s PRO 20 N -3.20 3.50 0.13 0.39 0.04 -1.26 -4.64 135.00 129.96 1duy s PRO 20 Ca 0.74 2.09 -0.30 0.00 0.04 0.00 0.00 61.00 63.57 1duy s PRO 20 Cb -0.29 -2.41 -0.07 0.00 0.04 0.00 0.00 34.50 31.77 1duy s PRO 20 CO 0.32 -0.85 1.22 0.50 0.04 0.00 0.00 177.00 178.23 1duy s ARG 21 N -2.70 4.45 -0.13 4.56 6.06 0.14 -4.82 118.95 126.50 1duy s ARG 21 Ca 0.66 1.86 0.01 0.00 -2.50 0.00 0.00 55.73 55.76 1duy s ARG 21 Cb -0.37 -3.28 0.02 0.00 0.06 0.00 0.00 34.95 31.38 1duy s ARG 21 CO 0.45 -0.19 -0.16 0.12 -2.50 0.00 0.00 175.30 173.01 1duy s PHE 22 N 0.51 2.23 -0.12 5.12 5.36 -1.26 -1.26 117.98 128.57 1duy s PHE 22 Ca 0.56 -1.17 0.00 0.00 -0.96 0.00 0.00 56.93 55.37 1duy s PHE 22 Cb -0.32 -1.60 0.02 0.00 -0.34 0.00 0.00 43.02 40.79 1duy s PHE 22 CO 0.33 -0.60 -0.11 0.42 -1.46 0.00 0.00 175.22 173.80 1duy s ILE 23 N 1.18 1.24 -0.06 3.12 1.01 -0.31 -1.01 121.20 126.37 1duy s ILE 23 Ca -0.01 -0.44 0.05 0.00 0.00 0.00 0.00 60.65 60.25 1duy s ILE 23 Cb -0.14 -1.20 -0.01 0.00 0.01 0.00 0.00 42.46 41.13 1duy s ILE 23 CO -0.06 0.40 -0.21 0.00 0.00 0.00 0.00 174.94 175.07 1duy s ALA 24 N 1.46 1.85 0.02 9.38 0.00 -0.48 -0.29 121.76 133.71 1duy s ALA 24 Ca 0.02 -0.86 0.00 0.00 0.00 0.00 0.00 51.96 51.12 1duy s ALA 24 Cb -0.13 -0.61 -0.02 0.00 0.00 0.00 0.00 23.12 22.36 1duy s ALA 24 CO -0.07 0.33 -0.04 0.14 0.00 0.00 0.00 175.76 176.12 1duy s VAL 25 N 0.02 0.16 -0.02 0.00 -7.23 -0.29 -0.72 120.40 112.32 1duy s VAL 25 Ca -0.06 -0.90 0.06 0.00 -1.81 0.00 0.00 61.98 59.27 1duy s VAL 25 Cb -0.13 -0.30 -0.01 0.00 0.56 0.00 0.00 36.38 36.50 1duy s VAL 25 CO 0.04 -0.47 -0.19 -0.83 -0.31 0.00 0.00 175.10 173.34 1duy s GLY 26 N -1.43 0.97 0.14 2.32 0.00 -0.82 -0.88 107.32 107.61 1duy s GLY 26 Ca -0.15 -0.82 0.08 0.00 0.00 0.00 0.00 44.72 43.84 1duy s GLY 26 CO -0.01 -0.61 -0.18 -0.19 0.00 0.00 0.00 173.10 172.11 1duy s TYR 27 N -0.31 1.74 -0.24 1.90 1.51 0.18 -0.12 117.35 122.01 1duy s TYR 27 Ca 0.04 -0.47 -0.01 0.00 -1.01 0.00 0.00 57.07 55.63 1duy s TYR 27 Cb -0.09 -0.90 0.07 0.00 -0.11 0.00 0.00 41.96 40.93 1duy s TYR 27 CO 0.00 0.26 0.01 0.08 -1.11 0.00 0.00 175.55 174.80 1duy s VAL 28 N -1.79 1.09 0.00 0.71 1.01 -0.38 -1.30 120.40 119.73 1duy s VAL 28 Ca 0.12 -1.09 0.00 0.00 0.00 0.00 0.00 61.98 61.01 1duy s VAL 28 Cb -0.07 -1.55 0.00 0.00 0.00 0.00 0.00 36.38 34.76 1duy s VAL 28 CO 0.05 -0.28 0.00 0.47 0.00 0.00 0.00 175.10 175.34 1duy n ASP 29 N 4.82 0.00 -1.26 3.32 8.00 0.23 -2.09 116.55 129.56 1duy n ASP 29 Ca -0.08 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.48 1duy n ASP 29 Cb 0.45 0.00 0.26 0.00 -0.02 0.00 0.00 41.12 41.80 1duy n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1duy n ASP 30 N 3.95 3.69 -4.36 -2.24 8.00 -1.26 -4.88 116.55 119.44 1duy n ASP 30 Ca 0.00 -2.40 -0.35 0.00 0.71 0.00 0.00 54.79 52.75 1duy n ASP 30 Cb 0.00 -0.52 -0.14 0.00 -0.02 0.00 0.00 41.12 40.44 1duy n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1duy s THR 31 N -1.87 3.59 0.32 -3.53 2.01 -0.89 -5.10 115.64 110.17 1duy s THR 31 Ca 0.36 -0.43 -0.28 0.00 0.31 0.00 0.00 61.69 61.66 1duy s THR 31 Cb 0.25 -2.63 -0.09 0.00 0.01 0.00 0.00 72.50 70.03 1duy s THR 31 CO 0.16 0.42 1.16 -1.58 -0.69 0.00 0.00 174.62 174.09 1duy s GLN 32 N 1.33 4.42 0.00 4.92 0.74 -1.26 -1.25 119.66 128.56 1duy s GLN 32 Ca 0.04 1.90 0.00 0.00 0.05 0.00 0.00 55.36 57.35 1duy s GLN 32 Cb -0.14 -3.02 0.00 0.00 1.10 0.00 0.00 33.01 30.95 1duy s GLN 32 CO -0.01 -0.02 0.00 1.97 -0.55 0.00 0.00 175.29 176.68 1duy n PHE 33 N 0.79 0.00 -3.84 1.67 -1.74 0.83 -4.17 117.46 110.99 1duy n PHE 33 Ca 0.01 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.80 1duy n PHE 33 Cb 0.45 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.38 1duy n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1duy s VAL 34 N -0.99 0.11 0.14 1.97 -7.23 -1.21 -0.78 120.40 112.41 1duy s VAL 34 Ca 0.00 -1.12 -0.20 0.00 -1.81 0.00 0.00 61.98 58.85 1duy s VAL 34 Cb 0.00 -1.44 0.05 0.00 0.56 0.00 0.00 36.38 35.56 1duy s VAL 34 CO 0.00 -0.50 0.51 0.00 -0.31 0.00 0.00 175.10 174.81 1duy s ARG 35 N -3.88 1.18 -0.10 4.82 1.70 -0.53 -1.95 118.95 120.20 1duy s ARG 35 Ca 0.08 -0.57 -0.06 0.00 -0.47 0.00 0.00 55.73 54.71 1duy s ARG 35 Cb 0.04 0.53 0.04 0.00 -0.57 0.00 0.00 34.95 34.99 1duy s ARG 35 CO -0.08 -0.49 0.24 0.12 -1.08 0.00 0.00 175.30 174.00 1duy s PHE 36 N -3.74 -0.30 -0.12 5.89 5.36 0.11 -0.15 117.98 125.04 1duy s PHE 36 Ca 0.02 0.72 -0.02 0.00 -0.96 0.00 0.00 56.93 56.69 1duy s PHE 36 Cb 0.00 0.06 0.04 0.00 -0.34 0.00 0.00 43.02 42.78 1duy s PHE 36 CO -0.12 -0.19 0.02 0.34 -1.46 0.00 0.00 175.22 173.80 1duy s ASP 37 N 0.87 2.05 0.51 6.13 2.15 -1.26 -1.38 116.67 125.75 1duy s ASP 37 Ca -0.06 -0.35 0.30 0.00 0.43 0.00 0.00 52.55 52.87 1duy s ASP 37 Cb -0.07 -0.48 1.41 0.00 -0.30 0.00 0.00 42.92 43.48 1duy s ASP 37 CO -0.05 -0.24 1.86 0.77 -0.17 0.00 0.00 175.17 177.33 1duy h SER 38 N 8.31 0.10 0.23 -0.34 4.64 -1.46 0.19 113.55 125.21 1duy h SER 38 Ca -0.18 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 1duy h SER 38 Cb 1.12 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1duy h SER 38 CO 0.29 0.03 -0.19 0.47 -0.87 0.00 0.00 176.83 176.56 1duy n ASP 39 N -4.32 0.95 -4.85 4.97 9.92 -1.26 -4.89 116.55 117.07 1duy n ASP 39 Ca 0.21 -0.90 -0.31 0.00 -0.53 0.00 0.00 54.79 53.26 1duy n ASP 39 Cb 0.98 0.07 0.04 0.00 -0.64 0.00 0.00 41.12 41.57 1duy n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1duy s ALA 40 N -2.42 2.85 0.16 2.24 0.00 0.68 -4.99 121.76 120.27 1duy s ALA 40 Ca 0.27 -0.14 0.05 0.00 0.00 0.00 0.00 51.96 52.15 1duy s ALA 40 Cb 0.20 -3.09 -0.04 0.00 0.00 0.00 0.00 23.12 20.19 1duy s ALA 40 CO 0.48 -1.06 1.36 0.00 0.00 0.00 0.00 175.76 176.55 1duy h ALA 41 N -0.59 0.51 -0.38 0.00 0.00 -1.90 -3.35 119.26 113.55 1duy h ALA 41 Ca -0.45 -0.78 -0.02 0.00 0.00 0.00 0.00 54.91 53.66 1duy h ALA 41 Cb 1.22 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1duy h ALA 41 CO 0.61 1.02 0.15 0.66 0.00 0.00 0.00 179.25 181.69 1duy h SER 42 N 0.04 0.52 -1.12 0.00 4.64 -1.94 -3.46 113.55 112.24 1duy h SER 42 Ca -0.03 -0.17 -0.19 0.00 -0.47 0.00 0.00 61.79 60.93 1duy h SER 42 Cb 1.57 -0.14 -0.03 0.00 -0.31 0.00 0.00 62.40 63.49 1duy h SER 42 CO 0.13 0.55 -0.23 0.00 -0.87 0.00 0.00 176.83 176.41 1duy n GLN 43 N -4.66 -0.74 -4.30 4.77 1.13 -1.26 -5.00 117.38 107.32 1duy n GLN 43 Ca -0.01 0.57 -0.16 0.00 -1.94 0.00 0.00 57.00 55.46 1duy n GLN 43 Cb 0.14 -4.57 -0.10 0.00 0.11 0.00 0.00 30.24 25.83 1duy n GLN 43 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1duy s ARG 44 N -4.02 1.23 0.22 -1.09 0.52 -1.26 -5.03 118.95 109.52 1duy s ARG 44 Ca 0.00 -1.57 -0.30 0.00 -0.52 0.00 0.00 55.73 53.34 1duy s ARG 44 Cb 0.00 -0.72 -0.08 0.00 0.52 0.00 0.00 34.95 34.67 1duy s ARG 44 CO 0.00 0.02 1.12 1.41 0.02 0.00 0.00 175.30 177.87 1duy s MET 45 N -3.77 4.59 0.03 3.54 -2.45 -1.26 -4.64 119.30 115.34 1duy s MET 45 Ca 0.23 1.78 0.08 0.00 -1.25 0.00 0.00 55.69 56.52 1duy s MET 45 Cb 0.03 -3.24 -0.02 0.00 1.25 0.00 0.00 34.83 32.85 1duy s MET 45 CO 0.05 0.10 -0.22 -1.21 1.05 0.00 0.00 175.02 174.79 1duy s GLU 46 N -0.78 1.56 0.47 4.11 2.02 0.79 -4.92 118.70 121.95 1duy s GLU 46 Ca 0.48 -0.95 -0.21 0.00 0.02 0.00 0.00 54.97 54.31 1duy s GLU 46 Cb -0.31 -1.66 -0.08 0.00 0.10 0.00 0.00 34.13 32.19 1duy s GLU 46 CO 0.38 0.43 1.08 -1.25 0.02 0.00 0.00 175.26 175.92 1duy s PRO 47 N -1.06 3.78 0.00 0.39 0.04 -1.26 -1.45 135.00 135.44 1duy s PRO 47 Ca 0.09 1.53 0.00 0.00 0.04 0.00 0.00 61.00 62.65 1duy s PRO 47 Cb -0.09 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.22 1duy s PRO 47 CO 0.01 -0.48 0.37 0.54 0.04 0.00 0.00 177.00 177.49 1duy n ARG 48 N -0.75 0.23 -4.02 4.56 5.12 0.04 -4.86 116.66 116.98 1duy n ARG 48 Ca 0.08 -0.44 -0.14 0.00 -1.93 0.00 0.00 57.85 55.42 1duy n ARG 48 Cb 0.51 -0.66 -0.14 0.00 -1.16 0.00 0.00 32.46 31.01 1duy n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1duy s ALA 49 N -0.14 0.23 0.23 7.54 0.00 -1.23 -4.70 121.76 123.70 1duy s ALA 49 Ca 0.00 -0.12 -0.07 0.00 0.00 0.00 0.00 51.96 51.77 1duy s ALA 49 Cb 0.00 -0.06 0.39 0.00 0.00 0.00 0.00 23.12 23.44 1duy s ALA 49 CO 0.00 0.05 1.68 -1.35 0.00 0.00 0.00 175.76 176.14 1duy h PRO 50 N 6.10 0.21 -0.05 0.00 0.11 -1.94 -2.62 132.00 133.81 1duy h PRO 50 Ca -0.26 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1duy h PRO 50 Cb 1.20 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1duy h PRO 50 CO 0.51 0.14 0.00 -2.67 -0.21 0.00 0.00 178.00 175.76 1duy n TRP 51 N -5.20 0.00 -0.01 0.65 4.27 -1.26 -2.36 117.44 113.54 1duy n TRP 51 Ca 0.12 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.73 1duy n TRP 51 Cb 0.41 -0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.35 1duy n TRP 51 CO 0.00 0.00 0.00 1.51 -2.29 0.00 0.00 177.69 176.91 1duy n ILE 52 N -0.45 0.00 -0.05 -1.67 0.13 -0.99 -4.67 119.36 111.65 1duy n ILE 52 Ca 0.00 -0.35 0.06 0.00 -1.10 0.00 0.00 62.75 61.37 1duy n ILE 52 Cb 0.01 1.01 0.43 0.00 -0.84 0.00 0.00 39.64 40.25 1duy n ILE 52 CO 0.00 0.00 0.00 -0.33 2.80 0.00 0.00 176.55 179.02 1duy h GLU 53 N 0.00 0.54 -0.22 9.51 5.08 -1.46 -2.58 114.58 125.45 1duy h GLU 53 Ca 0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1duy h GLU 53 Cb 0.01 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.13 1duy h GLU 53 CO 0.00 0.36 0.00 1.04 -1.00 0.00 0.00 179.01 179.41 1duy n GLN 54 N -4.47 1.61 -2.07 2.33 1.13 -1.26 -4.85 117.38 109.78 1duy n GLN 54 Ca 0.06 -0.93 -0.41 0.00 -1.94 0.00 0.00 57.00 53.78 1duy n GLN 54 Cb 0.17 -1.28 -0.02 0.00 0.11 0.00 0.00 30.24 29.22 1duy n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1duy s GLU 55 N -1.72 4.32 0.30 -1.09 0.41 -0.98 -4.98 118.70 114.97 1duy s GLU 55 Ca 0.24 2.25 -0.05 0.00 -0.41 0.00 0.00 54.97 57.00 1duy s GLU 55 Cb 0.12 -3.09 0.08 0.00 -1.78 0.00 0.00 34.13 29.46 1duy s GLU 55 CO 0.18 -0.28 0.23 0.41 -0.49 0.00 0.00 175.26 175.30 1duy n GLY 56 N 1.35 -3.01 0.20 -1.39 0.00 -1.26 -4.78 105.19 96.30 1duy n GLY 56 Ca 0.03 -1.38 0.04 0.00 0.00 0.00 0.00 46.02 44.71 1duy n GLY 56 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1duy h PRO 57 N 0.00 0.00 -0.23 1.61 0.13 -1.98 -2.99 132.00 128.53 1duy h PRO 57 Ca -0.09 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.08 1duy h PRO 57 Cb 0.29 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.38 1duy h PRO 57 CO 0.06 0.30 0.00 1.49 -0.23 0.00 0.00 178.00 179.61 1duy h GLU 58 N 0.00 0.07 0.39 0.86 4.22 -1.99 0.13 114.58 118.26 1duy h GLU 58 Ca -0.00 -0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.41 1duy h GLU 58 Cb 0.55 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1duy h GLU 58 CO 0.04 0.05 -0.19 -0.92 -2.18 0.00 0.00 179.01 175.81 1duy h TYR 59 N 0.07 -0.49 -0.82 0.92 3.20 -1.88 -0.87 116.97 117.10 1duy h TYR 59 Ca 0.11 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.99 1duy h TYR 59 Cb 0.14 0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.53 1duy h TYR 59 CO -0.19 -0.27 0.54 -1.49 -1.64 0.00 0.00 178.16 175.12 1duy h TRP 60 N -0.59 1.01 -0.27 -3.82 4.06 -1.35 -0.66 115.95 114.33 1duy h TRP 60 Ca -0.05 0.02 -0.11 0.00 2.06 0.00 0.00 58.89 60.81 1duy h TRP 60 Cb 0.44 -0.34 -0.00 0.00 -1.00 0.00 0.00 29.16 28.25 1duy h TRP 60 CO -0.03 0.62 -0.24 -0.44 -3.56 0.00 0.00 178.44 174.78 1duy h ASP 61 N 1.07 0.68 -0.21 -3.49 3.32 -0.70 -1.75 116.42 115.34 1duy h ASP 61 Ca 0.31 -0.46 -0.00 0.00 0.02 0.00 0.00 57.03 56.90 1duy h ASP 61 Cb -0.06 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.29 1duy h ASP 61 CO -0.08 1.00 0.13 1.23 -1.72 0.00 0.00 179.24 179.81 1duy h GLY 62 N 0.37 0.31 1.63 2.75 0.00 -0.71 -0.33 103.07 107.08 1duy h GLY 62 Ca 0.05 -0.13 -0.08 0.00 0.00 0.00 0.00 47.33 47.17 1duy h GLY 62 CO 0.06 0.12 -0.19 0.83 0.00 0.00 0.00 176.54 177.36 1duy h GLU 63 N 0.26 0.44 -0.48 4.80 4.39 -1.17 -1.92 114.58 120.92 1duy h GLU 63 Ca 0.08 -0.14 -0.11 0.00 0.34 0.00 0.00 59.36 59.52 1duy h GLU 63 Cb 0.01 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 1duy h GLU 63 CO -0.01 0.62 -0.13 1.15 -1.16 0.00 0.00 179.01 179.47 1duy h THR 64 N 0.40 1.27 0.60 1.13 2.02 -0.95 0.70 112.91 118.08 1duy h THR 64 Ca 0.07 -1.25 -0.03 0.00 0.77 0.00 0.00 66.41 65.96 1duy h THR 64 Cb 0.57 1.04 0.01 0.00 -1.74 0.00 0.00 68.15 68.03 1duy h THR 64 CO 0.04 0.43 -0.29 -0.09 0.37 0.00 0.00 175.52 175.98 1duy h ARG 65 N 0.80 -0.78 -1.01 6.66 2.43 -0.66 -2.27 114.38 119.55 1duy h ARG 65 Ca 0.12 0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.39 1duy h ARG 65 Cb 0.66 0.18 -0.06 0.00 -0.42 0.00 0.00 29.97 30.33 1duy h ARG 65 CO 0.05 -0.48 0.66 0.87 -1.51 0.00 0.00 179.97 179.56 1duy h LYS 66 N -0.94 1.22 -0.46 0.20 1.57 -1.29 -1.94 116.57 114.94 1duy h LYS 66 Ca -0.08 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.52 1duy h LYS 66 Cb 0.66 -0.28 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 1duy h LYS 66 CO 0.14 0.81 -0.14 -0.24 -0.57 0.00 0.00 179.45 179.44 1duy h VAL 67 N 1.26 1.26 -0.26 0.50 3.04 -0.82 -0.38 116.25 120.85 1duy h VAL 67 Ca 0.41 -1.24 -0.07 0.00 -1.01 0.00 0.00 66.70 64.78 1duy h VAL 67 Cb 0.03 1.06 -0.01 0.00 -2.01 0.00 0.00 31.29 30.36 1duy h VAL 67 CO -0.14 0.43 -0.16 0.11 -1.01 0.00 0.00 177.57 176.80 1duy h LYS 68 N 0.76 0.45 -0.14 4.17 1.57 -1.12 -0.99 116.57 121.28 1duy h LYS 68 Ca 0.12 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1duy h LYS 68 Cb 0.66 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 1duy h LYS 68 CO 0.05 0.60 0.07 0.00 -0.57 0.00 0.00 179.45 179.60 1duy h ALA 69 N 1.42 0.18 -0.61 3.86 0.00 -0.72 -0.76 119.26 122.63 1duy h ALA 69 Ca 0.07 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.98 1duy h ALA 69 Cb 0.52 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 1duy h ALA 69 CO 0.03 -0.28 0.32 0.45 0.00 0.00 0.00 179.25 179.77 1duy h HIS 70 N 0.12 0.58 -0.16 0.00 3.86 -0.69 -1.30 115.15 117.56 1duy h HIS 70 Ca 0.05 0.02 0.05 0.00 -1.16 0.00 0.00 60.37 59.33 1duy h HIS 70 Cb 0.09 -0.17 -0.06 0.00 1.06 0.00 0.00 27.41 28.33 1duy h HIS 70 CO -0.04 0.26 -0.24 1.03 0.86 0.00 0.00 177.93 179.81 1duy h SER 71 N 0.59 -0.75 -0.55 2.45 0.87 -0.89 -1.04 113.55 114.24 1duy h SER 71 Ca 0.28 0.12 -0.04 0.00 -1.23 0.00 0.00 61.79 60.92 1duy h SER 71 Cb 0.20 0.34 -0.02 0.00 -0.44 0.00 0.00 62.40 62.47 1duy h SER 71 CO -0.19 -0.29 0.19 1.56 -0.53 0.00 0.00 176.83 177.58 1duy h GLN 72 N -0.29 0.83 -0.49 2.24 1.08 -0.47 -2.02 115.11 116.00 1duy h GLN 72 Ca 0.11 -0.17 -0.00 0.00 -1.45 0.00 0.00 58.65 57.14 1duy h GLN 72 Cb 0.45 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 27.73 1duy h GLN 72 CO -0.33 0.74 0.29 1.79 -0.95 0.00 0.00 178.83 180.38 1duy h THR 73 N 0.75 1.14 -0.11 -0.54 1.35 -0.88 -0.53 112.91 114.10 1duy h THR 73 Ca 0.18 -0.33 -0.07 0.00 -0.55 0.00 0.00 66.41 65.64 1duy h THR 73 Cb 0.24 0.46 -0.01 0.00 -1.73 0.00 0.00 68.15 67.11 1duy h THR 73 CO -0.01 0.15 -0.24 0.45 -0.25 0.00 0.00 175.52 175.63 1duy h HIS 74 N 0.67 0.21 -0.01 4.73 3.86 -0.58 0.26 115.15 124.30 1duy h HIS 74 Ca 0.18 -0.03 -0.16 0.00 -1.16 0.00 0.00 60.37 59.19 1duy h HIS 74 Cb -0.01 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 28.38 1duy h HIS 74 CO 0.00 0.43 -0.73 0.07 0.86 0.00 0.00 177.93 178.56 1duy h ARG 75 N 0.18 0.07 -0.12 2.45 0.11 -0.43 -1.23 114.38 115.41 1duy h ARG 75 Ca 0.03 -0.07 -0.20 0.00 0.10 0.00 0.00 59.98 59.84 1duy h ARG 75 Cb 0.52 0.02 0.00 0.00 1.11 0.00 0.00 29.97 31.62 1duy h ARG 75 CO 0.04 0.77 -0.74 0.28 0.10 0.00 0.00 179.97 180.41 1duy h VAL 76 N 0.05 1.33 -0.29 0.08 2.07 -0.96 -3.20 116.25 115.33 1duy h VAL 76 Ca -0.01 -2.04 0.07 0.00 0.82 0.00 0.00 66.70 65.53 1duy h VAL 76 Cb 1.28 2.03 -0.07 0.00 -1.52 0.00 0.00 31.29 33.02 1duy h VAL 76 CO 0.10 0.63 -0.15 0.44 0.02 0.00 0.00 177.57 178.61 1duy h ASP 77 N 0.41 -0.51 -0.96 0.57 3.32 0.00 -1.12 116.42 118.14 1duy h ASP 77 Ca -0.04 0.12 0.21 0.00 0.02 0.00 0.00 57.03 57.34 1duy h ASP 77 Cb 1.34 0.28 -0.08 0.00 0.22 0.00 0.00 39.33 41.09 1duy h ASP 77 CO 0.14 -0.19 0.62 -0.07 -1.72 0.00 0.00 179.24 178.02 1duy h LEU 78 N -0.12 0.50 0.57 1.55 3.38 -1.24 -0.91 115.31 119.05 1duy h LEU 78 Ca 0.15 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.16 1duy h LEU 78 Cb 0.35 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.08 1duy h LEU 78 CO -0.36 0.18 -0.27 1.23 0.09 0.00 0.00 178.44 179.30 1duy h GLY 79 N 0.49 -0.79 -0.64 0.83 0.00 -1.28 -2.55 103.07 99.13 1duy h GLY 79 Ca 0.52 0.29 0.16 0.00 0.00 0.00 0.00 47.33 48.31 1duy h GLY 79 CO -0.25 -0.29 -0.21 -0.84 0.00 0.00 0.00 176.54 174.96 1duy h THR 80 N -1.19 0.18 -0.73 4.70 2.02 -0.40 0.15 112.91 117.64 1duy h THR 80 Ca -0.08 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.04 1duy h THR 80 Cb 0.58 0.18 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 1duy h THR 80 CO 0.13 0.00 0.21 -0.07 0.37 0.00 0.00 175.52 176.15 1duy h LEU 81 N -0.00 1.07 -1.28 2.58 3.38 -1.29 0.34 115.31 120.12 1duy h LEU 81 Ca 0.39 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1duy h LEU 81 Cb 0.60 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 1duy h LEU 81 CO -0.84 1.01 0.43 -0.09 0.09 0.00 0.00 178.44 179.04 1duy h ARG 82 N 1.09 0.92 -0.09 1.13 2.43 -0.61 -1.40 114.38 117.85 1duy h ARG 82 Ca 0.23 -0.07 -0.12 0.00 -0.81 0.00 0.00 59.98 59.22 1duy h ARG 82 Cb 0.33 -0.20 0.01 0.00 -0.42 0.00 0.00 29.97 29.69 1duy h ARG 82 CO -0.00 0.63 -0.41 0.78 -1.51 0.00 0.00 179.97 179.46 1duy h GLY 83 N 0.96 0.48 1.74 2.80 0.00 -0.09 0.26 103.07 109.22 1duy h GLY 83 Ca 0.25 -0.67 0.01 0.00 0.00 0.00 0.00 47.33 46.92 1duy h GLY 83 CO -0.05 0.60 0.16 -0.97 0.00 0.00 0.00 176.54 176.27 1duy h TYR 84 N -0.00 0.27 -0.62 5.60 0.05 0.11 -1.61 116.97 120.77 1duy h TYR 84 Ca -0.02 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.76 1duy h TYR 84 Cb 1.05 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.70 1duy h TYR 84 CO 0.12 0.17 0.00 0.66 -1.05 0.00 0.00 178.16 178.06 1duy n TYR 85 N -4.50 0.82 -3.83 4.88 4.01 -0.57 -4.88 117.16 113.09 1duy n TYR 85 Ca 0.01 -0.47 -0.33 0.00 -0.16 0.00 0.00 57.90 56.95 1duy n TYR 85 Cb 0.10 -0.01 0.02 0.00 -0.31 0.00 0.00 39.34 39.14 1duy n TYR 85 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1duy n ASN 86 N 1.40 -3.81 -4.83 7.72 5.15 -0.61 -4.93 115.26 115.34 1duy n ASN 86 Ca 0.21 -1.07 -0.26 0.00 -0.60 0.00 0.00 54.58 52.86 1duy n ASN 86 Cb 0.58 -2.96 -0.05 0.00 -0.53 0.00 0.00 39.78 36.82 1duy n ASN 86 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1duy s GLN 87 N -6.41 3.01 0.46 1.20 -0.21 0.84 -5.03 119.66 113.51 1duy s GLN 87 Ca 0.36 -0.84 -0.24 0.00 0.02 0.00 0.00 55.36 54.65 1duy s GLN 87 Cb -0.15 -2.70 -0.07 0.00 1.00 0.00 0.00 33.01 31.09 1duy s GLN 87 CO 0.89 0.48 1.33 0.45 -2.12 0.00 0.00 175.29 176.32 1duy s SER 88 N -3.23 5.94 0.38 5.90 0.15 -1.26 -4.82 113.70 116.77 1duy s SER 88 Ca 0.32 2.70 0.28 0.00 0.70 0.00 0.00 55.95 59.95 1duy s SER 88 Cb -0.10 -2.64 1.11 0.00 -1.71 0.00 0.00 66.02 62.69 1duy s SER 88 CO 0.25 -1.11 1.83 -0.08 1.20 0.00 0.00 173.24 175.32 1duy h GLU 89 N 2.22 0.00 0.00 5.44 4.57 -1.98 -3.24 114.58 121.59 1duy h GLU 89 Ca -0.50 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 57.66 1duy h GLU 89 Cb 1.26 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.85 1duy h GLU 89 CO 0.61 0.00 -0.66 0.00 -1.18 0.00 0.00 179.01 177.77 1duy h ALA 90 N 2.16 0.69 -2.32 2.92 0.00 -1.99 -3.45 119.26 117.28 1duy h ALA 90 Ca 0.00 -0.10 -0.50 0.00 0.00 0.00 0.00 54.91 54.31 1duy h ALA 90 Cb 0.47 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.29 1duy h ALA 90 CO 0.00 0.12 0.11 0.20 0.00 0.00 0.00 179.25 179.68 1duy s GLY 91 N -4.35 1.83 0.01 0.00 0.00 -1.22 -4.78 107.32 98.80 1duy s GLY 91 Ca 0.02 -0.29 -0.18 0.00 0.00 0.00 0.00 44.72 44.27 1duy s GLY 91 CO 0.75 -0.11 0.51 -0.45 0.00 0.00 0.00 173.10 173.80 1duy s SER 92 N -3.40 6.93 0.14 1.64 0.15 -1.26 -4.78 113.70 113.12 1duy s SER 92 Ca 0.50 1.10 0.05 0.00 0.70 0.00 0.00 55.95 58.30 1duy s SER 92 Cb -0.10 -2.32 -0.04 0.00 -1.71 0.00 0.00 66.02 61.85 1duy s SER 92 CO 0.35 0.22 -0.12 -1.00 1.20 0.00 0.00 173.24 173.89 1duy s HIS 93 N -0.72 1.35 -0.10 3.44 3.76 -1.26 -4.95 115.29 116.82 1duy s HIS 93 Ca 0.27 -0.65 0.03 0.00 -0.15 0.00 0.00 55.06 54.56 1duy s HIS 93 Cb -0.18 -0.69 0.01 0.00 1.11 0.00 0.00 32.58 32.83 1duy s HIS 93 CO 0.16 0.14 -0.19 0.99 -0.85 0.00 0.00 174.74 174.98 1duy s THR 94 N -2.79 1.75 -0.11 1.30 2.01 -1.26 -2.02 115.64 114.53 1duy s THR 94 Ca 0.14 -0.82 0.01 0.00 0.31 0.00 0.00 61.69 61.33 1duy s THR 94 Cb -0.01 -1.55 -0.01 0.00 0.01 0.00 0.00 72.50 70.94 1duy s THR 94 CO 0.02 0.49 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.60 1duy s VAL 95 N 0.65 2.90 0.01 3.82 1.01 -0.51 0.95 120.40 129.23 1duy s VAL 95 Ca -0.13 -0.73 0.04 0.00 0.00 0.00 0.00 61.98 61.17 1duy s VAL 95 Cb -0.16 -2.19 -0.01 0.00 0.00 0.00 0.00 36.38 34.01 1duy s VAL 95 CO 0.03 0.54 -0.13 -1.10 0.00 0.00 0.00 175.10 174.44 1duy s GLN 96 N 0.16 1.00 -0.02 2.72 -0.21 -0.37 -0.89 119.66 122.04 1duy s GLN 96 Ca -0.08 -0.56 -0.01 0.00 0.02 0.00 0.00 55.36 54.73 1duy s GLN 96 Cb -0.15 -0.98 0.02 0.00 1.00 0.00 0.00 33.01 32.90 1duy s GLN 96 CO 0.05 0.26 0.05 0.50 -2.12 0.00 0.00 175.29 174.03 1duy s ARG 97 N -0.58 0.02 0.01 2.91 3.52 -0.53 -0.52 118.95 123.77 1duy s ARG 97 Ca 0.04 0.15 0.02 0.00 -0.13 0.00 0.00 55.73 55.81 1duy s ARG 97 Cb -0.06 -0.11 -0.01 0.00 -1.56 0.00 0.00 34.95 33.21 1duy s ARG 97 CO 0.00 -0.09 -0.07 1.41 -0.81 0.00 0.00 175.30 175.74 1duy s MET 98 N 0.60 0.50 -0.04 5.12 -2.45 -0.64 -0.90 119.30 121.48 1duy s MET 98 Ca -0.05 -0.36 -0.28 0.00 -1.25 0.00 0.00 55.69 53.75 1duy s MET 98 Cb -0.07 -0.43 0.06 0.00 1.25 0.00 0.00 34.83 35.65 1duy s MET 98 CO -0.02 0.11 0.61 1.52 1.05 0.00 0.00 175.02 178.29 1duy s TYR 99 N -0.46 -0.57 -2.49 4.11 -0.85 -1.00 -1.43 117.35 114.65 1duy s TYR 99 Ca -0.01 0.96 0.00 0.00 -0.52 0.00 0.00 57.07 57.51 1duy s TYR 99 Cb -0.04 0.36 0.00 0.00 0.38 0.00 0.00 41.96 42.65 1duy s TYR 99 CO -0.00 -0.58 0.00 0.41 -1.52 0.00 0.00 175.55 173.86 1duy n GLY 100 N 0.95 -1.52 3.12 5.49 0.00 -1.07 -1.13 105.19 111.02 1duy n GLY 100 Ca -0.19 -1.06 -0.12 0.00 0.00 0.00 0.00 46.02 44.65 1duy n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1duy s ASP 102 N -2.38 3.51 0.24 0.00 1.01 -0.11 -1.36 116.67 117.58 1duy s ASP 102 Ca 0.02 -0.38 0.09 0.00 0.71 0.00 0.00 52.55 52.99 1duy s ASP 102 Cb -0.02 -0.87 -0.05 0.00 1.01 0.00 0.00 42.92 42.99 1duy s ASP 102 CO -0.03 0.28 -0.15 0.68 0.21 0.00 0.00 175.17 176.16 1duy s VAL 103 N -0.35 1.97 0.00 -1.27 -7.23 0.50 -0.86 120.40 113.16 1duy s VAL 103 Ca 0.02 -2.27 0.00 0.00 -1.81 0.00 0.00 61.98 57.93 1duy s VAL 103 Cb -0.12 -2.17 0.00 0.00 0.56 0.00 0.00 36.38 34.65 1duy s VAL 103 CO 0.02 -0.50 0.00 0.61 -0.31 0.00 0.00 175.10 174.92 1duy n GLY 104 N -0.48 -0.26 0.23 2.32 0.00 -0.52 -2.01 105.19 104.47 1duy n GLY 104 Ca -0.07 -1.72 0.15 0.00 0.00 0.00 0.00 46.02 44.39 1duy n GLY 104 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1duy h SER 105 N 0.00 0.00 -0.26 1.61 0.87 -1.91 -2.38 113.55 111.48 1duy h SER 105 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1duy h SER 105 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1duy h SER 105 CO 0.00 0.00 0.00 -0.90 -0.53 0.00 0.00 176.83 175.40 1duy n ASP 106 N -2.82 2.12 -0.81 6.23 5.68 -1.26 -4.88 116.55 120.81 1duy n ASP 106 Ca 0.01 -1.83 -0.11 0.00 -0.50 0.00 0.00 54.79 52.37 1duy n ASP 106 Cb 0.30 -0.17 -0.05 0.00 -1.14 0.00 0.00 41.12 40.06 1duy n ASP 106 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 1duy n TRP 107 N 0.62 0.00 -3.71 2.11 7.02 -0.90 -4.99 117.44 117.59 1duy n TRP 107 Ca 0.16 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.31 1duy n TRP 107 Cb 0.38 -2.22 -0.05 0.00 -2.42 0.00 0.00 31.31 27.01 1duy n TRP 107 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1duy s ARG 108 N -2.73 3.61 0.28 -0.99 0.52 -1.26 -4.78 118.95 113.61 1duy s ARG 108 Ca 0.00 -0.06 -0.28 0.00 -0.52 0.00 0.00 55.73 54.87 1duy s ARG 108 Cb 0.00 -2.99 -0.14 0.00 0.52 0.00 0.00 34.95 32.34 1duy s ARG 108 CO 0.00 0.57 0.93 0.34 0.02 0.00 0.00 175.30 177.16 1duy n PHE 109 N 0.67 0.99 0.00 -0.53 7.35 -1.26 -1.44 117.46 123.25 1duy n PHE 109 Ca -0.07 0.74 0.00 0.00 -0.76 0.00 0.00 57.45 57.36 1duy n PHE 109 Cb 0.52 -2.20 0.00 0.00 0.35 0.00 0.00 39.48 38.15 1duy n PHE 109 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 1duy n LEU 110 N 1.32 0.92 -3.52 -2.13 7.94 -0.04 -4.77 117.00 116.73 1duy n LEU 110 Ca 0.11 0.00 -0.17 0.00 -1.11 0.00 0.00 56.01 54.84 1duy n LEU 110 Cb 0.31 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.21 1duy n LEU 110 CO 0.59 0.06 0.42 -0.60 -1.11 0.00 0.00 177.39 176.75 1duy s ARG 111 N -1.71 1.07 0.19 1.96 3.52 -1.18 -5.00 118.95 117.79 1duy s ARG 111 Ca 0.00 0.16 0.06 0.00 -0.13 0.00 0.00 55.73 55.83 1duy s ARG 111 Cb 0.00 0.50 -0.05 0.00 -1.56 0.00 0.00 34.95 33.85 1duy s ARG 111 CO 0.00 -0.35 -0.12 0.20 -0.81 0.00 0.00 175.30 174.22 1duy s GLY 112 N -1.37 1.33 0.04 8.12 0.00 -1.26 -0.94 107.32 113.24 1duy s GLY 112 Ca -0.10 -1.62 -0.06 0.00 0.00 0.00 0.00 44.72 42.94 1duy s GLY 112 CO 0.07 -1.70 0.11 -0.19 0.00 0.00 0.00 173.10 171.39 1duy s TYR 113 N -3.11 0.18 -0.30 1.90 1.51 -0.15 -4.85 117.35 112.53 1duy s TYR 113 Ca 0.21 -0.46 -0.05 0.00 -1.01 0.00 0.00 57.07 55.76 1duy s TYR 113 Cb 0.01 -0.13 0.19 0.00 -0.11 0.00 0.00 41.96 41.92 1duy s TYR 113 CO 0.05 -0.37 0.87 -1.58 -1.11 0.00 0.00 175.55 173.42 1duy s HIS 114 N -2.53 -1.00 -0.03 2.71 2.46 -1.25 -2.61 115.29 113.05 1duy s HIS 114 Ca -0.06 0.64 -0.11 0.00 0.47 0.00 0.00 55.06 56.01 1duy s HIS 114 Cb -0.02 0.19 0.02 0.00 -0.13 0.00 0.00 32.58 32.64 1duy s HIS 114 CO -0.04 -0.58 0.23 1.14 -2.47 0.00 0.00 174.74 173.02 1duy s GLN 115 N 2.91 0.52 0.35 2.88 -2.07 -0.51 -1.22 119.66 122.51 1duy s GLN 115 Ca 0.19 -0.16 0.09 0.00 -1.82 0.00 0.00 55.36 53.66 1duy s GLN 115 Cb -0.06 0.23 -0.05 0.00 -1.09 0.00 0.00 33.01 32.04 1duy s GLN 115 CO -0.23 -0.13 0.04 0.71 -1.32 0.00 0.00 175.29 174.36 1duy s TYR 116 N -1.04 2.56 -0.07 9.60 1.51 0.88 -1.61 117.35 129.18 1duy s TYR 116 Ca -0.11 -0.45 -0.06 0.00 -1.01 0.00 0.00 57.07 55.43 1duy s TYR 116 Cb -0.05 -1.55 0.02 0.00 -0.11 0.00 0.00 41.96 40.27 1duy s TYR 116 CO 0.02 0.44 0.19 0.00 -1.11 0.00 0.00 175.55 175.10 1duy s ALA 117 N -2.52 -0.47 -0.11 3.71 0.00 0.32 -1.86 121.76 120.83 1duy s ALA 117 Ca 0.35 0.58 0.03 0.00 0.00 0.00 0.00 51.96 52.92 1duy s ALA 117 Cb 0.00 -0.35 -0.00 0.00 0.00 0.00 0.00 23.12 22.78 1duy s ALA 117 CO 0.20 -0.10 -0.20 -0.47 0.00 0.00 0.00 175.76 175.18 1duy s TYR 118 N 0.25 2.65 -1.70 0.00 5.04 -0.78 -1.24 117.35 121.57 1duy s TYR 118 Ca -0.01 -0.94 -0.17 0.00 -2.44 0.00 0.00 57.07 53.50 1duy s TYR 118 Cb -0.03 -1.76 0.15 0.00 0.35 0.00 0.00 41.96 40.67 1duy s TYR 118 CO -0.01 -0.37 0.73 -0.25 -1.34 0.00 0.00 175.55 174.31 1duy n ASP 119 N 3.57 -2.86 0.00 4.32 8.00 0.27 -1.75 116.55 128.10 1duy n ASP 119 Ca -0.19 -1.04 0.00 0.00 0.71 0.00 0.00 54.79 54.27 1duy n ASP 119 Cb 0.53 -2.64 0.00 0.00 -0.02 0.00 0.00 41.12 38.98 1duy n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1duy n GLY 120 N -1.44 1.20 3.29 0.44 0.00 -1.26 -4.99 105.19 102.43 1duy n GLY 120 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 1duy n GLY 120 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1duy s LYS 121 N -0.38 1.61 0.17 1.61 -2.85 -0.72 -5.10 119.74 114.09 1duy s LYS 121 Ca 0.00 -1.00 -0.25 0.00 -1.00 0.00 0.00 55.97 53.72 1duy s LYS 121 Cb 0.00 -1.74 -0.15 0.00 -2.06 0.00 0.00 37.83 33.88 1duy s LYS 121 CO 0.00 0.45 0.49 -0.25 0.10 0.00 0.00 175.35 176.14 1duy n ASP 122 N 1.89 -1.06 0.05 0.03 9.92 -1.26 -1.87 116.55 124.24 1duy n ASP 122 Ca -0.17 1.01 0.00 0.00 -0.53 0.00 0.00 54.79 55.10 1duy n ASP 122 Cb 0.53 -0.84 0.00 0.00 -0.64 0.00 0.00 41.12 40.16 1duy n ASP 122 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1duy n TYR 123 N 0.06 -0.19 -3.73 1.24 9.36 -0.78 -4.63 117.16 118.50 1duy n TYR 123 Ca 0.16 0.03 -0.14 0.00 3.32 0.00 0.00 57.90 61.28 1duy n TYR 123 Cb 0.22 0.05 -0.09 0.00 -0.63 0.00 0.00 39.34 38.89 1duy n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1duy s ILE 124 N -1.77 0.03 -0.05 2.97 2.07 -1.15 -3.27 121.20 120.04 1duy s ILE 124 Ca 0.00 -0.26 -0.12 0.00 -1.41 0.00 0.00 60.65 58.87 1duy s ILE 124 Cb 0.00 -0.62 0.02 0.00 0.13 0.00 0.00 42.46 41.99 1duy s ILE 124 CO 0.00 -0.14 0.28 0.00 -1.91 0.00 0.00 174.94 173.17 1duy s ALA 125 N -0.74 -0.70 0.17 1.50 0.00 -0.79 -0.08 121.76 121.13 1duy s ALA 125 Ca -0.08 0.48 -0.30 0.00 0.00 0.00 0.00 51.96 52.06 1duy s ALA 125 Cb -0.04 -0.16 -0.07 0.00 0.00 0.00 0.00 23.12 22.85 1duy s ALA 125 CO 0.03 -0.20 1.02 -1.17 0.00 0.00 0.00 175.76 175.44 1duy s LEU 126 N -0.71 4.53 0.66 0.00 2.96 -0.36 -0.93 118.68 124.83 1duy s LEU 126 Ca -0.08 1.97 -0.11 0.00 -0.22 0.00 0.00 54.13 55.69 1duy s LEU 126 Cb -0.04 -3.60 -0.01 0.00 0.50 0.00 0.00 46.19 43.04 1duy s LEU 126 CO 0.02 -0.09 1.05 -0.54 -1.32 0.00 0.00 176.35 175.47 1duy s LYS 127 N -0.46 3.20 0.51 1.98 1.02 0.73 -4.73 119.74 122.00 1duy s LYS 127 Ca 0.47 0.56 0.27 0.00 0.02 0.00 0.00 55.97 57.28 1duy s LYS 127 Cb -0.27 -2.07 1.36 0.00 -0.52 0.00 0.00 37.83 36.34 1duy s LYS 127 CO 0.33 -0.79 1.91 1.49 -0.92 0.00 0.00 175.35 177.37 1duy h GLU 128 N -0.46 0.10 0.00 1.68 4.81 -1.88 0.00 114.58 118.83 1duy h GLU 128 Ca -0.45 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 1duy h GLU 128 Cb 1.22 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.58 1duy h GLU 128 CO 0.63 0.06 0.00 -0.40 -0.73 0.00 0.00 179.01 178.57 1duy n ASP 129 N -4.35 0.00 -0.99 1.04 5.75 -1.26 -4.83 116.55 111.91 1duy n ASP 129 Ca 0.16 -0.40 -0.10 0.00 -0.01 0.00 0.00 54.79 54.45 1duy n ASP 129 Cb 0.80 -0.05 -0.04 0.00 -1.03 0.00 0.00 41.12 40.80 1duy n ASP 129 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1duy n LEU 130 N -1.05 -0.52 0.00 -2.12 4.77 -0.01 -4.69 117.00 113.38 1duy n LEU 130 Ca 0.11 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.33 1duy n LEU 130 Cb 0.07 -2.01 0.00 0.00 -2.33 0.00 0.00 43.42 39.15 1duy n LEU 130 CO 0.09 -0.71 -0.06 0.54 -1.33 0.00 0.00 177.39 175.92 1duy n ARG 131 N -1.16 4.65 -4.20 3.23 1.74 -1.26 -4.56 116.66 115.11 1duy n ARG 131 Ca -0.10 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 56.86 1duy n ARG 131 Cb 0.42 -0.45 -0.10 0.00 -1.02 0.00 0.00 32.46 31.31 1duy n ARG 131 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1duy s SER 132 N -0.86 0.99 0.26 0.55 1.04 -1.26 -4.97 113.70 109.44 1duy s SER 132 Ca 0.00 -1.13 0.11 0.00 0.48 0.00 0.00 55.95 55.41 1duy s SER 132 Cb 0.00 0.15 -0.05 0.00 0.10 0.00 0.00 66.02 66.22 1duy s SER 132 CO 0.00 -0.57 -0.13 0.26 0.98 0.00 0.00 173.24 173.78 1duy s TRP 133 N -3.74 2.46 -0.20 5.02 0.52 -1.26 -0.19 118.94 121.55 1duy s TRP 133 Ca 0.20 -0.29 0.01 0.00 0.02 0.00 0.00 56.10 56.05 1duy s TRP 133 Cb 0.06 -1.10 0.03 0.00 -1.15 0.00 0.00 33.47 31.31 1duy s TRP 133 CO 0.01 0.65 -0.18 0.99 0.02 0.00 0.00 176.95 178.44 1duy s THR 134 N -2.31 2.06 -0.15 2.01 2.01 -0.11 -4.87 115.64 114.29 1duy s THR 134 Ca 0.29 -1.09 0.00 0.00 0.31 0.00 0.00 61.69 61.21 1duy s THR 134 Cb -0.06 -1.94 -0.00 0.00 0.01 0.00 0.00 72.50 70.51 1duy s THR 134 CO 0.16 0.40 -0.15 0.00 -0.69 0.00 0.00 174.62 174.34 1duy s ALA 135 N 1.25 2.49 -0.07 7.40 0.00 -1.26 -1.88 121.76 129.69 1duy s ALA 135 Ca 0.02 -1.04 -0.02 0.00 0.00 0.00 0.00 51.96 50.92 1duy s ALA 135 Cb -0.15 -1.22 -0.01 0.00 0.00 0.00 0.00 23.12 21.75 1duy s ALA 135 CO -0.11 -0.02 -0.04 0.00 0.00 0.00 0.00 175.76 175.60 1duy h ALA 136 N 7.27 0.00 -2.24 0.00 0.00 -1.88 -3.46 119.26 118.95 1duy h ALA 136 Ca -0.32 -0.13 -0.44 0.00 0.00 0.00 0.00 54.91 54.01 1duy h ALA 136 Cb 1.19 0.11 0.16 0.00 0.00 0.00 0.00 17.79 19.24 1duy h ALA 136 CO 0.57 0.11 0.28 -0.51 0.00 0.00 0.00 179.25 179.69 1duy s ASP 137 N -4.77 2.65 0.18 0.00 1.11 -1.26 -4.92 116.67 109.66 1duy s ASP 137 Ca -0.03 0.71 0.02 0.00 0.18 0.00 0.00 52.55 53.43 1duy s ASP 137 Cb 0.00 -1.07 0.07 0.00 1.07 0.00 0.00 42.92 42.99 1duy s ASP 137 CO 0.05 -3.06 1.43 -0.03 1.18 0.00 0.00 175.17 174.74 1duy h MET 138 N -1.85 0.25 -0.29 8.23 4.05 -1.99 -2.84 114.93 120.48 1duy h MET 138 Ca -0.48 -0.23 -0.02 0.00 -0.28 0.00 0.00 59.70 58.69 1duy h MET 138 Cb 1.30 0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 32.14 1duy h MET 138 CO 0.48 0.92 0.10 0.00 0.23 0.00 0.00 176.91 178.64 1duy h ALA 139 N 1.01 0.38 -0.53 0.39 0.00 -1.92 -2.10 119.26 116.48 1duy h ALA 139 Ca -0.03 -0.14 0.12 0.00 0.00 0.00 0.00 54.91 54.86 1duy h ALA 139 Cb 1.37 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 1duy h ALA 139 CO 0.12 0.00 0.37 0.00 0.00 0.00 0.00 179.25 179.74 1duy h ALA 140 N 0.94 2.25 -0.28 0.00 0.00 -1.81 -0.46 119.26 119.89 1duy h ALA 140 Ca 0.09 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 1duy h ALA 140 Cb 0.22 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1duy h ALA 140 CO -0.00 -0.39 -0.32 1.96 0.00 0.00 0.00 179.25 180.50 1duy h GLN 141 N 0.19 0.58 -0.37 0.00 4.20 -1.16 0.16 115.11 118.71 1duy h GLN 141 Ca 0.25 -0.26 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 1duy h GLN 141 Cb 0.75 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.50 1duy h GLN 141 CO -0.04 0.83 0.17 1.15 -0.67 0.00 0.00 178.83 180.27 1duy h THR 142 N 0.50 1.17 -0.08 -0.54 2.02 -0.85 -0.35 112.91 114.78 1duy h THR 142 Ca 0.06 -0.50 -0.00 0.00 0.77 0.00 0.00 66.41 66.74 1duy h THR 142 Cb 0.79 0.82 -0.00 0.00 -1.74 0.00 0.00 68.15 68.02 1duy h THR 142 CO 0.06 0.18 0.04 0.74 0.37 0.00 0.00 175.52 176.92 1duy h THR 143 N 0.46 1.08 -0.50 3.16 2.02 -1.10 -1.75 112.91 116.28 1duy h THR 143 Ca 0.13 -0.22 0.10 0.00 0.77 0.00 0.00 66.41 67.19 1duy h THR 143 Cb 0.13 1.08 -0.10 0.00 -1.74 0.00 0.00 68.15 67.53 1duy h THR 143 CO -0.01 0.07 -0.15 0.50 0.37 0.00 0.00 175.52 176.30 1duy h LYS 144 N 0.04 -0.03 -0.71 6.66 3.64 -0.30 0.46 116.57 126.33 1duy h LYS 144 Ca 0.03 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1duy h LYS 144 Cb 0.07 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 1duy h LYS 144 CO -0.00 -0.02 0.43 0.45 -2.27 0.00 0.00 179.45 178.04 1duy h HIS 145 N -0.03 0.93 -0.09 1.91 3.86 -0.83 0.86 115.15 121.76 1duy h HIS 145 Ca 0.24 0.00 0.04 0.00 -1.16 0.00 0.00 60.37 59.49 1duy h HIS 145 Cb 0.39 -0.31 -0.06 0.00 1.06 0.00 0.00 27.41 28.50 1duy h HIS 145 CO -0.44 0.62 -0.28 0.87 0.86 0.00 0.00 177.93 179.56 1duy h LYS 146 N 0.97 -0.36 0.00 2.45 1.57 -0.23 -0.45 116.57 120.52 1duy h LYS 146 Ca 0.26 0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 59.02 1duy h LYS 146 Cb -0.04 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 1duy h LYS 146 CO -0.05 -0.24 -0.21 -1.49 -0.57 0.00 0.00 179.45 176.90 1duy h TRP 147 N -0.37 0.00 -0.02 -1.35 6.55 -0.28 -1.85 115.95 118.63 1duy h TRP 147 Ca 0.09 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.92 1duy h TRP 147 Cb 0.50 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.80 1duy h TRP 147 CO -0.35 0.21 -0.03 0.93 -1.05 0.00 0.00 178.44 178.15 1duy h GLU 148 N 0.00 0.05 -0.95 0.49 5.08 -0.23 -1.09 114.58 117.94 1duy h GLU 148 Ca -0.00 -0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.43 1duy h GLU 148 Cb 0.39 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.58 1duy h GLU 148 CO 0.03 0.60 0.61 0.00 -1.00 0.00 0.00 179.01 179.24 1duy h ALA 149 N 0.45 1.57 -0.01 3.43 0.00 -0.78 -0.45 119.26 123.46 1duy h ALA 149 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1duy h ALA 149 Cb 0.60 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1duy h ALA 149 CO 0.01 0.24 0.00 0.00 0.00 0.00 0.00 179.25 179.49 1duy n ALA 150 N -2.38 2.60 -3.56 0.00 0.00 -0.72 -4.96 120.51 111.49 1duy n ALA 150 Ca 0.16 -0.40 -0.21 0.00 0.00 0.00 0.00 53.44 53.00 1duy n ALA 150 Cb 0.30 -1.23 0.05 0.00 0.00 0.00 0.00 19.45 18.57 1duy n ALA 150 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1duy n HIS 151 N -0.05 -2.07 0.01 0.00 -0.00 -0.18 -4.93 115.22 107.99 1duy n HIS 151 Ca 0.20 0.81 -0.18 0.00 -0.00 0.00 0.00 57.72 58.55 1duy n HIS 151 Cb 0.31 -4.36 -0.10 0.00 -0.00 0.00 0.00 29.99 25.83 1duy n HIS 151 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 1duy h VAL 152 N -1.73 1.38 -0.81 1.59 2.07 -1.49 -3.21 116.25 114.05 1duy h VAL 152 Ca -0.61 -2.08 0.16 0.00 0.82 0.00 0.00 66.70 64.99 1duy h VAL 152 Cb 1.35 2.48 -0.10 0.00 -1.52 0.00 0.00 31.29 33.50 1duy h VAL 152 CO 0.52 0.62 0.34 0.00 0.02 0.00 0.00 177.57 179.07 1duy h ALA 153 N 0.36 1.19 -0.79 1.67 0.00 -1.89 0.78 119.26 120.59 1duy h ALA 153 Ca -0.08 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1duy h ALA 153 Cb 1.38 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.23 1duy h ALA 153 CO 0.14 -0.23 0.32 0.93 0.00 0.00 0.00 179.25 180.41 1duy h GLU 154 N 0.46 1.18 -0.18 0.00 3.07 -1.80 0.10 114.58 117.41 1duy h GLU 154 Ca 0.46 -0.21 -0.12 0.00 -0.50 0.00 0.00 59.36 58.98 1duy h GLU 154 Cb 0.75 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.46 1duy h GLU 154 CO -0.44 0.95 -0.42 0.37 -1.40 0.00 0.00 179.01 178.07 1duy h GLN 155 N 1.15 0.42 -0.02 2.33 4.15 -1.13 -3.02 115.11 118.98 1duy h GLN 155 Ca 0.26 -0.21 -0.20 0.00 0.77 0.00 0.00 58.65 59.27 1duy h GLN 155 Cb 0.21 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 1duy h GLN 155 CO -0.02 0.77 -0.85 -0.07 -1.93 0.00 0.00 178.83 176.73 1duy h LEU 156 N 0.34 0.39 -0.34 -2.39 3.38 -0.54 -3.19 115.31 112.96 1duy h LEU 156 Ca 0.03 -0.29 0.05 0.00 0.09 0.00 0.00 57.88 57.75 1duy h LEU 156 Cb 0.89 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.48 1duy h LEU 156 CO 0.07 1.07 0.07 -0.09 0.09 0.00 0.00 178.44 179.66 1duy h ARG 157 N 0.18 0.19 -0.82 1.13 2.43 -0.68 0.44 114.38 117.25 1duy h ARG 157 Ca -0.05 -0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.15 1duy h ARG 157 Cb 1.46 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 30.91 1duy h ARG 157 CO 0.14 0.12 0.52 0.00 -1.51 0.00 0.00 179.97 179.24 1duy h ALA 158 N 1.25 1.10 -0.03 2.80 0.00 -1.58 -0.99 119.26 121.80 1duy h ALA 158 Ca 0.16 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1duy h ALA 158 Cb 0.18 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1duy h ALA 158 CO -0.21 0.31 -0.03 -0.92 0.00 0.00 0.00 179.25 178.41 1duy h TYR 159 N 0.99 0.08 -0.69 0.00 3.20 -1.39 -0.82 116.97 118.34 1duy h TYR 159 Ca 0.34 -0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.11 1duy h TYR 159 Cb 0.07 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 1duy h TYR 159 CO -0.03 0.53 0.15 -0.07 -1.64 0.00 0.00 178.16 177.10 1duy h LEU 160 N -0.39 1.07 0.00 2.82 3.38 -0.80 0.30 115.31 121.68 1duy h LEU 160 Ca 0.00 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1duy h LEU 160 Cb 0.52 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1duy h LEU 160 CO 0.01 1.03 -0.56 -0.62 0.09 0.00 0.00 178.44 178.39 1duy n GLU 161 N -4.24 0.16 0.00 1.13 1.02 -0.39 -3.85 120.64 114.47 1duy n GLU 161 Ca 0.05 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 1duy n GLU 161 Cb 0.27 -1.60 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 1duy n GLU 161 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1duy n GLY 162 N 1.41 0.45 0.39 0.62 0.00 -0.31 -4.69 105.19 103.06 1duy n GLY 162 Ca 0.04 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.99 1duy n GLY 162 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1duy h THR 163 N 0.00 0.06 -0.35 2.61 2.02 -1.51 0.18 112.91 115.92 1duy h THR 163 Ca 0.00 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.26 1duy h THR 163 Cb 0.00 0.06 -0.08 0.00 -1.74 0.00 0.00 68.15 66.39 1duy h THR 163 CO 0.00 0.00 -0.22 0.00 0.37 0.00 0.00 175.52 175.67 1duy h VAL 165 N -0.17 1.23 0.02 0.00 2.07 -1.33 -1.21 116.25 116.86 1duy h VAL 165 Ca 0.18 -0.85 -0.00 0.00 0.82 0.00 0.00 66.70 66.84 1duy h VAL 165 Cb 0.44 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 30.85 1duy h VAL 165 CO -0.45 0.32 -0.01 -0.33 0.02 0.00 0.00 177.57 177.12 1duy h GLU 166 N 0.86 -0.02 -0.55 1.57 5.08 0.82 -1.16 114.58 121.18 1duy h GLU 166 Ca 0.19 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.44 1duy h GLU 166 Cb 0.31 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1duy h GLU 166 CO -0.00 0.09 -0.09 -1.49 -1.00 0.00 0.00 179.01 176.53 1duy h TRP 167 N -0.13 1.14 -0.49 4.33 4.06 -0.87 -1.63 115.95 122.36 1duy h TRP 167 Ca -0.00 -0.23 0.07 0.00 2.06 0.00 0.00 58.89 60.79 1duy h TRP 167 Cb 0.12 -0.29 -0.06 0.00 -1.00 0.00 0.00 29.16 27.94 1duy h TRP 167 CO -0.04 1.04 0.18 1.25 -3.56 0.00 0.00 178.44 177.31 1duy h LEU 168 N 0.92 0.18 -0.88 -4.49 5.85 -1.11 0.18 115.31 115.96 1duy h LEU 168 Ca 0.15 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.92 1duy h LEU 168 Cb 0.65 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.68 1duy h LEU 168 CO 0.04 0.13 0.51 0.03 -0.34 0.00 0.00 178.44 178.82 1duy h ARG 169 N 0.35 1.21 -0.39 1.25 3.08 -0.82 -0.33 114.38 118.74 1duy h ARG 169 Ca 0.23 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 60.14 1duy h ARG 169 Cb 0.24 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 1duy h ARG 169 CO -0.24 0.87 0.18 -0.09 -1.07 0.00 0.00 179.97 179.62 1duy h ARG 170 N 1.22 0.57 0.05 0.04 2.43 -0.30 -2.36 114.38 116.04 1duy h ARG 170 Ca 0.31 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 59.39 1duy h ARG 170 Cb -0.02 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.43 1duy h ARG 170 CO -0.06 0.52 -0.02 1.88 -1.51 0.00 0.00 179.97 180.78 1duy h TYR 171 N 0.49 -0.06 -0.98 2.20 0.05 -0.23 -1.06 116.97 117.38 1duy h TYR 171 Ca 0.13 -0.00 0.22 0.00 0.05 0.00 0.00 58.73 59.14 1duy h TYR 171 Cb 0.14 0.02 -0.09 0.00 1.01 0.00 0.00 36.73 37.81 1duy h TYR 171 CO -0.01 -0.02 0.63 -0.07 -1.05 0.00 0.00 178.16 177.64 1duy h LEU 172 N -0.09 0.52 0.02 3.88 3.38 -0.93 0.86 115.31 122.96 1duy h LEU 172 Ca -0.01 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1duy h LEU 172 Cb 0.07 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1duy h LEU 172 CO 0.01 0.17 -0.01 -0.08 0.09 0.00 0.00 178.44 178.62 1duy h GLU 173 N 0.50 -0.03 -0.71 1.13 4.57 -1.05 -2.89 114.58 116.10 1duy h GLU 173 Ca 0.55 0.00 0.11 0.00 -1.18 0.00 0.00 59.36 58.83 1duy h GLU 173 Cb 1.22 0.01 -0.08 0.00 -0.16 0.00 0.00 28.75 29.74 1duy h GLU 173 CO -0.28 0.45 0.32 -0.91 -1.18 0.00 0.00 179.01 177.42 1duy h ASN 174 N -0.99 0.38 -0.82 1.04 -0.26 -0.82 -0.49 115.58 113.61 1duy h ASN 174 Ca -0.00 0.08 -0.42 0.00 -0.56 0.00 0.00 56.30 55.39 1duy h ASN 174 Cb 0.49 0.02 -0.25 0.00 -1.06 0.00 0.00 38.32 37.52 1duy h ASN 174 CO 0.00 0.20 0.54 0.61 -1.06 0.00 0.00 177.43 177.72 1duy n GLY 175 N -1.31 4.05 0.39 2.83 0.00 0.26 -4.74 105.19 106.67 1duy n GLY 175 Ca 0.12 -0.89 -0.10 0.00 0.00 0.00 0.00 46.02 45.14 1duy n GLY 175 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1duy n LYS 176 N -0.85 -0.40 0.09 1.61 4.81 -0.20 -0.44 118.16 122.78 1duy n LYS 176 Ca 0.49 1.44 0.20 0.00 -0.87 0.00 0.00 58.31 59.58 1duy n LYS 176 Cb 1.47 -2.12 0.71 0.00 0.02 0.00 0.00 35.03 35.10 1duy n LYS 176 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1duy h GLU 177 N 0.00 0.00 0.00 1.64 5.08 -1.85 -1.77 114.58 117.68 1duy h GLU 177 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1duy h GLU 177 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1duy h GLU 177 CO -0.86 0.00 -0.68 2.41 -1.00 0.00 0.00 179.01 178.87 1duy n THR 178 N -3.54 1.05 0.17 1.13 -1.04 0.33 -4.30 114.28 108.09 1duy n THR 178 Ca 0.08 0.25 0.03 0.00 -2.04 0.00 0.00 64.05 62.37 1duy n THR 178 Cb 0.71 -2.08 0.41 0.00 -1.82 0.00 0.00 70.33 67.55 1duy n THR 178 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1duy h LEU 179 N -0.68 0.11 -2.86 -4.42 3.38 -0.77 -3.05 115.31 107.02 1duy h LEU 179 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1duy h LEU 179 Cb 0.68 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1duy h LEU 179 CO 0.00 0.32 0.00 0.00 0.09 0.00 0.00 178.44 178.85 1duy n GLN 180 N -4.25 2.97 -2.46 1.13 6.02 -0.67 -4.97 117.38 115.16 1duy n GLN 180 Ca -0.02 -2.66 -0.30 0.00 -0.01 0.00 0.00 57.00 54.02 1duy n GLN 180 Cb 0.30 -1.61 -0.01 0.00 1.02 0.00 0.00 30.24 29.93 1duy n GLN 180 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 1duy s ARG 181 N -1.20 3.70 -0.23 -1.09 1.70 -1.16 -5.01 118.95 115.66 1duy s ARG 181 Ca 0.47 0.56 -0.02 0.00 -0.47 0.00 0.00 55.73 56.27 1duy s ARG 181 Cb 0.26 -2.26 0.07 0.00 -0.57 0.00 0.00 34.95 32.45 1duy s ARG 181 CO 0.29 -0.26 0.04 -0.08 -1.08 0.00 0.00 175.30 174.21 1duy s THR 182 N -2.73 0.76 -0.53 4.99 -1.32 -1.26 -4.55 115.64 111.00 1duy s THR 182 Ca 0.53 -0.87 -0.18 0.00 -1.21 0.00 0.00 61.69 59.95 1duy s THR 182 Cb -0.10 -1.31 0.08 0.00 -1.51 0.00 0.00 72.50 69.66 1duy s THR 182 CO 0.41 -0.32 0.59 -1.81 -2.21 0.00 0.00 174.62 171.28 1duy s ASP 183 N 1.73 6.19 0.34 8.08 1.01 0.49 -4.80 116.67 129.71 1duy s ASP 183 Ca 0.01 -1.24 -0.27 0.00 0.71 0.00 0.00 52.55 51.77 1duy s ASP 183 Cb -0.17 -2.26 -0.13 0.00 1.01 0.00 0.00 42.92 41.37 1duy s ASP 183 CO -0.12 -0.91 1.04 0.00 0.21 0.00 0.00 175.17 175.38 1duy n ALA 184 N 5.94 0.10 -1.78 5.23 0.00 -1.26 -2.53 120.51 126.20 1duy n ALA 184 Ca -0.09 0.33 -0.35 0.00 0.00 0.00 0.00 53.44 53.32 1duy n ALA 184 Cb 0.44 -2.07 -0.01 0.00 0.00 0.00 0.00 19.45 17.81 1duy n ALA 184 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1duy s PRO 185 N -1.75 3.62 -0.17 0.00 0.04 -1.26 -4.56 135.00 130.92 1duy s PRO 185 Ca 0.60 1.58 -0.13 0.00 0.04 0.00 0.00 61.00 63.08 1duy s PRO 185 Cb -0.63 -2.16 -0.05 0.00 0.04 0.00 0.00 34.50 31.70 1duy s PRO 185 CO 0.59 -0.62 0.28 0.15 0.04 0.00 0.00 177.00 177.44 1duy s LYS 186 N -3.07 4.25 0.19 4.56 1.02 0.35 -4.84 119.74 122.19 1duy s LYS 186 Ca 0.68 0.06 0.11 0.00 0.02 0.00 0.00 55.97 56.84 1duy s LYS 186 Cb -0.23 -3.43 -0.04 0.00 -0.52 0.00 0.00 37.83 33.61 1duy s LYS 186 CO 0.27 0.23 -0.23 0.95 -0.92 0.00 0.00 175.35 175.65 1duy s THR 187 N 0.51 2.26 0.07 2.17 -4.23 -1.26 -0.94 115.64 114.22 1duy s THR 187 Ca 0.15 -2.02 -0.26 0.00 -1.18 0.00 0.00 61.69 58.38 1duy s THR 187 Cb -0.13 -2.08 0.09 0.00 1.34 0.00 0.00 72.50 71.72 1duy s THR 187 CO 0.03 -0.16 0.78 -1.38 -0.54 0.00 0.00 174.62 173.35 1duy s HIS 188 N -1.76 -0.41 0.18 3.99 -3.43 -1.12 -5.00 115.29 107.74 1duy s HIS 188 Ca 0.20 0.23 0.10 0.00 -0.80 0.00 0.00 55.06 54.79 1duy s HIS 188 Cb -0.07 0.55 -0.04 0.00 -1.43 0.00 0.00 32.58 31.59 1duy s HIS 188 CO 0.09 -0.68 -0.16 -1.64 -2.00 0.00 0.00 174.74 170.35 1duy s MET 189 N -3.38 1.81 0.02 -0.38 -1.94 -1.26 -0.50 119.30 113.67 1duy s MET 189 Ca 0.04 -1.37 0.07 0.00 -1.71 0.00 0.00 55.69 52.72 1duy s MET 189 Cb -0.01 -2.02 -0.02 0.00 2.01 0.00 0.00 34.83 34.78 1duy s MET 189 CO -0.10 0.42 -0.20 0.99 -0.01 0.00 0.00 175.02 176.13 1duy s THR 190 N -1.64 1.60 -0.15 2.05 2.01 0.34 -4.96 115.64 114.89 1duy s THR 190 Ca 0.22 -1.03 -0.00 0.00 0.31 0.00 0.00 61.69 61.19 1duy s THR 190 Cb -0.09 -1.36 0.03 0.00 0.01 0.00 0.00 72.50 71.09 1duy s THR 190 CO 0.12 0.31 -0.08 -2.28 -0.69 0.00 0.00 174.62 172.00 1duy s HIS 191 N -0.65 1.86 -0.16 4.92 2.46 -1.26 -0.53 115.29 121.94 1duy s HIS 191 Ca 0.07 -1.11 -0.02 0.00 0.47 0.00 0.00 55.06 54.47 1duy s HIS 191 Cb -0.08 -1.41 0.05 0.00 -0.13 0.00 0.00 32.58 31.01 1duy s HIS 191 CO 0.01 -0.62 0.00 -1.58 -2.47 0.00 0.00 174.74 170.07 1duy s HIS 192 N 1.58 1.16 0.03 3.88 5.04 -0.74 -4.99 115.29 121.25 1duy s HIS 192 Ca 0.02 -0.79 -0.31 0.00 -1.54 0.00 0.00 55.06 52.44 1duy s HIS 192 Cb -0.14 -1.07 -0.10 0.00 0.04 0.00 0.00 32.58 31.31 1duy s HIS 192 CO -0.09 -0.55 1.94 0.00 -2.34 0.00 0.00 174.74 173.70 1duy n ALA 193 N 5.01 1.54 -0.00 1.58 0.00 -1.26 -1.77 120.51 125.61 1duy n ALA 193 Ca -0.09 0.24 -0.15 0.00 0.00 0.00 0.00 53.44 53.44 1duy n ALA 193 Cb 0.48 -2.64 -0.14 0.00 0.00 0.00 0.00 19.45 17.15 1duy n ALA 193 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1duy h VAL 194 N 5.44 0.76 -0.79 0.00 2.07 -1.80 -3.48 116.25 118.46 1duy h VAL 194 Ca -0.49 -2.54 0.00 0.00 0.82 0.00 0.00 66.70 64.49 1duy h VAL 194 Cb 1.24 2.48 0.00 0.00 -1.52 0.00 0.00 31.29 33.50 1duy h VAL 194 CO 0.94 0.70 0.00 -1.54 0.02 0.00 0.00 177.57 177.70 1duy n SER 195 N -3.28 0.00 -0.19 0.57 3.41 -1.10 -5.00 113.62 108.03 1duy n SER 195 Ca -0.24 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.49 1duy n SER 195 Cb 1.05 0.00 0.24 0.00 -0.26 0.00 0.00 64.21 65.24 1duy n SER 195 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1duy n ASP 196 N 0.00 1.02 0.00 4.04 5.75 -1.26 -4.25 116.55 121.85 1duy n ASP 196 Ca 0.00 -0.81 0.00 0.00 -0.01 0.00 0.00 54.79 53.97 1duy n ASP 196 Cb 0.00 0.31 0.00 0.00 -1.03 0.00 0.00 41.12 40.40 1duy n ASP 196 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1duy n HIS 197 N -0.89 0.00 -3.89 2.11 1.44 -1.26 -4.94 115.22 107.78 1duy n HIS 197 Ca 0.09 -0.15 -0.09 0.00 -2.01 0.00 0.00 57.72 55.56 1duy n HIS 197 Cb 0.36 -0.02 -0.08 0.00 0.12 0.00 0.00 29.99 30.37 1duy n HIS 197 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 1duy s GLU 198 N -0.30 0.76 0.05 -1.40 2.02 -1.26 -0.59 118.70 117.98 1duy s GLU 198 Ca 0.00 -0.91 -0.17 0.00 0.02 0.00 0.00 54.97 53.91 1duy s GLU 198 Cb 0.00 0.30 0.03 0.00 0.10 0.00 0.00 34.13 34.56 1duy s GLU 198 CO 0.00 -0.22 0.38 0.00 0.02 0.00 0.00 175.26 175.44 1duy s ALA 199 N -3.51 -0.90 -0.10 5.21 0.00 -0.49 -2.32 121.76 119.64 1duy s ALA 199 Ca 0.02 0.18 -0.04 0.00 0.00 0.00 0.00 51.96 52.12 1duy s ALA 199 Cb 0.04 0.37 -0.04 0.00 0.00 0.00 0.00 23.12 23.49 1duy s ALA 199 CO -0.09 -0.46 0.07 0.99 0.00 0.00 0.00 175.76 176.27 1duy s THR 200 N -2.63 4.89 -0.23 0.00 2.01 -0.73 0.12 115.64 119.07 1duy s THR 200 Ca -0.04 -0.02 -0.03 0.00 0.31 0.00 0.00 61.69 61.90 1duy s THR 200 Cb -0.00 -3.10 0.00 0.00 0.01 0.00 0.00 72.50 69.41 1duy s THR 200 CO -0.04 0.61 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.69 1duy s LEU 201 N -0.94 2.94 -0.15 4.42 1.43 -0.76 -1.79 118.68 123.83 1duy s LEU 201 Ca 0.14 -0.54 -0.03 0.00 -1.03 0.00 0.00 54.13 52.67 1duy s LEU 201 Cb -0.12 -1.70 -0.03 0.00 0.03 0.00 0.00 46.19 44.37 1duy s LEU 201 CO 0.03 -0.05 -0.05 -0.60 0.23 0.00 0.00 176.35 175.91 1duy s ARG 202 N 1.43 3.57 -0.25 1.70 3.52 0.31 -2.25 118.95 126.98 1duy s ARG 202 Ca 0.04 -0.53 -0.05 0.00 -0.13 0.00 0.00 55.73 55.06 1duy s ARG 202 Cb -0.15 -2.87 0.00 0.00 -1.56 0.00 0.00 34.95 30.37 1duy s ARG 202 CO -0.04 0.28 0.01 0.00 -0.81 0.00 0.00 175.30 174.74 1duy s TRP 204 N 1.48 3.54 -0.19 0.00 0.52 0.35 -1.87 118.94 122.77 1duy s TRP 204 Ca 0.04 0.47 0.01 0.00 0.02 0.00 0.00 56.10 56.64 1duy s TRP 204 Cb -0.16 -1.95 0.03 0.00 -1.15 0.00 0.00 33.47 30.25 1duy s TRP 204 CO -0.01 0.67 -0.13 0.00 0.02 0.00 0.00 176.95 177.50 1duy s ALA 205 N -0.88 2.06 0.17 0.98 0.00 -0.34 -2.81 121.76 120.93 1duy s ALA 205 Ca 0.14 -1.17 0.05 0.00 0.00 0.00 0.00 51.96 50.98 1duy s ALA 205 Cb -0.12 -1.22 -0.05 0.00 0.00 0.00 0.00 23.12 21.73 1duy s ALA 205 CO 0.03 -0.65 -0.10 -0.51 0.00 0.00 0.00 175.76 174.53 1duy s LEU 206 N 1.38 2.50 -1.68 0.00 1.43 -0.12 -1.35 118.68 120.85 1duy s LEU 206 Ca 0.01 -1.04 0.00 0.00 -1.03 0.00 0.00 54.13 52.07 1duy s LEU 206 Cb -0.15 -0.40 0.00 0.00 0.03 0.00 0.00 46.19 45.67 1duy s LEU 206 CO -0.09 -0.32 0.00 -1.20 0.23 0.00 0.00 176.35 174.96 1duy n SER 207 N -0.25 -4.93 -4.94 2.29 7.64 -0.93 -0.50 113.62 111.99 1duy n SER 207 Ca -0.09 0.23 -0.24 0.00 1.01 0.00 0.00 58.87 59.79 1duy n SER 207 Cb 0.61 -4.26 -0.01 0.00 -1.01 0.00 0.00 64.21 59.53 1duy n SER 207 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1duy s PHE 208 N -2.71 3.48 -0.27 1.43 -0.12 -1.09 -4.73 117.98 113.97 1duy s PHE 208 Ca 0.00 0.31 -0.19 0.00 -0.05 0.00 0.00 56.93 57.00 1duy s PHE 208 Cb 0.00 -1.89 0.08 0.00 -0.63 0.00 0.00 43.02 40.57 1duy s PHE 208 CO 0.00 0.12 0.69 -0.47 -0.05 0.00 0.00 175.22 175.51 1duy s TYR 209 N -2.30 -0.95 1.13 3.49 5.04 -1.05 -0.52 117.35 122.19 1duy s TYR 209 Ca 0.40 2.04 -0.18 0.00 -2.44 0.00 0.00 57.07 56.89 1duy s TYR 209 Cb -0.10 0.49 0.26 0.00 0.35 0.00 0.00 41.96 42.96 1duy s TYR 209 CO 0.36 -0.47 1.15 -1.25 -1.34 0.00 0.00 175.55 174.00 1duy s PRO 210 N 1.15 -0.69 0.49 4.97 0.04 -1.26 -0.38 135.00 139.31 1duy s PRO 210 Ca -0.06 -0.09 0.24 0.00 0.04 0.00 0.00 61.00 61.12 1duy s PRO 210 Cb -0.05 -1.66 1.27 0.00 0.04 0.00 0.00 34.50 34.10 1duy s PRO 210 CO -0.12 -3.36 2.02 0.00 0.04 0.00 0.00 177.00 175.59 1duy h ALA 211 N -2.33 1.34 -2.55 8.56 0.00 -1.96 -3.45 119.26 118.88 1duy h ALA 211 Ca -0.45 -0.15 -0.54 0.00 0.00 0.00 0.00 54.91 53.77 1duy h ALA 211 Cb 1.29 -0.03 0.06 0.00 0.00 0.00 0.00 17.79 19.11 1duy h ALA 211 CO 0.37 0.20 0.99 -1.91 0.00 0.00 0.00 179.25 178.90 1duy n GLU 212 N -3.78 2.66 -3.48 0.00 2.13 -1.26 -4.96 120.64 111.95 1duy n GLU 212 Ca -0.02 0.96 -0.10 0.00 0.66 0.00 0.00 57.16 58.66 1duy n GLU 212 Cb 0.27 -2.80 -0.02 0.00 0.27 0.00 0.00 31.44 29.16 1duy n GLU 212 CO 0.00 0.00 0.00 -1.50 -0.41 0.00 0.00 177.13 175.22 1duy s ILE 213 N 1.38 0.00 -0.09 6.31 2.07 -1.26 -4.68 121.20 124.94 1duy s ILE 213 Ca 0.77 -0.08 -0.00 0.00 -1.41 0.00 0.00 60.65 59.93 1duy s ILE 213 Cb -0.54 -1.09 0.02 0.00 0.13 0.00 0.00 42.46 40.99 1duy s ILE 213 CO 0.34 0.00 -0.05 -0.89 -1.91 0.00 0.00 174.94 172.43 1duy s THR 214 N -3.55 0.75 -0.06 4.00 2.01 -0.87 -5.00 115.64 112.91 1duy s THR 214 Ca 0.03 -0.14 -0.00 0.00 0.31 0.00 0.00 61.69 61.89 1duy s THR 214 Cb -0.01 -0.80 0.03 0.00 0.01 0.00 0.00 72.50 71.72 1duy s THR 214 CO -0.10 0.31 -0.02 -0.22 -0.69 0.00 0.00 174.62 173.89 1duy s LEU 215 N 1.60 0.93 0.16 4.42 2.96 -1.25 -0.91 118.68 126.59 1duy s LEU 215 Ca 0.01 -0.12 -0.08 0.00 -0.22 0.00 0.00 54.13 53.72 1duy s LEU 215 Cb -0.13 -0.48 -0.01 0.00 0.50 0.00 0.00 46.19 46.07 1duy s LEU 215 CO -0.05 -0.13 0.27 0.42 -1.32 0.00 0.00 176.35 175.54 1duy s THR 216 N 1.54 0.07 0.11 3.68 -4.23 -0.45 -4.95 115.64 111.40 1duy s THR 216 Ca -0.01 -1.44 0.08 0.00 -1.18 0.00 0.00 61.69 59.14 1duy s THR 216 Cb -0.13 -1.88 -0.04 0.00 1.34 0.00 0.00 72.50 71.79 1duy s THR 216 CO -0.04 -0.30 -0.14 0.26 -0.54 0.00 0.00 174.62 173.87 1duy s TRP 217 N -3.98 2.65 0.01 3.99 0.52 -1.26 -0.12 118.94 120.75 1duy s TRP 217 Ca 0.18 -0.20 0.01 0.00 0.02 0.00 0.00 56.10 56.11 1duy s TRP 217 Cb 0.04 -1.40 -0.01 0.00 -1.15 0.00 0.00 33.47 30.95 1duy s TRP 217 CO 0.01 0.40 -0.03 -0.65 0.02 0.00 0.00 176.95 176.70 1duy s GLN 218 N -2.15 0.27 -0.20 4.98 -0.21 -0.14 -3.81 119.66 118.40 1duy s GLN 218 Ca 0.20 -0.27 -0.01 0.00 0.02 0.00 0.00 55.36 55.30 1duy s GLN 218 Cb -0.11 -0.17 0.01 0.00 1.00 0.00 0.00 33.01 33.73 1duy s GLN 218 CO 0.12 0.04 -0.12 0.50 -2.12 0.00 0.00 175.29 173.71 1duy s ARG 219 N -0.49 3.17 -1.60 2.91 3.52 -0.85 -0.89 118.95 124.72 1duy s ARG 219 Ca -0.03 -0.74 0.00 0.00 -0.13 0.00 0.00 55.73 54.83 1duy s ARG 219 Cb -0.04 -2.80 0.00 0.00 -1.56 0.00 0.00 34.95 30.55 1duy s ARG 219 CO -0.00 -0.21 0.00 -0.25 -0.81 0.00 0.00 175.30 174.03 1duy n ASP 220 N 4.71 -5.05 -0.00 -2.12 8.00 0.52 -1.25 116.55 121.36 1duy n ASP 220 Ca -0.19 0.15 -0.00 0.00 0.71 0.00 0.00 54.79 55.46 1duy n ASP 220 Cb 0.50 -4.30 -0.00 0.00 -0.02 0.00 0.00 41.12 37.30 1duy n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1duy n GLY 221 N -0.79 0.48 3.70 0.44 0.00 -1.26 -5.03 105.19 102.73 1duy n GLY 221 Ca -0.20 -0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.56 1duy n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1duy s GLU 222 N -0.07 2.54 0.21 1.61 0.41 -0.38 -5.04 118.70 117.99 1duy s GLU 222 Ca 0.00 -1.08 -0.30 0.00 -0.41 0.00 0.00 54.97 53.18 1duy s GLU 222 Cb 0.00 -2.42 -0.16 0.00 -1.78 0.00 0.00 34.13 29.78 1duy s GLU 222 CO 0.00 0.45 0.85 -3.47 -0.49 0.00 0.00 175.26 172.60 1duy n ASP 223 N -0.33 0.20 -0.38 -0.19 2.03 -1.26 -2.01 116.55 114.61 1duy n ASP 223 Ca -0.09 1.15 0.00 0.00 0.52 0.00 0.00 54.79 56.37 1duy n ASP 223 Cb 0.56 -1.11 0.00 0.00 -0.72 0.00 0.00 41.12 39.84 1duy n ASP 223 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1duy n GLN 224 N 1.09 0.00 -0.25 -0.67 1.13 -1.25 -4.71 117.38 112.72 1duy n GLN 224 Ca 0.15 -0.86 -0.10 0.00 -1.94 0.00 0.00 57.00 54.25 1duy n GLN 224 Cb 0.26 -0.49 -0.06 0.00 0.11 0.00 0.00 30.24 30.07 1duy n GLN 224 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1duy h THR 225 N 6.00 0.04 0.00 5.09 2.02 -1.91 0.42 112.91 124.57 1duy h THR 225 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1duy h THR 225 Cb 1.30 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 1duy h THR 225 CO 0.00 0.00 0.00 1.56 0.37 0.00 0.00 175.52 177.45 1duy h GLN 226 N -0.20 0.00 -0.28 6.66 4.20 -2.00 -2.12 115.11 121.37 1duy h GLN 226 Ca 0.16 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.81 1duy h GLN 226 Cb 0.54 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.29 1duy h GLN 226 CO -0.74 0.00 -0.01 -0.25 -0.67 0.00 0.00 178.83 177.16 1duy n ASP 227 N -2.76 3.42 -4.23 1.46 9.92 0.07 -4.97 116.55 119.47 1duy n ASP 227 Ca -0.02 -3.24 -0.31 0.00 -0.53 0.00 0.00 54.79 50.69 1duy n ASP 227 Cb 0.11 -0.57 -0.17 0.00 -0.64 0.00 0.00 41.12 39.85 1duy n ASP 227 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1duy s THR 228 N -2.96 1.98 -0.32 -3.53 2.01 -0.80 -4.53 115.64 107.50 1duy s THR 228 Ca 0.43 -1.00 -0.15 0.00 0.31 0.00 0.00 61.69 61.27 1duy s THR 228 Cb 0.36 -1.70 -0.02 0.00 0.01 0.00 0.00 72.50 71.15 1duy s THR 228 CO 0.06 0.55 0.36 -0.70 -0.69 0.00 0.00 174.62 174.20 1duy s GLU 229 N 0.10 3.72 -0.21 4.92 2.12 0.19 -4.92 118.70 124.63 1duy s GLU 229 Ca -0.11 -0.27 0.01 0.00 0.36 0.00 0.00 54.97 54.97 1duy s GLU 229 Cb -0.16 -3.75 0.04 0.00 0.26 0.00 0.00 34.13 30.53 1duy s GLU 229 CO 0.06 -0.44 -0.11 -1.17 -0.54 0.00 0.00 175.26 173.06 1duy s LEU 230 N 2.04 2.47 0.40 2.70 2.96 -1.26 -0.10 118.68 127.88 1duy s LEU 230 Ca 0.13 -0.97 -0.13 0.00 -0.22 0.00 0.00 54.13 52.94 1duy s LEU 230 Cb -0.16 -1.30 -0.07 0.00 0.50 0.00 0.00 46.19 45.16 1duy s LEU 230 CO 0.11 -0.15 0.79 0.68 -1.32 0.00 0.00 176.35 176.47 1duy s VAL 231 N 1.34 4.71 0.38 1.68 -7.23 -1.04 -5.02 120.40 115.23 1duy s VAL 231 Ca -0.02 0.81 -0.26 0.00 -1.81 0.00 0.00 61.98 60.69 1duy s VAL 231 Cb -0.17 -3.69 -0.11 0.00 0.56 0.00 0.00 36.38 32.96 1duy s VAL 231 CO -0.08 -0.45 1.12 1.21 -0.31 0.00 0.00 175.10 176.59 1duy n GLU 232 N -1.08 1.64 -1.84 4.82 2.13 -1.26 -4.59 120.64 120.46 1duy n GLU 232 Ca 0.03 0.58 -0.41 0.00 0.66 0.00 0.00 57.16 58.02 1duy n GLU 232 Cb 0.54 -2.14 -0.01 0.00 0.27 0.00 0.00 31.44 30.10 1duy n GLU 232 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1duy s THR 233 N -1.18 2.18 0.03 6.31 2.01 -1.26 -4.82 115.64 118.90 1duy s THR 233 Ca 0.60 0.16 0.03 0.00 0.31 0.00 0.00 61.69 62.79 1duy s THR 233 Cb -0.58 -3.10 -0.02 0.00 0.01 0.00 0.00 72.50 68.81 1duy s THR 233 CO 0.59 0.03 -0.08 0.00 -0.69 0.00 0.00 174.62 174.46 1duy s ARG 234 N -1.08 0.57 0.16 4.92 1.70 -0.33 -4.97 118.95 119.93 1duy s ARG 234 Ca 0.58 -0.63 -0.30 0.00 -0.47 0.00 0.00 55.73 54.91 1duy s ARG 234 Cb -0.46 -0.44 -0.07 0.00 -0.57 0.00 0.00 34.95 33.41 1duy s ARG 234 CO 0.53 0.10 1.14 -1.25 -1.08 0.00 0.00 175.30 174.73 1duy s PRO 235 N -1.18 4.54 0.37 3.89 0.04 -1.26 -0.49 135.00 140.91 1duy s PRO 235 Ca -0.05 1.76 0.20 0.00 0.04 0.00 0.00 61.00 62.95 1duy s PRO 235 Cb -0.08 -3.28 0.33 0.00 0.04 0.00 0.00 34.50 31.51 1duy s PRO 235 CO 0.00 -0.01 1.57 0.00 0.04 0.00 0.00 177.00 178.60 1duy h ALA 236 N 5.37 0.84 0.00 8.56 0.00 -1.73 -3.47 119.26 128.84 1duy h ALA 236 Ca -0.44 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.22 1duy h ALA 236 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1duy h ALA 236 CO 0.74 0.34 0.00 0.41 0.00 0.00 0.00 179.25 180.74 1duy n GLY 237 N 0.99 0.44 0.32 0.00 0.00 -1.26 -4.92 105.19 100.76 1duy n GLY 237 Ca 0.02 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.08 1duy n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1duy n ASP 238 N 0.00 2.50 0.00 1.61 5.75 -1.26 -4.96 116.55 120.19 1duy n ASP 238 Ca 0.00 -2.10 0.00 0.00 -0.01 0.00 0.00 54.79 52.68 1duy n ASP 238 Cb 0.00 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 39.95 1duy n ASP 238 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1duy n GLY 239 N -0.10 1.42 3.65 6.12 0.00 -1.26 -5.08 105.19 109.94 1duy n GLY 239 Ca 0.07 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.89 1duy n GLY 239 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1duy n THR 240 N -1.49 0.00 -4.26 2.61 -2.24 -1.26 -4.87 114.28 102.77 1duy n THR 240 Ca 0.00 -1.86 -0.14 0.00 -2.27 0.00 0.00 64.05 59.78 1duy n THR 240 Cb 0.00 -0.45 -0.10 0.00 -2.10 0.00 0.00 70.33 67.67 1duy n THR 240 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1duy s PHE 241 N -2.41 1.28 0.07 4.78 0.08 0.32 -2.04 117.98 120.07 1duy s PHE 241 Ca 0.52 -1.00 0.01 0.00 0.12 0.00 0.00 56.93 56.58 1duy s PHE 241 Cb -0.04 -0.73 -0.04 0.00 -0.57 0.00 0.00 43.02 41.64 1duy s PHE 241 CO 0.33 -0.18 -0.05 -0.65 -0.10 0.00 0.00 175.22 174.57 1duy s GLN 242 N -3.91 0.69 -0.05 0.44 -0.21 0.36 -2.19 119.66 114.79 1duy s GLN 242 Ca 0.25 -1.18 -0.29 0.00 0.02 0.00 0.00 55.36 54.16 1duy s GLN 242 Cb 0.06 -0.06 0.09 0.00 1.00 0.00 0.00 33.01 34.10 1duy s GLN 242 CO 0.05 -0.04 0.81 0.21 -2.12 0.00 0.00 175.29 174.20 1duy s LYS 243 N -3.42 0.89 0.07 2.91 2.20 -0.46 -1.19 119.74 120.74 1duy s LYS 243 Ca 0.06 0.01 -0.11 0.00 -0.36 0.00 0.00 55.97 55.58 1duy s LYS 243 Cb 0.03 0.42 0.01 0.00 -1.51 0.00 0.00 37.83 36.78 1duy s LYS 243 CO -0.06 -0.32 0.23 1.67 -0.36 0.00 0.00 175.35 176.52 1duy s TRP 244 N -1.88 0.04 0.00 4.03 1.48 -1.26 -1.20 118.94 120.15 1duy s TRP 244 Ca -0.03 -0.35 0.02 0.00 -1.06 0.00 0.00 56.10 54.67 1duy s TRP 244 Cb -0.00 0.01 -0.01 0.00 -1.16 0.00 0.00 33.47 32.31 1duy s TRP 244 CO 0.00 -0.52 -0.07 0.00 -4.06 0.00 0.00 176.95 172.31 1duy s ALA 245 N -3.29 0.54 0.03 2.67 0.00 -0.78 -2.49 121.76 118.43 1duy s ALA 245 Ca 0.00 -0.33 0.02 0.00 0.00 0.00 0.00 51.96 51.66 1duy s ALA 245 Cb 0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 23.12 23.01 1duy s ALA 245 CO -0.08 0.11 -0.06 0.00 0.00 0.00 0.00 175.76 175.73 1duy s ALA 246 N -0.28 0.47 0.03 0.00 0.00 0.86 -0.02 121.76 122.82 1duy s ALA 246 Ca 0.01 -0.61 0.03 0.00 0.00 0.00 0.00 51.96 51.40 1duy s ALA 246 Cb -0.03 0.02 -0.02 0.00 0.00 0.00 0.00 23.12 23.09 1duy s ALA 246 CO -0.00 -0.01 -0.10 0.14 0.00 0.00 0.00 175.76 175.79 1duy s VAL 247 N -1.08 0.76 -0.36 0.00 -7.23 -0.95 -0.64 120.40 110.90 1duy s VAL 247 Ca -0.08 -0.83 -0.22 0.00 -1.81 0.00 0.00 61.98 59.04 1duy s VAL 247 Cb -0.08 -0.72 0.01 0.00 0.56 0.00 0.00 36.38 36.15 1duy s VAL 247 CO 0.00 -0.09 0.72 -0.69 -0.31 0.00 0.00 175.10 174.73 1duy s VAL 248 N -0.84 4.80 -0.21 1.32 1.01 -1.26 -1.84 120.40 123.39 1duy s VAL 248 Ca -0.02 0.77 -0.13 0.00 0.00 0.00 0.00 61.98 62.61 1duy s VAL 248 Cb -0.07 -4.15 -0.05 0.00 0.00 0.00 0.00 36.38 32.11 1duy s VAL 248 CO 0.01 -0.37 0.26 -0.69 0.00 0.00 0.00 175.10 174.30 1duy s VAL 249 N 2.92 5.30 0.54 2.92 1.01 0.32 -4.89 120.40 128.52 1duy s VAL 249 Ca 0.28 0.41 -0.21 0.00 0.00 0.00 0.00 61.98 62.47 1duy s VAL 249 Cb -0.14 -3.59 -0.05 0.00 0.00 0.00 0.00 36.38 32.60 1duy s VAL 249 CO 0.16 0.33 1.28 -2.84 0.00 0.00 0.00 175.10 174.03 1duy s PRO 250 N 0.96 3.20 0.19 2.72 0.02 -1.26 -1.40 135.00 139.43 1duy s PRO 250 Ca 0.13 2.04 -0.32 0.00 0.02 0.00 0.00 61.00 62.86 1duy s PRO 250 Cb -0.13 -2.19 -0.15 0.00 0.02 0.00 0.00 34.50 32.04 1duy s PRO 250 CO 0.05 -1.08 1.24 -1.13 -0.33 0.00 0.00 177.00 175.74 1duy n SER 251 N -1.09 1.74 0.00 2.53 3.41 0.24 -2.19 113.62 118.26 1duy n SER 251 Ca 0.11 1.14 0.00 0.00 -0.26 0.00 0.00 58.87 59.86 1duy n SER 251 Cb 0.47 -1.27 0.00 0.00 -0.26 0.00 0.00 64.21 63.15 1duy n SER 251 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1duy n GLY 252 N 2.08 0.55 0.34 5.00 0.00 -1.26 -4.91 105.19 107.00 1duy n GLY 252 Ca 0.14 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.25 1duy n GLY 252 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1duy n GLN 253 N -2.40 1.95 -0.20 1.61 6.02 -0.93 -4.73 117.38 118.70 1duy n GLN 253 Ca 0.00 -2.58 0.06 0.00 -0.01 0.00 0.00 57.00 54.47 1duy n GLN 253 Cb 0.04 -1.57 0.34 0.00 1.02 0.00 0.00 30.24 30.07 1duy n GLN 253 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1duy h GLU 254 N 0.63 0.76 0.00 -1.09 3.07 -1.91 -1.84 114.58 114.21 1duy h GLU 254 Ca 0.00 -0.05 -0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1duy h GLU 254 Cb 1.10 -0.17 -0.00 0.00 -0.84 0.00 0.00 28.75 28.84 1duy h GLU 254 CO 0.07 0.50 -0.01 -0.56 -1.40 0.00 0.00 179.01 177.61 1duy h GLN 255 N 0.78 0.00 0.00 2.33 -0.00 -1.85 -2.67 115.11 113.71 1duy h GLN 255 Ca 0.32 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.95 1duy h GLN 255 Cb 0.26 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 27.74 1duy h GLN 255 CO -0.11 0.01 -0.13 0.00 -0.00 0.00 0.00 178.83 178.60 1duy h ARG 256 N 0.00 0.00 -5.96 0.06 3.08 -1.69 -3.45 114.38 106.41 1duy h ARG 256 Ca -0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 1duy h ARG 256 Cb 0.28 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.27 1duy h ARG 256 CO 0.00 0.13 -0.18 0.71 -1.07 0.00 0.00 179.97 179.56 1duy s TYR 257 N -3.40 3.69 0.00 3.04 1.51 -1.01 -0.35 117.35 120.83 1duy s TYR 257 Ca 0.03 0.99 0.05 0.00 -1.01 0.00 0.00 57.07 57.13 1duy s TYR 257 Cb 0.08 -2.36 -0.01 0.00 -0.11 0.00 0.00 41.96 39.55 1duy s TYR 257 CO 0.64 0.53 -0.15 0.95 -1.11 0.00 0.00 175.55 176.41 1duy s THR 258 N -0.70 1.21 -0.19 -0.71 -4.23 -0.07 -4.31 115.64 106.65 1duy s THR 258 Ca 0.24 -0.75 -0.08 0.00 -1.18 0.00 0.00 61.69 59.93 1duy s THR 258 Cb -0.17 -1.03 -0.04 0.00 1.34 0.00 0.00 72.50 72.61 1duy s THR 258 CO 0.13 0.26 0.07 0.00 -0.54 0.00 0.00 174.62 174.54 1duy s HIS 260 N 0.41 2.77 -0.06 0.00 3.76 0.84 -0.67 115.29 122.33 1duy s HIS 260 Ca 0.03 -0.35 0.01 0.00 -0.15 0.00 0.00 55.06 54.61 1duy s HIS 260 Cb -0.12 -1.73 0.02 0.00 1.11 0.00 0.00 32.58 31.85 1duy s HIS 260 CO 0.00 0.03 -0.07 0.08 -0.85 0.00 0.00 174.74 173.93 1duy s VAL 261 N -0.27 0.79 -0.12 -0.90 1.01 -0.46 -1.34 120.40 119.11 1duy s VAL 261 Ca 0.02 -0.25 0.03 0.00 0.00 0.00 0.00 61.98 61.78 1duy s VAL 261 Cb -0.13 -0.79 0.01 0.00 0.00 0.00 0.00 36.38 35.47 1duy s VAL 261 CO 0.03 0.29 -0.23 -1.10 0.00 0.00 0.00 175.10 174.09 1duy s GLN 262 N 1.03 3.02 -0.11 2.72 -0.21 -0.09 -0.30 119.66 125.73 1duy s GLN 262 Ca -0.09 -0.86 -0.20 0.00 0.02 0.00 0.00 55.36 54.23 1duy s GLN 262 Cb -0.14 -2.38 0.05 0.00 1.00 0.00 0.00 33.01 31.53 1duy s GLN 262 CO -0.00 0.06 0.49 -1.58 -2.12 0.00 0.00 175.29 172.14 1duy s HIS 263 N 0.64 -0.47 0.65 0.91 2.46 -1.26 -2.06 115.29 116.16 1duy s HIS 263 Ca -0.12 1.00 0.39 0.00 0.47 0.00 0.00 55.06 56.81 1duy s HIS 263 Cb -0.16 0.21 2.18 0.00 -0.13 0.00 0.00 32.58 34.68 1duy s HIS 263 CO 0.02 -0.38 2.28 1.49 -2.47 0.00 0.00 174.74 175.68 1duy h GLU 264 N 4.41 0.00 -0.01 2.88 4.81 -1.94 0.17 114.58 124.90 1duy h GLU 264 Ca -0.28 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 1duy h GLU 264 Cb 1.17 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.55 1duy h GLU 264 CO 0.29 0.00 -0.01 0.41 -0.73 0.00 0.00 179.01 178.97 1duy n GLY 265 N -1.16 -0.36 3.31 1.92 0.00 -1.26 -4.75 105.19 102.89 1duy n GLY 265 Ca -0.02 -0.36 -0.36 0.00 0.00 0.00 0.00 46.02 45.27 1duy n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1duy s LEU 266 N -2.03 3.42 0.14 0.99 1.43 0.60 -4.31 118.68 118.93 1duy s LEU 266 Ca 0.41 -0.62 -0.24 0.00 -1.03 0.00 0.00 54.13 52.65 1duy s LEU 266 Cb 0.21 -1.80 0.00 0.00 0.03 0.00 0.00 46.19 44.64 1duy s LEU 266 CO 0.35 -0.12 1.63 1.55 0.23 0.00 0.00 176.35 179.99 1duy h PRO 267 N 8.15 -0.29 -6.53 1.29 0.13 -1.85 -3.42 132.00 129.47 1duy h PRO 267 Ca -0.35 0.02 -0.65 0.00 -0.87 0.00 0.00 66.00 64.15 1duy h PRO 267 Cb 1.14 0.07 -0.15 0.00 0.13 0.00 0.00 31.00 32.18 1duy h PRO 267 CO 0.59 -0.20 -0.74 0.15 -0.23 0.00 0.00 178.00 177.58 1duy s LYS 268 N -6.06 2.05 0.63 0.86 1.02 -1.26 -5.11 119.74 111.87 1duy s LYS 268 Ca -0.15 -1.15 -0.17 0.00 0.02 0.00 0.00 55.97 54.52 1duy s LYS 268 Cb 0.11 -2.22 -0.01 0.00 -0.52 0.00 0.00 37.83 35.19 1duy s LYS 268 CO 0.67 0.47 1.16 -2.14 -0.92 0.00 0.00 175.35 174.59 1duy s PRO 269 N -2.47 2.81 -0.03 -1.68 0.02 -1.26 -4.94 135.00 127.45 1duy s PRO 269 Ca 0.22 1.63 -0.13 0.00 0.02 0.00 0.00 61.00 62.74 1duy s PRO 269 Cb -0.10 -1.93 -0.05 0.00 0.02 0.00 0.00 34.50 32.44 1duy s PRO 269 CO 0.14 -1.28 0.35 -0.51 -0.33 0.00 0.00 177.00 175.37 1duy s LEU 270 N -4.51 4.45 -0.27 -5.54 1.43 0.59 -4.92 118.68 109.91 1duy s LEU 270 Ca 0.72 0.85 0.01 0.00 -1.03 0.00 0.00 54.13 54.68 1duy s LEU 270 Cb -0.26 -2.48 0.08 0.00 0.03 0.00 0.00 46.19 43.56 1duy s LEU 270 CO 0.37 0.33 0.00 -0.89 0.23 0.00 0.00 176.35 176.39 1duy s THR 271 N -0.98 1.43 0.16 5.49 2.01 -1.26 -1.36 115.64 121.15 1duy s THR 271 Ca 0.22 -1.39 0.05 0.00 0.31 0.00 0.00 61.69 60.88 1duy s THR 271 Cb -0.16 -1.86 -0.04 0.00 0.01 0.00 0.00 72.50 70.46 1duy s THR 271 CO 0.11 -0.32 0.11 -0.76 -0.69 0.00 0.00 174.62 173.07 1duy s LEU 272 N 1.40 3.70 -0.12 4.42 1.43 0.15 -4.93 118.68 124.73 1duy s LEU 272 Ca 0.01 -0.18 -0.14 0.00 -1.03 0.00 0.00 54.13 52.78 1duy s LEU 272 Cb -0.18 -2.32 0.04 0.00 0.03 0.00 0.00 46.19 43.75 1duy s LEU 272 CO -0.11 0.08 0.39 -0.60 0.23 0.00 0.00 176.35 176.33 1duy s ARG 273 N -3.05 0.52 -0.14 1.70 3.52 -1.26 0.22 118.95 120.47 1duy s ARG 273 Ca 0.30 0.38 -0.26 0.00 -0.13 0.00 0.00 55.73 56.02 1duy s ARG 273 Cb -0.10 0.25 -0.02 0.00 -1.56 0.00 0.00 34.95 33.52 1duy s ARG 273 CO 0.22 -0.09 0.87 -0.46 -0.81 0.00 0.00 175.30 175.03 1duy s TRP 274 N -0.17 3.47 0.00 5.12 -0.11 -1.26 -5.04 118.94 120.95 1duy s TRP 274 Ca -0.03 1.36 0.00 0.00 1.22 0.00 0.00 56.10 58.65 1duy s TRP 274 Cb -0.03 -3.05 0.00 0.00 -1.50 0.00 0.00 33.47 28.89 1duy s TRP 274 CO 0.02 -0.20 0.00 -0.85 -4.62 0.00 0.00 176.95 171.29