#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r56 n GLN 5 N 0.00 -1.36 -3.33 -0.78 -0.06 -1.26 -5.03 117.38 105.56 2r56 n GLN 5 Ca 0.00 1.37 -0.19 0.00 -2.00 0.00 0.00 57.00 56.18 2r56 n GLN 5 Cb 0.00 -5.18 -0.01 0.00 -4.06 0.00 0.00 30.24 20.99 2r56 n GLN 5 CO 0.00 0.00 0.00 0.95 -0.20 0.00 0.00 177.06 177.81 2r56 s THR 6 N -3.00 3.11 0.77 1.69 -4.23 -1.26 -4.97 115.64 107.75 2r56 s THR 6 Ca 0.00 -1.14 -0.15 0.00 -1.18 0.00 0.00 61.69 59.22 2r56 s THR 6 Cb -0.00 -3.08 0.01 0.00 1.34 0.00 0.00 72.50 70.77 2r56 s THR 6 CO 0.77 -0.04 0.80 0.80 -0.54 0.00 0.00 174.62 176.42 2r56 n MET 7 N -1.68 0.27 0.00 3.99 1.56 -0.86 -5.00 117.12 115.41 2r56 n MET 7 Ca 0.04 0.15 0.00 0.00 -0.27 0.00 0.00 57.70 57.62 2r56 n MET 7 Cb 0.60 -2.09 0.00 0.00 2.15 0.00 0.00 33.22 33.88 2r56 n MET 7 CO 0.00 0.00 0.00 1.63 -0.73 0.00 0.00 175.97 176.87 2r56 n LYS 8 N -1.76 0.00 -2.27 2.12 5.02 -1.26 -4.12 118.16 115.88 2r56 n LYS 8 Ca 0.11 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 56.00 2r56 n LYS 8 Cb 0.50 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.48 2r56 n LYS 8 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2r56 s GLY 9 N 0.00 2.88 -0.08 0.72 0.00 -1.26 -3.38 107.32 106.21 2r56 s GLY 9 Ca 0.00 1.09 0.04 0.00 0.00 0.00 0.00 44.72 45.84 2r56 s GLY 9 CO 0.00 1.81 -0.20 -2.27 0.00 0.00 0.00 173.10 172.44 2r56 s LEU 10 N -1.20 2.38 -1.21 0.66 2.96 -1.26 -4.97 118.68 116.03 2r56 s LEU 10 Ca 0.49 -0.40 -0.15 0.00 -0.22 0.00 0.00 54.13 53.85 2r56 s LEU 10 Cb -0.36 -1.47 0.15 0.00 0.50 0.00 0.00 46.19 45.00 2r56 s LEU 10 CO 0.45 0.24 1.48 -0.62 -1.32 0.00 0.00 176.35 176.58 2r56 s ASP 11 N -0.10 6.99 0.38 3.68 3.68 -1.26 -4.86 116.67 125.18 2r56 s ASP 11 Ca -0.04 -2.81 0.21 0.00 2.13 0.00 0.00 52.55 52.04 2r56 s ASP 11 Cb -0.14 -2.44 1.24 0.00 -1.45 0.00 0.00 42.92 40.13 2r56 s ASP 11 CO 0.04 -0.86 1.65 0.40 0.13 0.00 0.00 175.17 176.53 2r56 h ILE 12 N 4.94 0.23 0.00 4.11 2.04 -1.97 0.17 117.51 127.03 2r56 h ILE 12 Ca 0.34 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 66.11 2r56 h ILE 12 Cb 0.88 -0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.96 2r56 h ILE 12 CO 1.29 0.04 -0.05 1.56 0.00 0.00 0.00 178.15 180.99 2r56 h GLN 13 N 0.21 0.00 0.00 2.37 1.08 -1.99 -3.06 115.11 113.72 2r56 h GLN 13 Ca 0.76 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.96 2r56 h GLN 13 Cb 2.03 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.46 2r56 h GLN 13 CO -0.53 0.05 -1.03 1.63 -0.95 0.00 0.00 178.83 178.00 2r56 n LYS 14 N -3.59 0.24 0.00 1.46 5.02 0.61 -3.95 118.16 117.95 2r56 n LYS 14 Ca -0.02 -0.01 0.15 0.00 -2.02 0.00 0.00 58.31 56.40 2r56 n LYS 14 Cb 0.16 -1.57 0.75 0.00 -0.02 0.00 0.00 35.03 34.35 2r56 n LYS 14 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2r56 n VAL 15 N -1.88 0.00 -1.67 -0.18 0.24 -1.16 -4.88 118.33 108.80 2r56 n VAL 15 Ca 0.02 -0.03 -0.36 0.00 -2.04 0.00 0.00 64.34 61.93 2r56 n VAL 15 Cb 0.42 -0.31 0.07 0.00 -1.47 0.00 0.00 33.84 32.55 2r56 n VAL 15 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2r56 s ALA 16 N -2.34 2.30 0.00 2.33 0.00 -1.25 -4.67 121.76 118.12 2r56 s ALA 16 Ca 0.35 1.06 0.00 0.00 0.00 0.00 0.00 51.96 53.36 2r56 s ALA 16 Cb 0.21 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.82 2r56 s ALA 16 CO 0.43 -1.63 0.00 0.41 0.00 0.00 0.00 175.76 174.97 2r56 n GLY 17 N 0.65 -0.18 3.79 0.00 0.00 -0.57 -4.92 105.19 103.95 2r56 n GLY 17 Ca 0.15 -2.25 -0.36 0.00 0.00 0.00 0.00 46.02 43.55 2r56 n GLY 17 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r56 s THR 18 N 0.00 4.06 0.20 2.61 2.01 -1.26 -1.19 115.64 122.06 2r56 s THR 18 Ca 0.00 1.58 -0.08 0.00 0.31 0.00 0.00 61.69 63.50 2r56 s THR 18 Cb 0.00 -3.82 -0.02 0.00 0.01 0.00 0.00 72.50 68.67 2r56 s THR 18 CO 0.00 0.01 0.29 0.26 -0.69 0.00 0.00 174.62 174.50 2r56 s TRP 19 N -1.73 0.60 0.01 4.92 0.52 -0.48 -4.61 118.94 118.18 2r56 s TRP 19 Ca 0.55 -0.93 0.01 0.00 0.02 0.00 0.00 56.10 55.75 2r56 s TRP 19 Cb -0.18 -0.13 -0.01 0.00 -1.15 0.00 0.00 33.47 32.00 2r56 s TRP 19 CO 0.23 -0.78 -0.04 0.71 0.02 0.00 0.00 176.95 177.10 2r56 s TYR 20 N -4.04 0.38 -0.63 -1.98 1.51 -0.39 -4.25 117.35 107.96 2r56 s TYR 20 Ca 0.25 -0.22 -0.21 0.00 -1.01 0.00 0.00 57.07 55.87 2r56 s TYR 20 Cb 0.03 -0.24 0.08 0.00 -0.11 0.00 0.00 41.96 41.72 2r56 s TYR 20 CO 0.06 -0.05 0.86 -1.12 -1.11 0.00 0.00 175.55 174.20 2r56 s SER 21 N -0.61 6.18 -0.03 2.29 0.01 -1.26 -1.46 113.70 118.81 2r56 s SER 21 Ca -0.04 -1.17 -0.23 0.00 1.31 0.00 0.00 55.95 55.83 2r56 s SER 21 Cb -0.04 -2.37 -0.22 0.00 0.21 0.00 0.00 66.02 63.59 2r56 s SER 21 CO -0.00 -1.32 1.09 0.25 0.41 0.00 0.00 173.24 173.67 2r56 h LEU 22 N 10.82 0.29 -7.80 2.44 6.46 -1.36 -3.45 115.31 122.72 2r56 h LEU 22 Ca -0.29 -0.73 -0.11 0.00 -0.12 0.00 0.00 57.88 56.64 2r56 h LEU 22 Cb 1.08 -0.09 -0.17 0.00 -0.73 0.00 0.00 40.66 40.75 2r56 h LEU 22 CO 1.15 0.97 -0.42 0.00 -0.62 0.00 0.00 178.44 179.53 2r56 s ALA 23 N -3.32 -0.25 0.07 1.25 0.00 -1.19 0.11 121.76 118.44 2r56 s ALA 23 Ca -0.15 -0.43 -0.12 0.00 0.00 0.00 0.00 51.96 51.26 2r56 s ALA 23 Cb 0.02 0.32 0.01 0.00 0.00 0.00 0.00 23.12 23.47 2r56 s ALA 23 CO 0.75 -0.39 0.27 0.00 0.00 0.00 0.00 175.76 176.40 2r56 s MET 24 N -2.90 0.86 0.07 0.00 0.23 -0.11 -1.06 119.30 116.40 2r56 s MET 24 Ca -0.02 -0.71 -0.11 0.00 -1.03 0.00 0.00 55.69 53.82 2r56 s MET 24 Cb 0.00 0.36 0.01 0.00 -1.53 0.00 0.00 34.83 33.68 2r56 s MET 24 CO -0.06 -0.29 0.24 0.00 -2.03 0.00 0.00 175.02 172.89 2r56 s ALA 25 N -3.23 -0.44 0.08 3.16 0.00 -0.28 -0.51 121.76 120.54 2r56 s ALA 25 Ca -0.00 -0.34 -0.12 0.00 0.00 0.00 0.00 51.96 51.49 2r56 s ALA 25 Cb 0.02 0.43 0.02 0.00 0.00 0.00 0.00 23.12 23.59 2r56 s ALA 25 CO -0.08 -0.48 0.28 0.00 0.00 0.00 0.00 175.76 175.49 2r56 s ALA 26 N -3.31 -0.57 0.18 0.00 0.00 -1.04 -0.19 121.76 116.84 2r56 s ALA 26 Ca 0.01 -0.25 0.17 0.00 0.00 0.00 0.00 51.96 51.89 2r56 s ALA 26 Cb 0.02 0.48 0.61 0.00 0.00 0.00 0.00 23.12 24.23 2r56 s ALA 26 CO -0.08 -0.51 1.71 0.66 0.00 0.00 0.00 175.76 177.54 2r56 h SER 27 N 2.82 0.00 -3.37 0.00 4.64 -1.38 -0.36 113.55 115.91 2r56 h SER 27 Ca -0.33 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.37 2r56 h SER 27 Cb 1.21 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 62.97 2r56 h SER 27 CO 0.50 0.42 -0.85 -1.81 -0.87 0.00 0.00 176.83 174.21 2r56 s ASP 28 N -6.51 2.59 0.23 4.97 1.11 -1.26 -3.82 116.67 113.99 2r56 s ASP 28 Ca -0.00 -0.46 -0.06 0.00 0.18 0.00 0.00 52.55 52.21 2r56 s ASP 28 Cb 0.11 -1.19 0.40 0.00 1.07 0.00 0.00 42.92 43.31 2r56 s ASP 28 CO 0.70 0.11 1.74 0.40 1.18 0.00 0.00 175.17 179.30 2r56 h ILE 29 N 5.81 0.70 -0.10 0.77 2.04 -1.83 -0.68 117.51 124.21 2r56 h ILE 29 Ca -0.24 -0.15 0.03 0.00 1.00 0.00 0.00 64.86 65.50 2r56 h ILE 29 Cb 1.22 0.22 -0.00 0.00 -0.74 0.00 0.00 36.82 37.51 2r56 h ILE 29 CO 0.47 0.08 0.21 0.77 0.00 0.00 0.00 178.15 179.68 2r56 h SER 30 N 0.44 0.00 -0.07 1.72 4.64 -1.96 0.92 113.55 119.24 2r56 h SER 30 Ca 0.38 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.63 2r56 h SER 30 Cb 0.54 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.61 2r56 h SER 30 CO -0.37 0.00 -0.16 -0.07 -0.87 0.00 0.00 176.83 175.36 2r56 h LEU 31 N 0.00 0.42 0.00 5.97 3.38 -1.51 -3.34 115.31 120.22 2r56 h LEU 31 Ca 0.05 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2r56 h LEU 31 Cb 0.47 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2r56 h LEU 31 CO -0.00 0.61 -0.78 0.18 0.09 0.00 0.00 178.44 178.54 2r56 n LEU 32 N -4.19 0.00 -4.69 1.67 4.32 -0.62 -2.72 117.00 110.77 2r56 n LEU 32 Ca 0.00 -0.03 -0.42 0.00 -0.02 0.00 0.00 56.01 55.53 2r56 n LEU 32 Cb 0.33 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.10 2r56 n LEU 32 CO 0.40 0.00 1.48 -0.67 -1.22 0.00 0.00 177.39 177.38 2r56 n ASP 33 N -1.23 4.04 -0.00 -1.43 2.03 0.31 -4.48 116.55 115.78 2r56 n ASP 33 Ca 0.00 0.98 0.00 0.00 0.52 0.00 0.00 54.79 56.29 2r56 n ASP 33 Cb 0.00 -1.54 0.00 0.00 -0.72 0.00 0.00 41.12 38.86 2r56 n ASP 33 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2r56 n ALA 34 N 5.70 -2.99 -0.30 -1.67 0.00 -1.26 -4.59 120.51 115.40 2r56 n ALA 34 Ca 0.18 0.00 0.24 0.00 0.00 0.00 0.00 53.44 53.86 2r56 n ALA 34 Cb 0.37 -0.50 0.55 0.00 0.00 0.00 0.00 19.45 19.87 2r56 n ALA 34 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2r56 h GLN 35 N 0.00 0.32 -2.01 0.00 4.15 -2.00 -2.45 115.11 113.12 2r56 h GLN 35 Ca 0.00 -0.02 -0.27 0.00 0.77 0.00 0.00 58.65 59.13 2r56 h GLN 35 Cb 0.00 -0.07 -0.10 0.00 0.21 0.00 0.00 27.48 27.52 2r56 h GLN 35 CO 0.00 0.21 -0.17 0.45 -1.93 0.00 0.00 178.83 177.39 2r56 n SER 36 N -4.54 5.56 -4.88 -0.69 2.88 -1.26 -4.52 113.62 106.17 2r56 n SER 36 Ca 0.24 -2.66 -0.30 0.00 -1.33 0.00 0.00 58.87 54.82 2r56 n SER 36 Cb 0.90 -1.37 -0.04 0.00 -0.75 0.00 0.00 64.21 62.95 2r56 n SER 36 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2r56 s ALA 37 N 0.34 3.49 -0.83 -1.46 0.00 -0.92 -4.99 121.76 117.39 2r56 s ALA 37 Ca 0.65 -0.34 0.21 0.00 0.00 0.00 0.00 51.96 52.48 2r56 s ALA 37 Cb 0.33 -2.50 0.85 0.00 0.00 0.00 0.00 23.12 21.81 2r56 s ALA 37 CO -0.06 0.21 1.65 -0.35 0.00 0.00 0.00 175.76 177.21 2r56 n PRO 38 N -0.89 0.08 -0.09 0.00 -0.04 -1.24 -3.22 135.00 129.60 2r56 n PRO 38 Ca 0.00 0.25 0.01 0.00 -0.04 0.00 0.00 63.50 63.73 2r56 n PRO 38 Cb 0.54 -1.64 0.02 0.00 -0.04 0.00 0.00 33.50 32.38 2r56 n PRO 38 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2r56 n LEU 39 N -1.79 0.92 -4.06 1.53 4.77 -1.10 -4.90 117.00 112.37 2r56 n LEU 39 Ca 0.04 -1.18 -0.43 0.00 -0.03 0.00 0.00 56.01 54.41 2r56 n LEU 39 Cb 0.24 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 2r56 n LEU 39 CO 0.19 0.29 1.77 -1.14 -1.33 0.00 0.00 177.39 177.17 2r56 n ARG 40 N -0.34 3.55 -4.10 3.23 0.63 -1.20 -4.94 116.66 113.50 2r56 n ARG 40 Ca 0.02 -3.64 -0.24 0.00 -0.92 0.00 0.00 57.85 53.07 2r56 n ARG 40 Cb 0.47 -2.96 -0.05 0.00 0.45 0.00 0.00 32.46 30.37 2r56 n ARG 40 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 2r56 s VAL 41 N 0.75 4.47 -0.14 5.15 -7.23 -1.26 -4.39 120.40 117.75 2r56 s VAL 41 Ca 0.41 -1.22 0.00 0.00 -1.81 0.00 0.00 61.98 59.35 2r56 s VAL 41 Cb 0.06 -3.34 0.02 0.00 0.56 0.00 0.00 36.38 33.67 2r56 s VAL 41 CO 0.00 -0.22 -0.12 -0.31 -0.31 0.00 0.00 175.10 174.15 2r56 s TYR 42 N -1.92 1.98 0.29 2.82 1.51 0.58 -4.95 117.35 117.65 2r56 s TYR 42 Ca 0.32 -1.10 -0.29 0.00 -1.01 0.00 0.00 57.07 54.99 2r56 s TYR 42 Cb -0.09 -1.49 -0.09 0.00 -0.11 0.00 0.00 41.96 40.17 2r56 s TYR 42 CO 0.24 -0.63 1.09 0.08 -1.11 0.00 0.00 175.55 175.23 2r56 s VAL 43 N 1.55 3.51 0.00 0.71 1.01 -1.26 -0.91 120.40 125.00 2r56 s VAL 43 Ca 0.05 1.48 0.00 0.00 0.00 0.00 0.00 61.98 63.51 2r56 s VAL 43 Cb -0.13 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 32.33 2r56 s VAL 43 CO -0.10 0.32 0.00 -0.62 0.00 0.00 0.00 175.10 174.70 2r56 n GLU 44 N 1.06 0.00 -3.88 2.72 1.02 0.12 -4.16 120.64 117.52 2r56 n GLU 44 Ca -0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.02 2r56 n GLU 44 Cb 0.45 -0.65 -0.12 0.00 -0.02 0.00 0.00 31.44 31.10 2r56 n GLU 44 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2r56 s GLU 45 N -1.81 0.24 -0.25 3.49 2.56 -1.06 -1.38 118.70 120.48 2r56 s GLU 45 Ca 0.00 -0.15 0.02 0.00 0.00 0.00 0.00 54.97 54.85 2r56 s GLU 45 Cb 0.00 0.10 0.06 0.00 2.00 0.00 0.00 34.13 36.29 2r56 s GLU 45 CO 0.00 -0.04 -0.09 -0.51 -0.56 0.00 0.00 175.26 174.06 2r56 s LEU 46 N -0.59 3.16 -0.32 2.70 1.43 -0.33 -1.22 118.68 123.50 2r56 s LEU 46 Ca -0.07 -1.33 -0.01 0.00 -1.03 0.00 0.00 54.13 51.69 2r56 s LEU 46 Cb -0.04 -1.42 0.07 0.00 0.03 0.00 0.00 46.19 44.82 2r56 s LEU 46 CO 0.00 -0.21 0.03 -0.75 0.23 0.00 0.00 176.35 175.66 2r56 s LYS 47 N 1.20 2.19 0.25 1.70 2.20 -0.01 -1.51 119.74 125.77 2r56 s LYS 47 Ca -0.08 -1.47 -0.30 0.00 -0.36 0.00 0.00 55.97 53.77 2r56 s LYS 47 Cb -0.20 -3.23 -0.09 0.00 -1.51 0.00 0.00 37.83 32.81 2r56 s LYS 47 CO -0.05 -0.75 1.17 -1.25 -0.36 0.00 0.00 175.35 174.11 2r56 s PRO 48 N 1.16 4.54 0.31 4.03 0.04 -1.26 0.97 135.00 144.79 2r56 s PRO 48 Ca -0.01 1.90 0.03 0.00 0.04 0.00 0.00 61.00 62.97 2r56 s PRO 48 Cb -0.20 -3.19 -0.03 0.00 0.04 0.00 0.00 34.50 31.12 2r56 s PRO 48 CO -0.03 0.03 0.47 0.95 0.04 0.00 0.00 177.00 178.46 2r56 s THR 49 N -0.74 4.96 0.25 1.26 -4.23 0.36 -4.87 115.64 112.63 2r56 s THR 49 Ca 0.48 -0.75 -0.06 0.00 -1.18 0.00 0.00 61.69 60.19 2r56 s THR 49 Cb -0.34 -3.78 0.26 0.00 1.34 0.00 0.00 72.50 69.99 2r56 s THR 49 CO 0.41 -0.40 1.93 1.55 -0.54 0.00 0.00 174.62 177.57 2r56 h PRO 50 N 0.92 1.32 0.00 3.99 0.13 -1.97 -1.28 132.00 135.11 2r56 h PRO 50 Ca -0.50 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.55 2r56 h PRO 50 Cb 1.23 -0.30 0.00 0.00 0.13 0.00 0.00 31.00 32.06 2r56 h PRO 50 CO 0.60 0.87 0.00 -0.85 -0.23 0.00 0.00 178.00 178.39 2r56 n GLU 51 N -4.39 0.33 -0.28 0.86 0.00 -1.26 -4.78 120.64 111.12 2r56 n GLU 51 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.28 2r56 n GLU 51 Cb 0.02 -1.46 0.00 0.00 0.00 0.00 0.00 31.44 30.00 2r56 n GLU 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2r56 n GLY 52 N -0.32 0.67 3.95 -1.84 0.00 -0.48 -4.99 105.19 102.18 2r56 n GLY 52 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 2r56 n GLY 52 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2r56 s ASP 53 N -2.86 3.77 -0.17 1.61 1.01 -1.25 -4.51 116.67 114.27 2r56 s ASP 53 Ca 0.00 0.12 -0.01 0.00 0.71 0.00 0.00 52.55 53.37 2r56 s ASP 53 Cb 0.00 -0.36 0.04 0.00 1.01 0.00 0.00 42.92 43.62 2r56 s ASP 53 CO 0.00 -2.29 -0.03 -0.22 0.21 0.00 0.00 175.17 172.84 2r56 s LEU 54 N -5.57 1.49 0.27 1.23 2.96 -0.79 -0.49 118.68 117.79 2r56 s LEU 54 Ca 0.69 -0.67 -0.22 0.00 -0.22 0.00 0.00 54.13 53.71 2r56 s LEU 54 Cb -0.05 -0.83 -0.09 0.00 0.50 0.00 0.00 46.19 45.72 2r56 s LEU 54 CO 0.49 -0.21 0.82 -0.70 -1.32 0.00 0.00 176.35 175.43 2r56 s GLU 55 N 1.69 4.38 -0.07 1.98 2.12 0.27 -0.85 118.70 128.23 2r56 s GLU 55 Ca 0.00 1.06 0.01 0.00 0.36 0.00 0.00 54.97 56.40 2r56 s GLU 55 Cb -0.15 -2.81 0.02 0.00 0.26 0.00 0.00 34.13 31.45 2r56 s GLU 55 CO -0.07 0.33 -0.07 0.42 -0.54 0.00 0.00 175.26 175.32 2r56 s ILE 56 N -1.60 0.82 -0.26 -3.70 1.01 0.49 -0.83 121.20 117.14 2r56 s ILE 56 Ca 0.47 -0.24 -0.12 0.00 0.00 0.00 0.00 60.65 60.76 2r56 s ILE 56 Cb -0.17 -0.83 -0.05 0.00 0.01 0.00 0.00 42.46 41.42 2r56 s ILE 56 CO 0.22 0.31 0.22 -0.22 0.00 0.00 0.00 174.94 175.46 2r56 s LEU 57 N 1.18 4.07 0.25 2.97 2.96 -0.36 -0.02 118.68 129.73 2r56 s LEU 57 Ca -0.06 0.11 -0.05 0.00 -0.22 0.00 0.00 54.13 53.91 2r56 s LEU 57 Cb -0.14 -2.18 -0.02 0.00 0.50 0.00 0.00 46.19 44.35 2r56 s LEU 57 CO -0.02 -0.02 0.33 -1.48 -1.32 0.00 0.00 176.35 173.83 2r56 s LEU 58 N 1.49 0.84 0.05 -0.68 0.05 0.08 -0.71 118.68 119.81 2r56 s LEU 58 Ca 0.09 -1.25 0.06 0.00 0.05 0.00 0.00 54.13 53.08 2r56 s LEU 58 Cb -0.15 1.09 -0.03 0.00 -2.05 0.00 0.00 46.19 45.06 2r56 s LEU 58 CO 0.08 -1.04 -0.17 -1.10 -0.55 0.00 0.00 176.35 173.57 2r56 s GLN 59 N -3.90 1.07 -0.12 1.48 -1.52 -0.09 -0.39 119.66 116.20 2r56 s GLN 59 Ca 0.31 -0.89 -0.29 0.00 -1.95 0.00 0.00 55.36 52.54 2r56 s GLN 59 Cb 0.03 -1.15 0.08 0.00 -0.22 0.00 0.00 33.01 31.74 2r56 s GLN 59 CO 0.13 0.28 0.74 -1.59 -0.25 0.00 0.00 175.29 174.60 2r56 s LYS 60 N -1.33 0.94 0.36 2.91 -2.85 -0.96 -0.31 119.74 118.51 2r56 s LYS 60 Ca 0.03 0.43 -0.27 0.00 -1.00 0.00 0.00 55.97 55.17 2r56 s LYS 60 Cb -0.09 0.45 -0.09 0.00 -2.06 0.00 0.00 37.83 36.04 2r56 s LYS 60 CO 0.02 -0.25 1.21 -0.46 0.10 0.00 0.00 175.35 175.97 2r56 s TRP 61 N -0.77 3.12 -0.29 1.78 -0.11 -1.26 -1.49 118.94 119.92 2r56 s TRP 61 Ca -0.07 1.53 0.00 0.00 1.22 0.00 0.00 56.10 58.78 2r56 s TRP 61 Cb -0.01 -3.48 0.18 0.00 -1.50 0.00 0.00 33.47 28.65 2r56 s TRP 61 CO 0.06 -1.42 0.54 -2.00 -4.62 0.00 0.00 176.95 169.52 2r56 s GLU 62 N -2.01 0.51 -0.94 5.86 2.12 -0.27 -4.80 118.70 119.16 2r56 s GLU 62 Ca 0.53 0.77 -0.09 0.00 0.36 0.00 0.00 54.97 56.54 2r56 s GLU 62 Cb -0.34 0.23 -0.01 0.00 0.26 0.00 0.00 34.13 34.27 2r56 s GLU 62 CO 0.44 -0.73 0.74 -1.71 -0.54 0.00 0.00 175.26 173.46 2r56 n ASN 63 N 5.41 -6.17 -3.76 -1.70 4.05 -1.26 -3.16 115.26 108.68 2r56 n ASN 63 Ca -0.00 -0.68 -0.24 0.00 0.45 0.00 0.00 54.58 54.10 2r56 n ASN 63 Cb 0.51 -3.85 0.04 0.00 1.23 0.00 0.00 39.78 37.71 2r56 n ASN 63 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2r56 n GLY 64 N -1.65 -0.38 3.65 8.20 0.00 -1.26 -4.97 105.19 108.77 2r56 n GLY 64 Ca -0.11 0.16 -0.02 0.00 0.00 0.00 0.00 46.02 46.05 2r56 n GLY 64 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2r56 s GLU 65 N -6.20 0.15 0.10 1.61 2.12 -1.19 -5.14 118.70 110.15 2r56 s GLU 65 Ca 0.28 0.21 -0.30 0.00 0.36 0.00 0.00 54.97 55.51 2r56 s GLU 65 Cb -0.14 0.06 -0.06 0.00 0.26 0.00 0.00 34.13 34.25 2r56 s GLU 65 CO 0.81 -0.02 1.14 0.00 -0.54 0.00 0.00 175.26 176.65 2r56 s ALA 67 N 0.57 2.27 -0.10 0.00 0.00 -0.56 -4.94 121.76 119.01 2r56 s ALA 67 Ca 0.55 -1.20 -0.14 0.00 0.00 0.00 0.00 51.96 51.16 2r56 s ALA 67 Cb -0.29 -0.54 -0.05 0.00 0.00 0.00 0.00 23.12 22.24 2r56 s ALA 67 CO 0.31 0.54 0.34 -1.14 0.00 0.00 0.00 175.76 175.81 2r56 s GLN 68 N -1.03 4.06 0.02 0.00 0.74 -1.26 -2.26 119.66 119.93 2r56 s GLN 68 Ca 0.11 0.22 0.01 0.00 0.05 0.00 0.00 55.36 55.75 2r56 s GLN 68 Cb -0.10 -3.33 -0.01 0.00 1.10 0.00 0.00 33.01 30.66 2r56 s GLN 68 CO 0.01 0.44 -0.04 0.15 -0.55 0.00 0.00 175.29 175.30 2r56 s LYS 69 N -0.18 0.29 -0.26 1.67 1.02 0.48 -4.99 119.74 117.77 2r56 s LYS 69 Ca 0.20 -0.42 -0.03 0.00 0.02 0.00 0.00 55.97 55.75 2r56 s LYS 69 Cb -0.14 -0.08 0.02 0.00 -0.52 0.00 0.00 37.83 37.11 2r56 s LYS 69 CO 0.08 0.01 -0.03 0.15 -0.92 0.00 0.00 175.35 174.64 2r56 s LYS 70 N -0.90 2.86 0.07 1.68 1.02 -1.26 -0.75 119.74 122.47 2r56 s LYS 70 Ca -0.08 -0.97 0.06 0.00 0.02 0.00 0.00 55.97 55.00 2r56 s LYS 70 Cb -0.06 -3.07 -0.04 0.00 -0.52 0.00 0.00 37.83 34.14 2r56 s LYS 70 CO -0.00 -0.42 -0.10 0.42 -0.92 0.00 0.00 175.35 174.33 2r56 s ILE 71 N 1.35 3.38 -0.23 2.17 -1.09 0.97 -4.89 121.20 122.86 2r56 s ILE 71 Ca 0.00 -1.13 -0.01 0.00 -2.23 0.00 0.00 60.65 57.28 2r56 s ILE 71 Cb -0.17 -2.53 0.02 0.00 -1.58 0.00 0.00 42.46 38.20 2r56 s ILE 71 CO -0.03 0.21 -0.08 0.27 -1.23 0.00 0.00 174.94 174.08 2r56 s ILE 72 N -1.13 2.77 -0.45 2.92 -0.00 -1.26 0.19 121.20 124.24 2r56 s ILE 72 Ca 0.20 -0.97 -0.17 0.00 -0.00 0.00 0.00 60.65 59.71 2r56 s ILE 72 Cb -0.11 -2.36 0.04 0.00 -0.00 0.00 0.00 42.46 40.03 2r56 s ILE 72 CO 0.11 0.28 0.45 0.00 -0.00 0.00 0.00 174.94 175.77 2r56 s ALA 73 N 1.33 3.46 0.07 2.27 0.00 -0.03 -4.26 121.76 124.60 2r56 s ALA 73 Ca 0.01 -1.75 -0.30 0.00 0.00 0.00 0.00 51.96 49.93 2r56 s ALA 73 Cb -0.16 -3.10 -0.05 0.00 0.00 0.00 0.00 23.12 19.82 2r56 s ALA 73 CO -0.06 -1.69 1.05 -1.21 0.00 0.00 0.00 175.76 173.85 2r56 s GLU 74 N 2.04 4.56 0.49 0.00 2.02 0.12 -1.89 118.70 126.04 2r56 s GLU 74 Ca 0.10 1.56 -0.22 0.00 0.02 0.00 0.00 54.97 56.43 2r56 s GLU 74 Cb -0.20 -3.38 -0.07 0.00 0.10 0.00 0.00 34.13 30.58 2r56 s GLU 74 CO 0.11 -0.03 1.15 -1.59 0.02 0.00 0.00 175.26 174.92 2r56 s LYS 75 N 0.60 3.62 0.16 1.61 0.00 -1.26 -0.48 119.74 123.98 2r56 s LYS 75 Ca 0.52 1.72 0.00 0.00 0.00 0.00 0.00 55.97 58.21 2r56 s LYS 75 Cb -0.25 -2.27 0.00 0.00 0.00 0.00 0.00 37.83 35.31 2r56 s LYS 75 CO 0.30 -0.65 0.02 0.25 0.00 0.00 0.00 175.35 175.27 2r56 n THR 76 N -0.76 0.00 0.62 3.79 -2.24 -1.16 -4.88 114.28 109.64 2r56 n THR 76 Ca 0.09 -0.72 -0.00 0.00 -2.27 0.00 0.00 64.05 61.14 2r56 n THR 76 Cb 0.49 0.07 0.06 0.00 -2.10 0.00 0.00 70.33 68.85 2r56 n THR 76 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2r56 n LYS 77 N -0.46 1.59 -4.55 -0.78 5.02 -1.26 -4.70 118.16 113.02 2r56 n LYS 77 Ca -0.06 -0.59 -0.26 0.00 -2.02 0.00 0.00 58.31 55.38 2r56 n LYS 77 Cb 0.19 -1.52 -0.17 0.00 -0.02 0.00 0.00 35.03 33.52 2r56 n LYS 77 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2r56 s ILE 78 N -1.12 1.28 0.00 -0.18 1.01 -1.26 -5.11 121.20 115.83 2r56 s ILE 78 Ca 0.11 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 60.21 2r56 s ILE 78 Cb 0.08 -1.17 0.00 0.00 0.01 0.00 0.00 42.46 41.38 2r56 s ILE 78 CO 0.03 0.39 0.00 -2.65 0.00 0.00 0.00 174.94 172.71 2r56 n PRO 79 N 3.98 0.00 -1.74 2.79 -0.02 -1.26 -2.58 135.00 136.17 2r56 n PRO 79 Ca -0.21 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 60.90 2r56 n PRO 79 Cb 0.52 -0.04 0.05 0.00 -0.02 0.00 0.00 33.50 34.01 2r56 n PRO 79 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2r56 n ALA 80 N -0.35 6.39 -3.64 3.55 0.00 -1.22 -4.60 120.51 120.65 2r56 n ALA 80 Ca 0.00 -3.90 -0.27 0.00 0.00 0.00 0.00 53.44 49.27 2r56 n ALA 80 Cb 0.00 -1.85 -0.17 0.00 0.00 0.00 0.00 19.45 17.44 2r56 n ALA 80 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2r56 s VAL 81 N -5.00 1.33 0.44 0.00 1.01 -1.06 -1.54 120.40 115.58 2r56 s VAL 81 Ca 0.56 -0.54 0.05 0.00 0.00 0.00 0.00 61.98 62.05 2r56 s VAL 81 Cb 0.46 -1.23 -0.06 0.00 0.00 0.00 0.00 36.38 35.55 2r56 s VAL 81 CO -0.26 0.41 0.01 -0.36 0.00 0.00 0.00 175.10 174.89 2r56 s PHE 82 N 1.01 2.35 0.03 5.22 0.40 -0.80 -3.00 117.98 123.18 2r56 s PHE 82 Ca -0.07 -0.75 0.03 0.00 -0.60 0.00 0.00 56.93 55.54 2r56 s PHE 82 Cb -0.15 -1.73 -0.02 0.00 0.51 0.00 0.00 43.02 41.63 2r56 s PHE 82 CO -0.01 0.39 -0.09 0.21 0.70 0.00 0.00 175.22 176.41 2r56 s LYS 83 N -3.75 0.65 -0.22 0.44 2.20 0.37 -2.40 119.74 117.02 2r56 s LYS 83 Ca 0.27 -0.60 -0.06 0.00 -0.36 0.00 0.00 55.97 55.22 2r56 s LYS 83 Cb 0.08 -0.56 -0.03 0.00 -1.51 0.00 0.00 37.83 35.81 2r56 s LYS 83 CO 0.14 0.13 0.04 0.42 -0.36 0.00 0.00 175.35 175.72 2r56 s ILE 84 N -0.85 4.20 -1.03 5.43 1.01 -0.78 0.16 121.20 129.34 2r56 s ILE 84 Ca -0.03 -0.22 0.05 0.00 0.00 0.00 0.00 60.65 60.45 2r56 s ILE 84 Cb -0.07 -2.93 0.04 0.00 0.01 0.00 0.00 42.46 39.51 2r56 s ILE 84 CO 0.01 0.39 1.15 -0.67 0.00 0.00 0.00 174.94 175.82 2r56 n ASP 85 N 4.49 0.00 -4.50 3.58 4.64 -1.26 -3.94 116.55 119.55 2r56 n ASP 85 Ca -0.17 0.48 -0.30 0.00 -1.38 0.00 0.00 54.79 53.43 2r56 n ASP 85 Cb 0.52 -0.49 0.21 0.00 -1.04 0.00 0.00 41.12 40.32 2r56 n ASP 85 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2r56 n ALA 86 N -1.49 -2.39 -0.54 -1.67 0.00 -1.26 -4.88 120.51 108.28 2r56 n ALA 86 Ca 0.01 -0.96 -0.29 0.00 0.00 0.00 0.00 53.44 52.20 2r56 n ALA 86 Cb 0.06 -1.99 0.23 0.00 0.00 0.00 0.00 19.45 17.75 2r56 n ALA 86 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2r56 n LEU 87 N -4.06 -0.65 0.00 0.00 7.94 -1.26 -2.74 117.00 116.23 2r56 n LEU 87 Ca 0.06 -0.04 0.00 0.00 -1.11 0.00 0.00 56.01 54.92 2r56 n LEU 87 Cb 0.54 -1.26 0.00 0.00 0.53 0.00 0.00 43.42 43.23 2r56 n LEU 87 CO 0.53 -3.09 0.00 0.59 -1.11 0.00 0.00 177.39 174.32 2r56 n ASN 88 N -4.33 0.00 -3.11 1.96 3.02 -1.26 -4.06 115.26 107.49 2r56 n ASN 88 Ca 0.04 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.46 2r56 n ASN 88 Cb 0.54 -0.20 0.06 0.00 -0.61 0.00 0.00 39.78 39.58 2r56 n ASN 88 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2r56 n GLU 89 N -1.66 -2.19 -1.77 3.52 -0.58 -1.11 -2.89 120.64 113.96 2r56 n GLU 89 Ca 0.00 0.80 -0.42 0.00 -0.42 0.00 0.00 57.16 57.12 2r56 n GLU 89 Cb 0.00 -5.48 -0.03 0.00 -0.57 0.00 0.00 31.44 25.37 2r56 n GLU 89 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 2r56 s ASN 90 N -3.38 6.41 -0.08 1.62 0.01 -1.25 -3.36 114.94 114.90 2r56 s ASN 90 Ca 0.41 2.86 0.01 0.00 -0.71 0.00 0.00 52.86 55.43 2r56 s ASN 90 Cb -0.05 -2.61 -0.03 0.00 0.41 0.00 0.00 41.25 38.97 2r56 s ASN 90 CO 0.68 -0.93 -0.09 -0.54 -1.51 0.00 0.00 177.10 174.71 2r56 s LYS 91 N 0.61 2.85 -0.07 -0.60 1.02 0.20 -1.86 119.74 121.90 2r56 s LYS 91 Ca 0.70 -0.59 0.01 0.00 0.02 0.00 0.00 55.97 56.12 2r56 s LYS 91 Cb -0.48 -2.58 -0.03 0.00 -0.52 0.00 0.00 37.83 34.21 2r56 s LYS 91 CO 0.37 0.58 -0.09 0.08 -0.92 0.00 0.00 175.35 175.37 2r56 s VAL 92 N -0.58 3.50 -0.08 3.17 1.01 -1.01 -0.98 120.40 125.43 2r56 s VAL 92 Ca 0.09 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 61.52 2r56 s VAL 92 Cb -0.12 -2.42 0.02 0.00 0.00 0.00 0.00 36.38 33.86 2r56 s VAL 92 CO 0.02 0.59 -0.07 -0.76 0.00 0.00 0.00 175.10 174.87 2r56 s LEU 93 N -0.70 1.30 -0.49 3.92 2.01 -0.21 -1.91 118.68 122.61 2r56 s LEU 93 Ca 0.11 -0.23 -0.23 0.00 0.01 0.00 0.00 54.13 53.79 2r56 s LEU 93 Cb -0.11 -0.69 0.03 0.00 0.01 0.00 0.00 46.19 45.43 2r56 s LEU 93 CO 0.01 -0.06 0.81 -0.69 1.01 0.00 0.00 176.35 177.43 2r56 s VAL 94 N 1.20 4.61 0.06 -1.59 1.01 -0.59 -1.57 120.40 123.53 2r56 s VAL 94 Ca -0.05 0.26 -0.17 0.00 0.00 0.00 0.00 61.98 62.02 2r56 s VAL 94 Cb -0.14 -4.38 -0.18 0.00 0.00 0.00 0.00 36.38 31.68 2r56 s VAL 94 CO -0.02 -0.84 1.24 -0.07 0.00 0.00 0.00 175.10 175.41 2r56 h LEU 95 N 10.31 0.70 -7.13 3.92 3.38 -0.25 -2.27 115.31 123.97 2r56 h LEU 95 Ca -0.25 -0.65 0.10 0.00 0.09 0.00 0.00 57.88 57.17 2r56 h LEU 95 Cb 1.08 -0.21 -0.13 0.00 0.09 0.00 0.00 40.66 41.49 2r56 h LEU 95 CO 1.00 1.24 0.44 -0.62 0.09 0.00 0.00 178.44 180.58 2r56 s ASP 96 N -6.80 -0.37 -0.28 -0.43 2.15 -1.15 -2.98 116.67 106.82 2r56 s ASP 96 Ca -0.12 -0.08 -0.26 0.00 0.43 0.00 0.00 52.55 52.51 2r56 s ASP 96 Cb 0.06 0.45 0.17 0.00 -0.30 0.00 0.00 42.92 43.30 2r56 s ASP 96 CO 0.85 -0.74 1.32 0.28 -0.17 0.00 0.00 175.17 176.71 2r56 s THR 97 N -3.27 0.00 -1.76 1.71 -1.32 -1.26 -0.15 115.64 109.59 2r56 s THR 97 Ca 0.06 0.00 0.18 0.00 -1.21 0.00 0.00 61.69 60.72 2r56 s THR 97 Cb -0.01 -1.00 0.01 0.00 -1.51 0.00 0.00 72.50 69.99 2r56 s THR 97 CO -0.07 0.00 0.95 -0.90 -2.21 0.00 0.00 174.62 172.39 2r56 n ASP 98 N 1.37 1.87 0.00 8.08 5.75 -1.10 -4.99 116.55 127.54 2r56 n ASP 98 Ca -0.08 -1.44 0.00 0.00 -0.01 0.00 0.00 54.79 53.26 2r56 n ASP 98 Cb 0.57 0.41 0.00 0.00 -1.03 0.00 0.00 41.12 41.07 2r56 n ASP 98 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 2r56 n TYR 99 N 0.06 0.00 0.19 2.11 4.01 -1.25 -4.57 117.16 117.71 2r56 n TYR 99 Ca 0.08 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.93 2r56 n TYR 99 Cb 0.39 0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 39.34 2r56 n TYR 99 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2r56 n LYS 100 N 0.00 0.54 0.05 -0.72 4.76 -1.26 -4.84 118.16 116.69 2r56 n LYS 100 Ca 0.00 -0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.37 2r56 n LYS 100 Cb 0.00 -1.61 0.00 0.00 -1.84 0.00 0.00 35.03 31.58 2r56 n LYS 100 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2r56 n LYS 101 N -2.27 0.00 -4.43 1.97 5.02 -1.26 -4.72 118.16 112.46 2r56 n LYS 101 Ca -0.01 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.07 2r56 n LYS 101 Cb 0.53 -0.20 -0.11 0.00 -0.02 0.00 0.00 35.03 35.23 2r56 n LYS 101 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 2r56 s TYR 102 N -2.00 1.91 -0.24 2.13 1.13 -1.26 -1.46 117.35 117.56 2r56 s TYR 102 Ca 0.00 -0.93 -0.16 0.00 -1.41 0.00 0.00 57.07 54.57 2r56 s TYR 102 Cb 0.00 -1.22 0.07 0.00 -1.10 0.00 0.00 41.96 39.71 2r56 s TYR 102 CO 0.00 0.03 0.60 -1.17 -2.51 0.00 0.00 175.55 172.50 2r56 s LEU 103 N -3.46 -0.54 -0.11 -3.49 0.20 -0.98 -2.70 118.68 107.61 2r56 s LEU 103 Ca 0.35 1.28 0.04 0.00 0.69 0.00 0.00 54.13 56.48 2r56 s LEU 103 Cb 0.08 2.06 0.00 0.00 -0.43 0.00 0.00 46.19 47.90 2r56 s LEU 103 CO 0.14 -0.22 -0.23 -0.76 -0.29 0.00 0.00 176.35 174.99 2r56 s LEU 104 N 1.10 2.09 0.15 -0.68 1.43 0.79 -0.89 118.68 122.67 2r56 s LEU 104 Ca -0.06 -0.57 -0.07 0.00 -1.03 0.00 0.00 54.13 52.40 2r56 s LEU 104 Cb -0.05 -1.41 -0.02 0.00 0.03 0.00 0.00 46.19 44.74 2r56 s LEU 104 CO -0.11 0.14 0.22 0.72 0.23 0.00 0.00 176.35 177.56 2r56 s PHE 105 N 0.43 0.50 0.09 0.29 -0.71 -0.99 0.53 117.98 118.13 2r56 s PHE 105 Ca -0.17 -0.87 0.02 0.00 -1.04 0.00 0.00 56.93 54.87 2r56 s PHE 105 Cb -0.18 -0.17 -0.04 0.00 -1.21 0.00 0.00 43.02 41.43 2r56 s PHE 105 CO 0.07 -0.66 -0.07 0.00 -1.34 0.00 0.00 175.22 173.22 2r56 s MET 107 N -3.44 -0.01 0.10 0.00 0.23 0.38 -1.04 119.30 115.52 2r56 s MET 107 Ca 0.08 0.14 0.03 0.00 -1.03 0.00 0.00 55.69 54.91 2r56 s MET 107 Cb 0.03 -0.14 -0.04 0.00 -1.53 0.00 0.00 34.83 33.14 2r56 s MET 107 CO -0.04 -0.11 -0.08 -1.83 -2.03 0.00 0.00 175.02 170.94 2r56 s GLU 108 N 0.68 0.85 -0.31 3.16 -1.05 -0.16 -1.05 118.70 120.83 2r56 s GLU 108 Ca -0.06 -1.27 -0.09 0.00 -0.15 0.00 0.00 54.97 53.40 2r56 s GLU 108 Cb -0.08 -0.36 -0.00 0.00 -0.44 0.00 0.00 34.13 33.25 2r56 s GLU 108 CO -0.02 0.03 0.14 -0.80 0.95 0.00 0.00 175.26 175.55 2r56 s ASN 109 N -2.82 5.47 0.41 0.83 -0.87 -1.18 0.63 114.94 117.41 2r56 s ASN 109 Ca 0.09 -0.56 0.24 0.00 -1.57 0.00 0.00 52.86 51.06 2r56 s ASN 109 Cb 0.02 -1.98 1.28 0.00 -0.02 0.00 0.00 41.25 40.55 2r56 s ASN 109 CO -0.02 -0.19 1.66 -1.28 -2.57 0.00 0.00 177.10 174.70 2r56 h SER 110 N 8.33 0.35 -0.10 -1.22 0.87 -1.53 0.43 113.55 120.68 2r56 h SER 110 Ca -0.32 0.14 0.04 0.00 -1.23 0.00 0.00 61.79 60.42 2r56 h SER 110 Cb 1.14 0.11 -0.05 0.00 -0.44 0.00 0.00 62.40 63.16 2r56 h SER 110 CO 0.61 -0.12 -0.21 0.00 -0.53 0.00 0.00 176.83 176.58 2r56 h ALA 111 N 1.67 -0.18 -2.62 6.23 0.00 -1.87 -3.32 119.26 119.17 2r56 h ALA 111 Ca 0.75 0.04 -0.60 0.00 0.00 0.00 0.00 54.91 55.09 2r56 h ALA 111 Cb 2.12 0.40 -0.40 0.00 0.00 0.00 0.00 17.79 19.91 2r56 h ALA 111 CO -0.44 -0.67 -0.78 0.39 0.00 0.00 0.00 179.25 177.75 2r56 n GLU 112 N -5.34 1.19 -0.08 0.00 4.71 0.10 -4.97 120.64 116.26 2r56 n GLU 112 Ca -0.03 -3.90 0.00 0.00 -0.01 0.00 0.00 57.16 53.22 2r56 n GLU 112 Cb 0.26 -1.96 0.00 0.00 -1.01 0.00 0.00 31.44 28.73 2r56 n GLU 112 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 2r56 n PRO 113 N 2.12 0.61 0.00 3.49 -0.04 -0.94 -2.56 135.00 137.68 2r56 n PRO 113 Ca 0.25 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.71 2r56 n PRO 113 Cb 0.42 -1.19 0.00 0.00 -0.04 0.00 0.00 33.50 32.69 2r56 n PRO 113 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2r56 n GLU 114 N 0.94 0.83 -2.24 0.54 1.02 -1.26 -4.88 120.64 115.59 2r56 n GLU 114 Ca 0.00 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.91 2r56 n GLU 114 Cb 0.31 -0.63 0.02 0.00 -0.02 0.00 0.00 31.44 31.11 2r56 n GLU 114 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2r56 n GLN 115 N -1.09 3.36 -2.56 3.49 0.00 -1.06 -4.73 117.38 114.80 2r56 n GLN 115 Ca 0.00 -4.21 -0.04 0.00 0.00 0.00 0.00 57.00 52.75 2r56 n GLN 115 Cb 0.13 -2.19 0.06 0.00 0.00 0.00 0.00 30.24 28.24 2r56 n GLN 115 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 2r56 n SER 116 N -0.61 -1.36 -4.16 2.61 3.41 -1.22 -4.91 113.62 107.38 2r56 n SER 116 Ca 0.39 -1.97 -0.35 0.00 -0.26 0.00 0.00 58.87 56.67 2r56 n SER 116 Cb 0.85 0.86 -0.13 0.00 -0.26 0.00 0.00 64.21 65.54 2r56 n SER 116 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2r56 s LEU 117 N -2.62 4.35 0.03 1.04 2.96 -1.26 -3.11 118.68 120.07 2r56 s LEU 117 Ca 0.11 -1.50 0.07 0.00 -0.22 0.00 0.00 54.13 52.60 2r56 s LEU 117 Cb 0.24 -1.76 -0.03 0.00 0.50 0.00 0.00 46.19 45.14 2r56 s LEU 117 CO -0.06 -0.35 -0.21 0.00 -1.32 0.00 0.00 176.35 174.41 2r56 s ALA 118 N 1.23 2.45 0.09 5.97 0.00 -0.21 -1.36 121.76 129.93 2r56 s ALA 118 Ca -0.01 -1.19 0.04 0.00 0.00 0.00 0.00 51.96 50.81 2r56 s ALA 118 Cb -0.21 -0.66 -0.03 0.00 0.00 0.00 0.00 23.12 22.22 2r56 s ALA 118 CO -0.02 0.55 -0.12 0.00 0.00 0.00 0.00 175.76 176.18 2r56 s GLN 120 N -2.41 0.60 -0.28 0.00 -0.21 0.10 -1.13 119.66 116.34 2r56 s GLN 120 Ca 0.03 -0.98 0.01 0.00 0.02 0.00 0.00 55.36 54.44 2r56 s GLN 120 Cb -0.06 0.22 0.06 0.00 1.00 0.00 0.00 33.01 34.23 2r56 s GLN 120 CO 0.01 -0.14 -0.06 0.00 -2.12 0.00 0.00 175.29 172.99 2r56 s LEU 122 N 1.16 3.99 0.05 0.00 1.43 -0.07 -0.90 118.68 124.34 2r56 s LEU 122 Ca -0.07 0.32 -0.13 0.00 -1.03 0.00 0.00 54.13 53.22 2r56 s LEU 122 Cb -0.20 -3.18 0.02 0.00 0.03 0.00 0.00 46.19 42.86 2r56 s LEU 122 CO -0.03 -0.34 0.29 0.68 0.23 0.00 0.00 176.35 177.17 2r56 s VAL 123 N -2.30 0.09 -0.03 -1.59 -7.23 -0.54 -2.33 120.40 106.48 2r56 s VAL 123 Ca 0.41 -0.72 -0.23 0.00 -1.81 0.00 0.00 61.98 59.63 2r56 s VAL 123 Cb -0.10 -0.96 -0.22 0.00 0.56 0.00 0.00 36.38 35.67 2r56 s VAL 123 CO 0.35 -0.40 1.10 0.03 -0.31 0.00 0.00 175.10 175.87 2r56 h ARG 124 N 3.21 0.23 -6.11 4.82 2.47 -1.51 -1.02 114.38 116.48 2r56 h ARG 124 Ca -0.32 -0.21 -0.62 0.00 -1.26 0.00 0.00 59.98 57.56 2r56 h ARG 124 Cb 1.20 0.05 -0.07 0.00 -1.65 0.00 0.00 29.97 29.50 2r56 h ARG 124 CO 0.47 0.90 -0.56 0.95 0.56 0.00 0.00 179.97 182.28 2r56 s THR 125 N -3.38 4.79 0.00 2.04 -4.23 -1.26 -4.63 115.64 108.96 2r56 s THR 125 Ca -0.15 -0.70 -0.03 0.00 -1.18 0.00 0.00 61.69 59.63 2r56 s THR 125 Cb 0.02 -3.34 -0.15 0.00 1.34 0.00 0.00 72.50 70.37 2r56 s THR 125 CO 0.75 0.09 2.32 -0.81 -0.54 0.00 0.00 174.62 176.44 2r56 n PRO 126 N 0.28 1.17 -4.43 3.99 -0.04 -1.26 -4.79 135.00 129.92 2r56 n PRO 126 Ca -0.08 -0.57 -0.22 0.00 -0.04 0.00 0.00 63.50 62.60 2r56 n PRO 126 Cb 0.52 -1.77 -0.10 0.00 -0.04 0.00 0.00 33.50 32.10 2r56 n PRO 126 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2r56 s GLU 127 N 1.76 1.55 -0.41 0.54 2.56 -1.26 -4.59 118.70 118.85 2r56 s GLU 127 Ca 0.38 -1.75 -0.23 0.00 0.00 0.00 0.00 54.97 53.38 2r56 s GLU 127 Cb 0.18 -1.35 0.02 0.00 2.00 0.00 0.00 34.13 34.98 2r56 s GLU 127 CO 0.00 0.16 0.78 0.08 -0.56 0.00 0.00 175.26 175.71 2r56 s VAL 128 N -2.84 4.70 -0.78 3.70 1.01 -1.26 -4.99 120.40 119.94 2r56 s VAL 128 Ca 0.28 0.64 -0.17 0.00 0.00 0.00 0.00 61.98 62.73 2r56 s VAL 128 Cb 0.00 -4.26 0.15 0.00 0.00 0.00 0.00 36.38 32.28 2r56 s VAL 128 CO 0.12 -0.57 0.85 -0.62 0.00 0.00 0.00 175.10 174.88 2r56 s ASP 129 N 1.99 6.53 0.24 3.32 -1.08 -1.26 -4.91 116.67 121.50 2r56 s ASP 129 Ca 0.30 -2.08 -0.04 0.00 -0.52 0.00 0.00 52.55 50.21 2r56 s ASP 129 Cb -0.13 -2.30 0.40 0.00 -1.46 0.00 0.00 42.92 39.44 2r56 s ASP 129 CO 0.20 -0.90 1.80 0.44 0.52 0.00 0.00 175.17 177.22 2r56 h ASP 130 N 8.58 0.62 -0.01 -0.34 3.32 -1.99 -0.71 116.42 125.89 2r56 h ASP 130 Ca -0.01 0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.04 2r56 h ASP 130 Cb 1.05 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.53 2r56 h ASP 130 CO 0.98 0.35 -0.12 -0.08 -1.72 0.00 0.00 179.24 178.65 2r56 h GLU 131 N 0.74 0.28 -0.13 3.56 4.81 -1.99 -0.77 114.58 121.07 2r56 h GLU 131 Ca 0.40 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.48 2r56 h GLU 131 Cb 0.39 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.74 2r56 h GLU 131 CO -0.26 0.41 -0.24 0.00 -0.73 0.00 0.00 179.01 178.19 2r56 h ALA 132 N 1.62 0.21 -0.61 2.92 0.00 -1.59 -2.60 119.26 119.20 2r56 h ALA 132 Ca 0.05 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2r56 h ALA 132 Cb 0.38 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2r56 h ALA 132 CO 0.02 0.18 0.40 -0.07 0.00 0.00 0.00 179.25 179.78 2r56 h LEU 133 N -0.00 0.70 0.22 0.00 3.38 -0.95 -1.92 115.31 116.74 2r56 h LEU 133 Ca 0.01 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.97 2r56 h LEU 133 Cb 0.82 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 2r56 h LEU 133 CO 0.05 0.51 -0.31 -0.33 0.09 0.00 0.00 178.44 178.46 2r56 h GLU 134 N 0.83 -0.57 0.00 1.13 4.39 -0.99 0.26 114.58 119.63 2r56 h GLU 134 Ca 0.22 0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.95 2r56 h GLU 134 Cb -0.09 0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.69 2r56 h GLU 134 CO -0.05 -0.38 -0.04 0.87 -1.16 0.00 0.00 179.01 178.26 2r56 h LYS 135 N -0.59 0.00 -0.08 2.33 1.57 -1.06 -1.04 116.57 117.70 2r56 h LYS 135 Ca 0.01 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.68 2r56 h LYS 135 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.89 2r56 h LYS 135 CO -0.12 0.04 -0.37 0.35 -0.57 0.00 0.00 179.45 178.78 2r56 h PHE 136 N 0.00 0.52 -0.75 -1.35 3.57 -0.31 -2.00 116.94 116.63 2r56 h PHE 136 Ca -0.00 -0.23 -0.05 0.00 3.53 0.00 0.00 57.97 61.22 2r56 h PHE 136 Cb 0.09 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 2r56 h PHE 136 CO 0.00 0.98 0.26 -0.44 -2.23 0.00 0.00 178.31 176.88 2r56 h ASP 137 N -0.08 1.06 -0.52 0.41 3.45 0.05 -1.92 116.42 118.87 2r56 h ASP 137 Ca -0.03 -0.18 -0.01 0.00 0.43 0.00 0.00 57.03 57.24 2r56 h ASP 137 Cb 1.02 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 39.49 2r56 h ASP 137 CO 0.08 0.97 0.27 0.50 -1.57 0.00 0.00 179.24 179.48 2r56 h LYS 138 N 1.11 0.73 0.00 3.56 3.64 -1.22 -1.69 116.57 122.70 2r56 h LYS 138 Ca 0.25 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2r56 h LYS 138 Cb 0.26 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 2r56 h LYS 138 CO -0.01 0.59 0.00 0.00 -2.27 0.00 0.00 179.45 177.75 2r56 n ALA 139 N -2.30 2.20 -0.03 5.00 0.00 -0.75 -3.17 120.51 121.45 2r56 n ALA 139 Ca 0.02 -0.10 0.07 0.00 0.00 0.00 0.00 53.44 53.43 2r56 n ALA 139 Cb 0.10 -1.40 -0.16 0.00 0.00 0.00 0.00 19.45 17.99 2r56 n ALA 139 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2r56 n LEU 140 N -1.39 0.00 0.00 0.00 4.32 -0.75 -4.32 117.00 114.86 2r56 n LEU 140 Ca 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.08 2r56 n LEU 140 Cb 0.24 0.09 0.00 0.00 -1.62 0.00 0.00 43.42 42.13 2r56 n LEU 140 CO 0.21 0.09 0.47 2.29 -1.22 0.00 0.00 177.39 179.22 2r56 n LYS 141 N -2.32 0.00 -0.10 3.23 2.85 -0.71 -0.04 118.16 121.08 2r56 n LYS 141 Ca -0.09 0.43 0.06 0.00 -1.05 0.00 0.00 58.31 57.66 2r56 n LYS 141 Cb 0.65 -1.51 0.12 0.00 -0.65 0.00 0.00 35.03 33.64 2r56 n LYS 141 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2r56 n ALA 142 N -1.42 2.34 -2.56 0.58 0.00 -1.26 -4.98 120.51 113.20 2r56 n ALA 142 Ca 0.00 -0.89 -0.27 0.00 0.00 0.00 0.00 53.44 52.28 2r56 n ALA 142 Cb 0.01 -0.46 -0.09 0.00 0.00 0.00 0.00 19.45 18.90 2r56 n ALA 142 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2r56 s LEU 143 N -1.03 2.92 -1.15 0.00 1.43 0.95 -5.03 118.68 116.77 2r56 s LEU 143 Ca 0.21 -0.61 -0.08 0.00 -1.03 0.00 0.00 54.13 52.62 2r56 s LEU 143 Cb 0.12 -1.61 -0.06 0.00 0.03 0.00 0.00 46.19 44.68 2r56 s LEU 143 CO 0.17 0.10 2.93 -0.81 0.23 0.00 0.00 176.35 178.97 2r56 n PRO 144 N 0.04 3.50 -2.73 1.29 -0.04 -1.26 -4.95 135.00 130.85 2r56 n PRO 144 Ca -0.11 -2.30 -0.42 0.00 -0.04 0.00 0.00 63.50 60.63 2r56 n PRO 144 Cb 0.56 -2.55 -0.04 0.00 -0.04 0.00 0.00 33.50 31.43 2r56 n PRO 144 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2r56 s MET 145 N 0.80 4.60 -0.18 0.54 -1.94 -1.26 -4.15 119.30 117.70 2r56 s MET 145 Ca 0.65 1.40 0.13 0.00 -1.71 0.00 0.00 55.69 56.16 2r56 s MET 145 Cb 0.22 -3.43 0.40 0.00 2.01 0.00 0.00 34.83 34.03 2r56 s MET 145 CO -0.07 0.04 1.21 0.72 -0.01 0.00 0.00 175.02 176.91 2r56 n HIS 146 N 3.53 0.00 0.00 -0.03 8.25 -0.14 -4.94 115.22 121.88 2r56 n HIS 146 Ca 0.04 -1.34 0.00 0.00 -0.26 0.00 0.00 57.72 56.16 2r56 n HIS 146 Cb 0.50 -0.23 0.00 0.00 1.12 0.00 0.00 29.99 31.39 2r56 n HIS 146 CO 0.00 0.00 0.00 1.51 0.64 0.00 0.00 176.34 178.49 2r56 n ILE 147 N -1.01 0.00 -3.91 1.59 3.06 -1.24 -4.45 119.36 113.40 2r56 n ILE 147 Ca 0.17 0.00 -0.11 0.00 -2.50 0.00 0.00 62.75 60.32 2r56 n ILE 147 Cb 0.72 0.00 -0.13 0.00 0.54 0.00 0.00 39.64 40.78 2r56 n ILE 147 CO 0.00 0.00 0.00 -0.13 -2.50 0.00 0.00 176.55 173.92 2r56 s ARG 148 N -0.29 0.15 0.02 9.51 3.00 -1.26 -2.48 118.95 127.60 2r56 s ARG 148 Ca 0.00 -0.23 0.03 0.00 0.00 0.00 0.00 55.73 55.52 2r56 s ARG 148 Cb 0.00 0.06 -0.02 0.00 0.00 0.00 0.00 34.95 34.99 2r56 s ARG 148 CO 0.00 -0.03 -0.09 -0.51 0.00 0.00 0.00 175.30 174.68 2r56 s LEU 149 N -0.61 2.14 -0.03 2.53 1.02 0.33 -4.98 118.68 119.08 2r56 s LEU 149 Ca -0.07 -0.36 0.02 0.00 0.02 0.00 0.00 54.13 53.75 2r56 s LEU 149 Cb -0.04 -0.34 0.01 0.00 0.02 0.00 0.00 46.19 45.83 2r56 s LEU 149 CO -0.00 -0.03 -0.09 -0.55 0.02 0.00 0.00 176.35 175.70 2r56 s SER 150 N -0.91 1.24 0.37 2.29 0.15 -1.26 -0.93 113.70 114.66 2r56 s SER 150 Ca -0.02 -0.19 0.07 0.00 0.70 0.00 0.00 55.95 56.51 2r56 s SER 150 Cb -0.06 -0.39 -0.01 0.00 -1.71 0.00 0.00 66.02 63.85 2r56 s SER 150 CO 0.00 0.05 0.45 -0.36 1.20 0.00 0.00 173.24 174.59 2r56 s PHE 151 N 0.31 2.94 0.22 3.44 0.08 0.12 -4.99 117.98 120.10 2r56 s PHE 151 Ca -0.05 -0.32 0.08 0.00 0.12 0.00 0.00 56.93 56.76 2r56 s PHE 151 Cb -0.10 -2.08 -0.04 0.00 -0.57 0.00 0.00 43.02 40.23 2r56 s PHE 151 CO 0.01 -0.10 0.07 -0.80 -0.10 0.00 0.00 175.22 174.30 2r56 s ASN 152 N -4.18 5.02 0.25 1.36 0.02 -1.26 -4.96 114.94 111.18 2r56 s ASN 152 Ca 0.47 -0.40 -0.05 0.00 -1.02 0.00 0.00 52.86 51.87 2r56 s ASN 152 Cb -0.08 -1.13 0.47 0.00 0.02 0.00 0.00 41.25 40.53 2r56 s ASN 152 CO 0.30 0.02 1.67 -0.65 0.02 0.00 0.00 177.10 178.47 2r56 h PRO 153 N 2.05 0.23 -0.53 -0.60 0.11 -1.94 0.25 132.00 131.56 2r56 h PRO 153 Ca -0.47 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 2r56 h PRO 153 Cb 1.23 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 2r56 h PRO 153 CO 0.60 0.15 0.24 1.15 -0.21 0.00 0.00 178.00 179.93 2r56 h THR 154 N 0.23 1.18 0.00 -1.15 2.02 -1.95 -1.93 112.91 111.32 2r56 h THR 154 Ca 0.42 -0.53 -0.07 0.00 0.77 0.00 0.00 66.41 67.01 2r56 h THR 154 Cb 0.74 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 2r56 h THR 154 CO -0.55 0.22 -0.32 1.56 0.37 0.00 0.00 175.52 176.80 2r56 h GLN 155 N 0.74 0.00 0.00 6.66 4.20 -0.94 -2.38 115.11 123.39 2r56 h GLN 155 Ca 0.18 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.89 2r56 h GLN 155 Cb 0.10 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.88 2r56 h GLN 155 CO -0.02 0.32 0.00 1.28 -0.67 0.00 0.00 178.83 179.74 2r56 n LEU 156 N -3.55 0.25 0.00 1.46 4.77 -0.61 -2.39 117.00 116.92 2r56 n LEU 156 Ca -0.00 0.55 0.15 0.00 -0.03 0.00 0.00 56.01 56.67 2r56 n LEU 156 Cb 0.46 -0.50 0.86 0.00 -2.33 0.00 0.00 43.42 41.91 2r56 n LEU 156 CO 0.36 -0.27 1.04 -0.62 -1.33 0.00 0.00 177.39 176.56 2r56 n GLU 157 N -1.76 0.86 -3.99 3.23 1.02 -0.90 -4.73 120.64 114.38 2r56 n GLU 157 Ca 0.04 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 56.83 2r56 n GLU 157 Cb 0.24 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 30.04 2r56 n GLU 157 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2r56 s GLU 158 N -2.08 3.68 0.42 3.49 0.41 -1.01 -4.97 118.70 118.65 2r56 s GLU 158 Ca 0.42 -0.48 0.27 0.00 -0.41 0.00 0.00 54.97 54.77 2r56 s GLU 158 Cb 0.20 -3.16 1.36 0.00 -1.78 0.00 0.00 34.13 30.75 2r56 s GLU 158 CO 0.36 0.00 1.63 -0.56 -0.49 0.00 0.00 175.26 176.20 2r56 h GLN 159 N 7.55 0.11 -0.02 1.61 3.07 -1.89 0.66 115.11 126.21 2r56 h GLN 159 Ca -0.36 -0.01 -0.00 0.00 0.09 0.00 0.00 58.65 58.37 2r56 h GLN 159 Cb 1.18 -0.03 -0.00 0.00 0.08 0.00 0.00 27.48 28.71 2r56 h GLN 159 CO 0.61 0.08 -0.09 0.00 0.09 0.00 0.00 178.83 179.52 2r56 n HIS 161 N -1.34 -3.21 0.00 0.00 8.25 0.23 -5.03 115.22 114.12 2r56 n HIS 161 Ca 0.17 1.91 0.00 0.00 -0.26 0.00 0.00 57.72 59.54 2r56 n HIS 161 Cb 0.67 -2.84 0.00 0.00 1.12 0.00 0.00 29.99 28.94 2r56 n HIS 161 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09