#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rb3 s ILE 2 N 0.00 5.24 0.01 3.17 1.01 -1.26 -0.19 121.20 129.18 1rb3 s ILE 2 Ca 0.00 0.13 0.03 0.00 0.00 0.00 0.00 60.65 60.81 1rb3 s ILE 2 Cb 0.00 -3.39 -0.01 0.00 0.01 0.00 0.00 42.46 39.07 1rb3 s ILE 2 CO 0.00 0.44 -0.10 -0.44 0.00 0.00 0.00 174.94 174.84 1rb3 s SER 3 N 0.39 1.19 -0.15 3.58 0.01 -0.01 -1.36 113.70 117.35 1rb3 s SER 3 Ca 0.07 -0.28 -0.06 0.00 1.31 0.00 0.00 55.95 56.98 1rb3 s SER 3 Cb -0.11 -0.10 -0.04 0.00 0.21 0.00 0.00 66.02 65.98 1rb3 s SER 3 CO -0.01 0.06 0.06 -0.76 0.41 0.00 0.00 173.24 172.99 1rb3 s LEU 4 N -0.60 3.85 -0.11 2.44 1.02 -0.81 -1.06 118.68 123.39 1rb3 s LEU 4 Ca 0.01 0.16 0.02 0.00 0.02 0.00 0.00 54.13 54.34 1rb3 s LEU 4 Cb -0.05 -1.95 -0.01 0.00 0.02 0.00 0.00 46.19 44.21 1rb3 s LEU 4 CO 0.00 0.26 -0.20 -0.51 0.02 0.00 0.00 176.35 175.92 1rb3 s ILE 5 N -0.15 2.45 0.12 -0.59 2.07 -0.10 -1.46 121.20 123.53 1rb3 s ILE 5 Ca 0.07 -0.88 -0.17 0.00 -1.41 0.00 0.00 60.65 58.26 1rb3 s ILE 5 Cb -0.12 -1.98 0.04 0.00 0.13 0.00 0.00 42.46 40.53 1rb3 s ILE 5 CO 0.01 0.55 0.42 0.00 -1.91 0.00 0.00 174.94 174.01 1rb3 s ALA 6 N 0.37 -1.01 -0.20 1.50 0.00 0.18 -4.54 121.76 118.06 1rb3 s ALA 6 Ca -0.15 0.05 -0.02 0.00 0.00 0.00 0.00 51.96 51.84 1rb3 s ALA 6 Cb -0.17 0.66 -0.01 0.00 0.00 0.00 0.00 23.12 23.60 1rb3 s ALA 6 CO 0.07 -0.63 -0.08 0.00 0.00 0.00 0.00 175.76 175.12 1rb3 s ALA 7 N -3.61 2.71 -0.18 0.00 0.00 -1.26 -1.08 121.76 118.34 1rb3 s ALA 7 Ca 0.02 -1.13 -0.04 0.00 0.00 0.00 0.00 51.96 50.81 1rb3 s ALA 7 Cb 0.01 -1.54 -0.02 0.00 0.00 0.00 0.00 23.12 21.57 1rb3 s ALA 7 CO -0.11 -0.30 -0.04 -0.51 0.00 0.00 0.00 175.76 174.81 1rb3 s LEU 8 N 1.25 3.11 0.00 0.00 1.02 0.50 -4.69 118.68 119.87 1rb3 s LEU 8 Ca 0.03 -0.24 0.00 0.00 0.02 0.00 0.00 54.13 53.94 1rb3 s LEU 8 Cb -0.14 -1.77 0.00 0.00 0.02 0.00 0.00 46.19 44.30 1rb3 s LEU 8 CO -0.03 0.09 0.00 0.00 0.02 0.00 0.00 176.35 176.43 1rb3 n ALA 9 N 4.05 0.00 -1.73 4.21 0.00 0.73 -1.60 120.51 126.16 1rb3 n ALA 9 Ca -0.18 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.86 1rb3 n ALA 9 Cb 0.52 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.99 1rb3 n ALA 9 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1rb3 n VAL 10 N -1.52 2.73 -2.09 0.00 0.24 -0.42 -2.22 118.33 115.06 1rb3 n VAL 10 Ca 0.00 -0.50 -0.13 0.00 -2.04 0.00 0.00 64.34 61.67 1rb3 n VAL 10 Cb 0.00 -1.69 -0.02 0.00 -1.47 0.00 0.00 33.84 30.66 1rb3 n VAL 10 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1rb3 n ASP 11 N -0.03 -4.21 -0.98 -1.34 8.00 -1.26 -2.70 116.55 114.02 1rb3 n ASP 11 Ca 0.06 0.05 -0.12 0.00 0.71 0.00 0.00 54.79 55.49 1rb3 n ASP 11 Cb 0.41 -3.29 -0.05 0.00 -0.02 0.00 0.00 41.12 38.16 1rb3 n ASP 11 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1rb3 n ARG 12 N -2.33 -0.87 -2.46 -1.24 1.74 -0.94 -4.87 116.66 105.69 1rb3 n ARG 12 Ca -0.15 0.91 -0.42 0.00 -0.77 0.00 0.00 57.85 57.42 1rb3 n ARG 12 Cb 0.58 -4.94 -0.03 0.00 -1.02 0.00 0.00 32.46 27.05 1rb3 n ARG 12 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1rb3 s VAL 13 N -2.47 4.05 -0.04 1.55 1.01 -1.10 -1.51 120.40 121.90 1rb3 s VAL 13 Ca 0.00 1.54 0.01 0.00 0.00 0.00 0.00 61.98 63.53 1rb3 s VAL 13 Cb 0.00 -3.98 -0.01 0.00 0.00 0.00 0.00 36.38 32.39 1rb3 s VAL 13 CO 0.00 0.15 0.10 2.30 0.00 0.00 0.00 175.10 177.65 1rb3 n ILE 14 N 3.54 0.00 -3.85 2.22 -5.35 0.16 -0.19 119.36 115.89 1rb3 n ILE 14 Ca 0.07 -0.49 -0.00 0.00 -0.27 0.00 0.00 62.75 62.07 1rb3 n ILE 14 Cb 0.47 1.00 0.01 0.00 -1.74 0.00 0.00 39.64 39.38 1rb3 n ILE 14 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1rb3 s GLY 15 N -0.93 -0.12 0.00 3.28 0.00 -1.11 -4.97 107.32 103.47 1rb3 s GLY 15 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 44.72 44.78 1rb3 s GLY 15 CO 0.03 2.87 0.00 1.15 0.00 0.00 0.00 173.10 177.14 1rb3 n MET 16 N -0.71 0.00 0.20 2.90 0.00 -1.26 -1.80 117.12 116.45 1rb3 n MET 16 Ca -0.02 0.00 -0.15 0.00 0.00 0.00 0.00 57.70 57.53 1rb3 n MET 16 Cb 0.60 0.00 -0.08 0.00 0.00 0.00 0.00 33.22 33.74 1rb3 n MET 16 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 175.97 177.46 1rb3 h GLU 17 N 0.00 -0.45 -6.29 3.17 4.81 -2.01 -3.45 114.58 110.35 1rb3 h GLU 17 Ca 0.00 0.03 -0.46 0.00 -0.13 0.00 0.00 59.36 58.80 1rb3 h GLU 17 Cb 0.00 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 1rb3 h GLU 17 CO 0.00 -0.23 -0.35 -0.80 -0.73 0.00 0.00 179.01 176.90 1rb3 s ASN 18 N -4.87 5.54 0.42 1.04 0.02 -1.26 -5.06 114.94 110.77 1rb3 s ASN 18 Ca -0.15 -0.44 -0.23 0.00 -1.02 0.00 0.00 52.86 51.02 1rb3 s ASN 18 Cb 0.04 -0.88 -0.12 0.00 0.02 0.00 0.00 41.25 40.31 1rb3 s ASN 18 CO 0.61 -0.55 0.73 0.00 0.02 0.00 0.00 177.10 177.92 1rb3 n ALA 19 N -1.62 -0.85 -1.77 0.60 0.00 -1.26 -4.87 120.51 110.73 1rb3 n ALA 19 Ca 0.02 0.19 -0.41 0.00 0.00 0.00 0.00 53.44 53.24 1rb3 n ALA 19 Cb 0.59 -1.90 -0.00 0.00 0.00 0.00 0.00 19.45 18.15 1rb3 n ALA 19 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1rb3 n MET 20 N 0.36 2.68 -1.04 0.00 0.00 -1.26 -4.90 117.12 112.96 1rb3 n MET 20 Ca 0.11 0.94 -0.29 0.00 0.00 0.00 0.00 57.70 58.46 1rb3 n MET 20 Cb 0.39 -2.67 -0.04 0.00 0.00 0.00 0.00 33.22 30.90 1rb3 n MET 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 1rb3 n PRO 21 N 0.45 2.86 -4.00 0.03 -0.04 -1.26 -4.83 135.00 128.20 1rb3 n PRO 21 Ca 0.01 -1.75 -0.10 0.00 -0.04 0.00 0.00 63.50 61.62 1rb3 n PRO 21 Cb 0.39 -2.56 -0.07 0.00 -0.04 0.00 0.00 33.50 31.22 1rb3 n PRO 21 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 1rb3 s TRP 22 N 2.50 0.50 -0.34 0.54 -2.14 -1.26 -5.09 118.94 113.65 1rb3 s TRP 22 Ca 0.57 -0.85 -0.01 0.00 2.66 0.00 0.00 56.10 58.47 1rb3 s TRP 22 Cb 0.16 -0.09 0.12 0.00 -3.10 0.00 0.00 33.47 30.56 1rb3 s TRP 22 CO -0.04 -0.75 0.16 1.21 -2.66 0.00 0.00 176.95 174.86 1rb3 s ASN 23 N -3.00 3.65 -0.54 -2.66 3.04 -1.26 -5.04 114.94 109.13 1rb3 s ASN 23 Ca 0.21 -1.90 0.06 0.00 0.04 0.00 0.00 52.86 51.27 1rb3 s ASN 23 Cb 0.03 -0.72 0.22 0.00 -1.54 0.00 0.00 41.25 39.25 1rb3 s ASN 23 CO 0.03 -0.37 0.57 0.18 -3.04 0.00 0.00 177.10 174.47 1rb3 n LEU 24 N 4.48 1.80 -0.32 3.21 4.77 -1.26 -1.83 117.00 127.86 1rb3 n LEU 24 Ca 0.02 -4.99 0.13 0.00 -0.03 0.00 0.00 56.01 51.14 1rb3 n LEU 24 Cb 0.39 -0.07 0.31 0.00 -2.33 0.00 0.00 43.42 41.73 1rb3 n LEU 24 CO 0.13 1.98 1.10 1.55 -1.33 0.00 0.00 177.39 180.82 1rb3 h PRO 25 N 4.57 0.51 -1.00 3.23 0.13 -1.98 0.79 132.00 138.25 1rb3 h PRO 25 Ca 0.16 -0.03 0.05 0.00 -0.87 0.00 0.00 66.00 65.31 1rb3 h PRO 25 Cb 0.79 -0.11 -0.06 0.00 0.13 0.00 0.00 31.00 31.74 1rb3 h PRO 25 CO 0.62 0.33 0.65 0.00 -0.23 0.00 0.00 178.00 179.38 1rb3 h ALA 26 N 1.68 1.37 -0.74 -0.56 0.00 -1.91 -0.66 119.26 118.44 1rb3 h ALA 26 Ca 0.57 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.40 1rb3 h ALA 26 Cb 1.01 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1rb3 h ALA 26 CO -0.47 0.51 0.32 0.22 0.00 0.00 0.00 179.25 179.83 1rb3 h ASP 27 N 1.23 0.99 -0.79 0.00 3.58 0.17 -2.55 116.42 119.06 1rb3 h ASP 27 Ca 0.41 -0.13 -0.01 0.00 0.42 0.00 0.00 57.03 57.71 1rb3 h ASP 27 Cb 0.07 -0.26 -0.04 0.00 1.72 0.00 0.00 39.33 40.82 1rb3 h ASP 27 CO -0.14 0.87 0.44 -0.07 -2.88 0.00 0.00 179.24 177.45 1rb3 h LEU 28 N 1.07 0.98 -1.06 2.28 3.38 -0.37 0.25 115.31 121.84 1rb3 h LEU 28 Ca 0.25 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 1rb3 h LEU 28 Cb 0.17 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1rb3 h LEU 28 CO -0.03 0.79 -0.45 0.00 0.09 0.00 0.00 178.44 178.85 1rb3 h ALA 29 N 1.23 1.16 -0.25 1.53 0.00 -1.02 0.31 119.26 122.22 1rb3 h ALA 29 Ca 0.28 -0.41 -0.18 0.00 0.00 0.00 0.00 54.91 54.61 1rb3 h ALA 29 Cb 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1rb3 h ALA 29 CO -0.05 0.56 -0.53 2.35 0.00 0.00 0.00 179.25 181.58 1rb3 h TRP 30 N 0.00 1.02 -0.39 0.00 2.91 -1.08 0.63 115.95 119.03 1rb3 h TRP 30 Ca -0.00 -0.37 -0.01 0.00 1.13 0.00 0.00 58.89 59.63 1rb3 h TRP 30 Cb 0.84 -0.19 -0.02 0.00 -0.51 0.00 0.00 29.16 29.28 1rb3 h TRP 30 CO 0.00 1.19 0.21 0.35 -1.03 0.00 0.00 178.44 179.16 1rb3 h PHE 31 N 0.56 0.55 -0.50 2.65 3.04 -0.21 -0.13 116.94 122.90 1rb3 h PHE 31 Ca 0.01 -0.02 -0.02 0.00 3.98 0.00 0.00 57.97 61.92 1rb3 h PHE 31 Cb 1.14 -0.17 -0.02 0.00 2.56 0.00 0.00 35.95 39.45 1rb3 h PHE 31 CO 0.08 0.43 0.22 -0.22 -2.02 0.00 0.00 178.31 176.80 1rb3 h LYS 32 N 0.50 0.73 -0.56 1.11 3.64 -0.32 -2.64 116.57 119.02 1rb3 h LYS 32 Ca 0.14 -0.12 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1rb3 h LYS 32 Cb 0.07 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 1rb3 h LYS 32 CO -0.02 0.63 0.33 -0.09 -2.27 0.00 0.00 179.45 178.03 1rb3 h ARG 33 N 0.66 0.77 -0.00 1.90 2.43 -0.49 -2.07 114.38 117.58 1rb3 h ARG 33 Ca 0.17 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1rb3 h ARG 33 Cb 0.15 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1rb3 h ARG 33 CO -0.02 0.56 -0.01 0.09 -1.51 0.00 0.00 179.97 179.08 1rb3 n ASN 34 N -4.64 0.32 -0.00 -3.80 3.02 -0.09 -3.58 115.26 106.49 1rb3 n ASN 34 Ca 0.03 -0.98 0.04 0.00 -0.03 0.00 0.00 54.58 53.65 1rb3 n ASN 34 Cb 0.06 -0.03 -0.06 0.00 -0.61 0.00 0.00 39.78 39.14 1rb3 n ASN 34 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1rb3 n THR 35 N -0.80 0.00 -1.61 3.41 -2.24 -1.01 -4.99 114.28 107.04 1rb3 n THR 35 Ca 0.21 -0.27 -0.49 0.00 -2.27 0.00 0.00 64.05 61.23 1rb3 n THR 35 Cb 0.18 0.91 -0.05 0.00 -2.10 0.00 0.00 70.33 69.28 1rb3 n THR 35 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1rb3 n LEU 36 N -1.29 2.05 -3.97 3.22 7.94 -0.80 -2.37 117.00 121.78 1rb3 n LEU 36 Ca 0.01 1.12 -0.30 0.00 -1.11 0.00 0.00 56.01 55.74 1rb3 n LEU 36 Cb 0.16 -1.27 0.01 0.00 0.53 0.00 0.00 43.42 42.84 1rb3 n LEU 36 CO 0.19 -0.93 -0.00 0.47 -1.11 0.00 0.00 177.39 176.01 1rb3 n ASP 37 N 2.45 -3.24 -3.99 1.96 9.92 -1.25 -4.98 116.55 117.42 1rb3 n ASP 37 Ca 0.16 -0.88 -0.09 0.00 -0.53 0.00 0.00 54.79 53.45 1rb3 n ASP 37 Cb 0.24 -3.49 -0.10 0.00 -0.64 0.00 0.00 41.12 37.13 1rb3 n ASP 37 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1rb3 s LYS 38 N -6.60 0.44 0.16 -1.24 1.02 -1.00 -5.03 119.74 107.49 1rb3 s LYS 38 Ca 0.49 -0.76 -0.30 0.00 0.02 0.00 0.00 55.97 55.42 1rb3 s LYS 38 Cb -0.26 0.16 -0.07 0.00 -0.52 0.00 0.00 37.83 37.14 1rb3 s LYS 38 CO 0.86 -0.08 1.00 -2.14 -0.92 0.00 0.00 175.35 174.06 1rb3 s PRO 39 N -2.22 4.70 -0.10 -1.68 0.02 -1.26 -3.54 135.00 130.92 1rb3 s PRO 39 Ca -0.09 1.53 -0.00 0.00 0.02 0.00 0.00 61.00 62.46 1rb3 s PRO 39 Cb -0.04 -3.33 -0.03 0.00 0.02 0.00 0.00 34.50 31.12 1rb3 s PRO 39 CO -0.04 0.24 -0.08 0.14 -0.33 0.00 0.00 177.00 176.93 1rb3 s VAL 40 N -0.30 3.56 -0.18 3.83 -7.23 0.76 -0.84 120.40 119.99 1rb3 s VAL 40 Ca 0.46 -0.51 -0.02 0.00 -1.81 0.00 0.00 61.98 60.11 1rb3 s VAL 40 Cb -0.26 -2.49 -0.01 0.00 0.56 0.00 0.00 36.38 34.19 1rb3 s VAL 40 CO 0.32 0.55 -0.10 -0.63 -0.31 0.00 0.00 175.10 174.93 1rb3 s ILE 41 N -0.24 3.06 0.14 -0.62 1.01 0.19 -0.60 121.20 124.14 1rb3 s ILE 41 Ca 0.03 -0.62 -0.06 0.00 0.00 0.00 0.00 60.65 60.00 1rb3 s ILE 41 Cb -0.13 -2.34 -0.02 0.00 0.01 0.00 0.00 42.46 39.98 1rb3 s ILE 41 CO 0.03 0.48 0.18 0.00 0.00 0.00 0.00 174.94 175.63 1rb3 s MET 42 N 0.98 1.01 0.48 2.79 0.23 -0.82 -0.79 119.30 123.18 1rb3 s MET 42 Ca -0.01 -1.23 -0.00 0.00 -1.03 0.00 0.00 55.69 53.42 1rb3 s MET 42 Cb -0.15 0.32 0.00 0.00 -1.53 0.00 0.00 34.83 33.48 1rb3 s MET 42 CO -0.01 -0.33 0.71 0.20 -2.03 0.00 0.00 175.02 173.56 1rb3 s GLY 43 N -2.97 1.60 0.21 3.16 0.00 0.18 -2.03 107.32 107.47 1rb3 s GLY 43 Ca 0.17 -1.04 -0.09 0.00 0.00 0.00 0.00 44.72 43.76 1rb3 s GLY 43 CO -0.02 -0.84 1.73 -0.09 0.00 0.00 0.00 173.10 173.88 1rb3 h ARG 44 N 0.28 0.36 -0.50 2.90 2.43 -1.89 -0.43 114.38 117.53 1rb3 h ARG 44 Ca -0.46 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 58.71 1rb3 h ARG 44 Cb 1.26 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 30.70 1rb3 h ARG 44 CO 0.57 0.24 0.31 0.45 -1.51 0.00 0.00 179.97 180.03 1rb3 h HIS 45 N 0.37 0.58 -0.14 2.20 3.86 -1.94 -1.12 115.15 118.97 1rb3 h HIS 45 Ca 0.32 0.02 -0.08 0.00 -1.16 0.00 0.00 60.37 59.47 1rb3 h HIS 45 Cb 0.43 -0.19 -0.01 0.00 1.06 0.00 0.00 27.41 28.69 1rb3 h HIS 45 CO -0.19 0.35 -0.26 1.15 0.86 0.00 0.00 177.93 179.84 1rb3 h THR 46 N 0.63 1.24 -0.17 2.45 2.02 -1.64 -2.21 112.91 115.23 1rb3 h THR 46 Ca 0.20 -1.13 -0.02 0.00 0.77 0.00 0.00 66.41 66.22 1rb3 h THR 46 Cb -0.01 1.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.81 1rb3 h THR 46 CO -0.07 0.34 0.02 -0.25 0.37 0.00 0.00 175.52 175.92 1rb3 h TRP 47 N 0.22 0.31 0.00 3.16 2.91 -0.26 -1.66 115.95 120.64 1rb3 h TRP 47 Ca 0.04 -0.05 -0.01 0.00 1.13 0.00 0.00 58.89 60.00 1rb3 h TRP 47 Cb 0.58 -0.08 -0.00 0.00 -0.51 0.00 0.00 29.16 29.15 1rb3 h TRP 47 CO 0.01 0.47 -0.02 0.93 -1.03 0.00 0.00 178.44 178.80 1rb3 h GLU 48 N 0.05 0.00 0.00 2.65 5.08 -1.13 0.16 114.58 121.39 1rb3 h GLU 48 Ca 0.05 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.37 1rb3 h GLU 48 Cb 0.34 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1rb3 h GLU 48 CO 0.01 0.02 -0.20 0.66 -1.00 0.00 0.00 179.01 178.50 1rb3 h SER 49 N 0.00 0.00 0.12 1.42 4.64 -0.74 -3.23 113.55 115.76 1rb3 h SER 49 Ca -0.00 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.03 1rb3 h SER 49 Cb 0.04 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.13 1rb3 h SER 49 CO 0.00 0.20 -1.48 0.40 -0.87 0.00 0.00 176.83 175.08 1rb3 h ILE 50 N 0.00 0.98 0.00 0.95 2.04 -0.41 -3.49 117.51 117.58 1rb3 h ILE 50 Ca -0.00 -2.39 0.00 0.00 1.00 0.00 0.00 64.86 63.47 1rb3 h ILE 50 Cb 0.97 2.68 0.00 0.00 -0.74 0.00 0.00 36.82 39.72 1rb3 h ILE 50 CO 0.03 0.72 0.00 0.61 0.00 0.00 0.00 178.15 179.50 1rb3 n GLY 51 N 1.76 1.62 3.58 5.37 0.00 0.47 -4.97 105.19 113.02 1rb3 n GLY 51 Ca -0.26 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.69 1rb3 n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1rb3 s ARG 52 N -0.06 0.94 0.51 1.61 1.70 -1.26 -5.07 118.95 117.32 1rb3 s ARG 52 Ca 0.00 -0.41 -0.21 0.00 -0.47 0.00 0.00 55.73 54.63 1rb3 s ARG 52 Cb 0.00 0.39 -0.06 0.00 -0.57 0.00 0.00 34.95 34.71 1rb3 s ARG 52 CO 0.00 -0.42 1.19 -2.14 -1.08 0.00 0.00 175.30 172.85 1rb3 s PRO 53 N -3.18 3.46 0.03 3.89 0.02 -1.26 -4.95 135.00 133.01 1rb3 s PRO 53 Ca 0.07 1.81 -0.28 0.00 0.02 0.00 0.00 61.00 62.61 1rb3 s PRO 53 Cb -0.01 -2.22 -0.04 0.00 0.02 0.00 0.00 34.50 32.25 1rb3 s PRO 53 CO -0.06 -0.81 0.91 -0.51 -0.33 0.00 0.00 177.00 176.20 1rb3 s LEU 54 N -3.44 4.41 0.76 -5.54 1.43 -1.26 -5.00 118.68 110.05 1rb3 s LEU 54 Ca 0.69 1.61 -0.11 0.00 -1.03 0.00 0.00 54.13 55.29 1rb3 s LEU 54 Cb -0.29 -3.46 0.05 0.00 0.03 0.00 0.00 46.19 42.51 1rb3 s LEU 54 CO 0.34 -0.14 1.09 -2.84 0.23 0.00 0.00 176.35 175.03 1rb3 s PRO 55 N 0.53 2.32 -1.33 1.29 0.02 -1.26 -3.90 135.00 132.68 1rb3 s PRO 55 Ca 0.47 1.18 0.00 0.00 0.02 0.00 0.00 61.00 62.67 1rb3 s PRO 55 Cb -0.21 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.40 1rb3 s PRO 55 CO 0.27 -1.59 0.00 0.41 -0.33 0.00 0.00 177.00 175.75 1rb3 n GLY 56 N -1.18 0.58 3.16 0.52 0.00 -1.26 -4.94 105.19 102.07 1rb3 n GLY 56 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.03 1rb3 n GLY 56 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rb3 s ARG 57 N -3.90 0.83 -0.28 1.61 0.52 -1.25 -3.80 118.95 112.67 1rb3 s ARG 57 Ca 0.00 -1.24 -0.18 0.00 -0.52 0.00 0.00 55.73 53.79 1rb3 s ARG 57 Cb 0.00 0.27 -0.02 0.00 0.52 0.00 0.00 34.95 35.71 1rb3 s ARG 57 CO 0.00 -0.23 0.51 0.21 0.02 0.00 0.00 175.30 175.82 1rb3 s LYS 58 N -3.96 3.99 -0.18 3.54 2.20 -1.23 -4.87 119.74 119.23 1rb3 s LYS 58 Ca 0.14 0.23 -0.18 0.00 -0.36 0.00 0.00 55.97 55.80 1rb3 s LYS 58 Cb 0.07 -3.68 -0.03 0.00 -1.51 0.00 0.00 37.83 32.67 1rb3 s LYS 58 CO -0.05 -0.41 0.51 -0.80 -0.36 0.00 0.00 175.35 174.24 1rb3 s ASN 59 N 1.59 6.59 -0.12 1.43 0.02 -1.26 -0.17 114.94 123.02 1rb3 s ASN 59 Ca 0.21 0.71 -0.01 0.00 -1.02 0.00 0.00 52.86 52.75 1rb3 s ASN 59 Cb -0.16 -2.29 0.03 0.00 0.02 0.00 0.00 41.25 38.85 1rb3 s ASN 59 CO 0.10 -0.13 -0.06 -0.63 0.02 0.00 0.00 177.10 176.40 1rb3 s ILE 60 N 1.39 0.93 -0.11 0.60 1.01 0.23 -1.79 121.20 123.45 1rb3 s ILE 60 Ca 0.24 -0.29 -0.01 0.00 0.00 0.00 0.00 60.65 60.59 1rb3 s ILE 60 Cb -0.15 -1.01 -0.03 0.00 0.01 0.00 0.00 42.46 41.28 1rb3 s ILE 60 CO 0.10 0.30 -0.06 -0.63 0.00 0.00 0.00 174.94 174.65 1rb3 s ILE 61 N 1.74 3.77 -0.13 2.92 1.09 0.31 -1.95 121.20 128.94 1rb3 s ILE 61 Ca 0.04 -0.43 -0.19 0.00 -1.10 0.00 0.00 60.65 58.97 1rb3 s ILE 61 Cb -0.13 -2.60 -0.04 0.00 -1.06 0.00 0.00 42.46 38.64 1rb3 s ILE 61 CO -0.08 0.55 0.52 -0.76 -0.10 0.00 0.00 174.94 175.07 1rb3 s LEU 62 N -0.21 4.25 -0.27 2.97 1.43 -0.86 -0.80 118.68 125.18 1rb3 s LEU 62 Ca 0.03 0.83 -0.25 0.00 -1.03 0.00 0.00 54.13 53.71 1rb3 s LEU 62 Cb -0.13 -2.75 0.07 0.00 0.03 0.00 0.00 46.19 43.41 1rb3 s LEU 62 CO 0.03 -0.06 0.73 -0.55 0.23 0.00 0.00 176.35 176.72 1rb3 s SER 63 N 0.78 -0.75 0.00 2.29 0.15 -0.75 -3.26 113.70 112.16 1rb3 s SER 63 Ca 0.27 1.44 0.23 0.00 0.70 0.00 0.00 55.95 58.58 1rb3 s SER 63 Cb -0.15 1.45 1.35 0.00 -1.71 0.00 0.00 66.02 66.96 1rb3 s SER 63 CO 0.11 -0.25 1.78 -1.54 1.20 0.00 0.00 173.24 174.54 1rb3 n SER 64 N 2.73 0.00 -4.36 5.45 3.41 -1.26 -4.27 113.62 115.32 1rb3 n SER 64 Ca -0.14 -0.99 -0.23 0.00 -0.26 0.00 0.00 58.87 57.25 1rb3 n SER 64 Cb 0.55 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.39 1rb3 n SER 64 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1rb3 s GLN 65 N -2.00 1.35 0.20 4.33 -1.52 -1.26 -5.06 119.66 115.70 1rb3 s GLN 65 Ca 0.34 -1.44 -0.31 0.00 -1.95 0.00 0.00 55.36 52.00 1rb3 s GLN 65 Cb 0.16 -1.50 -0.16 0.00 -0.22 0.00 0.00 33.01 31.29 1rb3 s GLN 65 CO 0.26 0.31 1.03 -0.35 -0.25 0.00 0.00 175.29 176.29 1rb3 n PRO 66 N 0.30 1.02 -1.11 2.91 -0.04 -1.26 -4.91 135.00 131.90 1rb3 n PRO 66 Ca -0.13 0.36 -0.32 0.00 -0.04 0.00 0.00 63.50 63.37 1rb3 n PRO 66 Cb 0.57 -1.75 0.12 0.00 -0.04 0.00 0.00 33.50 32.39 1rb3 n PRO 66 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1rb3 s GLY 67 N -0.30 1.91 -0.07 0.55 0.00 -1.26 -4.97 107.32 103.18 1rb3 s GLY 67 Ca 0.68 0.60 0.14 0.00 0.00 0.00 0.00 44.72 46.15 1rb3 s GLY 67 CO 0.55 1.00 1.13 -1.30 0.00 0.00 0.00 173.10 174.48 1rb3 n THR 68 N -3.50 0.85 -3.47 0.90 -2.24 -1.26 -5.00 114.28 100.56 1rb3 n THR 68 Ca 0.12 -1.46 -0.02 0.00 -2.27 0.00 0.00 64.05 60.42 1rb3 n THR 68 Cb 0.52 0.35 -0.05 0.00 -2.10 0.00 0.00 70.33 69.05 1rb3 n THR 68 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1rb3 s ASP 69 N -2.16 -0.89 0.62 3.42 -1.08 -1.26 -5.03 116.67 110.29 1rb3 s ASP 69 Ca 0.25 1.10 0.40 0.00 -0.52 0.00 0.00 52.55 53.78 1rb3 s ASP 69 Cb 0.26 1.95 2.04 0.00 -1.46 0.00 0.00 42.92 45.71 1rb3 s ASP 69 CO -0.06 -0.24 2.24 0.44 0.52 0.00 0.00 175.17 178.06 1rb3 h ASP 70 N 8.05 0.00 0.30 -0.34 5.19 -2.04 -3.07 116.42 124.52 1rb3 h ASP 70 Ca -0.19 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.22 1rb3 h ASP 70 Cb 1.13 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.64 1rb3 h ASP 70 CO 0.17 0.01 -0.03 0.54 -3.12 0.00 0.00 179.24 176.81 1rb3 n ARG 71 N -3.15 0.74 -4.22 3.56 1.74 -1.26 -4.84 116.66 109.24 1rb3 n ARG 71 Ca -0.02 -0.12 -0.14 0.00 -0.77 0.00 0.00 57.85 56.81 1rb3 n ARG 71 Cb 0.15 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 29.99 1rb3 n ARG 71 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1rb3 s VAL 72 N -2.34 1.02 -0.16 1.55 -7.23 -1.16 -4.89 120.40 107.19 1rb3 s VAL 72 Ca 0.35 -1.93 -0.20 0.00 -1.81 0.00 0.00 61.98 58.39 1rb3 s VAL 72 Cb 0.21 -1.69 -0.03 0.00 0.56 0.00 0.00 36.38 35.42 1rb3 s VAL 72 CO 0.43 -0.72 0.58 -0.89 -0.31 0.00 0.00 175.10 174.19 1rb3 s THR 73 N -3.15 5.08 0.01 5.32 2.01 -0.74 -4.86 115.64 119.31 1rb3 s THR 73 Ca 0.13 1.12 0.01 0.00 0.31 0.00 0.00 61.69 63.26 1rb3 s THR 73 Cb 0.02 -3.91 -0.04 0.00 0.01 0.00 0.00 72.50 68.58 1rb3 s THR 73 CO -0.01 0.19 0.04 0.26 -0.69 0.00 0.00 174.62 174.42 1rb3 s TRP 74 N 1.40 3.16 0.05 4.92 0.52 -1.26 0.11 118.94 127.85 1rb3 s TRP 74 Ca 0.28 0.12 -0.04 0.00 0.02 0.00 0.00 56.10 56.48 1rb3 s TRP 74 Cb -0.16 -1.68 -0.02 0.00 -1.15 0.00 0.00 33.47 30.46 1rb3 s TRP 74 CO 0.11 0.50 0.07 0.14 0.02 0.00 0.00 176.95 177.79 1rb3 s VAL 75 N -1.17 0.16 -0.92 4.03 -7.23 0.02 -4.90 120.40 110.39 1rb3 s VAL 75 Ca 0.22 -1.33 0.15 0.00 -1.81 0.00 0.00 61.98 59.21 1rb3 s VAL 75 Cb -0.12 -1.14 -0.11 0.00 0.56 0.00 0.00 36.38 35.57 1rb3 s VAL 75 CO 0.13 -0.73 0.69 0.29 -0.31 0.00 0.00 175.10 175.17 1rb3 n LYS 76 N 0.45 2.04 -4.11 4.82 5.02 -1.26 -1.81 118.16 123.31 1rb3 n LYS 76 Ca -0.17 -0.26 -0.09 0.00 -2.02 0.00 0.00 58.31 55.77 1rb3 n LYS 76 Cb 0.60 -1.21 -0.10 0.00 -0.02 0.00 0.00 35.03 34.30 1rb3 n LYS 76 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1rb3 s SER 77 N -2.20 0.30 0.29 4.39 1.04 -1.26 -4.83 113.70 111.43 1rb3 s SER 77 Ca 0.08 -1.12 0.01 0.00 0.48 0.00 0.00 55.95 55.40 1rb3 s SER 77 Cb 0.11 0.30 0.43 0.00 0.10 0.00 0.00 66.02 66.96 1rb3 s SER 77 CO 0.53 -0.73 1.78 0.58 0.98 0.00 0.00 173.24 176.38 1rb3 h VAL 78 N 2.87 1.23 -0.19 5.02 2.07 -1.98 -2.41 116.25 122.86 1rb3 h VAL 78 Ca -0.34 -1.00 -0.05 0.00 0.82 0.00 0.00 66.70 66.12 1rb3 h VAL 78 Cb 1.19 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 1rb3 h VAL 78 CO 0.59 0.34 -0.07 0.44 0.02 0.00 0.00 177.57 178.89 1rb3 h ASP 79 N 0.59 0.39 -0.50 0.57 3.32 -1.99 -0.40 116.42 118.40 1rb3 h ASP 79 Ca 0.11 -0.39 0.01 0.00 0.02 0.00 0.00 57.03 56.78 1rb3 h ASP 79 Cb 0.47 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.89 1rb3 h ASP 79 CO 0.02 0.69 0.33 -0.33 -1.72 0.00 0.00 179.24 178.24 1rb3 h GLU 80 N 0.08 0.63 -0.36 3.56 5.08 -1.94 -0.07 114.58 121.55 1rb3 h GLU 80 Ca 0.04 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1rb3 h GLU 80 Cb 0.54 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1rb3 h GLU 80 CO 0.02 0.41 0.13 0.00 -1.00 0.00 0.00 179.01 178.58 1rb3 h ALA 81 N 1.69 0.47 -0.28 3.43 0.00 -1.09 0.15 119.26 123.63 1rb3 h ALA 81 Ca 0.19 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1rb3 h ALA 81 Cb -0.03 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1rb3 h ALA 81 CO -0.04 0.08 -0.07 0.82 0.00 0.00 0.00 179.25 180.03 1rb3 h ILE 82 N 0.43 1.28 -0.35 0.00 2.04 -0.28 -3.01 117.51 117.62 1rb3 h ILE 82 Ca 0.12 -1.10 -0.01 0.00 1.00 0.00 0.00 64.86 64.87 1rb3 h ILE 82 Cb 0.21 1.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.70 1rb3 h ILE 82 CO -0.01 0.35 0.18 0.00 0.00 0.00 0.00 178.15 178.67 1rb3 h ALA 83 N 0.77 1.65 0.00 1.87 0.00 -0.83 -0.05 119.26 122.68 1rb3 h ALA 83 Ca 0.07 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1rb3 h ALA 83 Cb 0.55 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1rb3 h ALA 83 CO 0.03 0.29 0.00 0.00 0.00 0.00 0.00 179.25 179.57 1rb3 h ALA 84 N 1.71 1.00 -0.03 0.00 0.00 -0.57 -2.76 119.26 118.61 1rb3 h ALA 84 Ca 0.13 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.89 1rb3 h ALA 84 Cb 0.04 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1rb3 h ALA 84 CO -0.02 0.00 -0.66 0.00 0.00 0.00 0.00 179.25 178.57 1rb3 n GLY 86 N 0.38 -1.26 3.50 0.00 0.00 -1.04 -4.51 105.19 102.25 1rb3 n GLY 86 Ca -0.02 -1.24 -0.42 0.00 0.00 0.00 0.00 46.02 44.33 1rb3 n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rb3 s ASP 87 N -4.00 6.26 0.05 1.61 2.15 -1.26 -4.96 116.67 116.51 1rb3 s ASP 87 Ca 0.00 -0.99 0.01 0.00 0.43 0.00 0.00 52.55 52.00 1rb3 s ASP 87 Cb 0.00 -2.48 -0.03 0.00 -0.30 0.00 0.00 42.92 40.11 1rb3 s ASP 87 CO 0.00 -1.53 -0.06 0.68 -0.17 0.00 0.00 175.17 174.09 1rb3 s VAL 88 N 4.53 0.43 0.04 1.11 -7.23 -1.26 -5.06 120.40 112.97 1rb3 s VAL 88 Ca 0.30 -1.28 0.30 0.00 -1.81 0.00 0.00 61.98 59.49 1rb3 s VAL 88 Cb -0.11 -0.82 0.34 0.00 0.56 0.00 0.00 36.38 36.35 1rb3 s VAL 88 CO 0.07 -0.57 1.89 1.55 -0.31 0.00 0.00 175.10 177.73 1rb3 h PRO 89 N 4.10 0.00 -2.31 4.82 0.13 -1.93 -3.36 132.00 133.45 1rb3 h PRO 89 Ca -0.35 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.73 1rb3 h PRO 89 Cb 1.19 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.09 1rb3 h PRO 89 CO 0.48 0.07 -0.11 -2.00 -0.23 0.00 0.00 178.00 176.21 1rb3 s GLU 90 N -3.60 0.58 -0.11 0.86 2.12 -1.26 -2.18 118.70 115.12 1rb3 s GLU 90 Ca 0.02 0.97 0.00 0.00 0.36 0.00 0.00 54.97 56.32 1rb3 s GLU 90 Cb 0.09 0.12 -0.02 0.00 0.26 0.00 0.00 34.13 34.58 1rb3 s GLU 90 CO 0.59 -0.14 -0.12 0.42 -0.54 0.00 0.00 175.26 175.47 1rb3 s ILE 91 N 1.25 3.21 -0.17 -3.70 1.01 0.73 -4.33 121.20 119.21 1rb3 s ILE 91 Ca -0.08 -0.62 -0.06 0.00 0.00 0.00 0.00 60.65 59.89 1rb3 s ILE 91 Cb -0.06 -2.33 -0.04 0.00 0.01 0.00 0.00 42.46 40.04 1rb3 s ILE 91 CO -0.13 0.54 0.03 -0.04 0.00 0.00 0.00 174.94 175.34 1rb3 s MET 92 N 0.01 3.86 -0.36 2.79 -1.94 -0.02 -0.83 119.30 122.81 1rb3 s MET 92 Ca -0.03 -0.40 -0.09 0.00 -1.71 0.00 0.00 55.69 53.46 1rb3 s MET 92 Cb -0.14 -3.11 0.03 0.00 2.01 0.00 0.00 34.83 33.62 1rb3 s MET 92 CO 0.04 0.28 0.17 0.08 -0.01 0.00 0.00 175.02 175.58 1rb3 s VAL 93 N 0.31 4.34 -2.62 -6.03 1.01 -0.23 0.56 120.40 117.76 1rb3 s VAL 93 Ca 0.01 -0.90 0.24 0.00 0.00 0.00 0.00 61.98 61.33 1rb3 s VAL 93 Cb -0.13 -3.41 0.38 0.00 0.00 0.00 0.00 36.38 33.22 1rb3 s VAL 93 CO 0.01 -0.19 1.44 2.30 0.00 0.00 0.00 175.10 178.67 1rb3 n ILE 94 N 4.94 0.19 0.00 2.22 -5.35 0.03 -0.92 119.36 120.48 1rb3 n ILE 94 Ca -0.12 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 61.86 1rb3 n ILE 94 Cb 0.46 0.95 0.00 0.00 -1.74 0.00 0.00 39.64 39.31 1rb3 n ILE 94 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1rb3 n GLY 95 N 1.33 2.03 0.00 3.28 0.00 -1.26 -4.92 105.19 105.65 1rb3 n GLY 95 Ca 0.17 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 44.13 1rb3 n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rb3 n GLY 96 N -1.40 1.57 0.14 -0.02 0.00 -1.26 -0.65 105.19 103.57 1rb3 n GLY 96 Ca 0.00 -1.68 -0.10 0.00 0.00 0.00 0.00 46.02 44.24 1rb3 n GLY 96 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1rb3 h GLY 97 N 0.00 0.43 1.89 -0.02 0.00 -1.95 -1.79 103.07 101.63 1rb3 h GLY 97 Ca 0.00 -0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.08 1rb3 h GLY 97 CO 0.00 0.21 -0.07 -0.09 0.00 0.00 0.00 176.54 176.59 1rb3 h ARG 98 N 0.31 0.14 -0.09 4.80 2.43 -1.94 -1.97 114.38 118.05 1rb3 h ARG 98 Ca 0.09 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.17 1rb3 h ARG 98 Cb 0.14 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1rb3 h ARG 98 CO -0.01 0.22 -0.21 0.28 -1.51 0.00 0.00 179.97 178.74 1rb3 h VAL 99 N 0.14 1.40 -0.42 0.20 2.07 -1.82 -3.08 116.25 114.74 1rb3 h VAL 99 Ca 0.03 -1.52 0.03 0.00 0.82 0.00 0.00 66.70 66.06 1rb3 h VAL 99 Cb 0.21 2.16 -0.03 0.00 -1.52 0.00 0.00 31.29 32.11 1rb3 h VAL 99 CO 0.01 0.44 0.21 1.88 0.02 0.00 0.00 177.57 180.13 1rb3 h TYR 100 N -0.15 0.39 -0.67 1.57 0.05 -1.11 -1.25 116.97 115.80 1rb3 h TYR 100 Ca 0.00 0.02 0.10 0.00 0.05 0.00 0.00 58.73 58.90 1rb3 h TYR 100 Cb 0.81 -0.11 -0.04 0.00 1.01 0.00 0.00 36.73 38.39 1rb3 h TYR 100 CO 0.11 0.20 0.44 1.49 -1.05 0.00 0.00 178.16 179.36 1rb3 h GLU 101 N 0.43 0.48 -0.01 4.88 4.81 -1.39 0.46 114.58 124.23 1rb3 h GLU 101 Ca 0.18 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.34 1rb3 h GLU 101 Cb 0.08 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.35 1rb3 h GLU 101 CO -0.12 0.32 -0.14 1.96 -0.73 0.00 0.00 179.01 180.30 1rb3 h GLN 102 N 0.50 0.12 0.00 1.92 4.20 -1.25 -3.35 115.11 117.25 1rb3 h GLN 102 Ca 0.31 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.91 1rb3 h GLN 102 Cb 0.54 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.35 1rb3 h GLN 102 CO -0.10 0.82 -0.05 1.19 -0.67 0.00 0.00 178.83 180.02 1rb3 n PHE 103 N -4.61 0.89 -0.22 2.96 3.72 -0.55 -3.95 117.46 115.69 1rb3 n PHE 103 Ca -0.09 0.26 0.00 0.00 -0.05 0.00 0.00 57.45 57.57 1rb3 n PHE 103 Cb 0.43 -0.91 0.23 0.00 -0.94 0.00 0.00 39.48 38.29 1rb3 n PHE 103 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 1rb3 h LEU 104 N 0.00 0.88 -2.10 4.37 5.85 -0.23 -0.41 115.31 123.66 1rb3 h LEU 104 Ca 0.00 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 1rb3 h LEU 104 Cb 0.73 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.54 1rb3 h LEU 104 CO 0.00 0.65 -0.02 -0.65 -0.34 0.00 0.00 178.44 178.08 1rb3 h PRO 105 N 1.03 0.00 0.00 5.25 0.11 -1.80 -2.46 132.00 134.13 1rb3 h PRO 105 Ca 0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.39 1rb3 h PRO 105 Cb -0.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.01 1rb3 h PRO 105 CO -0.06 0.02 -0.82 1.63 -0.21 0.00 0.00 178.00 178.56 1rb3 n LYS 106 N -3.16 0.02 -2.26 1.05 5.02 -0.26 -4.97 118.16 113.58 1rb3 n LYS 106 Ca -0.01 -0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.87 1rb3 n LYS 106 Cb 0.21 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.69 1rb3 n LYS 106 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rb3 s ALA 107 N -3.01 3.46 -0.12 7.82 0.00 -0.60 -4.63 121.76 124.68 1rb3 s ALA 107 Ca 0.09 1.11 0.19 0.00 0.00 0.00 0.00 51.96 53.35 1rb3 s ALA 107 Cb 0.16 -3.42 -0.28 0.00 0.00 0.00 0.00 23.12 19.59 1rb3 s ALA 107 CO 0.80 -0.45 0.45 1.04 0.00 0.00 0.00 175.76 177.61 1rb3 n GLN 108 N 0.94 0.61 -3.92 0.00 1.13 -0.46 -4.84 117.38 110.84 1rb3 n GLN 108 Ca -0.00 -0.15 -0.10 0.00 -1.94 0.00 0.00 57.00 54.80 1rb3 n GLN 108 Cb 0.43 -1.44 -0.11 0.00 0.11 0.00 0.00 30.24 29.23 1rb3 n GLN 108 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 1rb3 s LYS 109 N -3.24 0.29 -0.05 -1.09 2.20 -1.23 -0.28 119.74 116.34 1rb3 s LYS 109 Ca -0.05 -0.38 0.03 0.00 -0.36 0.00 0.00 55.97 55.21 1rb3 s LYS 109 Cb 0.12 0.11 0.00 0.00 -1.51 0.00 0.00 37.83 36.56 1rb3 s LYS 109 CO 0.78 -0.06 -0.13 -0.51 -0.36 0.00 0.00 175.35 175.07 1rb3 s LEU 110 N -1.07 1.79 -0.37 5.43 1.43 -0.68 -1.93 118.68 123.28 1rb3 s LEU 110 Ca -0.12 -0.29 0.02 0.00 -1.03 0.00 0.00 54.13 52.72 1rb3 s LEU 110 Cb -0.07 -0.82 0.11 0.00 0.03 0.00 0.00 46.19 45.44 1rb3 s LEU 110 CO -0.00 0.09 0.10 -0.31 0.23 0.00 0.00 176.35 176.46 1rb3 s TYR 111 N 0.30 3.69 -0.09 0.29 1.51 -0.54 -1.47 117.35 121.04 1rb3 s TYR 111 Ca -0.08 -2.90 -0.04 0.00 -1.01 0.00 0.00 57.07 53.05 1rb3 s TYR 111 Cb -0.12 -2.99 -0.04 0.00 -0.11 0.00 0.00 41.96 38.70 1rb3 s TYR 111 CO 0.02 -0.94 0.08 -0.51 -1.11 0.00 0.00 175.55 173.10 1rb3 s LEU 112 N 0.85 4.04 -0.29 -1.29 1.43 -0.40 -0.65 118.68 122.37 1rb3 s LEU 112 Ca 0.11 0.31 -0.00 0.00 -1.03 0.00 0.00 54.13 53.52 1rb3 s LEU 112 Cb -0.20 -2.02 0.06 0.00 0.03 0.00 0.00 46.19 44.05 1rb3 s LEU 112 CO -0.07 0.38 -0.03 -0.89 0.23 0.00 0.00 176.35 175.97 1rb3 s THR 113 N -1.01 2.71 -0.46 5.49 2.01 -0.24 0.28 115.64 124.43 1rb3 s THR 113 Ca 0.16 -1.51 -0.23 0.00 0.31 0.00 0.00 61.69 60.42 1rb3 s THR 113 Cb -0.12 -2.59 0.03 0.00 0.01 0.00 0.00 72.50 69.83 1rb3 s THR 113 CO 0.05 -0.11 0.77 -1.00 -0.69 0.00 0.00 174.62 173.64 1rb3 s HIS 114 N 1.19 2.99 -0.17 4.92 0.09 0.21 -0.37 115.29 124.15 1rb3 s HIS 114 Ca -0.06 0.09 -0.06 0.00 -0.00 0.00 0.00 55.06 55.03 1rb3 s HIS 114 Cb -0.20 -3.65 -0.04 0.00 -0.00 0.00 0.00 32.58 28.70 1rb3 s HIS 114 CO -0.03 -1.00 0.02 0.42 -0.00 0.00 0.00 174.74 174.15 1rb3 s ILE 115 N 3.25 4.44 -1.09 0.60 1.01 -0.63 -1.06 121.20 127.72 1rb3 s ILE 115 Ca 0.28 -0.16 -0.09 0.00 0.00 0.00 0.00 60.65 60.69 1rb3 s ILE 115 Cb -0.13 -2.98 -0.14 0.00 0.01 0.00 0.00 42.46 39.22 1rb3 s ILE 115 CO 0.21 0.48 3.16 0.47 0.00 0.00 0.00 174.94 179.27 1rb3 n ASP 116 N 3.50 7.62 -4.22 3.58 8.00 -1.10 -3.34 116.55 130.60 1rb3 n ASP 116 Ca -0.17 -2.56 -0.33 0.00 0.71 0.00 0.00 54.79 52.44 1rb3 n ASP 116 Cb 0.52 -1.51 -0.16 0.00 -0.02 0.00 0.00 41.12 39.96 1rb3 n ASP 116 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1rb3 s ALA 117 N 1.68 2.41 -0.41 2.24 0.00 -1.26 -4.62 121.76 121.81 1rb3 s ALA 117 Ca 0.69 -1.09 -0.11 0.00 0.00 0.00 0.00 51.96 51.45 1rb3 s ALA 117 Cb 0.23 -1.17 0.05 0.00 0.00 0.00 0.00 23.12 22.24 1rb3 s ALA 117 CO -0.04 -0.09 0.26 -2.00 0.00 0.00 0.00 175.76 173.88 1rb3 s GLU 118 N 0.90 2.76 0.21 0.00 2.12 -1.26 -1.30 118.70 122.14 1rb3 s GLU 118 Ca -0.04 -1.27 0.08 0.00 0.36 0.00 0.00 54.97 54.11 1rb3 s GLU 118 Cb -0.15 -3.81 -0.05 0.00 0.26 0.00 0.00 34.13 30.38 1rb3 s GLU 118 CO -0.02 -0.85 -0.15 0.14 -0.54 0.00 0.00 175.26 173.83 1rb3 s VAL 119 N 1.52 1.84 -0.53 3.70 -7.23 -1.26 -5.01 120.40 113.43 1rb3 s VAL 119 Ca 0.03 -2.23 -0.23 0.00 -1.81 0.00 0.00 61.98 57.73 1rb3 s VAL 119 Cb -0.21 -2.07 0.04 0.00 0.56 0.00 0.00 36.38 34.69 1rb3 s VAL 119 CO 0.05 -0.56 0.88 -1.61 -0.31 0.00 0.00 175.10 173.55 1rb3 s GLU 120 N -3.61 3.32 0.14 4.82 0.41 -1.26 -4.92 118.70 117.61 1rb3 s GLU 120 Ca 0.23 -0.31 -0.08 0.00 -0.41 0.00 0.00 54.97 54.40 1rb3 s GLU 120 Cb -0.01 -4.04 -0.01 0.00 -1.78 0.00 0.00 34.13 28.28 1rb3 s GLU 120 CO 0.08 -1.40 0.25 0.20 -0.49 0.00 0.00 175.26 173.89 1rb3 s GLY 121 N 2.73 0.43 -0.04 -1.39 0.00 -1.26 -4.88 107.32 102.91 1rb3 s GLY 121 Ca 0.29 -0.87 0.02 0.00 0.00 0.00 0.00 44.72 44.16 1rb3 s GLY 121 CO 0.19 -0.87 0.68 1.29 0.00 0.00 0.00 173.10 174.39 1rb3 h ASP 122 N 2.61 0.23 -3.01 1.64 3.04 -1.73 -3.48 116.42 115.73 1rb3 h ASP 122 Ca -0.32 -0.42 -0.61 0.00 -3.24 0.00 0.00 57.03 52.44 1rb3 h ASP 122 Cb 1.22 -0.07 -0.06 0.00 -1.04 0.00 0.00 39.33 39.38 1rb3 h ASP 122 CO 0.51 1.36 -0.23 -0.89 -2.04 0.00 0.00 179.24 177.95 1rb3 s THR 123 N -2.60 5.10 0.19 1.15 2.01 -1.04 -4.99 115.64 115.46 1rb3 s THR 123 Ca -0.10 0.77 0.09 0.00 0.31 0.00 0.00 61.69 62.76 1rb3 s THR 123 Cb 0.07 -3.68 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 1rb3 s THR 123 CO 0.82 0.56 -0.19 -1.00 -0.69 0.00 0.00 174.62 174.12 1rb3 s HIS 124 N -0.90 1.95 0.36 4.92 3.76 -1.26 -0.66 115.29 123.46 1rb3 s HIS 124 Ca 0.23 -0.45 -0.24 0.00 -0.15 0.00 0.00 55.06 54.45 1rb3 s HIS 124 Cb -0.16 -0.94 -0.10 0.00 1.11 0.00 0.00 32.58 32.49 1rb3 s HIS 124 CO 0.12 0.42 0.95 0.12 -0.85 0.00 0.00 174.74 175.50 1rb3 s PHE 125 N -2.20 3.55 1.21 1.40 5.36 -0.57 -4.72 117.98 122.00 1rb3 s PHE 125 Ca 0.20 1.72 -0.14 0.00 -0.96 0.00 0.00 56.93 57.75 1rb3 s PHE 125 Cb -0.05 -2.90 0.30 0.00 -0.34 0.00 0.00 43.02 40.03 1rb3 s PHE 125 CO 0.08 0.08 1.01 -1.25 -1.46 0.00 0.00 175.22 173.69 1rb3 s PRO 126 N -2.47 -1.26 0.04 10.12 0.04 -1.26 -4.96 135.00 135.25 1rb3 s PRO 126 Ca 0.55 0.72 -0.18 0.00 0.04 0.00 0.00 61.00 62.13 1rb3 s PRO 126 Cb -0.15 -1.52 -0.06 0.00 0.04 0.00 0.00 34.50 32.80 1rb3 s PRO 126 CO 0.20 -3.92 0.51 0.34 0.04 0.00 0.00 177.00 174.16 1rb3 s ASP 127 N -2.58 6.96 -0.03 6.66 2.15 -1.26 -5.07 116.67 123.50 1rb3 s ASP 127 Ca 0.69 1.14 0.04 0.00 0.43 0.00 0.00 52.55 54.85 1rb3 s ASP 127 Cb -0.24 -2.32 -0.00 0.00 -0.30 0.00 0.00 42.92 40.06 1rb3 s ASP 127 CO 0.64 0.29 -0.15 -0.72 -0.17 0.00 0.00 175.17 175.06 1rb3 s TYR 128 N -1.06 1.47 0.00 -5.34 1.13 -1.26 -5.10 117.35 107.19 1rb3 s TYR 128 Ca 0.27 -0.39 -0.30 0.00 -1.41 0.00 0.00 57.07 55.23 1rb3 s TYR 128 Cb -0.18 -0.99 -0.06 0.00 -1.10 0.00 0.00 41.96 39.62 1rb3 s TYR 128 CO 0.17 -0.13 1.44 -1.21 -2.51 0.00 0.00 175.55 173.30 1rb3 s GLU 129 N 0.04 4.27 0.33 -3.49 0.41 -1.26 -4.91 118.70 114.09 1rb3 s GLU 129 Ca -0.03 2.01 0.12 0.00 -0.41 0.00 0.00 54.97 56.67 1rb3 s GLU 129 Cb -0.10 -3.60 0.55 0.00 -1.78 0.00 0.00 34.13 29.21 1rb3 s GLU 129 CO 0.01 -0.61 1.72 -1.35 -0.49 0.00 0.00 175.26 174.55 1rb3 h PRO 130 N 7.96 0.00 0.00 0.39 0.11 -1.99 -2.20 132.00 136.27 1rb3 h PRO 130 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1rb3 h PRO 130 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1rb3 h PRO 130 CO 0.91 0.49 0.00 -0.25 -0.21 0.00 0.00 178.00 178.94 1rb3 n ASP 131 N -3.90 0.00 -0.06 -2.05 9.92 -1.26 -1.99 116.55 117.21 1rb3 n ASP 131 Ca -0.01 -1.34 -0.04 0.00 -0.53 0.00 0.00 54.79 52.87 1rb3 n ASP 131 Cb 0.51 0.00 -0.11 0.00 -0.64 0.00 0.00 41.12 40.88 1rb3 n ASP 131 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1rb3 n ASP 132 N -0.64 1.50 -4.58 -2.24 9.92 -0.83 -4.95 116.55 114.73 1rb3 n ASP 132 Ca 0.05 0.00 -0.31 0.00 -0.53 0.00 0.00 54.79 54.00 1rb3 n ASP 132 Cb 0.02 1.01 -0.10 0.00 -0.64 0.00 0.00 41.12 41.41 1rb3 n ASP 132 CO 0.00 0.00 0.00 0.26 0.13 0.00 0.00 177.20 177.59 1rb3 s TRP 133 N -2.48 2.81 -0.15 1.24 0.52 -0.84 -0.53 118.94 119.52 1rb3 s TRP 133 Ca -0.07 -0.11 -0.02 0.00 0.02 0.00 0.00 56.10 55.93 1rb3 s TRP 133 Cb 0.05 -1.52 -0.02 0.00 -1.15 0.00 0.00 33.47 30.84 1rb3 s TRP 133 CO 0.59 0.39 -0.09 -2.00 0.02 0.00 0.00 176.95 175.86 1rb3 s GLU 134 N -1.82 3.49 -0.39 4.98 2.12 0.44 -4.89 118.70 122.63 1rb3 s GLU 134 Ca 0.19 -0.62 -0.27 0.00 0.36 0.00 0.00 54.97 54.63 1rb3 s GLU 134 Cb -0.11 -2.76 0.02 0.00 0.26 0.00 0.00 34.13 31.54 1rb3 s GLU 134 CO 0.11 0.20 1.01 0.45 -0.54 0.00 0.00 175.26 176.49 1rb3 s SER 135 N 0.43 6.71 0.00 -1.70 0.15 -1.26 -0.12 113.70 117.90 1rb3 s SER 135 Ca -0.07 0.61 0.19 0.00 0.70 0.00 0.00 55.95 57.37 1rb3 s SER 135 Cb -0.15 -2.50 0.24 0.00 -1.71 0.00 0.00 66.02 61.89 1rb3 s SER 135 CO 0.04 -0.98 1.18 1.33 1.20 0.00 0.00 173.24 176.00 1rb3 n VAL 136 N 6.22 0.24 -3.64 4.45 0.24 0.11 -4.98 118.33 120.98 1rb3 n VAL 136 Ca 0.09 -0.62 -0.02 0.00 -2.04 0.00 0.00 64.34 61.75 1rb3 n VAL 136 Cb 0.48 1.17 -0.05 0.00 -1.47 0.00 0.00 33.84 33.98 1rb3 n VAL 136 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1rb3 s PHE 137 N -1.43 -0.05 -0.23 6.34 2.19 -1.16 -4.95 117.98 118.69 1rb3 s PHE 137 Ca 0.26 0.10 -0.26 0.00 0.33 0.00 0.00 56.93 57.36 1rb3 s PHE 137 Cb 0.17 0.49 0.07 0.00 -1.31 0.00 0.00 43.02 42.44 1rb3 s PHE 137 CO 0.24 -0.04 0.71 -1.54 1.83 0.00 0.00 175.22 176.42 1rb3 s SER 138 N -0.82 -0.73 -0.27 6.13 1.04 -1.25 -1.59 113.70 116.22 1rb3 s SER 138 Ca 0.08 1.31 -0.05 0.00 0.48 0.00 0.00 55.95 57.77 1rb3 s SER 138 Cb -0.02 1.29 0.14 0.00 0.10 0.00 0.00 66.02 67.53 1rb3 s SER 138 CO -0.09 -0.32 0.54 -0.70 0.98 0.00 0.00 173.24 173.65 1rb3 s GLU 139 N 0.07 0.48 0.27 4.02 2.12 -0.06 -4.95 118.70 120.65 1rb3 s GLU 139 Ca -0.02 1.06 -0.06 0.00 0.36 0.00 0.00 54.97 56.31 1rb3 s GLU 139 Cb -0.04 0.41 -0.05 0.00 0.26 0.00 0.00 34.13 34.71 1rb3 s GLU 139 CO 0.03 -0.43 0.54 0.12 -0.54 0.00 0.00 175.26 174.98 1rb3 s PHE 140 N 2.76 3.47 -0.14 5.30 2.19 -1.26 -0.51 117.98 129.79 1rb3 s PHE 140 Ca 0.07 0.67 -0.10 0.00 0.33 0.00 0.00 56.93 57.90 1rb3 s PHE 140 Cb -0.14 -2.12 0.04 0.00 -1.31 0.00 0.00 43.02 39.50 1rb3 s PHE 140 CO -0.18 0.21 0.35 -1.01 1.83 0.00 0.00 175.22 176.42 1rb3 s HIS 141 N -2.01 -0.45 0.58 10.12 3.76 0.51 -4.94 115.29 122.85 1rb3 s HIS 141 Ca 0.44 1.04 -0.14 0.00 -0.15 0.00 0.00 55.06 56.25 1rb3 s HIS 141 Cb -0.11 0.16 -0.05 0.00 1.11 0.00 0.00 32.58 33.69 1rb3 s HIS 141 CO 0.28 -0.25 1.01 -0.51 -0.85 0.00 0.00 174.74 174.43 1rb3 s ASP 142 N 0.79 6.31 0.81 1.40 1.01 -1.26 0.11 116.67 125.83 1rb3 s ASP 142 Ca -0.05 1.52 -0.12 0.00 0.71 0.00 0.00 52.55 54.62 1rb3 s ASP 142 Cb -0.06 -2.49 0.08 0.00 1.01 0.00 0.00 42.92 41.46 1rb3 s ASP 142 CO -0.06 -0.81 1.14 0.00 0.21 0.00 0.00 175.17 175.66 1rb3 s ALA 143 N -2.88 1.92 0.00 5.23 0.00 -1.26 -4.72 121.76 120.05 1rb3 s ALA 143 Ca 0.57 0.58 0.00 0.00 0.00 0.00 0.00 51.96 53.11 1rb3 s ALA 143 Cb -0.11 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.61 1rb3 s ALA 143 CO 0.43 -2.16 0.00 -0.40 0.00 0.00 0.00 175.76 173.63 1rb3 n ASP 144 N -3.52 0.00 0.26 0.00 5.68 0.17 -4.94 116.55 114.21 1rb3 n ASP 144 Ca 0.11 -0.06 0.17 0.00 -0.50 0.00 0.00 54.79 54.51 1rb3 n ASP 144 Cb 0.52 0.00 0.66 0.00 -1.14 0.00 0.00 41.12 41.16 1rb3 n ASP 144 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1rb3 h ALA 145 N 1.48 1.00 0.00 2.12 0.00 -2.01 -3.22 119.26 118.63 1rb3 h ALA 145 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.62 1rb3 h ALA 145 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 1rb3 h ALA 145 CO 0.00 0.00 -2.24 1.04 0.00 0.00 0.00 179.25 178.05 1rb3 n GLN 146 N -2.96 0.87 -3.99 0.00 6.02 -1.26 -4.93 117.38 111.13 1rb3 n GLN 146 Ca 0.01 -0.04 -0.34 0.00 -0.01 0.00 0.00 57.00 56.62 1rb3 n GLN 146 Cb 0.29 -1.48 -0.15 0.00 1.02 0.00 0.00 30.24 29.92 1rb3 n GLN 146 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1rb3 s ASN 147 N -5.17 3.85 0.53 1.08 0.01 -1.22 -4.45 114.94 109.57 1rb3 s ASN 147 Ca -0.09 -0.49 0.25 0.00 -0.71 0.00 0.00 52.86 51.82 1rb3 s ASN 147 Cb 0.07 -1.64 1.47 0.00 0.41 0.00 0.00 41.25 41.56 1rb3 s ASN 147 CO 0.79 -0.01 2.11 0.77 -1.51 0.00 0.00 177.10 179.25 1rb3 h SER 148 N 8.05 0.00 -5.20 -1.22 4.64 -1.59 0.49 113.55 118.72 1rb3 h SER 148 Ca -0.43 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.79 1rb3 h SER 148 Cb 1.15 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.11 1rb3 h SER 148 CO 0.62 0.09 -0.39 -1.00 -0.87 0.00 0.00 176.83 175.28 1rb3 s HIS 149 N -4.44 0.27 0.70 4.77 3.76 -1.26 -4.87 115.29 114.22 1rb3 s HIS 149 Ca -0.04 -0.69 -0.13 0.00 -0.15 0.00 0.00 55.06 54.05 1rb3 s HIS 149 Cb 0.14 -0.10 0.02 0.00 1.11 0.00 0.00 32.58 33.75 1rb3 s HIS 149 CO 0.60 -0.58 1.09 -1.54 -0.85 0.00 0.00 174.74 173.45 1rb3 s SER 150 N -2.90 5.03 -0.07 1.40 1.04 -1.26 -4.14 113.70 112.80 1rb3 s SER 150 Ca 0.09 1.85 -0.25 0.00 0.48 0.00 0.00 55.95 58.13 1rb3 s SER 150 Cb 0.05 -2.53 0.05 0.00 0.10 0.00 0.00 66.02 63.69 1rb3 s SER 150 CO -0.07 -1.68 0.56 -0.72 0.98 0.00 0.00 173.24 172.30 1rb3 s TYR 151 N -2.66 -0.52 -0.07 5.02 1.13 0.29 -2.70 117.35 117.84 1rb3 s TYR 151 Ca 0.63 0.95 0.01 0.00 -1.41 0.00 0.00 57.07 57.25 1rb3 s TYR 151 Cb -0.18 0.29 0.02 0.00 -1.10 0.00 0.00 41.96 40.99 1rb3 s TYR 151 CO 0.48 -0.50 -0.07 0.00 -2.51 0.00 0.00 175.55 172.95 1rb3 s PHE 153 N 1.17 3.68 0.07 0.00 0.08 0.34 0.67 117.98 123.99 1rb3 s PHE 153 Ca -0.06 1.13 0.00 0.00 0.12 0.00 0.00 56.93 58.12 1rb3 s PHE 153 Cb -0.14 -2.53 -0.04 0.00 -0.57 0.00 0.00 43.02 39.74 1rb3 s PHE 153 CO -0.02 0.41 -0.05 -2.00 -0.10 0.00 0.00 175.22 173.47 1rb3 s GLU 154 N -0.36 0.67 -0.06 0.44 2.12 0.14 -0.88 118.70 120.76 1rb3 s GLU 154 Ca 0.29 -1.19 -0.03 0.00 0.36 0.00 0.00 54.97 54.40 1rb3 s GLU 154 Cb -0.18 0.02 0.04 0.00 0.26 0.00 0.00 34.13 34.28 1rb3 s GLU 154 CO 0.16 -0.06 0.12 0.42 -0.54 0.00 0.00 175.26 175.35 1rb3 s ILE 155 N -3.50 -0.16 0.05 -3.70 1.01 -0.62 -1.27 121.20 113.01 1rb3 s ILE 155 Ca 0.06 0.32 0.06 0.00 0.00 0.00 0.00 60.65 61.09 1rb3 s ILE 155 Cb 0.05 -0.23 -0.02 0.00 0.01 0.00 0.00 42.46 42.27 1rb3 s ILE 155 CO -0.07 0.13 -0.18 -0.76 0.00 0.00 0.00 174.94 174.06 1rb3 s LEU 156 N 1.86 2.18 -0.07 2.97 1.02 -0.54 0.07 118.68 126.17 1rb3 s LEU 156 Ca -0.01 -0.51 0.03 0.00 0.02 0.00 0.00 54.13 53.66 1rb3 s LEU 156 Cb -0.12 -0.80 -0.02 0.00 0.02 0.00 0.00 46.19 45.27 1rb3 s LEU 156 CO -0.05 0.09 -0.15 -1.61 0.02 0.00 0.00 176.35 174.65 1rb3 s GLU 157 N -1.24 2.74 0.25 1.70 2.02 0.82 -1.69 118.70 123.30 1rb3 s GLU 157 Ca 0.05 -0.72 -0.30 0.00 0.02 0.00 0.00 54.97 54.02 1rb3 s GLU 157 Cb -0.09 -2.42 -0.09 0.00 0.10 0.00 0.00 34.13 31.63 1rb3 s GLU 157 CO 0.02 0.49 1.23 0.50 0.02 0.00 0.00 175.26 177.52 1rb3 s ARG 158 N -0.38 4.47 0.00 1.61 3.52 0.61 0.17 118.95 128.94 1rb3 s ARG 158 Ca 0.04 2.00 0.29 0.00 -0.13 0.00 0.00 55.73 57.93 1rb3 s ARG 158 Cb -0.12 -3.17 1.23 0.00 -1.56 0.00 0.00 34.95 31.33 1rb3 s ARG 158 CO 0.02 -0.08 1.85 0.54 -0.81 0.00 0.00 175.30 176.82