#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rlb s GLY 6 N 0.00 1.76 -0.11 3.41 0.00 -1.26 -5.03 107.32 106.08 1rlb s GLY 6 Ca 0.00 -1.72 -0.15 0.00 0.00 0.00 0.00 44.72 42.86 1rlb s GLY 6 CO 0.00 -1.10 0.43 -2.09 0.00 0.00 0.00 173.10 170.34 1rlb h GLU 7 N -0.70 -0.03 0.00 2.90 4.22 -2.08 -3.44 114.58 115.45 1rlb h GLU 7 Ca -0.37 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.08 1rlb h GLU 7 Cb 1.26 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1rlb h GLU 7 CO 0.39 0.44 0.00 0.43 -2.18 0.00 0.00 179.01 178.09 1rlb n SER 8 N -4.73 0.00 -4.71 1.04 7.64 -1.26 -5.11 113.62 106.49 1rlb n SER 8 Ca -0.05 -0.24 -0.42 0.00 1.01 0.00 0.00 58.87 59.16 1rlb n SER 8 Cb 0.23 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.40 1rlb n SER 8 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1rlb s LYS 9 N 0.00 4.38 -0.39 1.43 1.02 -1.26 -4.95 119.74 119.97 1rlb s LYS 9 Ca 0.00 1.91 0.07 0.00 0.02 0.00 0.00 55.97 57.98 1rlb s LYS 9 Cb 0.00 -3.30 0.18 0.00 -0.52 0.00 0.00 37.83 34.19 1rlb s LYS 9 CO 0.00 -0.34 0.63 0.00 -0.92 0.00 0.00 175.35 174.72 1rlb h PRO 11 N 7.13 -0.04 -4.51 0.00 0.13 -1.87 -3.40 132.00 129.45 1rlb h PRO 11 Ca 0.04 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.64 1rlb h PRO 11 Cb 1.18 0.01 -0.34 0.00 0.13 0.00 0.00 31.00 31.98 1rlb h PRO 11 CO 0.10 -0.03 -0.81 -1.17 -0.23 0.00 0.00 178.00 175.86 1rlb s LEU 12 N -10.61 1.56 -0.12 1.56 2.96 -1.25 -0.26 118.68 112.52 1rlb s LEU 12 Ca -0.14 -0.32 -0.07 0.00 -0.22 0.00 0.00 54.13 53.38 1rlb s LEU 12 Cb 0.14 -0.87 0.05 0.00 0.50 0.00 0.00 46.19 46.01 1rlb s LEU 12 CO 0.70 -0.00 0.29 -0.32 -1.32 0.00 0.00 176.35 175.70 1rlb s MET 13 N 0.94 0.27 -0.07 1.98 1.75 -0.49 -4.33 119.30 119.36 1rlb s MET 13 Ca -0.09 0.57 0.05 0.00 -1.25 0.00 0.00 55.69 54.97 1rlb s MET 13 Cb -0.15 -0.05 -0.01 0.00 2.84 0.00 0.00 34.83 37.45 1rlb s MET 13 CO 0.00 -0.14 -0.21 0.08 -0.65 0.00 0.00 175.02 174.10 1rlb s VAL 14 N 1.12 2.38 -0.04 10.11 1.01 -1.26 -0.12 120.40 133.59 1rlb s VAL 14 Ca -0.08 -0.95 0.03 0.00 0.00 0.00 0.00 61.98 60.98 1rlb s VAL 14 Cb -0.09 -1.90 0.01 0.00 0.00 0.00 0.00 36.38 34.40 1rlb s VAL 14 CO -0.08 0.57 -0.11 -0.75 0.00 0.00 0.00 175.10 174.73 1rlb s LYS 15 N -0.19 1.32 -0.00 2.72 2.20 -0.74 -1.52 119.74 123.53 1rlb s LYS 15 Ca -0.02 -0.37 0.04 0.00 -0.36 0.00 0.00 55.97 55.26 1rlb s LYS 15 Cb -0.14 -1.16 -0.01 0.00 -1.51 0.00 0.00 37.83 35.01 1rlb s LYS 15 CO 0.03 0.09 -0.13 0.08 -0.36 0.00 0.00 175.35 175.06 1rlb s VAL 16 N 0.38 1.03 0.03 4.02 1.01 -0.68 0.52 120.40 126.71 1rlb s VAL 16 Ca -0.08 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.27 1rlb s VAL 16 Cb -0.12 -0.87 -0.02 0.00 0.00 0.00 0.00 36.38 35.37 1rlb s VAL 16 CO 0.02 0.23 -0.03 -0.76 0.00 0.00 0.00 175.10 174.56 1rlb s LEU 17 N -0.45 2.28 -0.49 3.92 1.43 -0.79 -2.83 118.68 121.75 1rlb s LEU 17 Ca 0.04 -0.59 -0.05 0.00 -1.03 0.00 0.00 54.13 52.50 1rlb s LEU 17 Cb -0.05 0.09 0.13 0.00 0.03 0.00 0.00 46.19 46.39 1rlb s LEU 17 CO -0.00 -0.34 0.31 -0.62 0.23 0.00 0.00 176.35 175.93 1rlb s ASP 18 N -1.72 5.44 0.00 2.29 -1.08 0.26 -0.09 116.67 121.78 1rlb s ASP 18 Ca -0.12 -2.18 0.17 0.00 -0.52 0.00 0.00 52.55 49.90 1rlb s ASP 18 Cb -0.07 -1.90 1.01 0.00 -1.46 0.00 0.00 42.92 40.50 1rlb s ASP 18 CO -0.02 -0.56 1.47 0.00 0.52 0.00 0.00 175.17 176.58 1rlb n ALA 19 N 4.45 2.31 -0.13 3.66 0.00 -0.66 -0.74 120.51 129.40 1rlb n ALA 19 Ca -0.01 -0.11 -0.18 0.00 0.00 0.00 0.00 53.44 53.14 1rlb n ALA 19 Cb 0.41 -1.27 -0.11 0.00 0.00 0.00 0.00 19.45 18.47 1rlb n ALA 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1rlb n VAL 20 N -0.87 1.43 -1.61 0.00 0.31 -1.26 -4.60 118.33 111.73 1rlb n VAL 20 Ca 0.13 -0.53 -0.14 0.00 -0.01 0.00 0.00 64.34 63.79 1rlb n VAL 20 Cb 0.06 -1.43 0.13 0.00 -0.91 0.00 0.00 33.84 31.69 1rlb n VAL 20 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1rlb n ARG 21 N -3.33 2.45 -2.86 5.55 1.74 -0.97 -4.98 116.66 114.25 1rlb n ARG 21 Ca -0.45 -3.49 -0.14 0.00 -0.77 0.00 0.00 57.85 53.00 1rlb n ARG 21 Cb 0.96 -2.01 -0.03 0.00 -1.02 0.00 0.00 32.46 30.36 1rlb n ARG 21 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rlb n GLY 22 N -0.98 -0.37 3.67 -0.13 0.00 0.08 -4.81 105.19 102.64 1rlb n GLY 22 Ca 0.40 0.02 -0.11 0.00 0.00 0.00 0.00 46.02 46.34 1rlb n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rlb s SER 23 N -2.10 0.34 0.12 1.61 1.04 -1.05 -4.98 113.70 108.69 1rlb s SER 23 Ca 0.27 -1.24 -0.34 0.00 0.48 0.00 0.00 55.95 55.13 1rlb s SER 23 Cb -0.16 0.76 -0.13 0.00 0.10 0.00 0.00 66.02 66.58 1rlb s SER 23 CO 0.34 -1.48 1.66 -2.65 0.98 0.00 0.00 173.24 172.08 1rlb n PRO 24 N -0.53 2.25 -2.21 4.02 -0.02 -1.26 -0.57 135.00 136.67 1rlb n PRO 24 Ca -0.04 0.82 -0.32 0.00 -2.02 0.00 0.00 63.50 61.93 1rlb n PRO 24 Cb 0.61 -2.61 -0.04 0.00 -0.02 0.00 0.00 33.50 31.43 1rlb n PRO 24 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1rlb s ALA 25 N 1.58 2.17 0.15 3.55 0.00 -1.13 -4.74 121.76 123.33 1rlb s ALA 25 Ca 0.81 -2.21 -0.30 0.00 0.00 0.00 0.00 51.96 50.26 1rlb s ALA 25 Cb -0.65 -4.64 -0.07 0.00 0.00 0.00 0.00 23.12 17.76 1rlb s ALA 25 CO 0.40 -4.61 1.13 0.42 0.00 0.00 0.00 175.76 173.09 1rlb s ILE 26 N 8.91 3.91 -0.32 0.00 1.01 -1.26 -3.94 121.20 129.51 1rlb s ILE 26 Ca 0.64 1.57 0.00 0.00 0.00 0.00 0.00 60.65 62.86 1rlb s ILE 26 Cb -0.01 -4.00 0.00 0.00 0.01 0.00 0.00 42.46 38.46 1rlb s ILE 26 CO 0.08 0.23 0.00 -3.20 0.00 0.00 0.00 174.94 172.05 1rlb n ASN 27 N 2.77 -1.93 -4.81 3.58 4.05 -0.75 -4.96 115.26 113.22 1rlb n ASN 27 Ca 0.04 -0.00 -0.32 0.00 0.45 0.00 0.00 54.58 54.75 1rlb n ASN 27 Cb 0.46 -1.29 0.02 0.00 1.23 0.00 0.00 39.78 40.20 1rlb n ASN 27 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1rlb s VAL 28 N -2.19 3.85 -0.71 3.44 1.01 -1.25 -4.55 120.40 120.00 1rlb s VAL 28 Ca 0.00 0.82 -0.08 0.00 0.00 0.00 0.00 61.98 62.72 1rlb s VAL 28 Cb 0.00 -3.38 0.19 0.00 0.00 0.00 0.00 36.38 33.18 1rlb s VAL 28 CO 0.00 -0.57 0.58 0.00 0.00 0.00 0.00 175.10 175.11 1rlb s ALA 29 N -2.57 3.80 0.09 5.51 0.00 -1.26 -2.13 121.76 125.20 1rlb s ALA 29 Ca 0.62 -3.27 -0.26 0.00 0.00 0.00 0.00 51.96 49.05 1rlb s ALA 29 Cb -0.16 -3.04 -0.06 0.00 0.00 0.00 0.00 23.12 19.86 1rlb s ALA 29 CO 0.40 -2.18 0.82 0.08 0.00 0.00 0.00 175.76 174.89 1rlb s VAL 30 N 0.07 4.57 -0.44 0.00 1.01 -0.73 -2.71 120.40 122.18 1rlb s VAL 30 Ca 0.17 1.77 0.02 0.00 0.00 0.00 0.00 61.98 63.94 1rlb s VAL 30 Cb -0.16 -4.18 0.14 0.00 0.00 0.00 0.00 36.38 32.18 1rlb s VAL 30 CO -0.06 0.39 0.24 -1.00 0.00 0.00 0.00 175.10 174.68 1rlb s HIS 31 N -0.32 1.97 -0.24 5.22 3.76 0.35 -1.52 115.29 124.51 1rlb s HIS 31 Ca 0.40 -2.42 -0.29 0.00 -0.15 0.00 0.00 55.06 52.60 1rlb s HIS 31 Cb -0.22 -1.86 -0.01 0.00 1.11 0.00 0.00 32.58 31.60 1rlb s HIS 31 CO 0.26 -0.78 1.31 0.08 -0.85 0.00 0.00 174.74 174.75 1rlb s VAL 32 N 0.33 4.17 -0.09 -0.90 1.01 0.17 -2.97 120.40 122.12 1rlb s VAL 32 Ca 0.18 1.36 -0.04 0.00 0.00 0.00 0.00 61.98 63.48 1rlb s VAL 32 Cb -0.23 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 1rlb s VAL 32 CO -0.00 -0.32 0.07 -0.36 0.00 0.00 0.00 175.10 174.49 1rlb s PHE 33 N 4.06 3.37 -0.19 5.22 0.40 0.25 -0.49 117.98 130.61 1rlb s PHE 33 Ca 0.57 0.35 -0.02 0.00 -0.60 0.00 0.00 56.93 57.22 1rlb s PHE 33 Cb -0.19 -1.85 -0.00 0.00 0.51 0.00 0.00 43.02 41.49 1rlb s PHE 33 CO 0.20 0.60 -0.11 0.50 0.70 0.00 0.00 175.22 177.11 1rlb s ARG 34 N -1.05 3.26 0.15 0.44 3.52 -0.34 0.63 118.95 125.54 1rlb s ARG 34 Ca 0.15 -0.70 -0.30 0.00 -0.13 0.00 0.00 55.73 54.75 1rlb s ARG 34 Cb -0.12 -2.82 -0.07 0.00 -1.56 0.00 0.00 34.95 30.39 1rlb s ARG 34 CO 0.04 -0.14 1.14 0.21 -0.81 0.00 0.00 175.30 175.74 1rlb s LYS 35 N 1.26 4.53 0.20 5.12 2.20 -0.04 -0.69 119.74 132.32 1rlb s LYS 35 Ca 0.03 1.76 0.02 0.00 -0.36 0.00 0.00 55.97 57.41 1rlb s LYS 35 Cb -0.14 -3.29 0.02 0.00 -1.51 0.00 0.00 37.83 32.90 1rlb s LYS 35 CO -0.05 -0.04 0.13 0.00 -0.36 0.00 0.00 175.35 175.03 1rlb n ALA 36 N 2.81 0.29 0.15 3.13 0.00 0.45 -4.43 120.51 122.91 1rlb n ALA 36 Ca 0.05 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.67 1rlb n ALA 36 Cb 0.46 0.36 0.00 0.00 0.00 0.00 0.00 19.45 20.27 1rlb n ALA 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rlb n ALA 37 N -2.55 0.00 -2.74 0.00 0.00 -1.26 -2.55 120.51 111.40 1rlb n ALA 37 Ca -0.07 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.36 1rlb n ALA 37 Cb 0.23 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.77 1rlb n ALA 37 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1rlb n ASP 38 N -1.44 0.07 -3.28 0.00 5.75 -1.26 -4.97 116.55 111.42 1rlb n ASP 38 Ca 0.00 -2.12 -0.20 0.00 -0.01 0.00 0.00 54.79 52.47 1rlb n ASP 38 Cb 0.56 0.09 0.08 0.00 -1.03 0.00 0.00 41.12 40.81 1rlb n ASP 38 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1rlb n ASP 39 N -1.04 -4.76 -4.08 -1.12 8.00 -1.06 -5.02 116.55 107.48 1rlb n ASP 39 Ca -0.05 -0.51 -0.32 0.00 0.71 0.00 0.00 54.79 54.62 1rlb n ASP 39 Cb 0.84 -4.64 -0.16 0.00 -0.02 0.00 0.00 41.12 37.14 1rlb n ASP 39 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1rlb s THR 40 N -3.30 1.87 -0.87 -3.53 2.01 -1.25 -4.97 115.64 105.61 1rlb s THR 40 Ca 0.37 -0.85 -0.25 0.00 0.31 0.00 0.00 61.69 61.27 1rlb s THR 40 Cb -0.16 -1.73 0.03 0.00 0.01 0.00 0.00 72.50 70.66 1rlb s THR 40 CO 0.66 0.48 1.41 0.26 -0.69 0.00 0.00 174.62 176.74 1rlb s TRP 41 N 1.36 2.35 -0.11 4.92 0.52 -1.26 -0.41 118.94 126.31 1rlb s TRP 41 Ca 0.04 -0.35 -0.24 0.00 0.02 0.00 0.00 56.10 55.57 1rlb s TRP 41 Cb -0.13 -4.62 -0.03 0.00 -1.15 0.00 0.00 33.47 27.54 1rlb s TRP 41 CO -0.12 -2.01 0.75 -2.00 0.02 0.00 0.00 176.95 173.59 1rlb s GLU 42 N 5.49 4.37 -0.33 4.98 2.12 0.13 -4.83 118.70 130.63 1rlb s GLU 42 Ca 0.43 0.92 -0.42 0.00 0.36 0.00 0.00 54.97 56.26 1rlb s GLU 42 Cb -0.04 -3.51 -0.17 0.00 0.26 0.00 0.00 34.13 30.67 1rlb s GLU 42 CO 0.03 -0.11 1.71 -2.30 -0.54 0.00 0.00 175.26 174.04 1rlb n PRO 43 N 4.44 0.86 0.00 4.30 -0.02 -1.26 -1.20 135.00 142.12 1rlb n PRO 43 Ca 0.01 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1rlb n PRO 43 Cb 0.50 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 1rlb n PRO 43 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1rlb n PHE 44 N 5.02 0.00 -4.17 6.00 7.35 -0.83 -4.76 117.46 126.08 1rlb n PHE 44 Ca 0.28 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.86 1rlb n PHE 44 Cb 0.08 0.00 -0.10 0.00 0.35 0.00 0.00 39.48 39.81 1rlb n PHE 44 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1rlb s ALA 45 N -4.31 0.98 0.11 3.13 0.00 0.36 -4.99 121.76 117.04 1rlb s ALA 45 Ca 0.00 -1.57 -0.15 0.00 0.00 0.00 0.00 51.96 50.25 1rlb s ALA 45 Cb 0.00 1.17 0.03 0.00 0.00 0.00 0.00 23.12 24.32 1rlb s ALA 45 CO 0.00 -0.56 0.35 0.45 0.00 0.00 0.00 175.76 176.00 1rlb s SER 46 N -3.11 -0.16 -0.00 0.00 0.15 -1.26 0.41 113.70 109.73 1rlb s SER 46 Ca 0.32 -0.35 -0.14 0.00 0.70 0.00 0.00 55.95 56.49 1rlb s SER 46 Cb 0.07 0.44 0.05 0.00 -1.71 0.00 0.00 66.02 64.86 1rlb s SER 46 CO 0.08 -0.80 0.64 0.61 1.20 0.00 0.00 173.24 174.97 1rlb n GLY 47 N -0.08 0.46 2.95 9.45 0.00 -0.58 -4.99 105.19 112.40 1rlb n GLY 47 Ca -0.16 -0.95 -0.22 0.00 0.00 0.00 0.00 46.02 44.69 1rlb n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rlb s LYS 48 N -2.01 1.19 0.38 1.61 1.02 -1.25 -1.77 119.74 118.90 1rlb s LYS 48 Ca 0.15 -0.23 -0.26 0.00 0.02 0.00 0.00 55.97 55.64 1rlb s LYS 48 Cb -0.00 -1.06 -0.09 0.00 -0.52 0.00 0.00 37.83 36.15 1rlb s LYS 48 CO -0.00 -0.03 1.22 0.95 -0.92 0.00 0.00 175.35 176.57 1rlb s THR 49 N 0.79 2.98 1.11 2.17 -4.23 -0.91 -4.72 115.64 112.83 1rlb s THR 49 Ca -0.13 0.88 -0.17 0.00 -1.18 0.00 0.00 61.69 61.09 1rlb s THR 49 Cb -0.15 -3.52 0.25 0.00 1.34 0.00 0.00 72.50 70.42 1rlb s THR 49 CO 0.02 0.13 1.16 -0.55 -0.54 0.00 0.00 174.62 174.84 1rlb s SER 50 N -0.90 1.73 0.59 3.99 0.15 -1.02 -1.82 113.70 116.42 1rlb s SER 50 Ca 0.54 0.62 0.28 0.00 0.70 0.00 0.00 55.95 58.10 1rlb s SER 50 Cb -0.34 -0.89 1.66 0.00 -1.71 0.00 0.00 66.02 64.74 1rlb s SER 50 CO 0.44 -3.63 2.12 -0.33 1.20 0.00 0.00 173.24 173.04 1rlb h GLU 51 N -2.24 0.00 -0.41 5.44 4.39 -1.94 0.12 114.58 119.93 1rlb h GLU 51 Ca -0.46 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.24 1rlb h GLU 51 Cb 1.29 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.94 1rlb h GLU 51 CO 0.39 0.00 0.00 -1.13 -1.16 0.00 0.00 179.01 177.11 1rlb n SER 52 N -3.84 2.70 -1.74 1.42 3.41 -1.26 -4.83 113.62 109.47 1rlb n SER 52 Ca 0.01 -1.93 -0.13 0.00 -0.26 0.00 0.00 58.87 56.56 1rlb n SER 52 Cb 0.30 -0.27 0.01 0.00 -0.26 0.00 0.00 64.21 63.99 1rlb n SER 52 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rlb n GLY 53 N 1.33 -0.07 2.88 5.00 0.00 0.41 -4.93 105.19 109.80 1rlb n GLY 53 Ca 0.18 -0.28 -0.23 0.00 0.00 0.00 0.00 46.02 45.69 1rlb n GLY 53 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rlb s GLU 54 N -5.02 1.05 0.45 1.61 2.02 -1.26 -1.68 118.70 115.88 1rlb s GLU 54 Ca 0.12 -0.13 -0.19 0.00 0.02 0.00 0.00 54.97 54.79 1rlb s GLU 54 Cb -0.05 -1.12 -0.10 0.00 0.10 0.00 0.00 34.13 32.96 1rlb s GLU 54 CO 0.15 -0.16 0.94 -1.17 0.02 0.00 0.00 175.26 175.04 1rlb s LEU 55 N 1.32 3.84 0.04 1.80 0.20 -0.57 -2.43 118.68 122.87 1rlb s LEU 55 Ca -0.04 1.61 -0.10 0.00 0.69 0.00 0.00 54.13 56.30 1rlb s LEU 55 Cb -0.14 -4.49 0.00 0.00 -0.43 0.00 0.00 46.19 41.14 1rlb s LEU 55 CO -0.03 -0.42 0.20 -1.00 -0.29 0.00 0.00 176.35 174.81 1rlb s HIS 56 N -2.32 0.04 -1.12 5.38 3.76 -1.26 -3.97 115.29 115.80 1rlb s HIS 56 Ca 0.60 -0.24 -0.06 0.00 -0.15 0.00 0.00 55.06 55.21 1rlb s HIS 56 Cb -0.09 -0.02 -0.04 0.00 1.11 0.00 0.00 32.58 33.53 1rlb s HIS 56 CO 0.20 -0.42 0.89 0.41 -0.85 0.00 0.00 174.74 174.97 1rlb n GLY 57 N 0.76 -0.88 0.01 -2.22 0.00 -1.26 -4.93 105.19 96.67 1rlb n GLY 57 Ca -0.19 0.42 0.13 0.00 0.00 0.00 0.00 46.02 46.38 1rlb n GLY 57 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rlb n LEU 58 N -3.67 0.24 -3.63 0.99 4.77 -1.26 -4.94 117.00 109.50 1rlb n LEU 58 Ca -0.14 0.33 -0.04 0.00 -0.03 0.00 0.00 56.01 56.13 1rlb n LEU 58 Cb 0.63 -0.39 -0.01 0.00 -2.33 0.00 0.00 43.42 41.31 1rlb n LEU 58 CO 0.62 0.03 0.82 0.28 -1.33 0.00 0.00 177.39 177.80 1rlb s THR 59 N -3.01 0.00 0.32 -5.08 -1.32 -1.26 -4.70 115.64 100.59 1rlb s THR 59 Ca 0.12 -0.29 0.07 0.00 -1.21 0.00 0.00 61.69 60.38 1rlb s THR 59 Cb 0.18 -1.57 -0.03 0.00 -1.51 0.00 0.00 72.50 69.57 1rlb s THR 59 CO 0.60 0.00 0.31 0.42 -2.21 0.00 0.00 174.62 173.74 1rlb s THR 60 N -2.95 3.79 0.29 5.08 -4.23 -1.26 -4.79 115.64 111.57 1rlb s THR 60 Ca 0.10 -1.30 0.26 0.00 -1.18 0.00 0.00 61.69 59.58 1rlb s THR 60 Cb 0.00 -3.27 0.27 0.00 1.34 0.00 0.00 72.50 70.84 1rlb s THR 60 CO -0.03 -0.20 1.96 -0.33 -0.54 0.00 0.00 174.62 175.48 1rlb h GLU 61 N 1.21 0.00 0.00 3.99 5.08 -2.02 -2.16 114.58 120.69 1rlb h GLU 61 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1rlb h GLU 61 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1rlb h GLU 61 CO 0.58 0.17 -0.04 -1.91 -1.00 0.00 0.00 179.01 176.81 1rlb n GLU 62 N -3.50 0.24 0.10 2.33 4.07 -1.26 -3.32 120.64 119.30 1rlb n GLU 62 Ca -0.01 0.18 0.09 0.00 -0.06 0.00 0.00 57.16 57.36 1rlb n GLU 62 Cb 0.32 -1.77 0.00 0.00 -0.06 0.00 0.00 31.44 29.94 1rlb n GLU 62 CO 0.00 0.00 0.00 1.96 -0.06 0.00 0.00 177.13 179.03 1rlb h GLN 63 N 0.00 0.00 -5.86 5.31 7.50 -1.80 -3.44 115.11 116.81 1rlb h GLN 63 Ca 0.00 0.00 -0.60 0.00 0.50 0.00 0.00 58.65 58.55 1rlb h GLN 63 Cb 0.71 0.00 -0.12 0.00 0.05 0.00 0.00 27.48 28.13 1rlb h GLN 63 CO 0.00 0.08 1.04 0.12 -1.50 0.00 0.00 178.83 178.56 1rlb s PHE 64 N -3.25 2.58 0.32 2.96 2.19 -0.89 -4.96 117.98 116.92 1rlb s PHE 64 Ca -0.00 -0.61 0.08 0.00 0.33 0.00 0.00 56.93 56.72 1rlb s PHE 64 Cb 0.09 -4.52 -0.04 0.00 -1.31 0.00 0.00 43.02 37.24 1rlb s PHE 64 CO 0.78 -1.85 0.18 0.14 1.83 0.00 0.00 175.22 176.30 1rlb s VAL 65 N 4.65 3.45 -0.35 3.12 -7.23 -1.26 -4.87 120.40 117.90 1rlb s VAL 65 Ca 0.35 -1.57 -0.27 0.00 -1.81 0.00 0.00 61.98 58.67 1rlb s VAL 65 Cb -0.07 -3.09 -0.06 0.00 0.56 0.00 0.00 36.38 33.72 1rlb s VAL 65 CO 0.02 -0.23 2.32 -0.62 -0.31 0.00 0.00 175.10 176.28 1rlb n GLU 66 N -1.19 1.51 -3.61 4.82 1.02 -1.26 -4.49 120.64 117.44 1rlb n GLU 66 Ca -0.04 0.28 -0.04 0.00 -0.02 0.00 0.00 57.16 57.34 1rlb n GLU 66 Cb 0.60 -3.30 -0.02 0.00 -0.02 0.00 0.00 31.44 28.70 1rlb n GLU 66 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1rlb s GLY 67 N 10.07 -0.36 -0.57 0.62 0.00 -1.26 -4.96 107.32 110.87 1rlb s GLY 67 Ca 1.00 0.87 -0.28 0.00 0.00 0.00 0.00 44.72 46.31 1rlb s GLY 67 CO 0.32 0.26 1.33 -0.42 0.00 0.00 0.00 173.10 174.58 1rlb s ILE 68 N -2.87 3.88 0.69 0.90 1.01 -1.26 -1.35 121.20 122.19 1rlb s ILE 68 Ca 0.10 0.76 0.02 0.00 0.00 0.00 0.00 60.65 61.53 1rlb s ILE 68 Cb 0.00 -4.55 0.12 0.00 0.01 0.00 0.00 42.46 38.04 1rlb s ILE 68 CO -0.04 -1.24 0.94 -0.31 0.00 0.00 0.00 174.94 174.29 1rlb s TYR 69 N 5.61 1.48 -0.26 3.97 1.51 -0.07 -0.86 117.35 128.73 1rlb s TYR 69 Ca 0.49 -0.41 -0.03 0.00 -1.01 0.00 0.00 57.07 56.10 1rlb s TYR 69 Cb -0.10 -2.78 0.15 0.00 -0.11 0.00 0.00 41.96 39.12 1rlb s TYR 69 CO 0.25 -1.59 0.49 0.21 -1.11 0.00 0.00 175.55 173.80 1rlb s LYS 70 N -5.02 0.45 -0.22 -0.62 2.20 0.20 -1.71 119.74 115.02 1rlb s LYS 70 Ca 0.65 0.83 -0.19 0.00 -0.36 0.00 0.00 55.97 56.90 1rlb s LYS 70 Cb -0.05 0.09 -0.03 0.00 -1.51 0.00 0.00 37.83 36.33 1rlb s LYS 70 CO 0.43 -0.56 0.56 0.08 -0.36 0.00 0.00 175.35 175.49 1rlb s VAL 71 N 2.70 5.06 -0.17 4.02 1.01 0.23 0.88 120.40 134.14 1rlb s VAL 71 Ca 0.13 1.01 0.01 0.00 0.00 0.00 0.00 61.98 63.13 1rlb s VAL 71 Cb -0.15 -3.87 0.01 0.00 0.00 0.00 0.00 36.38 32.37 1rlb s VAL 71 CO -0.18 0.12 -0.18 -0.70 0.00 0.00 0.00 175.10 174.16 1rlb s GLU 72 N 1.99 3.09 -0.23 2.72 2.12 -1.16 0.43 118.70 127.67 1rlb s GLU 72 Ca 0.25 -0.80 -0.07 0.00 0.36 0.00 0.00 54.97 54.71 1rlb s GLU 72 Cb -0.16 -2.59 -0.03 0.00 0.26 0.00 0.00 34.13 31.61 1rlb s GLU 72 CO 0.09 -0.10 0.07 0.42 -0.54 0.00 0.00 175.26 175.20 1rlb s ILE 73 N 1.05 4.45 -0.89 -3.70 1.01 0.24 -0.49 121.20 122.87 1rlb s ILE 73 Ca -0.01 -0.13 -0.25 0.00 0.00 0.00 0.00 60.65 60.26 1rlb s ILE 73 Cb -0.14 -3.05 0.04 0.00 0.01 0.00 0.00 42.46 39.31 1rlb s ILE 73 CO -0.06 0.37 1.40 -0.62 0.00 0.00 0.00 174.94 176.03 1rlb s ASP 74 N 1.23 6.30 -0.13 3.58 2.15 -1.10 -0.68 116.67 128.03 1rlb s ASP 74 Ca 0.05 -0.97 -0.10 0.00 0.43 0.00 0.00 52.55 51.96 1rlb s ASP 74 Cb -0.14 -2.56 -0.07 0.00 -0.30 0.00 0.00 42.92 39.84 1rlb s ASP 74 CO 0.03 -1.70 0.10 0.71 -0.17 0.00 0.00 175.17 174.15 1rlb h THR 75 N 6.48 0.41 -0.92 1.71 1.35 -1.88 -3.35 112.91 116.70 1rlb h THR 75 Ca -0.02 -1.36 0.17 0.00 -0.55 0.00 0.00 66.41 64.65 1rlb h THR 75 Cb 1.03 0.82 -0.17 0.00 -1.73 0.00 0.00 68.15 68.10 1rlb h THR 75 CO 1.36 0.14 -0.26 1.17 -0.25 0.00 0.00 175.52 177.67 1rlb n LYS 76 N -4.66 -0.11 -0.27 4.72 4.81 -1.19 0.99 118.16 122.43 1rlb n LYS 76 Ca -0.07 1.43 0.05 0.00 -0.87 0.00 0.00 58.31 58.85 1rlb n LYS 76 Cb 0.23 -2.14 0.19 0.00 0.02 0.00 0.00 35.03 33.34 1rlb n LYS 76 CO 0.00 0.00 0.00 0.77 1.17 0.00 0.00 177.40 179.34 1rlb h SER 77 N 0.00 0.45 -0.94 3.14 0.02 -1.87 0.28 113.55 114.64 1rlb h SER 77 Ca 0.41 0.09 0.09 0.00 -0.84 0.00 0.00 61.79 61.54 1rlb h SER 77 Cb 0.64 0.02 -0.07 0.00 0.14 0.00 0.00 62.40 63.14 1rlb h SER 77 CO -0.94 0.20 0.60 0.22 -1.14 0.00 0.00 176.83 175.78 1rlb h TYR 78 N 0.58 1.05 0.00 3.45 3.20 0.49 -1.81 116.97 123.93 1rlb h TYR 78 Ca 0.42 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 62.26 1rlb h TYR 78 Cb 0.58 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 1rlb h TYR 78 CO -0.11 0.49 -0.45 -1.49 -1.64 0.00 0.00 178.16 174.96 1rlb h TRP 79 N 0.99 0.00 -0.87 -3.82 -0.00 -0.69 -3.33 115.95 108.23 1rlb h TRP 79 Ca 0.43 0.00 0.20 0.00 -0.00 0.00 0.00 58.89 59.52 1rlb h TRP 79 Cb 0.34 0.00 -0.16 0.00 -0.00 0.00 0.00 29.16 29.35 1rlb h TRP 79 CO -0.00 0.73 -0.07 0.87 -0.00 0.00 0.00 178.44 179.97 1rlb h LYS 80 N -1.00 0.04 -1.07 0.49 1.57 -0.53 0.77 116.57 116.83 1rlb h LYS 80 Ca -0.10 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1rlb h LYS 80 Cb 0.77 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.07 1rlb h LYS 80 CO -0.06 0.03 0.00 0.00 -0.57 0.00 0.00 179.45 178.85 1rlb n ALA 81 N -3.18 2.31 -0.10 3.86 0.00 -0.69 -1.62 120.51 121.10 1rlb n ALA 81 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1rlb n ALA 81 Cb 0.54 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.99 1rlb n ALA 81 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1rlb n LEU 82 N 0.44 0.00 0.00 0.00 7.94 0.26 -5.01 117.00 120.63 1rlb n LEU 82 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1rlb n LEU 82 Cb 0.36 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.31 1rlb n LEU 82 CO 0.00 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 176.89 1rlb n GLY 83 N 0.00 0.74 3.53 -3.96 0.00 -0.63 -5.07 105.19 99.80 1rlb n GLY 83 Ca 0.00 -0.14 -0.33 0.00 0.00 0.00 0.00 46.02 45.55 1rlb n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rlb s ILE 84 N -2.00 3.38 -0.86 -0.61 1.01 -1.20 -5.03 121.20 115.88 1rlb s ILE 84 Ca 0.00 -0.60 -0.25 0.00 0.00 0.00 0.00 60.65 59.80 1rlb s ILE 84 Cb 0.00 -2.36 0.04 0.00 0.01 0.00 0.00 42.46 40.15 1rlb s ILE 84 CO 0.00 0.59 1.36 -0.44 0.00 0.00 0.00 174.94 176.45 1rlb s SER 85 N -0.74 6.31 0.79 3.58 0.01 -1.26 -3.74 113.70 118.64 1rlb s SER 85 Ca 0.11 -0.89 -0.15 0.00 1.31 0.00 0.00 55.95 56.33 1rlb s SER 85 Cb -0.11 -2.56 0.02 0.00 0.21 0.00 0.00 66.02 63.58 1rlb s SER 85 CO 0.01 -1.70 0.82 -0.81 0.41 0.00 0.00 173.24 171.98 1rlb n PRO 86 N 9.16 0.21 0.04 12.44 -0.04 -1.26 -4.98 135.00 150.57 1rlb n PRO 86 Ca 0.17 0.13 -0.22 0.00 -0.04 0.00 0.00 63.50 63.54 1rlb n PRO 86 Cb 0.50 -2.12 -0.14 0.00 -0.04 0.00 0.00 33.50 31.70 1rlb n PRO 86 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 1rlb h PHE 87 N -0.71 0.58 -3.30 0.54 3.57 -1.20 -3.46 116.94 112.95 1rlb h PHE 87 Ca -0.46 -0.42 -0.57 0.00 3.53 0.00 0.00 57.97 60.05 1rlb h PHE 87 Cb 1.32 -0.02 -0.06 0.00 2.79 0.00 0.00 35.95 39.98 1rlb h PHE 87 CO 0.40 1.53 0.40 -1.01 -2.23 0.00 0.00 178.31 177.40 1rlb s HIS 88 N -2.50 3.46 0.12 0.41 3.76 -1.26 -4.94 115.29 114.35 1rlb s HIS 88 Ca -0.17 1.35 -0.27 0.00 -0.15 0.00 0.00 55.06 55.82 1rlb s HIS 88 Cb 0.04 -3.04 -0.06 0.00 1.11 0.00 0.00 32.58 30.63 1rlb s HIS 88 CO 0.82 -0.20 1.63 0.93 -0.85 0.00 0.00 174.74 177.06 1rlb h GLU 89 N 7.21 -0.44 -3.34 1.40 4.39 -1.98 -3.30 114.58 118.52 1rlb h GLU 89 Ca -0.31 0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.39 1rlb h GLU 89 Cb 1.14 0.10 -0.06 0.00 -0.10 0.00 0.00 28.75 29.84 1rlb h GLU 89 CO 0.83 -0.30 0.08 -3.38 -1.16 0.00 0.00 179.01 175.08 1rlb s HIS 90 N -6.03 0.19 -0.19 4.33 -3.43 -1.26 -3.20 115.29 105.70 1rlb s HIS 90 Ca -0.16 -0.63 -0.04 0.00 -0.80 0.00 0.00 55.06 53.43 1rlb s HIS 90 Cb 0.09 0.48 -0.02 0.00 -1.43 0.00 0.00 32.58 31.69 1rlb s HIS 90 CO 0.65 -1.21 -0.02 0.00 -2.00 0.00 0.00 174.74 172.16 1rlb s ALA 91 N -3.55 2.97 0.36 -1.38 0.00 0.15 -4.87 121.76 115.44 1rlb s ALA 91 Ca 0.18 -0.96 0.08 0.00 0.00 0.00 0.00 51.96 51.25 1rlb s ALA 91 Cb -0.03 -1.67 -0.04 0.00 0.00 0.00 0.00 23.12 21.37 1rlb s ALA 91 CO 0.10 -0.07 0.19 -1.21 0.00 0.00 0.00 175.76 174.77 1rlb s GLU 92 N 0.86 2.39 -0.27 0.00 2.02 -1.26 0.80 118.70 123.23 1rlb s GLU 92 Ca -0.00 -1.59 0.00 0.00 0.02 0.00 0.00 54.97 53.40 1rlb s GLU 92 Cb -0.14 -2.18 0.15 0.00 0.10 0.00 0.00 34.13 32.06 1rlb s GLU 92 CO 0.02 0.03 0.41 0.08 0.02 0.00 0.00 175.26 175.81 1rlb s VAL 93 N -2.46 -0.65 -0.37 2.63 1.01 0.17 -4.95 120.40 115.79 1rlb s VAL 93 Ca 0.40 -0.19 -0.11 0.00 0.00 0.00 0.00 61.98 62.08 1rlb s VAL 93 Cb -0.02 -0.92 0.02 0.00 0.00 0.00 0.00 36.38 35.46 1rlb s VAL 93 CO 0.24 -0.20 0.21 0.68 0.00 0.00 0.00 175.10 176.02 1rlb s VAL 94 N 2.57 4.66 -0.01 2.92 -7.23 -1.26 -0.60 120.40 121.44 1rlb s VAL 94 Ca 0.11 -0.78 -0.01 0.00 -1.81 0.00 0.00 61.98 59.50 1rlb s VAL 94 Cb -0.14 -3.57 0.01 0.00 0.56 0.00 0.00 36.38 33.24 1rlb s VAL 94 CO -0.24 -0.20 0.03 0.72 -0.31 0.00 0.00 175.10 175.09 1rlb s PHE 95 N 1.58 -0.01 -0.23 2.82 -0.71 -0.69 -4.93 117.98 115.80 1rlb s PHE 95 Ca 0.03 0.08 -0.29 0.00 -1.04 0.00 0.00 56.93 55.71 1rlb s PHE 95 Cb -0.19 -0.05 -0.01 0.00 -1.21 0.00 0.00 43.02 41.56 1rlb s PHE 95 CO 0.07 -0.03 1.30 0.99 -1.34 0.00 0.00 175.22 176.20 1rlb s THR 96 N 0.30 4.19 0.00 -4.49 2.01 -1.26 -0.89 115.64 115.50 1rlb s THR 96 Ca -0.02 1.40 0.00 0.00 0.31 0.00 0.00 61.69 63.37 1rlb s THR 96 Cb -0.03 -4.06 0.00 0.00 0.01 0.00 0.00 72.50 68.42 1rlb s THR 96 CO -0.01 -0.30 0.00 0.00 -0.69 0.00 0.00 174.62 173.63 1rlb n ALA 97 N 7.15 0.00 -0.20 7.40 0.00 -0.46 -4.81 120.51 129.59 1rlb n ALA 97 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1rlb n ALA 97 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1rlb n ALA 97 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1rlb n ASN 98 N 0.00 4.37 0.09 0.00 3.02 -1.26 -4.61 115.26 116.87 1rlb n ASN 98 Ca 0.00 -2.16 -0.13 0.00 -0.03 0.00 0.00 54.58 52.26 1rlb n ASN 98 Cb 0.00 -0.90 -0.08 0.00 -0.61 0.00 0.00 39.78 38.19 1rlb n ASN 98 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1rlb h ASP 99 N 1.13 -1.26 -0.52 6.41 5.19 -1.93 -3.06 116.42 122.37 1rlb h ASP 99 Ca 0.00 0.13 -0.15 0.00 -0.62 0.00 0.00 57.03 56.39 1rlb h ASP 99 Cb 0.89 0.47 -0.09 0.00 0.18 0.00 0.00 39.33 40.78 1rlb h ASP 99 CO 0.00 -0.44 0.19 -1.20 -3.12 0.00 0.00 179.24 174.67 1rlb n SER 100 N -4.83 4.00 0.00 6.45 7.64 -1.26 -4.94 113.62 120.67 1rlb n SER 100 Ca -0.07 -2.85 0.00 0.00 1.01 0.00 0.00 58.87 56.97 1rlb n SER 100 Cb 0.33 -0.68 0.00 0.00 -1.01 0.00 0.00 64.21 62.85 1rlb n SER 100 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rlb n GLY 101 N -0.01 1.91 3.54 0.23 0.00 -1.16 -4.95 105.19 104.76 1rlb n GLY 101 Ca 0.29 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.87 1rlb n GLY 101 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1rlb s PRO 102 N 0.00 4.01 0.63 1.61 0.04 -1.26 -4.73 135.00 135.29 1rlb s PRO 102 Ca 0.00 -2.15 0.41 0.00 0.04 0.00 0.00 61.00 59.30 1rlb s PRO 102 Cb 0.00 -5.39 2.11 0.00 0.04 0.00 0.00 34.50 31.26 1rlb s PRO 102 CO 0.00 -2.11 2.25 0.00 0.04 0.00 0.00 177.00 177.18 1rlb h ARG 103 N 7.52 0.00 -4.29 4.56 3.08 -1.89 -3.41 114.38 119.95 1rlb h ARG 103 Ca 0.40 0.00 -0.74 0.00 0.07 0.00 0.00 59.98 59.71 1rlb h ARG 103 Cb 0.88 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 30.69 1rlb h ARG 103 CO 1.39 0.00 -0.34 1.03 -1.07 0.00 0.00 179.97 180.98 1rlb s ARG 104 N -3.99 2.88 -0.38 0.04 1.81 0.24 -4.50 118.95 115.05 1rlb s ARG 104 Ca -0.03 -1.46 -0.16 0.00 -1.72 0.00 0.00 55.73 52.36 1rlb s ARG 104 Cb 0.12 -4.09 0.00 0.00 -0.45 0.00 0.00 34.95 30.53 1rlb s ARG 104 CO 0.44 -1.08 0.39 0.71 -0.68 0.00 0.00 175.30 175.08 1rlb s TYR 105 N 1.58 3.20 -0.32 -0.53 1.51 0.65 -0.03 117.35 123.40 1rlb s TYR 105 Ca 0.04 -0.18 -0.06 0.00 -1.01 0.00 0.00 57.07 55.85 1rlb s TYR 105 Cb -0.25 -2.75 0.03 0.00 -0.11 0.00 0.00 41.96 38.87 1rlb s TYR 105 CO 0.05 -0.54 0.08 0.99 -1.11 0.00 0.00 175.55 175.02 1rlb s THR 106 N 2.05 3.76 -0.47 -0.71 2.01 -0.56 -1.39 115.64 120.33 1rlb s THR 106 Ca 0.12 -1.00 -0.18 0.00 0.31 0.00 0.00 61.69 60.94 1rlb s THR 106 Cb -0.17 -3.06 0.05 0.00 0.01 0.00 0.00 72.50 69.33 1rlb s THR 106 CO 0.12 -0.08 0.51 -0.63 -0.69 0.00 0.00 174.62 173.85 1rlb s ILE 107 N 1.42 5.03 0.03 1.82 -1.09 0.82 -1.26 121.20 127.98 1rlb s ILE 107 Ca -0.00 -0.58 0.02 0.00 -2.23 0.00 0.00 60.65 57.86 1rlb s ILE 107 Cb -0.19 -4.17 -0.04 0.00 -1.58 0.00 0.00 42.46 36.49 1rlb s ILE 107 CO 0.02 -0.62 0.02 0.00 -1.23 0.00 0.00 174.94 173.13 1rlb s ALA 108 N 2.22 3.35 0.16 9.38 0.00 0.06 -1.79 121.76 135.14 1rlb s ALA 108 Ca 0.11 -0.99 0.08 0.00 0.00 0.00 0.00 51.96 51.17 1rlb s ALA 108 Cb -0.20 -1.34 -0.04 0.00 0.00 0.00 0.00 23.12 21.54 1rlb s ALA 108 CO 0.11 0.68 -0.18 0.00 0.00 0.00 0.00 175.76 176.37 1rlb s ALA 109 N -1.18 1.94 -0.16 0.00 0.00 0.18 -2.45 121.76 120.10 1rlb s ALA 109 Ca 0.22 -1.46 -0.02 0.00 0.00 0.00 0.00 51.96 50.70 1rlb s ALA 109 Cb -0.12 -0.17 0.05 0.00 0.00 0.00 0.00 23.12 22.88 1rlb s ALA 109 CO 0.14 0.22 0.02 -1.17 0.00 0.00 0.00 175.76 174.97 1rlb s LEU 110 N -2.63 1.04 0.38 0.00 2.96 -0.19 -1.88 118.68 118.35 1rlb s LEU 110 Ca 0.15 -0.61 0.05 0.00 -0.22 0.00 0.00 54.13 53.51 1rlb s LEU 110 Cb -0.06 -0.58 -0.00 0.00 0.50 0.00 0.00 46.19 46.06 1rlb s LEU 110 CO 0.06 -0.27 0.54 -0.76 -1.32 0.00 0.00 176.35 174.60 1rlb s LEU 111 N 1.87 3.83 -0.18 -0.68 1.43 0.87 -2.19 118.68 123.63 1rlb s LEU 111 Ca 0.01 -0.14 -0.35 0.00 -1.03 0.00 0.00 54.13 52.62 1rlb s LEU 111 Cb -0.16 -2.81 0.14 0.00 0.03 0.00 0.00 46.19 43.39 1rlb s LEU 111 CO -0.07 -0.57 1.28 -0.94 0.23 0.00 0.00 176.35 176.28 1rlb s SER 112 N -4.23 -0.08 0.24 2.29 1.04 -1.01 -1.65 113.70 110.30 1rlb s SER 112 Ca 0.48 -0.02 -0.05 0.00 0.48 0.00 0.00 55.95 56.84 1rlb s SER 112 Cb -0.10 0.10 0.38 0.00 0.10 0.00 0.00 66.02 66.51 1rlb s SER 112 CO 0.33 -0.17 1.80 -0.65 0.98 0.00 0.00 173.24 175.53 1rlb h PRO 113 N 2.00 0.72 0.00 4.02 0.11 -1.99 -3.11 132.00 133.75 1rlb h PRO 113 Ca -0.12 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.94 1rlb h PRO 113 Cb 1.16 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.10 1rlb h PRO 113 CO 0.23 0.48 -0.12 0.66 -0.21 0.00 0.00 178.00 179.04 1rlb n TYR 114 N -4.77 0.00 -3.67 0.65 4.02 -1.26 -0.60 117.16 111.53 1rlb n TYR 114 Ca 0.13 -1.00 -0.15 0.00 -0.01 0.00 0.00 57.90 56.87 1rlb n TYR 114 Cb 0.28 -0.16 -0.08 0.00 -0.02 0.00 0.00 39.34 39.36 1rlb n TYR 114 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1rlb s SER 115 N -2.80 -0.42 -0.02 7.72 0.15 -1.18 -4.96 113.70 112.19 1rlb s SER 115 Ca 0.31 0.51 -0.21 0.00 0.70 0.00 0.00 55.95 57.26 1rlb s SER 115 Cb 0.28 0.55 0.04 0.00 -1.71 0.00 0.00 66.02 65.18 1rlb s SER 115 CO 0.01 -0.44 0.45 -0.72 1.20 0.00 0.00 173.24 173.73 1rlb s TYR 116 N -0.93 -0.35 0.07 3.44 1.13 -1.26 -2.40 117.35 117.05 1rlb s TYR 116 Ca -0.10 0.55 0.06 0.00 -1.41 0.00 0.00 57.07 56.17 1rlb s TYR 116 Cb -0.03 0.22 -0.03 0.00 -1.10 0.00 0.00 41.96 41.02 1rlb s TYR 116 CO 0.05 -0.49 -0.16 -1.12 -2.51 0.00 0.00 175.55 171.33 1rlb s SER 117 N -1.36 1.92 0.04 -0.18 0.01 -0.93 -4.97 113.70 108.22 1rlb s SER 117 Ca -0.12 -0.59 0.02 0.00 1.31 0.00 0.00 55.95 56.57 1rlb s SER 117 Cb -0.03 -0.09 -0.02 0.00 0.21 0.00 0.00 66.02 66.08 1rlb s SER 117 CO 0.05 -0.00 -0.07 0.28 0.41 0.00 0.00 173.24 173.91 1rlb s THR 118 N -1.12 0.50 -0.03 1.44 -1.32 -1.26 -1.03 115.64 112.83 1rlb s THR 118 Ca 0.01 -1.03 -0.05 0.00 -1.21 0.00 0.00 61.69 59.42 1rlb s THR 118 Cb -0.09 -0.57 0.01 0.00 -1.51 0.00 0.00 72.50 70.33 1rlb s THR 118 CO 0.02 -0.37 0.11 -0.89 -2.21 0.00 0.00 174.62 171.29 1rlb s THR 119 N -1.32 0.03 0.10 5.08 2.01 -1.03 -5.02 115.64 115.49 1rlb s THR 119 Ca -0.10 -0.22 0.06 0.00 0.31 0.00 0.00 61.69 61.74 1rlb s THR 119 Cb -0.10 -0.24 -0.04 0.00 0.01 0.00 0.00 72.50 72.13 1rlb s THR 119 CO 0.00 -0.12 -0.02 0.00 -0.69 0.00 0.00 174.62 173.79 1rlb s ALA 120 N -0.36 3.22 -0.27 7.40 0.00 -1.26 -0.76 121.76 129.73 1rlb s ALA 120 Ca -0.04 -1.17 -0.02 0.00 0.00 0.00 0.00 51.96 50.72 1rlb s ALA 120 Cb -0.03 -1.11 0.09 0.00 0.00 0.00 0.00 23.12 22.06 1rlb s ALA 120 CO 0.00 0.67 0.09 0.08 0.00 0.00 0.00 175.76 176.60 1rlb s VAL 121 N -1.33 0.46 -0.55 0.00 1.01 -0.39 -4.99 120.40 114.61 1rlb s VAL 121 Ca 0.25 -0.94 -0.12 0.00 0.00 0.00 0.00 61.98 61.18 1rlb s VAL 121 Cb -0.11 -1.25 0.14 0.00 0.00 0.00 0.00 36.38 35.15 1rlb s VAL 121 CO 0.17 -0.55 0.46 -0.69 0.00 0.00 0.00 175.10 174.49 1rlb s VAL 122 N 1.84 4.69 -0.12 2.92 1.01 -1.26 -1.50 120.40 127.99 1rlb s VAL 122 Ca 0.06 -1.86 -0.02 0.00 0.00 0.00 0.00 61.98 60.16 1rlb s VAL 122 Cb -0.17 -4.03 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 1rlb s VAL 122 CO -0.24 -0.85 -0.02 0.42 0.00 0.00 0.00 175.10 174.41 1rlb s THR 123 N 1.19 4.06 0.41 3.92 -4.23 0.96 -4.96 115.64 116.99 1rlb s THR 123 Ca 0.07 -0.32 -0.26 0.00 -1.18 0.00 0.00 61.69 60.00 1rlb s THR 123 Cb -0.25 -2.74 -0.09 0.00 1.34 0.00 0.00 72.50 70.77 1rlb s THR 123 CO -0.01 0.55 1.30 0.21 -0.54 0.00 0.00 174.62 176.14 1rlb s ASN 124 N -0.29 6.27 0.00 3.99 3.84 -1.26 -0.59 114.94 126.90 1rlb s ASN 124 Ca 0.05 2.66 0.00 0.00 0.21 0.00 0.00 52.86 55.78 1rlb s ASN 124 Cb -0.12 -2.64 0.00 0.00 -0.55 0.00 0.00 41.25 37.94 1rlb s ASN 124 CO 0.02 -0.88 0.00 -0.81 -2.79 0.00 0.00 177.10 172.65 1rlb n PRO 125 N 0.08 0.00 -3.11 0.43 -0.04 -1.26 -4.81 135.00 126.30 1rlb n PRO 125 Ca 0.04 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.25 1rlb n PRO 125 Cb 0.44 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.85 1rlb n PRO 125 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1rlb n LYS 126 N 0.00 2.45 -0.65 0.54 5.02 -1.26 -5.05 118.16 119.21 1rlb n LYS 126 Ca 0.00 -4.41 0.00 0.00 -2.02 0.00 0.00 58.31 51.88 1rlb n LYS 126 Cb 0.00 -2.06 0.00 0.00 -0.02 0.00 0.00 35.03 32.95 1rlb n LYS 126 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27