#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rx2 s ILE 2 N 0.00 3.84 0.03 1.12 1.01 -1.26 -0.46 121.20 125.48 1rx2 s ILE 2 Ca 0.00 -0.42 0.02 0.00 0.00 0.00 0.00 60.65 60.25 1rx2 s ILE 2 Cb 0.00 -2.59 -0.02 0.00 0.01 0.00 0.00 42.46 39.86 1rx2 s ILE 2 CO 0.00 0.59 -0.07 -0.44 0.00 0.00 0.00 174.94 175.02 1rx2 s SER 3 N -0.73 0.78 -0.10 3.58 0.01 -0.25 0.04 113.70 117.04 1rx2 s SER 3 Ca 0.11 -0.41 -0.04 0.00 1.31 0.00 0.00 55.95 56.92 1rx2 s SER 3 Cb -0.11 0.00 -0.04 0.00 0.21 0.00 0.00 66.02 66.09 1rx2 s SER 3 CO 0.02 -0.12 0.06 -0.76 0.41 0.00 0.00 173.24 172.84 1rx2 s LEU 4 N -1.14 3.91 -0.03 2.44 1.02 -0.29 -0.83 118.68 123.77 1rx2 s LEU 4 Ca -0.06 0.28 0.03 0.00 0.02 0.00 0.00 54.13 54.40 1rx2 s LEU 4 Cb -0.08 -1.92 0.00 0.00 0.02 0.00 0.00 46.19 44.21 1rx2 s LEU 4 CO 0.00 0.39 -0.12 -0.51 0.02 0.00 0.00 176.35 176.13 1rx2 s ILE 5 N -0.93 1.04 0.01 -0.59 2.07 -0.61 -0.31 121.20 121.89 1rx2 s ILE 5 Ca 0.14 -0.50 -0.28 0.00 -1.41 0.00 0.00 60.65 58.60 1rx2 s ILE 5 Cb -0.12 -0.91 0.10 0.00 0.13 0.00 0.00 42.46 41.66 1rx2 s ILE 5 CO 0.03 0.31 0.84 0.00 -1.91 0.00 0.00 174.94 174.21 1rx2 s ALA 6 N 0.14 -1.79 -0.18 1.50 0.00 -0.59 -4.56 121.76 116.27 1rx2 s ALA 6 Ca -0.03 0.98 -0.02 0.00 0.00 0.00 0.00 51.96 52.89 1rx2 s ALA 6 Cb -0.10 0.39 -0.01 0.00 0.00 0.00 0.00 23.12 23.40 1rx2 s ALA 6 CO 0.01 -0.66 -0.08 0.00 0.00 0.00 0.00 175.76 175.03 1rx2 s ALA 7 N -3.00 2.73 -0.02 0.00 0.00 -1.26 -1.74 121.76 118.48 1rx2 s ALA 7 Ca 0.03 -1.05 0.07 0.00 0.00 0.00 0.00 51.96 51.00 1rx2 s ALA 7 Cb -0.01 -1.50 -0.02 0.00 0.00 0.00 0.00 23.12 21.60 1rx2 s ALA 7 CO -0.08 -0.15 -0.22 -0.51 0.00 0.00 0.00 175.76 174.80 1rx2 s LEU 8 N 1.01 2.04 0.00 0.00 1.02 -0.37 -4.66 118.68 117.72 1rx2 s LEU 8 Ca -0.00 -0.40 0.00 0.00 0.02 0.00 0.00 54.13 53.75 1rx2 s LEU 8 Cb -0.15 -1.13 0.00 0.00 0.02 0.00 0.00 46.19 44.93 1rx2 s LEU 8 CO -0.01 0.27 0.00 0.00 0.02 0.00 0.00 176.35 176.63 1rx2 n ALA 9 N 2.57 0.00 -1.59 4.21 0.00 -0.75 0.04 120.51 124.98 1rx2 n ALA 9 Ca -0.16 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 52.84 1rx2 n ALA 9 Cb 0.52 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.96 1rx2 n ALA 9 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1rx2 n VAL 10 N -1.05 2.00 -1.36 0.00 0.31 -0.65 -1.51 118.33 116.08 1rx2 n VAL 10 Ca 0.00 -0.50 -0.12 0.00 -0.01 0.00 0.00 64.34 63.71 1rx2 n VAL 10 Cb 0.00 -1.03 -0.05 0.00 -0.91 0.00 0.00 33.84 31.85 1rx2 n VAL 10 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1rx2 n ASP 11 N 1.19 -4.63 -0.58 4.52 8.00 -1.26 -2.66 116.55 121.12 1rx2 n ASP 11 Ca 0.09 0.31 -0.08 0.00 0.71 0.00 0.00 54.79 55.82 1rx2 n ASP 11 Cb 0.32 -3.22 -0.03 0.00 -0.02 0.00 0.00 41.12 38.17 1rx2 n ASP 11 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1rx2 n ARG 12 N -2.46 -0.96 -2.01 -1.24 1.74 -0.57 -4.89 116.66 106.28 1rx2 n ARG 12 Ca -0.12 0.69 -0.42 0.00 -0.77 0.00 0.00 57.85 57.23 1rx2 n ARG 12 Cb 0.43 -4.65 -0.03 0.00 -1.02 0.00 0.00 32.46 27.19 1rx2 n ARG 12 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1rx2 s VAL 13 N -2.07 2.78 0.00 1.55 1.01 -1.09 -0.97 120.40 121.60 1rx2 s VAL 13 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 61.98 62.57 1rx2 s VAL 13 Cb 0.00 -3.37 0.00 0.00 0.00 0.00 0.00 36.38 33.01 1rx2 s VAL 13 CO 0.00 0.06 0.02 2.30 0.00 0.00 0.00 175.10 177.48 1rx2 n ILE 14 N 3.43 0.00 -3.72 2.22 -5.35 0.13 -1.81 119.36 114.26 1rx2 n ILE 14 Ca 0.11 -0.48 -0.03 0.00 -0.27 0.00 0.00 62.75 62.08 1rx2 n ILE 14 Cb 0.40 1.00 -0.01 0.00 -1.74 0.00 0.00 39.64 39.29 1rx2 n ILE 14 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1rx2 s GLY 15 N -0.92 -0.27 -0.17 3.28 0.00 -1.20 -4.79 107.32 103.25 1rx2 s GLY 15 Ca 0.00 0.26 -0.07 0.00 0.00 0.00 0.00 44.72 44.91 1rx2 s GLY 15 CO 0.00 0.03 0.37 -0.29 0.00 0.00 0.00 173.10 173.22 1rx2 s MET 16 N -3.11 0.31 -1.61 2.90 1.75 0.03 -1.23 119.30 118.35 1rx2 s MET 16 Ca 0.12 0.84 -0.15 0.00 -1.25 0.00 0.00 55.69 55.26 1rx2 s MET 16 Cb -0.00 0.08 0.11 0.00 2.84 0.00 0.00 34.83 37.86 1rx2 s MET 16 CO 0.01 -0.21 0.81 0.39 -0.65 0.00 0.00 175.02 175.37 1rx2 n GLU 17 N 4.79 -3.97 -2.64 4.11 1.02 -1.26 -1.66 120.64 121.03 1rx2 n GLU 17 Ca -0.16 0.45 -0.18 0.00 -0.02 0.00 0.00 57.16 57.26 1rx2 n GLU 17 Cb 0.52 -5.16 0.01 0.00 -0.02 0.00 0.00 31.44 26.80 1rx2 n GLU 17 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1rx2 n ASN 18 N -2.76 -5.14 -3.91 1.62 4.05 -1.26 -5.00 115.26 102.86 1rx2 n ASN 18 Ca 0.01 -0.14 -0.09 0.00 0.45 0.00 0.00 54.58 54.81 1rx2 n ASN 18 Cb 0.53 -4.09 -0.04 0.00 1.23 0.00 0.00 39.78 37.41 1rx2 n ASN 18 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1rx2 s ALA 19 N -2.97 -0.64 -0.29 5.20 0.00 -0.66 -4.59 121.76 117.81 1rx2 s ALA 19 Ca 0.14 -0.60 -0.05 0.00 0.00 0.00 0.00 51.96 51.45 1rx2 s ALA 19 Cb -0.06 0.96 0.02 0.00 0.00 0.00 0.00 23.12 24.04 1rx2 s ALA 19 CO 0.18 -0.90 0.04 -1.64 0.00 0.00 0.00 175.76 173.44 1rx2 s MET 20 N -3.96 2.91 0.31 0.00 -1.94 -1.26 -0.79 119.30 114.57 1rx2 s MET 20 Ca 0.17 -0.96 0.05 0.00 -1.71 0.00 0.00 55.69 53.23 1rx2 s MET 20 Cb -0.02 -3.26 0.67 0.00 2.01 0.00 0.00 34.83 34.23 1rx2 s MET 20 CO 0.06 -0.47 1.85 -1.35 -0.01 0.00 0.00 175.02 175.10 1rx2 h PRO 21 N 8.15 0.83 -7.63 2.03 0.11 -1.92 -3.44 132.00 130.13 1rx2 h PRO 21 Ca -0.30 -0.05 -0.46 0.00 0.11 0.00 0.00 66.00 65.30 1rx2 h PRO 21 Cb 1.11 -0.19 0.12 0.00 0.11 0.00 0.00 31.00 32.15 1rx2 h PRO 21 CO 0.59 0.55 0.38 1.67 -0.21 0.00 0.00 178.00 180.98 1rx2 s TRP 22 N -5.83 2.35 -0.15 0.65 -2.14 -1.26 -5.08 118.94 107.47 1rx2 s TRP 22 Ca -0.11 0.49 -0.04 0.00 2.66 0.00 0.00 56.10 59.10 1rx2 s TRP 22 Cb 0.22 -3.67 0.06 0.00 -3.10 0.00 0.00 33.47 26.98 1rx2 s TRP 22 CO 0.80 -2.06 0.11 1.21 -2.66 0.00 0.00 176.95 174.34 1rx2 s ASN 23 N -4.70 1.99 -0.33 -2.66 2.47 -1.26 -5.08 114.94 105.37 1rx2 s ASN 23 Ca 0.67 -0.43 -0.01 0.00 0.42 0.00 0.00 52.86 53.50 1rx2 s ASN 23 Cb -0.08 -0.12 0.12 0.00 -1.45 0.00 0.00 41.25 39.72 1rx2 s ASN 23 CO 0.50 -0.33 0.18 -0.76 -3.72 0.00 0.00 177.10 172.97 1rx2 s LEU 24 N 2.17 0.88 0.33 3.21 1.43 -1.26 -4.41 118.68 121.04 1rx2 s LEU 24 Ca 0.03 -1.84 0.09 0.00 -1.03 0.00 0.00 54.13 51.39 1rx2 s LEU 24 Cb -0.15 -0.40 0.85 0.00 0.03 0.00 0.00 46.19 46.52 1rx2 s LEU 24 CO -0.08 -0.36 1.77 -0.65 0.23 0.00 0.00 176.35 177.25 1rx2 h PRO 25 N 7.57 0.62 -0.18 1.29 0.11 -1.99 -0.83 132.00 138.60 1rx2 h PRO 25 Ca -0.05 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.94 1rx2 h PRO 25 Cb 0.99 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.94 1rx2 h PRO 25 CO 0.34 0.41 -0.27 0.00 -0.21 0.00 0.00 178.00 178.27 1rx2 h ALA 26 N 1.66 1.21 -0.38 -0.75 0.00 -1.93 -1.41 119.26 117.66 1rx2 h ALA 26 Ca 0.59 -0.33 -0.16 0.00 0.00 0.00 0.00 54.91 55.01 1rx2 h ALA 26 Cb 1.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1rx2 h ALA 26 CO -0.38 0.52 -0.38 0.22 0.00 0.00 0.00 179.25 179.23 1rx2 h ASP 27 N 0.30 0.97 0.77 0.00 3.58 -1.59 -1.98 116.42 118.46 1rx2 h ASP 27 Ca 0.04 -0.44 -0.04 0.00 0.42 0.00 0.00 57.03 57.01 1rx2 h ASP 27 Cb 0.64 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.41 1rx2 h ASP 27 CO 0.05 1.23 -0.21 -0.07 -2.88 0.00 0.00 179.24 177.36 1rx2 h LEU 28 N 0.74 0.00 -0.34 2.28 3.38 -1.26 0.47 115.31 120.58 1rx2 h LEU 28 Ca 0.06 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.84 1rx2 h LEU 28 Cb 0.97 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1rx2 h LEU 28 CO 0.09 0.21 -0.82 0.00 0.09 0.00 0.00 178.44 178.02 1rx2 h ALA 29 N 1.79 0.55 -0.48 1.53 0.00 -0.68 -2.48 119.26 119.49 1rx2 h ALA 29 Ca -0.00 -0.67 -0.11 0.00 0.00 0.00 0.00 54.91 54.13 1rx2 h ALA 29 Cb 0.65 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1rx2 h ALA 29 CO 0.03 0.83 -0.13 2.35 0.00 0.00 0.00 179.25 182.33 1rx2 h TRP 30 N 0.18 1.06 0.07 0.00 2.91 -0.77 -1.18 115.95 118.22 1rx2 h TRP 30 Ca -0.04 -0.23 0.01 0.00 1.13 0.00 0.00 58.89 59.75 1rx2 h TRP 30 Cb 1.42 -0.26 -0.01 0.00 -0.51 0.00 0.00 29.16 29.80 1rx2 h TRP 30 CO 0.04 1.02 -0.10 0.35 -1.03 0.00 0.00 178.44 178.72 1rx2 h PHE 31 N 0.79 -0.26 -0.55 2.65 3.57 -0.86 -2.16 116.94 120.11 1rx2 h PHE 31 Ca 0.12 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.67 1rx2 h PHE 31 Cb 0.69 0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.49 1rx2 h PHE 31 CO 0.05 -0.16 0.30 -0.22 -2.23 0.00 0.00 178.31 176.05 1rx2 h LYS 32 N -0.21 0.56 -0.92 1.11 3.64 -1.38 -1.66 116.57 117.72 1rx2 h LYS 32 Ca 0.02 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.41 1rx2 h LYS 32 Cb 0.22 -0.13 -0.06 0.00 -0.41 0.00 0.00 32.23 31.86 1rx2 h LYS 32 CO -0.05 0.37 0.60 -0.09 -2.27 0.00 0.00 179.45 178.01 1rx2 h ARG 33 N 0.58 1.10 0.00 1.90 2.43 -1.02 0.12 114.38 119.49 1rx2 h ARG 33 Ca 0.24 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1rx2 h ARG 33 Cb 0.11 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.41 1rx2 h ARG 33 CO -0.15 0.73 -0.44 -0.91 -1.51 0.00 0.00 179.97 177.69 1rx2 h ASN 34 N 1.13 0.00 0.00 -3.80 2.35 -1.05 -3.36 115.58 110.85 1rx2 h ASN 34 Ca 0.38 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 1rx2 h ASN 34 Cb 0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.43 1rx2 h ASN 34 CO -0.12 0.05 -1.27 0.35 -1.65 0.00 0.00 177.43 174.79 1rx2 n THR 35 N -2.35 0.00 -1.71 2.81 -2.24 -0.65 -4.96 114.28 105.17 1rx2 n THR 35 Ca 0.03 -0.24 -0.43 0.00 -2.27 0.00 0.00 64.05 61.15 1rx2 n THR 35 Cb 0.46 0.41 -0.01 0.00 -2.10 0.00 0.00 70.33 69.09 1rx2 n THR 35 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1rx2 n LEU 36 N -1.73 3.81 -0.72 3.22 7.94 0.40 -2.24 117.00 127.68 1rx2 n LEU 36 Ca -0.01 1.19 -0.09 0.00 -1.11 0.00 0.00 56.01 55.99 1rx2 n LEU 36 Cb 0.24 -1.51 -0.04 0.00 0.53 0.00 0.00 43.42 42.64 1rx2 n LEU 36 CO 0.21 -0.28 -0.09 0.47 -1.11 0.00 0.00 177.39 176.59 1rx2 n ASP 37 N 1.11 -4.59 -4.37 1.96 8.00 -0.11 -5.00 116.55 113.56 1rx2 n ASP 37 Ca 0.06 0.23 -0.19 0.00 0.71 0.00 0.00 54.79 55.60 1rx2 n ASP 37 Cb 0.36 -2.91 -0.10 0.00 -0.02 0.00 0.00 41.12 38.44 1rx2 n ASP 37 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1rx2 s LYS 38 N -2.59 1.39 0.27 -1.24 1.02 -0.95 -5.00 119.74 112.64 1rx2 s LYS 38 Ca 0.00 -1.67 -0.23 0.00 0.02 0.00 0.00 55.97 54.09 1rx2 s LYS 38 Cb 0.00 -1.02 -0.09 0.00 -0.52 0.00 0.00 37.83 36.20 1rx2 s LYS 38 CO 0.00 0.08 0.83 -1.25 -0.92 0.00 0.00 175.35 174.09 1rx2 s PRO 39 N -3.72 4.43 -0.07 -1.68 0.04 -1.26 -3.39 135.00 129.35 1rx2 s PRO 39 Ca 0.26 1.10 0.05 0.00 0.04 0.00 0.00 61.00 62.44 1rx2 s PRO 39 Cb 0.02 -2.86 -0.00 0.00 0.04 0.00 0.00 34.50 31.70 1rx2 s PRO 39 CO 0.09 0.35 -0.22 0.14 0.04 0.00 0.00 177.00 177.39 1rx2 s VAL 40 N -1.55 1.89 -0.11 -0.36 -7.23 -0.34 -1.73 120.40 110.97 1rx2 s VAL 40 Ca 0.46 -0.95 -0.02 0.00 -1.81 0.00 0.00 61.98 59.66 1rx2 s VAL 40 Cb -0.18 -1.62 -0.03 0.00 0.56 0.00 0.00 36.38 35.11 1rx2 s VAL 40 CO 0.23 0.52 -0.02 -0.63 -0.31 0.00 0.00 175.10 174.89 1rx2 s ILE 41 N 0.11 4.10 0.08 -0.62 1.01 0.19 -1.04 121.20 125.03 1rx2 s ILE 41 Ca -0.10 -0.31 -0.06 0.00 0.00 0.00 0.00 60.65 60.18 1rx2 s ILE 41 Cb -0.15 -2.75 -0.02 0.00 0.01 0.00 0.00 42.46 39.56 1rx2 s ILE 41 CO 0.05 0.56 0.11 0.00 0.00 0.00 0.00 174.94 175.67 1rx2 s MET 42 N -0.40 0.78 0.61 2.79 0.23 -0.26 -0.98 119.30 122.07 1rx2 s MET 42 Ca 0.07 -1.07 -0.06 0.00 -1.03 0.00 0.00 55.69 53.60 1rx2 s MET 42 Cb -0.12 0.29 0.02 0.00 -1.53 0.00 0.00 34.83 33.49 1rx2 s MET 42 CO 0.02 -0.22 0.91 0.20 -2.03 0.00 0.00 175.02 173.91 1rx2 s GLY 43 N -2.89 1.63 0.31 3.16 0.00 0.10 -0.59 107.32 109.05 1rx2 s GLY 43 Ca 0.07 -0.78 0.03 0.00 0.00 0.00 0.00 44.72 44.04 1rx2 s GLY 43 CO -0.10 -0.47 1.88 -0.09 0.00 0.00 0.00 173.10 174.32 1rx2 h ARG 44 N -0.23 0.91 -0.63 2.90 2.43 -1.76 -0.35 114.38 117.65 1rx2 h ARG 44 Ca -0.45 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 58.59 1rx2 h ARG 44 Cb 1.27 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 30.59 1rx2 h ARG 44 CO 0.60 0.60 0.11 0.45 -1.51 0.00 0.00 179.97 180.23 1rx2 h HIS 45 N 0.94 1.09 -0.56 2.20 3.86 -1.93 -1.91 115.15 118.84 1rx2 h HIS 45 Ca 0.43 -0.15 -0.02 0.00 -1.16 0.00 0.00 60.37 59.47 1rx2 h HIS 45 Cb 0.39 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.54 1rx2 h HIS 45 CO -0.00 0.93 0.27 1.15 0.86 0.00 0.00 177.93 181.13 1rx2 h THR 46 N 0.94 1.20 -0.95 2.45 2.02 -1.71 -0.98 112.91 115.88 1rx2 h THR 46 Ca 0.19 -0.57 0.13 0.00 0.77 0.00 0.00 66.41 66.93 1rx2 h THR 46 Cb 0.41 0.55 -0.08 0.00 -1.74 0.00 0.00 68.15 67.30 1rx2 h THR 46 CO 0.01 0.23 0.60 -0.25 0.37 0.00 0.00 175.52 176.48 1rx2 h TRP 47 N 0.75 1.01 -0.32 3.16 -0.00 -0.72 -0.38 115.95 119.44 1rx2 h TRP 47 Ca 0.19 0.03 -0.18 0.00 -0.00 0.00 0.00 58.89 58.93 1rx2 h TRP 47 Cb 0.11 -0.32 -0.00 0.00 -0.00 0.00 0.00 29.16 28.95 1rx2 h TRP 47 CO -0.00 0.40 -0.50 0.93 -0.00 0.00 0.00 178.44 179.27 1rx2 h GLU 48 N 0.88 0.89 0.00 2.65 5.08 -0.66 -1.57 114.58 121.84 1rx2 h GLU 48 Ca 0.47 -0.53 -0.11 0.00 -1.00 0.00 0.00 59.36 58.19 1rx2 h GLU 48 Cb 0.56 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 1rx2 h GLU 48 CO -0.23 1.17 -0.52 0.66 -1.00 0.00 0.00 179.01 179.09 1rx2 h SER 49 N 0.69 0.00 0.47 1.42 4.64 0.17 -2.82 113.55 118.12 1rx2 h SER 49 Ca 0.03 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.24 1rx2 h SER 49 Cb 1.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 1rx2 h SER 49 CO 0.11 0.52 -0.50 0.40 -0.87 0.00 0.00 176.83 176.49 1rx2 h ILE 50 N 0.00 1.36 0.00 0.95 2.04 -1.04 -3.47 117.51 117.35 1rx2 h ILE 50 Ca -0.01 -1.72 0.00 0.00 1.00 0.00 0.00 64.86 64.13 1rx2 h ILE 50 Cb 0.94 1.91 0.00 0.00 -0.74 0.00 0.00 36.82 38.93 1rx2 h ILE 50 CO 0.07 0.49 0.00 0.61 0.00 0.00 0.00 178.15 179.32 1rx2 n GLY 51 N -0.07 0.23 3.60 5.37 0.00 -0.60 -4.91 105.19 108.81 1rx2 n GLY 51 Ca -0.02 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.98 1rx2 n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1rx2 s ARG 52 N -0.93 0.42 0.32 1.61 1.70 -1.26 -5.07 118.95 115.75 1rx2 s ARG 52 Ca 0.00 -0.19 -0.29 0.00 -0.47 0.00 0.00 55.73 54.78 1rx2 s ARG 52 Cb 0.00 0.17 -0.10 0.00 -0.57 0.00 0.00 34.95 34.45 1rx2 s ARG 52 CO 0.00 -0.19 1.33 -2.14 -1.08 0.00 0.00 175.30 173.22 1rx2 s PRO 53 N -2.52 4.34 -0.22 3.89 0.02 -1.26 -4.97 135.00 134.26 1rx2 s PRO 53 Ca 0.11 2.24 -0.26 0.00 0.02 0.00 0.00 61.00 63.10 1rx2 s PRO 53 Cb 0.01 -3.07 -0.00 0.00 0.02 0.00 0.00 34.50 31.45 1rx2 s PRO 53 CO -0.04 -0.23 0.89 -0.51 -0.33 0.00 0.00 177.00 176.78 1rx2 s LEU 54 N -1.62 4.10 0.58 -5.54 1.43 -1.26 -5.01 118.68 111.37 1rx2 s LEU 54 Ca 0.50 1.16 -0.18 0.00 -1.03 0.00 0.00 54.13 54.59 1rx2 s LEU 54 Cb -0.40 -3.30 -0.04 0.00 0.03 0.00 0.00 46.19 42.48 1rx2 s LEU 54 CO 0.52 -0.54 1.12 -2.84 0.23 0.00 0.00 176.35 174.84 1rx2 s PRO 55 N 2.81 3.18 -0.60 1.29 0.01 -1.26 -3.57 135.00 136.87 1rx2 s PRO 55 Ca 0.38 1.51 0.00 0.00 0.01 0.00 0.00 61.00 62.90 1rx2 s PRO 55 Cb -0.15 -1.99 0.00 0.00 0.01 0.00 0.00 34.50 32.36 1rx2 s PRO 55 CO 0.08 -0.97 0.00 0.41 0.01 0.00 0.00 177.00 176.53 1rx2 n GLY 56 N -0.13 0.77 3.12 0.52 0.00 -1.26 -4.90 105.19 103.31 1rx2 n GLY 56 Ca 0.11 -0.36 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 1rx2 n GLY 56 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rx2 s ARG 57 N -2.03 0.47 -0.30 1.61 0.52 -1.23 -0.93 118.95 117.05 1rx2 s ARG 57 Ca 0.00 -0.30 -0.26 0.00 -0.52 0.00 0.00 55.73 54.65 1rx2 s ARG 57 Cb 0.00 0.20 0.01 0.00 0.52 0.00 0.00 34.95 35.68 1rx2 s ARG 57 CO 0.00 -0.11 0.92 0.21 0.02 0.00 0.00 175.30 176.34 1rx2 s LYS 58 N -1.20 4.06 -0.20 3.54 2.20 -1.22 -4.81 119.74 122.11 1rx2 s LYS 58 Ca -0.13 0.88 -0.17 0.00 -0.36 0.00 0.00 55.97 56.20 1rx2 s LYS 58 Cb -0.07 -3.71 -0.04 0.00 -1.51 0.00 0.00 37.83 32.51 1rx2 s LYS 58 CO 0.02 -0.73 0.43 -0.80 -0.36 0.00 0.00 175.35 173.91 1rx2 s ASN 59 N 1.55 6.47 -0.17 1.43 0.02 -1.26 -1.20 114.94 121.78 1rx2 s ASN 59 Ca 0.38 0.56 0.00 0.00 -1.02 0.00 0.00 52.86 52.79 1rx2 s ASN 59 Cb -0.14 -2.25 0.01 0.00 0.02 0.00 0.00 41.25 38.89 1rx2 s ASN 59 CO 0.12 -0.11 -0.17 -0.63 0.02 0.00 0.00 177.10 176.33 1rx2 s ILE 60 N 1.41 2.35 -0.09 0.60 1.01 -0.21 -1.42 121.20 124.85 1rx2 s ILE 60 Ca 0.20 -0.86 0.00 0.00 0.00 0.00 0.00 60.65 60.00 1rx2 s ILE 60 Cb -0.15 -1.99 -0.03 0.00 0.01 0.00 0.00 42.46 40.30 1rx2 s ILE 60 CO 0.09 0.52 -0.09 -0.63 0.00 0.00 0.00 174.94 174.83 1rx2 s ILE 61 N 1.14 3.49 -0.22 2.92 -1.09 0.70 -1.10 121.20 127.03 1rx2 s ILE 61 Ca 0.01 -0.54 -0.17 0.00 -2.23 0.00 0.00 60.65 57.72 1rx2 s ILE 61 Cb -0.14 -2.44 -0.03 0.00 -1.58 0.00 0.00 42.46 38.26 1rx2 s ILE 61 CO -0.07 0.56 0.47 -0.76 -1.23 0.00 0.00 174.94 173.91 1rx2 s LEU 62 N -0.32 4.11 -0.10 2.97 1.43 0.25 -1.01 118.68 126.01 1rx2 s LEU 62 Ca 0.04 0.55 -0.24 0.00 -1.03 0.00 0.00 54.13 53.45 1rx2 s LEU 62 Cb -0.13 -2.62 0.06 0.00 0.03 0.00 0.00 46.19 43.54 1rx2 s LEU 62 CO 0.02 -0.18 0.58 -0.55 0.23 0.00 0.00 176.35 176.45 1rx2 s SER 63 N 1.28 -0.55 0.33 2.29 0.15 -0.92 -2.04 113.70 114.25 1rx2 s SER 63 Ca 0.21 0.74 0.24 0.00 0.70 0.00 0.00 55.95 57.84 1rx2 s SER 63 Cb -0.15 0.70 0.50 0.00 -1.71 0.00 0.00 66.02 65.36 1rx2 s SER 63 CO 0.09 -0.45 1.64 0.77 1.20 0.00 0.00 173.24 176.49 1rx2 h SER 64 N 3.85 0.00 -3.35 5.45 4.64 -1.84 -3.36 113.55 118.93 1rx2 h SER 64 Ca -0.28 -0.01 -0.55 0.00 -0.47 0.00 0.00 61.79 60.48 1rx2 h SER 64 Cb 1.16 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.21 1rx2 h SER 64 CO 0.31 0.00 -0.16 -1.10 -0.87 0.00 0.00 176.83 175.02 1rx2 s GLN 65 N -3.17 3.78 0.72 4.77 1.11 -1.26 -5.04 119.66 120.56 1rx2 s GLN 65 Ca 0.08 0.21 -0.16 0.00 0.01 0.00 0.00 55.36 55.51 1rx2 s GLN 65 Cb 0.08 -2.73 0.03 0.00 -1.01 0.00 0.00 33.01 29.38 1rx2 s GLN 65 CO 0.65 0.37 1.24 -1.25 0.01 0.00 0.00 175.29 176.31 1rx2 s PRO 66 N -2.66 2.17 0.94 2.91 0.05 -1.26 -4.97 135.00 132.18 1rx2 s PRO 66 Ca 0.44 1.87 -0.11 0.00 0.05 0.00 0.00 61.00 63.26 1rx2 s PRO 66 Cb -0.12 -1.82 0.14 0.00 0.05 0.00 0.00 34.50 32.75 1rx2 s PRO 66 CO 0.21 -1.84 1.03 0.41 0.05 0.00 0.00 177.00 176.87 1rx2 n GLY 67 N 0.61 -0.72 0.88 0.56 0.00 -1.26 -5.00 105.19 100.26 1rx2 n GLY 67 Ca 0.14 -0.75 0.01 0.00 0.00 0.00 0.00 46.02 45.42 1rx2 n GLY 67 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1rx2 n THR 68 N -4.23 0.00 -3.37 2.61 -1.04 -1.26 -5.03 114.28 101.96 1rx2 n THR 68 Ca 0.11 -0.33 0.02 0.00 -2.04 0.00 0.00 64.05 61.81 1rx2 n THR 68 Cb 0.52 0.60 -0.04 0.00 -1.82 0.00 0.00 70.33 69.59 1rx2 n THR 68 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1rx2 s ASP 69 N -1.19 -0.44 0.00 8.00 -1.08 -1.26 -5.02 116.67 115.68 1rx2 s ASP 69 Ca 0.11 0.61 0.23 0.00 -0.52 0.00 0.00 52.55 52.99 1rx2 s ASP 69 Cb 0.13 1.48 1.10 0.00 -1.46 0.00 0.00 42.92 44.16 1rx2 s ASP 69 CO -0.06 -0.09 1.74 0.47 0.52 0.00 0.00 175.17 177.76 1rx2 n ASP 70 N 4.75 0.87 0.14 -0.34 8.00 -1.26 -3.56 116.55 125.15 1rx2 n ASP 70 Ca -0.09 -1.47 0.13 0.00 0.71 0.00 0.00 54.79 54.07 1rx2 n ASP 70 Cb 0.54 -0.04 0.45 0.00 -0.02 0.00 0.00 41.12 42.05 1rx2 n ASP 70 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1rx2 h ARG 71 N 1.22 0.00 -5.24 -1.24 3.08 -2.00 -3.45 114.38 106.75 1rx2 h ARG 71 Ca 0.00 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.50 1rx2 h ARG 71 Cb 0.26 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.18 1rx2 h ARG 71 CO 0.00 0.00 -0.57 0.14 -1.07 0.00 0.00 179.97 178.47 1rx2 s VAL 72 N -3.26 1.15 -0.18 2.04 -7.23 -1.23 -4.89 120.40 106.80 1rx2 s VAL 72 Ca 0.07 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.15 1rx2 s VAL 72 Cb 0.10 -2.61 -0.04 0.00 0.56 0.00 0.00 36.38 34.39 1rx2 s VAL 72 CO 0.51 0.00 0.09 -0.89 -0.31 0.00 0.00 175.10 174.50 1rx2 s THR 73 N -3.12 5.07 -0.10 5.32 2.01 -0.51 -4.96 115.64 119.36 1rx2 s THR 73 Ca 0.28 0.06 -0.01 0.00 0.31 0.00 0.00 61.69 62.33 1rx2 s THR 73 Cb 0.06 -3.28 -0.03 0.00 0.01 0.00 0.00 72.50 69.26 1rx2 s THR 73 CO 0.14 0.48 -0.05 0.26 -0.69 0.00 0.00 174.62 174.75 1rx2 s TRP 74 N 0.17 3.00 0.12 4.92 0.52 -1.26 -0.21 118.94 126.19 1rx2 s TRP 74 Ca 0.06 -0.08 0.05 0.00 0.02 0.00 0.00 56.10 56.16 1rx2 s TRP 74 Cb -0.12 -1.81 -0.04 0.00 -1.15 0.00 0.00 33.47 30.35 1rx2 s TRP 74 CO -0.00 0.21 -0.13 0.14 0.02 0.00 0.00 176.95 177.19 1rx2 s VAL 75 N -0.38 1.24 -1.79 4.03 -7.23 -0.18 -4.94 120.40 111.15 1rx2 s VAL 75 Ca 0.06 -1.76 0.16 0.00 -1.81 0.00 0.00 61.98 58.63 1rx2 s VAL 75 Cb -0.12 -1.55 0.21 0.00 0.56 0.00 0.00 36.38 35.48 1rx2 s VAL 75 CO 0.02 -0.49 1.10 0.29 -0.31 0.00 0.00 175.10 175.71 1rx2 n LYS 76 N 0.42 1.66 -3.63 4.82 5.02 -1.26 -2.17 118.16 123.01 1rx2 n LYS 76 Ca -0.15 -1.68 -0.10 0.00 -2.02 0.00 0.00 58.31 54.36 1rx2 n LYS 76 Cb 0.58 -1.33 -0.03 0.00 -0.02 0.00 0.00 35.03 34.23 1rx2 n LYS 76 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1rx2 s SER 77 N -1.23 -0.35 0.13 4.39 1.04 -1.26 -4.73 113.70 111.69 1rx2 s SER 77 Ca 0.23 -0.32 -0.19 0.00 0.48 0.00 0.00 55.95 56.15 1rx2 s SER 77 Cb 0.14 0.58 -0.05 0.00 0.10 0.00 0.00 66.02 66.79 1rx2 s SER 77 CO 0.21 -1.02 1.78 0.58 0.98 0.00 0.00 173.24 175.76 1rx2 h VAL 78 N 2.14 1.05 -0.94 5.02 2.07 -1.99 -0.59 116.25 123.02 1rx2 h VAL 78 Ca -0.30 -0.10 0.06 0.00 0.82 0.00 0.00 66.70 67.17 1rx2 h VAL 78 Cb 1.27 0.72 -0.06 0.00 -1.52 0.00 0.00 31.29 31.71 1rx2 h VAL 78 CO 0.38 0.06 0.61 0.44 0.02 0.00 0.00 177.57 179.07 1rx2 h ASP 79 N 0.30 0.97 -0.04 0.57 3.32 -1.99 -0.29 116.42 119.25 1rx2 h ASP 79 Ca 0.09 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.96 1rx2 h ASP 79 Cb -0.03 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.32 1rx2 h ASP 79 CO -0.02 0.63 -0.62 -0.08 -1.72 0.00 0.00 179.24 177.42 1rx2 h GLU 80 N 1.10 0.65 -0.50 3.56 4.81 -1.92 0.11 114.58 122.40 1rx2 h GLU 80 Ca 0.40 -0.45 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1rx2 h GLU 80 Cb 0.16 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1rx2 h GLU 80 CO -0.15 1.07 0.33 0.00 -0.73 0.00 0.00 179.01 179.53 1rx2 h ALA 81 N 0.82 0.63 -0.45 2.92 0.00 -0.55 0.32 119.26 122.94 1rx2 h ALA 81 Ca -0.01 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.73 1rx2 h ALA 81 Cb 1.20 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1rx2 h ALA 81 CO 0.12 0.07 -0.27 0.82 0.00 0.00 0.00 179.25 180.00 1rx2 h ILE 82 N 0.67 1.27 -0.09 0.00 2.04 -0.83 -2.75 117.51 117.82 1rx2 h ILE 82 Ca 0.18 -1.44 -0.07 0.00 1.00 0.00 0.00 64.86 64.53 1rx2 h ILE 82 Cb -0.08 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 1rx2 h ILE 82 CO -0.04 0.49 -0.26 0.00 0.00 0.00 0.00 178.15 178.34 1rx2 h ALA 83 N 0.85 1.40 0.00 1.87 0.00 -0.30 -2.49 119.26 120.58 1rx2 h ALA 83 Ca 0.10 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1rx2 h ALA 83 Cb 0.86 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1rx2 h ALA 83 CO 0.08 0.43 0.00 0.00 0.00 0.00 0.00 179.25 179.75 1rx2 h ALA 84 N 1.59 1.00 0.00 0.00 0.00 -0.07 -1.92 119.26 119.85 1rx2 h ALA 84 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 1rx2 h ALA 84 Cb 0.54 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1rx2 h ALA 84 CO 0.04 0.00 -0.60 0.00 0.00 0.00 0.00 179.25 178.69 1rx2 n GLY 86 N 0.65 -1.66 3.38 0.00 0.00 -0.73 -4.60 105.19 102.23 1rx2 n GLY 86 Ca -0.00 -1.35 -0.45 0.00 0.00 0.00 0.00 46.02 44.22 1rx2 n GLY 86 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1rx2 s ASP 87 N -4.00 6.18 0.06 1.61 1.01 -1.26 -4.97 116.67 115.30 1rx2 s ASP 87 Ca 0.00 -1.38 -0.00 0.00 0.71 0.00 0.00 52.55 51.88 1rx2 s ASP 87 Cb 0.00 -2.31 -0.04 0.00 1.01 0.00 0.00 42.92 41.58 1rx2 s ASP 87 CO 0.00 -1.12 -0.04 0.68 0.21 0.00 0.00 175.17 174.90 1rx2 s VAL 88 N 2.77 0.33 0.18 -1.27 -7.23 -1.26 -5.06 120.40 108.84 1rx2 s VAL 88 Ca 0.12 -1.72 -0.08 0.00 -1.81 0.00 0.00 61.98 58.50 1rx2 s VAL 88 Cb -0.23 -1.39 0.01 0.00 0.56 0.00 0.00 36.38 35.32 1rx2 s VAL 88 CO 0.07 -0.90 1.56 -0.65 -0.31 0.00 0.00 175.10 174.88 1rx2 h PRO 89 N 3.32 0.91 -3.32 4.82 0.11 -1.93 -3.38 132.00 132.53 1rx2 h PRO 89 Ca -0.34 -0.40 -0.23 0.00 0.11 0.00 0.00 66.00 65.14 1rx2 h PRO 89 Cb 1.16 -0.03 -0.31 0.00 0.11 0.00 0.00 31.00 31.93 1rx2 h PRO 89 CO 0.62 1.05 -0.60 -2.00 -0.21 0.00 0.00 178.00 176.86 1rx2 s GLU 90 N -4.60 0.10 -0.15 1.05 2.12 -1.26 0.14 118.70 116.11 1rx2 s GLU 90 Ca -0.11 0.31 -0.04 0.00 0.36 0.00 0.00 54.97 55.50 1rx2 s GLU 90 Cb 0.12 -0.12 -0.03 0.00 0.26 0.00 0.00 34.13 34.36 1rx2 s GLU 90 CO 0.86 -0.13 -0.02 0.42 -0.54 0.00 0.00 175.26 175.85 1rx2 s ILE 91 N 0.88 4.06 -0.25 -3.70 1.01 0.40 -4.37 121.20 119.23 1rx2 s ILE 91 Ca -0.07 -0.31 -0.08 0.00 0.00 0.00 0.00 60.65 60.20 1rx2 s ILE 91 Cb -0.09 -2.77 -0.04 0.00 0.01 0.00 0.00 42.46 39.58 1rx2 s ILE 91 CO -0.04 0.51 0.10 -0.04 0.00 0.00 0.00 174.94 175.46 1rx2 s MET 92 N 0.15 3.76 -0.24 2.79 -1.94 -0.70 -1.09 119.30 122.04 1rx2 s MET 92 Ca -0.00 -0.42 -0.13 0.00 -1.71 0.00 0.00 55.69 53.42 1rx2 s MET 92 Cb -0.13 -3.39 -0.04 0.00 2.01 0.00 0.00 34.83 33.27 1rx2 s MET 92 CO 0.02 -0.13 0.29 0.08 -0.01 0.00 0.00 175.02 175.28 1rx2 s VAL 93 N 1.50 5.26 -0.66 -6.03 1.01 -0.01 -0.64 120.40 120.83 1rx2 s VAL 93 Ca 0.06 0.45 0.15 0.00 0.00 0.00 0.00 61.98 62.64 1rx2 s VAL 93 Cb -0.15 -3.63 0.51 0.00 0.00 0.00 0.00 36.38 33.11 1rx2 s VAL 93 CO 0.05 0.26 1.43 2.30 0.00 0.00 0.00 175.10 179.13 1rx2 n ILE 94 N 4.60 1.76 -0.50 2.22 -5.35 -0.15 -1.57 119.36 120.38 1rx2 n ILE 94 Ca -0.11 -1.41 0.00 0.00 -0.27 0.00 0.00 62.75 60.96 1rx2 n ILE 94 Cb 0.51 0.09 0.00 0.00 -1.74 0.00 0.00 39.64 38.50 1rx2 n ILE 94 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1rx2 n GLY 95 N 0.26 -1.98 0.00 3.28 0.00 -1.26 -4.93 105.19 100.57 1rx2 n GLY 95 Ca 0.19 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 44.23 1rx2 n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rx2 n GLY 96 N -0.01 1.11 0.41 -0.02 0.00 -1.26 0.03 105.19 105.44 1rx2 n GLY 96 Ca 0.00 -1.53 -0.10 0.00 0.00 0.00 0.00 46.02 44.39 1rx2 n GLY 96 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1rx2 h GLY 97 N 0.00 -0.60 1.00 -0.02 0.00 -1.95 0.12 103.07 101.61 1rx2 h GLY 97 Ca 0.00 0.60 -0.01 0.00 0.00 0.00 0.00 47.33 47.92 1rx2 h GLY 97 CO 0.00 -0.15 0.36 3.21 0.00 0.00 0.00 176.54 179.96 1rx2 h ARG 98 N -0.27 0.88 -0.35 4.80 2.47 -1.95 -1.36 114.38 118.59 1rx2 h ARG 98 Ca 0.15 -0.10 -0.11 0.00 -1.26 0.00 0.00 59.98 58.67 1rx2 h ARG 98 Cb 0.57 -0.17 -0.01 0.00 -1.65 0.00 0.00 29.97 28.70 1rx2 h ARG 98 CO -0.66 0.66 -0.21 0.28 0.56 0.00 0.00 179.97 180.59 1rx2 h VAL 99 N 0.86 1.27 -0.62 2.04 2.07 -1.71 -2.78 116.25 117.37 1rx2 h VAL 99 Ca 0.22 -1.29 -0.02 0.00 0.82 0.00 0.00 66.70 66.43 1rx2 h VAL 99 Cb 0.03 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 1rx2 h VAL 99 CO -0.04 0.42 0.30 1.88 0.02 0.00 0.00 177.57 180.16 1rx2 h TYR 100 N 0.60 0.90 -0.91 1.57 0.05 -0.37 -2.46 116.97 116.35 1rx2 h TYR 100 Ca 0.09 -0.04 0.10 0.00 0.05 0.00 0.00 58.73 58.93 1rx2 h TYR 100 Cb 0.69 -0.28 -0.08 0.00 1.01 0.00 0.00 36.73 38.07 1rx2 h TYR 100 CO 0.03 0.68 0.55 1.49 -1.05 0.00 0.00 178.16 179.86 1rx2 h GLU 101 N 0.86 0.88 0.00 4.88 4.81 -1.11 -0.01 114.58 124.88 1rx2 h GLU 101 Ca 0.21 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 59.25 1rx2 h GLU 101 Cb 0.12 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1rx2 h GLU 101 CO -0.03 0.58 -0.68 1.96 -0.73 0.00 0.00 179.01 180.12 1rx2 h GLN 102 N 0.91 0.00 0.00 1.92 4.20 -1.24 -3.32 115.11 117.58 1rx2 h GLN 102 Ca 0.44 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.15 1rx2 h GLN 102 Cb 0.39 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.17 1rx2 h GLN 102 CO -0.25 0.68 -1.33 1.19 -0.67 0.00 0.00 178.83 178.45 1rx2 n PHE 103 N -3.73 0.59 -0.24 2.96 3.72 -0.95 -4.52 117.46 115.29 1rx2 n PHE 103 Ca -0.01 0.17 0.03 0.00 -0.05 0.00 0.00 57.45 57.60 1rx2 n PHE 103 Cb 0.67 -0.76 0.13 0.00 -0.94 0.00 0.00 39.48 38.57 1rx2 n PHE 103 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 1rx2 h LEU 104 N 0.00 -0.39 -1.94 4.37 5.85 -1.11 0.15 115.31 122.23 1rx2 h LEU 104 Ca 0.00 0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 1rx2 h LEU 104 Cb 0.97 0.35 -0.00 0.00 0.37 0.00 0.00 40.66 42.35 1rx2 h LEU 104 CO 0.00 -0.18 -0.11 -0.65 -0.34 0.00 0.00 178.44 177.17 1rx2 h PRO 105 N 0.08 0.00 0.00 5.25 0.10 -1.80 -2.18 132.00 133.45 1rx2 h PRO 105 Ca 0.38 0.00 0.00 0.00 0.10 0.00 0.00 66.00 66.48 1rx2 h PRO 105 Cb 0.64 0.00 0.00 0.00 0.10 0.00 0.00 31.00 31.74 1rx2 h PRO 105 CO -0.65 0.11 -0.74 1.63 0.10 0.00 0.00 178.00 178.45 1rx2 n LYS 106 N -3.59 0.01 -2.61 1.05 5.02 0.37 -4.96 118.16 113.45 1rx2 n LYS 106 Ca -0.02 -0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.91 1rx2 n LYS 106 Cb 0.23 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.69 1rx2 n LYS 106 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rx2 s ALA 107 N -3.01 3.13 -0.32 7.82 0.00 -0.40 -4.61 121.76 124.38 1rx2 s ALA 107 Ca 0.09 0.66 0.13 0.00 0.00 0.00 0.00 51.96 52.84 1rx2 s ALA 107 Cb 0.17 -3.25 -0.17 0.00 0.00 0.00 0.00 23.12 19.87 1rx2 s ALA 107 CO 0.78 -0.11 0.42 1.04 0.00 0.00 0.00 175.76 177.89 1rx2 n GLN 108 N 0.10 1.59 -3.80 0.00 1.13 0.11 -4.83 117.38 111.68 1rx2 n GLN 108 Ca 0.04 -0.06 -0.12 0.00 -1.94 0.00 0.00 57.00 54.92 1rx2 n GLN 108 Cb 0.50 -1.21 -0.11 0.00 0.11 0.00 0.00 30.24 29.53 1rx2 n GLN 108 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 1rx2 s LYS 109 N -2.56 0.42 -0.05 -1.09 2.20 -1.19 -1.24 119.74 116.23 1rx2 s LYS 109 Ca 0.00 0.05 0.04 0.00 -0.36 0.00 0.00 55.97 55.70 1rx2 s LYS 109 Cb 0.09 0.19 0.00 0.00 -1.51 0.00 0.00 37.83 36.60 1rx2 s LYS 109 CO 0.54 -0.09 -0.15 -0.51 -0.36 0.00 0.00 175.35 174.78 1rx2 s LEU 110 N -0.54 1.86 -0.41 5.43 1.43 -0.02 -1.13 118.68 125.29 1rx2 s LEU 110 Ca -0.06 -0.33 -0.05 0.00 -1.03 0.00 0.00 54.13 52.66 1rx2 s LEU 110 Cb -0.04 -0.91 0.10 0.00 0.03 0.00 0.00 46.19 45.37 1rx2 s LEU 110 CO 0.01 0.12 0.21 -0.31 0.23 0.00 0.00 176.35 176.62 1rx2 s TYR 111 N 0.19 3.50 -0.01 0.29 1.51 0.58 -1.29 117.35 122.12 1rx2 s TYR 111 Ca -0.06 -2.15 0.05 0.00 -1.01 0.00 0.00 57.07 53.89 1rx2 s TYR 111 Cb -0.12 -3.11 -0.03 0.00 -0.11 0.00 0.00 41.96 38.59 1rx2 s TYR 111 CO 0.03 -0.94 -0.15 -0.51 -1.11 0.00 0.00 175.55 172.87 1rx2 s LEU 112 N 1.23 2.74 -0.22 -1.29 1.43 0.25 -1.54 118.68 121.27 1rx2 s LEU 112 Ca 0.06 -0.28 -0.05 0.00 -1.03 0.00 0.00 54.13 52.83 1rx2 s LEU 112 Cb -0.23 -1.58 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 1rx2 s LEU 112 CO -0.02 0.30 -0.01 -0.89 0.23 0.00 0.00 176.35 175.96 1rx2 s THR 113 N -0.84 3.66 -0.21 5.49 2.01 -0.71 0.41 115.64 125.45 1rx2 s THR 113 Ca 0.14 -0.39 -0.12 0.00 0.31 0.00 0.00 61.69 61.62 1rx2 s THR 113 Cb -0.11 -2.68 -0.05 0.00 0.01 0.00 0.00 72.50 69.68 1rx2 s THR 113 CO 0.03 0.40 0.23 -1.00 -0.69 0.00 0.00 174.62 173.60 1rx2 s HIS 114 N 1.46 3.36 -0.09 4.92 0.09 0.76 -1.24 115.29 124.55 1rx2 s HIS 114 Ca 0.05 0.39 0.00 0.00 -0.00 0.00 0.00 55.06 55.51 1rx2 s HIS 114 Cb -0.14 -2.33 -0.03 0.00 -0.00 0.00 0.00 32.58 30.08 1rx2 s HIS 114 CO -0.01 0.10 -0.08 0.42 -0.00 0.00 0.00 174.74 175.17 1rx2 s ILE 115 N 0.93 3.56 -0.94 0.60 1.01 0.11 -0.73 121.20 125.74 1rx2 s ILE 115 Ca 0.12 -0.52 -0.21 0.00 0.00 0.00 0.00 60.65 60.04 1rx2 s ILE 115 Cb -0.13 -2.47 0.09 0.00 0.01 0.00 0.00 42.46 39.95 1rx2 s ILE 115 CO 0.04 0.57 1.26 -0.62 0.00 0.00 0.00 174.94 176.19 1rx2 s ASP 116 N -0.41 6.53 -0.27 3.58 2.15 -0.29 -3.63 116.67 124.33 1rx2 s ASP 116 Ca 0.06 -1.67 -0.23 0.00 0.43 0.00 0.00 52.55 51.14 1rx2 s ASP 116 Cb -0.12 -2.48 0.07 0.00 -0.30 0.00 0.00 42.92 40.09 1rx2 s ASP 116 CO 0.02 -1.31 0.70 0.00 -0.17 0.00 0.00 175.17 174.42 1rx2 s ALA 117 N 3.85 -1.77 -0.41 3.66 0.00 -1.26 -4.46 121.76 121.38 1rx2 s ALA 117 Ca 0.38 2.07 -0.11 0.00 0.00 0.00 0.00 51.96 54.30 1rx2 s ALA 117 Cb -0.04 -1.21 0.05 0.00 0.00 0.00 0.00 23.12 21.93 1rx2 s ALA 117 CO -0.08 -0.34 0.25 -2.00 0.00 0.00 0.00 175.76 173.60 1rx2 s GLU 118 N 0.61 2.75 -0.02 0.00 -6.30 -1.26 -1.64 118.70 112.84 1rx2 s GLU 118 Ca -0.02 -1.27 0.05 0.00 -2.50 0.00 0.00 54.97 51.23 1rx2 s GLU 118 Cb -0.05 -3.81 -0.01 0.00 0.00 0.00 0.00 34.13 30.26 1rx2 s GLU 118 CO -0.03 -0.85 -0.17 0.54 0.02 0.00 0.00 175.26 174.78 1rx2 s VAL 119 N 1.51 1.32 -0.52 3.70 0.11 -1.26 -5.06 120.40 120.21 1rx2 s VAL 119 Ca 0.03 -0.70 -0.23 0.00 -2.93 0.00 0.00 61.98 58.15 1rx2 s VAL 119 Cb -0.21 -1.11 0.04 0.00 -1.53 0.00 0.00 36.38 33.57 1rx2 s VAL 119 CO 0.05 0.38 0.84 -1.61 -3.33 0.00 0.00 175.10 171.42 1rx2 s GLU 120 N -0.29 3.29 0.03 1.54 2.02 -1.26 -4.90 118.70 119.13 1rx2 s GLU 120 Ca 0.04 -0.39 0.00 0.00 0.02 0.00 0.00 54.97 54.64 1rx2 s GLU 120 Cb -0.07 -4.05 -0.00 0.00 0.10 0.00 0.00 34.13 30.11 1rx2 s GLU 120 CO -0.00 -1.37 0.00 0.41 0.02 0.00 0.00 175.26 174.33 1rx2 n GLY 121 N 5.11 4.12 0.00 -1.39 0.00 -1.26 -4.87 105.19 106.90 1rx2 n GLY 121 Ca -0.00 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 43.92 1rx2 n GLY 121 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1rx2 n ASP 122 N -1.42 0.77 -4.06 1.61 5.68 -0.36 -4.97 116.55 113.80 1rx2 n ASP 122 Ca -0.01 -1.13 -0.19 0.00 -0.50 0.00 0.00 54.79 52.96 1rx2 n ASP 122 Cb 0.03 0.00 -0.14 0.00 -1.14 0.00 0.00 41.12 39.87 1rx2 n ASP 122 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1rx2 s THR 123 N -0.13 0.82 0.10 2.12 2.01 -1.18 -5.01 115.64 114.38 1rx2 s THR 123 Ca 0.00 -0.54 0.04 0.00 0.31 0.00 0.00 61.69 61.50 1rx2 s THR 123 Cb 0.00 -0.71 -0.04 0.00 0.01 0.00 0.00 72.50 71.77 1rx2 s THR 123 CO 0.00 0.16 -0.11 -1.00 -0.69 0.00 0.00 174.62 172.98 1rx2 s HIS 124 N -0.38 1.14 0.42 4.92 3.76 -1.26 -0.69 115.29 123.20 1rx2 s HIS 124 Ca 0.03 -0.64 -0.23 0.00 -0.15 0.00 0.00 55.06 54.07 1rx2 s HIS 124 Cb -0.05 -0.62 -0.09 0.00 1.11 0.00 0.00 32.58 32.94 1rx2 s HIS 124 CO -0.00 0.03 1.03 0.12 -0.85 0.00 0.00 174.74 175.07 1rx2 s PHE 125 N -2.40 3.24 0.75 1.40 5.36 -0.15 -4.66 117.98 121.52 1rx2 s PHE 125 Ca 0.06 1.64 -0.15 0.00 -0.96 0.00 0.00 56.93 57.52 1rx2 s PHE 125 Cb -0.03 -3.06 0.05 0.00 -0.34 0.00 0.00 43.02 39.64 1rx2 s PHE 125 CO 0.01 -0.54 1.24 -2.14 -1.46 0.00 0.00 175.22 172.32 1rx2 s PRO 126 N -2.72 1.96 -0.69 10.12 0.02 -1.26 -4.89 135.00 137.54 1rx2 s PRO 126 Ca 0.60 1.88 -0.21 0.00 0.02 0.00 0.00 61.00 63.29 1rx2 s PRO 126 Cb -0.19 -1.80 0.09 0.00 0.02 0.00 0.00 34.50 32.63 1rx2 s PRO 126 CO 0.24 -2.00 0.91 0.34 -0.33 0.00 0.00 177.00 176.15 1rx2 s ASP 127 N -1.87 6.27 0.28 2.53 2.15 -1.26 -5.00 116.67 119.77 1rx2 s ASP 127 Ca 0.77 -1.35 -0.09 0.00 0.43 0.00 0.00 52.55 52.31 1rx2 s ASP 127 Cb -0.32 -2.37 -0.07 0.00 -0.30 0.00 0.00 42.92 39.86 1rx2 s ASP 127 CO 0.47 -1.26 0.60 -0.72 -0.17 0.00 0.00 175.17 174.09 1rx2 s TYR 128 N 3.31 3.44 -0.72 -5.34 1.13 -1.26 -5.02 117.35 112.89 1rx2 s TYR 128 Ca 0.20 0.86 -0.26 0.00 -1.41 0.00 0.00 57.07 56.47 1rx2 s TYR 128 Cb -0.17 -2.27 -0.00 0.00 -1.10 0.00 0.00 41.96 38.42 1rx2 s TYR 128 CO 0.05 0.16 1.64 -2.00 -2.51 0.00 0.00 175.55 172.90 1rx2 s GLU 129 N -3.22 2.88 0.39 -3.49 2.56 -1.26 -4.89 118.70 111.67 1rx2 s GLU 129 Ca 0.48 0.09 0.19 0.00 0.00 0.00 0.00 54.97 55.73 1rx2 s GLU 129 Cb -0.11 -4.47 1.13 0.00 2.00 0.00 0.00 34.13 32.69 1rx2 s GLU 129 CO 0.25 -2.57 1.72 -1.00 -0.56 0.00 0.00 175.26 173.11 1rx2 h PRO 130 N 12.50 0.34 -0.69 4.30 0.13 -1.95 -1.73 132.00 144.90 1rx2 h PRO 130 Ca -0.19 -0.02 0.13 0.00 -0.87 0.00 0.00 66.00 65.05 1rx2 h PRO 130 Cb 1.10 -0.08 -0.09 0.00 0.13 0.00 0.00 31.00 32.05 1rx2 h PRO 130 CO 1.25 0.23 0.21 -0.44 -0.23 0.00 0.00 178.00 179.02 1rx2 h ASP 131 N 0.35 0.13 0.25 1.44 3.32 -2.05 -1.16 116.42 118.70 1rx2 h ASP 131 Ca 0.66 0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.83 1rx2 h ASP 131 Cb 1.69 0.13 0.00 0.00 0.22 0.00 0.00 39.33 41.37 1rx2 h ASP 131 CO -0.38 0.05 0.00 0.47 -1.72 0.00 0.00 179.24 177.66 1rx2 n ASP 132 N -5.08 0.00 -4.34 6.45 8.00 -0.65 -4.80 116.55 116.13 1rx2 n ASP 132 Ca 0.12 -0.09 -0.28 0.00 0.71 0.00 0.00 54.79 55.25 1rx2 n ASP 132 Cb 0.39 -0.22 -0.14 0.00 -0.02 0.00 0.00 41.12 41.13 1rx2 n ASP 132 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1rx2 s TRP 133 N -2.44 2.15 -0.17 1.24 0.52 -0.44 -0.89 118.94 118.90 1rx2 s TRP 133 Ca 0.18 -0.39 -0.02 0.00 0.02 0.00 0.00 56.10 55.89 1rx2 s TRP 133 Cb 0.12 -1.22 -0.01 0.00 -1.15 0.00 0.00 33.47 31.20 1rx2 s TRP 133 CO 0.25 0.22 -0.09 -2.00 0.02 0.00 0.00 176.95 175.35 1rx2 s GLU 134 N -1.67 3.38 -0.25 4.98 2.12 0.66 -4.84 118.70 123.08 1rx2 s GLU 134 Ca 0.11 -0.65 -0.28 0.00 0.36 0.00 0.00 54.97 54.51 1rx2 s GLU 134 Cb -0.10 -2.82 0.01 0.00 0.26 0.00 0.00 34.13 31.48 1rx2 s GLU 134 CO 0.04 0.01 1.02 0.45 -0.54 0.00 0.00 175.26 176.24 1rx2 s SER 135 N 0.90 7.02 0.00 -1.70 0.15 -1.26 -0.44 113.70 118.36 1rx2 s SER 135 Ca -0.02 1.24 0.12 0.00 0.70 0.00 0.00 55.95 58.00 1rx2 s SER 135 Cb -0.15 -2.52 -0.05 0.00 -1.71 0.00 0.00 66.02 61.59 1rx2 s SER 135 CO 0.00 -0.70 0.65 1.33 1.20 0.00 0.00 173.24 175.73 1rx2 n VAL 136 N 5.45 0.00 -3.71 4.45 0.24 0.96 -4.97 118.33 120.74 1rx2 n VAL 136 Ca 0.11 -0.31 -0.13 0.00 -2.04 0.00 0.00 64.34 61.97 1rx2 n VAL 136 Cb 0.46 1.10 -0.10 0.00 -1.47 0.00 0.00 33.84 33.83 1rx2 n VAL 136 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1rx2 s PHE 137 N -1.79 -0.53 -0.14 6.34 5.36 -1.15 -4.99 117.98 121.09 1rx2 s PHE 137 Ca 0.08 1.24 -0.09 0.00 -0.96 0.00 0.00 56.93 57.20 1rx2 s PHE 137 Cb 0.10 0.20 0.04 0.00 -0.34 0.00 0.00 43.02 43.02 1rx2 s PHE 137 CO 0.38 -0.27 0.34 0.45 -1.46 0.00 0.00 175.22 174.67 1rx2 s SER 138 N 0.51 -0.39 -0.25 6.13 0.15 -1.26 -1.62 113.70 116.97 1rx2 s SER 138 Ca -0.02 0.72 -0.02 0.00 0.70 0.00 0.00 55.95 57.33 1rx2 s SER 138 Cb -0.04 0.65 0.14 0.00 -1.71 0.00 0.00 66.02 65.06 1rx2 s SER 138 CO -0.03 -0.16 0.37 -0.70 1.20 0.00 0.00 173.24 173.93 1rx2 s GLU 139 N 0.85 0.35 0.26 5.44 2.12 -0.16 -4.96 118.70 122.61 1rx2 s GLU 139 Ca -0.05 0.41 -0.23 0.00 0.36 0.00 0.00 54.97 55.45 1rx2 s GLU 139 Cb -0.06 -0.49 -0.09 0.00 0.26 0.00 0.00 34.13 33.74 1rx2 s GLU 139 CO -0.06 -0.73 0.84 0.12 -0.54 0.00 0.00 175.26 174.88 1rx2 s PHE 140 N 2.53 3.70 -0.01 5.30 5.36 -1.26 -1.30 117.98 132.29 1rx2 s PHE 140 Ca 0.12 1.61 0.00 0.00 -0.96 0.00 0.00 56.93 57.70 1rx2 s PHE 140 Cb -0.15 -2.78 0.02 0.00 -0.34 0.00 0.00 43.02 39.76 1rx2 s PHE 140 CO -0.19 0.30 0.01 -1.01 -1.46 0.00 0.00 175.22 172.87 1rx2 s HIS 141 N -1.53 0.06 0.71 10.12 3.76 0.19 -4.99 115.29 123.62 1rx2 s HIS 141 Ca 0.46 0.05 -0.11 0.00 -0.15 0.00 0.00 55.06 55.31 1rx2 s HIS 141 Cb -0.18 -0.16 0.02 0.00 1.11 0.00 0.00 32.58 33.37 1rx2 s HIS 141 CO 0.23 -0.05 1.08 -0.51 -0.85 0.00 0.00 174.74 174.64 1rx2 s ASP 142 N 0.57 5.32 0.68 1.40 1.01 -1.26 -1.39 116.67 122.99 1rx2 s ASP 142 Ca -0.05 1.32 -0.14 0.00 0.71 0.00 0.00 52.55 54.39 1rx2 s ASP 142 Cb -0.07 -2.16 0.01 0.00 1.01 0.00 0.00 42.92 41.71 1rx2 s ASP 142 CO -0.01 -1.45 1.09 0.00 0.21 0.00 0.00 175.17 175.01 1rx2 s ALA 143 N -3.22 2.47 0.00 5.23 0.00 -1.26 -4.73 121.76 120.26 1rx2 s ALA 143 Ca 0.58 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.96 1rx2 s ALA 143 Cb -0.12 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.71 1rx2 s ALA 143 CO 0.53 -1.33 0.00 -0.40 0.00 0.00 0.00 175.76 174.56 1rx2 n ASP 144 N -2.70 0.00 0.24 0.00 5.68 0.15 -4.96 116.55 114.96 1rx2 n ASP 144 Ca 0.10 -0.82 0.09 0.00 -0.50 0.00 0.00 54.79 53.66 1rx2 n ASP 144 Cb 0.52 0.00 0.61 0.00 -1.14 0.00 0.00 41.12 41.11 1rx2 n ASP 144 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1rx2 h ALA 145 N 1.43 1.42 0.00 2.12 0.00 -2.01 -2.59 119.26 119.64 1rx2 h ALA 145 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1rx2 h ALA 145 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1rx2 h ALA 145 CO 0.00 0.21 -1.64 1.04 0.00 0.00 0.00 179.25 178.86 1rx2 n GLN 146 N -3.91 0.43 -3.88 0.00 6.02 -1.26 -4.84 117.38 109.93 1rx2 n GLN 146 Ca -0.02 -0.13 -0.30 0.00 -0.01 0.00 0.00 57.00 56.55 1rx2 n GLN 146 Cb 0.26 -1.51 -0.16 0.00 1.02 0.00 0.00 30.24 29.85 1rx2 n GLN 146 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1rx2 s ASN 147 N -3.97 3.66 0.32 1.08 0.01 -0.97 -4.47 114.94 110.59 1rx2 s ASN 147 Ca -0.02 -1.13 0.16 0.00 -0.71 0.00 0.00 52.86 51.16 1rx2 s ASN 147 Cb 0.15 -1.04 0.89 0.00 0.41 0.00 0.00 41.25 41.66 1rx2 s ASN 147 CO 0.89 -0.26 1.44 -0.24 -1.51 0.00 0.00 177.10 177.42 1rx2 n SER 148 N 4.76 0.43 -3.95 -1.22 2.88 -1.26 0.30 113.62 115.55 1rx2 n SER 148 Ca -0.11 0.64 -0.09 0.00 -1.33 0.00 0.00 58.87 57.98 1rx2 n SER 148 Cb 0.45 -0.63 -0.07 0.00 -0.75 0.00 0.00 64.21 63.20 1rx2 n SER 148 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1rx2 s HIS 149 N -3.41 0.38 0.41 0.66 3.76 -1.26 -4.91 115.29 110.93 1rx2 s HIS 149 Ca -0.02 -0.75 -0.09 0.00 -0.15 0.00 0.00 55.06 54.05 1rx2 s HIS 149 Cb 0.05 -0.05 -0.06 0.00 1.11 0.00 0.00 32.58 33.63 1rx2 s HIS 149 CO 0.15 -0.71 0.76 -1.54 -0.85 0.00 0.00 174.74 172.55 1rx2 s SER 150 N -2.96 6.47 0.11 1.40 1.04 -1.26 -4.00 113.70 114.50 1rx2 s SER 150 Ca 0.17 1.08 -0.08 0.00 0.48 0.00 0.00 55.95 57.59 1rx2 s SER 150 Cb 0.03 -2.30 -0.01 0.00 0.10 0.00 0.00 66.02 63.84 1rx2 s SER 150 CO -0.01 -0.42 0.21 -0.72 0.98 0.00 0.00 173.24 173.29 1rx2 s TYR 151 N -2.43 0.25 -0.08 5.02 1.13 -0.49 -1.14 117.35 119.61 1rx2 s TYR 151 Ca 0.50 -0.66 0.01 0.00 -1.41 0.00 0.00 57.07 55.52 1rx2 s TYR 151 Cb -0.10 -0.07 0.02 0.00 -1.10 0.00 0.00 41.96 40.70 1rx2 s TYR 151 CO 0.34 -0.60 -0.10 0.00 -2.51 0.00 0.00 175.55 172.67 1rx2 s PHE 153 N 1.06 3.53 0.02 0.00 0.08 -0.42 -0.17 117.98 122.09 1rx2 s PHE 153 Ca -0.07 0.99 0.00 0.00 0.12 0.00 0.00 56.93 57.97 1rx2 s PHE 153 Cb -0.15 -2.62 -0.02 0.00 -0.57 0.00 0.00 43.02 39.67 1rx2 s PHE 153 CO -0.01 0.15 -0.04 -2.00 -0.10 0.00 0.00 175.22 173.22 1rx2 s GLU 154 N 0.66 0.34 -0.10 0.44 2.12 0.17 -0.99 118.70 121.33 1rx2 s GLU 154 Ca 0.29 -0.63 0.00 0.00 0.36 0.00 0.00 54.97 54.99 1rx2 s GLU 154 Cb -0.16 0.06 0.02 0.00 0.26 0.00 0.00 34.13 34.32 1rx2 s GLU 154 CO 0.12 -0.04 -0.09 0.42 -0.54 0.00 0.00 175.26 175.13 1rx2 s ILE 155 N -1.47 1.10 0.07 -3.70 1.01 -0.64 -0.58 121.20 116.99 1rx2 s ILE 155 Ca -0.15 -0.36 0.07 0.00 0.00 0.00 0.00 60.65 60.21 1rx2 s ILE 155 Cb -0.10 -1.08 -0.04 0.00 0.01 0.00 0.00 42.46 41.26 1rx2 s ILE 155 CO -0.01 0.37 -0.14 -0.76 0.00 0.00 0.00 174.94 174.40 1rx2 s LEU 156 N 1.43 2.83 -0.06 2.97 1.43 -0.41 -0.03 118.68 126.84 1rx2 s LEU 156 Ca 0.00 -0.41 0.04 0.00 -1.03 0.00 0.00 54.13 52.74 1rx2 s LEU 156 Cb -0.13 -1.66 -0.00 0.00 0.03 0.00 0.00 46.19 44.43 1rx2 s LEU 156 CO -0.06 0.22 -0.18 -1.61 0.23 0.00 0.00 176.35 174.95 1rx2 s GLU 157 N -1.81 2.04 0.19 1.70 2.02 0.42 -0.84 118.70 122.42 1rx2 s GLU 157 Ca 0.18 -0.65 -0.32 0.00 0.02 0.00 0.00 54.97 54.20 1rx2 s GLU 157 Cb -0.11 -1.70 -0.11 0.00 0.10 0.00 0.00 34.13 32.31 1rx2 s GLU 157 CO 0.09 0.21 1.64 0.50 0.02 0.00 0.00 175.26 177.72 1rx2 s ARG 158 N 0.18 4.17 0.00 1.61 3.52 -0.37 -0.24 118.95 127.81 1rx2 s ARG 158 Ca -0.08 2.48 0.09 0.00 -0.13 0.00 0.00 55.73 58.09 1rx2 s ARG 158 Cb -0.14 -3.11 0.54 0.00 -1.56 0.00 0.00 34.95 30.69 1rx2 s ARG 158 CO 0.04 -0.67 0.99 0.54 -0.81 0.00 0.00 175.30 175.39