#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rlb n LYS 9 N 0.00 3.72 -3.68 1.43 3.00 -1.26 -4.81 118.16 116.56 1rlb n LYS 9 Ca 0.00 -2.85 -0.28 0.00 -0.00 0.00 0.00 58.31 55.18 1rlb n LYS 9 Cb 0.00 -2.89 -0.16 0.00 0.00 0.00 0.00 35.03 31.97 1rlb n LYS 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1rlb n PRO 11 N 5.11 0.00 -4.40 0.00 -0.02 -1.26 -4.32 135.00 130.10 1rlb n PRO 11 Ca -0.07 0.59 -0.25 0.00 -2.02 0.00 0.00 63.50 61.75 1rlb n PRO 11 Cb 0.47 -1.26 -0.09 0.00 -0.02 0.00 0.00 33.50 32.59 1rlb n PRO 11 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1rlb s LEU 12 N -3.57 2.88 -0.29 2.45 2.96 -1.26 -1.75 118.68 120.09 1rlb s LEU 12 Ca 0.00 -0.99 -0.20 0.00 -0.22 0.00 0.00 54.13 52.72 1rlb s LEU 12 Cb 0.00 -1.28 0.17 0.00 0.50 0.00 0.00 46.19 45.58 1rlb s LEU 12 CO 0.00 -0.14 1.16 -0.32 -1.32 0.00 0.00 176.35 175.73 1rlb s MET 13 N -3.65 0.24 -0.03 1.98 -2.45 -0.66 -4.60 119.30 110.13 1rlb s MET 13 Ca 0.33 0.36 0.03 0.00 -1.25 0.00 0.00 55.69 55.16 1rlb s MET 13 Cb -0.01 0.08 -0.03 0.00 1.25 0.00 0.00 34.83 36.11 1rlb s MET 13 CO 0.18 -0.04 -0.11 0.08 1.05 0.00 0.00 175.02 176.18 1rlb s VAL 14 N 0.78 3.36 0.05 10.11 1.01 -1.25 -0.14 120.40 134.32 1rlb s VAL 14 Ca -0.03 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 61.27 1rlb s VAL 14 Cb -0.04 -2.38 -0.02 0.00 0.00 0.00 0.00 36.38 33.94 1rlb s VAL 14 CO -0.12 0.52 -0.10 -0.75 0.00 0.00 0.00 175.10 174.65 1rlb s LYS 15 N -0.99 0.62 -0.02 2.72 2.20 -0.11 -2.55 119.74 121.62 1rlb s LYS 15 Ca 0.13 -0.79 -0.03 0.00 -0.36 0.00 0.00 55.97 54.93 1rlb s LYS 15 Cb -0.11 -0.48 0.00 0.00 -1.51 0.00 0.00 37.83 35.74 1rlb s LYS 15 CO 0.03 0.10 0.07 0.08 -0.36 0.00 0.00 175.35 175.27 1rlb s VAL 16 N -1.27 0.01 -0.04 4.02 1.01 -1.13 -1.88 120.40 121.12 1rlb s VAL 16 Ca -0.07 -0.10 -0.05 0.00 0.00 0.00 0.00 61.98 61.76 1rlb s VAL 16 Cb -0.10 -0.14 0.01 0.00 0.00 0.00 0.00 36.38 36.16 1rlb s VAL 16 CO 0.01 -0.06 0.13 -0.76 0.00 0.00 0.00 175.10 174.42 1rlb s LEU 17 N -0.14 1.53 -0.59 3.92 1.43 -0.96 -3.26 118.68 120.60 1rlb s LEU 17 Ca -0.02 0.18 -0.20 0.00 -1.03 0.00 0.00 54.13 53.06 1rlb s LEU 17 Cb -0.02 0.47 0.08 0.00 0.03 0.00 0.00 46.19 46.75 1rlb s LEU 17 CO 0.00 -0.09 0.79 -0.62 0.23 0.00 0.00 176.35 176.65 1rlb s ASP 18 N -0.16 6.20 0.43 2.29 -1.08 0.11 -1.03 116.67 123.43 1rlb s ASP 18 Ca -0.02 -1.10 0.11 0.00 -0.52 0.00 0.00 52.55 51.01 1rlb s ASP 18 Cb -0.02 -2.35 0.95 0.00 -1.46 0.00 0.00 42.92 40.05 1rlb s ASP 18 CO 0.00 -1.18 2.03 0.00 0.52 0.00 0.00 175.17 176.55 1rlb h ALA 19 N 9.27 1.72 -0.02 3.66 0.00 -1.25 0.24 119.26 132.88 1rlb h ALA 19 Ca -0.29 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 1rlb h ALA 19 Cb 1.08 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1rlb h ALA 19 CO 1.10 0.22 -0.07 0.28 0.00 0.00 0.00 179.25 180.78 1rlb h VAL 20 N 0.25 1.48 -0.50 0.00 2.07 -1.90 -3.28 116.25 114.37 1rlb h VAL 20 Ca 0.06 -1.52 0.00 0.00 0.82 0.00 0.00 66.70 66.06 1rlb h VAL 20 Cb 0.13 2.44 0.00 0.00 -1.52 0.00 0.00 31.29 32.34 1rlb h VAL 20 CO -0.00 0.41 0.00 0.54 0.02 0.00 0.00 177.57 178.54 1rlb n ARG 21 N -4.70 2.19 -4.15 1.57 1.74 -1.20 -4.95 116.66 107.15 1rlb n ARG 21 Ca -0.09 -1.80 -0.30 0.00 -0.77 0.00 0.00 57.85 54.89 1rlb n ARG 21 Cb 0.35 -1.40 -0.05 0.00 -1.02 0.00 0.00 32.46 30.34 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 1.28 -0.22 3.40 -0.13 0.00 0.05 -4.95 105.19 104.61 1rlb n GLY 22 Ca 0.17 0.15 -0.10 0.00 0.00 0.00 0.00 46.02 46.24 1rlb n GLY 22 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1rlb s SER 23 N -4.18 -0.12 0.49 1.61 0.15 -1.09 -5.01 113.70 105.55 1rlb s SER 23 Ca 0.14 -0.60 -0.21 0.00 0.70 0.00 0.00 55.95 55.98 1rlb s SER 23 Cb -0.08 0.49 -0.10 0.00 -1.71 0.00 0.00 66.02 64.62 1rlb s SER 23 CO 0.94 -0.94 0.64 -0.81 1.20 0.00 0.00 173.24 174.27 1rlb n PRO 24 N -0.26 0.70 -2.58 5.44 -0.04 -1.26 0.05 135.00 137.05 1rlb n PRO 24 Ca -0.10 0.26 -0.43 0.00 -0.04 0.00 0.00 63.50 63.18 1rlb n PRO 24 Cb 0.63 -1.71 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 1rlb n PRO 24 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1rlb n ALA 25 N -1.17 4.43 -1.77 0.55 0.00 -1.20 -4.47 120.51 116.87 1rlb n ALA 25 Ca 0.11 -4.16 -0.40 0.00 0.00 0.00 0.00 53.44 49.00 1rlb n ALA 25 Cb 0.43 -3.18 0.00 0.00 0.00 0.00 0.00 19.45 16.70 1rlb n ALA 25 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1rlb s ILE 26 N 1.85 2.40 -1.09 0.00 1.01 -1.26 -3.94 121.20 120.16 1rlb s ILE 26 Ca 0.44 0.37 -0.06 0.00 0.00 0.00 0.00 60.65 61.40 1rlb s ILE 26 Cb 0.04 -3.22 0.01 0.00 0.01 0.00 0.00 42.46 39.30 1rlb s ILE 26 CO 0.01 0.06 0.95 0.59 0.00 0.00 0.00 174.94 176.55 1rlb n ASN 27 N 0.11 -4.92 -4.76 3.58 5.03 0.93 -4.93 115.26 110.29 1rlb n ASN 27 Ca 0.04 -0.46 -0.39 0.00 0.87 0.00 0.00 54.58 54.64 1rlb n ASN 27 Cb 0.42 -4.26 -0.06 0.00 -1.02 0.00 0.00 39.78 34.87 1rlb n ASN 27 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1rlb s VAL 28 N -3.27 4.93 -0.98 2.41 1.01 -1.25 -4.70 120.40 118.54 1rlb s VAL 28 Ca 0.39 1.22 -0.20 0.00 0.00 0.00 0.00 61.98 63.39 1rlb s VAL 28 Cb -0.17 -3.92 0.10 0.00 0.00 0.00 0.00 36.38 32.39 1rlb s VAL 28 CO 0.60 0.42 1.26 0.00 0.00 0.00 0.00 175.10 177.38 1rlb s ALA 29 N -0.18 3.15 -0.05 5.51 0.00 -1.26 -2.07 121.76 126.86 1rlb s ALA 29 Ca 0.31 -2.61 -0.24 0.00 0.00 0.00 0.00 51.96 49.41 1rlb s ALA 29 Cb -0.18 -4.23 -0.04 0.00 0.00 0.00 0.00 23.12 18.67 1rlb s ALA 29 CO 0.17 -3.21 0.73 0.08 0.00 0.00 0.00 175.76 173.53 1rlb s VAL 30 N 3.48 5.01 -0.34 0.00 1.01 0.02 -2.39 120.40 127.19 1rlb s VAL 30 Ca 0.38 1.52 0.02 0.00 0.00 0.00 0.00 61.98 63.89 1rlb s VAL 30 Cb -0.03 -4.07 0.10 0.00 0.00 0.00 0.00 36.38 32.38 1rlb s VAL 30 CO -0.09 0.25 0.09 -1.00 0.00 0.00 0.00 175.10 174.35 1rlb s HIS 31 N 0.76 2.76 0.29 5.22 3.76 0.92 -1.37 115.29 127.63 1rlb s HIS 31 Ca 0.39 -2.44 -0.25 0.00 -0.15 0.00 0.00 55.06 52.60 1rlb s HIS 31 Cb -0.18 -2.35 -0.09 0.00 1.11 0.00 0.00 32.58 31.07 1rlb s HIS 31 CO 0.19 -0.90 0.90 0.08 -0.85 0.00 0.00 174.74 174.16 1rlb s VAL 32 N 1.11 4.26 0.03 -0.90 1.01 0.11 -1.51 120.40 124.51 1rlb s VAL 32 Ca 0.11 1.76 0.04 0.00 0.00 0.00 0.00 61.98 63.89 1rlb s VAL 32 Cb -0.19 -4.03 -0.02 0.00 0.00 0.00 0.00 36.38 32.14 1rlb s VAL 32 CO -0.14 0.22 -0.12 -0.36 0.00 0.00 0.00 175.10 174.69 1rlb s PHE 33 N -1.52 1.05 -0.22 5.22 0.40 0.03 -1.10 117.98 121.85 1rlb s PHE 33 Ca 0.47 -0.32 -0.00 0.00 -0.60 0.00 0.00 56.93 56.48 1rlb s PHE 33 Cb -0.19 -0.64 0.06 0.00 0.51 0.00 0.00 43.02 42.76 1rlb s PHE 33 CO 0.24 0.01 -0.03 0.50 0.70 0.00 0.00 175.22 176.64 1rlb s ARG 34 N -0.96 1.37 0.16 0.44 3.52 0.10 -0.78 118.95 122.79 1rlb s ARG 34 Ca 0.01 -0.81 -0.31 0.00 -0.13 0.00 0.00 55.73 54.48 1rlb s ARG 34 Cb -0.07 -2.42 -0.10 0.00 -1.56 0.00 0.00 34.95 30.80 1rlb s ARG 34 CO 0.01 -0.59 1.60 0.21 -0.81 0.00 0.00 175.30 175.71 1rlb s LYS 35 N 1.53 4.20 0.00 5.12 2.20 -1.05 -2.54 119.74 129.20 1rlb s LYS 35 Ca -0.04 2.39 0.00 0.00 -0.36 0.00 0.00 55.97 57.96 1rlb s LYS 35 Cb -0.18 -3.20 0.00 0.00 -1.51 0.00 0.00 37.83 32.93 1rlb s LYS 35 CO -0.07 -0.64 0.00 0.00 -0.36 0.00 0.00 175.35 174.28 1rlb n ALA 36 N 4.18 0.00 0.29 3.13 0.00 -0.19 -4.45 120.51 123.47 1rlb n ALA 36 Ca 0.14 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.76 1rlb n ALA 36 Cb 0.38 0.00 0.92 0.00 0.00 0.00 0.00 19.45 20.76 1rlb n ALA 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rlb h ALA 37 N -1.30 1.00 -0.35 0.00 0.00 -1.93 -3.27 119.26 113.41 1rlb h ALA 37 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.67 1rlb h ALA 37 Cb 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 17.79 17.49 1rlb h ALA 37 CO 0.00 0.00 -0.80 -0.40 0.00 0.00 0.00 179.25 178.05 1rlb n ASP 38 N -2.78 0.31 -2.17 0.00 5.75 -1.26 -4.96 116.55 111.43 1rlb n ASP 38 Ca -0.02 -2.23 -0.20 0.00 -0.01 0.00 0.00 54.79 52.34 1rlb n ASP 38 Cb 0.10 0.01 -0.02 0.00 -1.03 0.00 0.00 41.12 40.18 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 -0.80 -5.64 -4.37 -1.12 9.92 -1.23 -4.95 116.55 108.35 1rlb n ASP 39 Ca -0.01 0.05 -0.35 0.00 -0.53 0.00 0.00 54.79 53.95 1rlb n ASP 39 Cb 0.83 -4.70 -0.14 0.00 -0.64 0.00 0.00 41.12 36.48 1rlb n ASP 39 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1rlb s THR 40 N -2.96 3.53 -1.29 -3.53 2.01 -1.26 -4.93 115.64 107.21 1rlb s THR 40 Ca 0.00 -0.45 -0.17 0.00 0.31 0.00 0.00 61.69 61.38 1rlb s THR 40 Cb 0.00 -2.59 0.09 0.00 0.01 0.00 0.00 72.50 70.02 1rlb s THR 40 CO 0.00 0.44 1.69 0.79 -0.69 0.00 0.00 174.62 176.85 1rlb n TRP 41 N 4.40 4.69 -2.48 4.92 7.02 -1.26 -1.02 117.44 133.71 1rlb n TRP 41 Ca -0.18 -2.95 -0.41 0.00 -1.02 0.00 0.00 57.50 52.93 1rlb n TRP 41 Cb 0.51 -2.54 -0.04 0.00 -2.42 0.00 0.00 31.31 26.83 1rlb n TRP 41 CO 0.00 0.00 0.00 -1.83 -2.02 0.00 0.00 177.69 173.84 1rlb s GLU 42 N 3.60 4.53 -0.38 -0.99 -1.05 -1.05 -4.76 118.70 118.60 1rlb s GLU 42 Ca 0.51 1.74 -0.39 0.00 -0.15 0.00 0.00 54.97 56.68 1rlb s GLU 42 Cb 0.03 -3.30 -0.15 0.00 -0.44 0.00 0.00 34.13 30.27 1rlb s GLU 42 CO 0.06 -0.05 2.08 -2.30 0.95 0.00 0.00 175.26 176.00 1rlb n PRO 43 N 2.90 0.75 0.00 -4.83 -0.02 -1.26 -0.72 135.00 131.82 1rlb n PRO 43 Ca 0.05 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 1rlb n PRO 43 Cb 0.46 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 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 8.17 0.00 -3.72 6.00 7.35 -1.15 -4.79 117.46 129.31 1rlb n PHE 44 Ca 0.42 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 57.01 1rlb n PHE 44 Cb 0.12 0.00 -0.05 0.00 0.35 0.00 0.00 39.48 39.90 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 -4.45 -0.67 -0.05 3.13 0.00 -0.26 -4.94 121.76 114.54 1rlb s ALA 45 Ca 0.00 -0.28 -0.15 0.00 0.00 0.00 0.00 51.96 51.53 1rlb s ALA 45 Cb 0.00 0.65 0.03 0.00 0.00 0.00 0.00 23.12 23.80 1rlb s ALA 45 CO 0.00 -0.61 0.34 0.45 0.00 0.00 0.00 175.76 175.94 1rlb s SER 46 N -2.83 -0.26 0.18 0.00 0.15 -1.26 0.09 113.70 109.76 1rlb s SER 46 Ca 0.05 0.27 -0.24 0.00 0.70 0.00 0.00 55.95 56.73 1rlb s SER 46 Cb 0.03 0.43 0.05 0.00 -1.71 0.00 0.00 66.02 64.82 1rlb s SER 46 CO -0.11 -0.37 0.91 -0.83 1.20 0.00 0.00 173.24 174.04 1rlb s GLY 47 N -0.94 -0.21 -0.14 9.45 0.00 -0.47 -5.02 107.32 110.00 1rlb s GLY 47 Ca -0.10 0.04 0.01 0.00 0.00 0.00 0.00 44.72 44.67 1rlb s GLY 47 CO 0.04 -0.01 -0.15 0.54 0.00 0.00 0.00 173.10 173.51 1rlb s LYS 48 N -3.42 3.27 0.21 2.90 1.02 -1.26 -0.80 119.74 121.66 1rlb s LYS 48 Ca 0.12 -0.74 -0.31 0.00 0.02 0.00 0.00 55.97 55.06 1rlb s LYS 48 Cb -0.02 -2.58 -0.11 0.00 -0.52 0.00 0.00 37.83 34.60 1rlb s LYS 48 CO 0.03 0.13 1.57 0.95 -0.92 0.00 0.00 175.35 177.11 1rlb s THR 49 N 0.54 2.44 1.43 2.17 -4.23 -0.88 -4.72 115.64 112.38 1rlb s THR 49 Ca -0.10 0.33 -0.24 0.00 -1.18 0.00 0.00 61.69 60.51 1rlb s THR 49 Cb -0.16 -3.21 0.37 0.00 1.34 0.00 0.00 72.50 70.83 1rlb s THR 49 CO 0.04 0.04 0.95 -0.94 -0.54 0.00 0.00 174.62 174.16 1rlb s SER 50 N 0.89 -1.07 0.41 3.99 1.04 -1.19 -0.05 113.70 117.72 1rlb s SER 50 Ca 0.68 0.73 0.17 0.00 0.48 0.00 0.00 55.95 58.00 1rlb s SER 50 Cb -0.45 -0.99 1.06 0.00 0.10 0.00 0.00 66.02 65.74 1rlb s SER 50 CO 0.36 -5.35 1.85 -0.33 0.98 0.00 0.00 173.24 170.75 1rlb h GLU 51 N -3.42 0.42 -0.65 4.02 4.39 -1.93 -0.86 114.58 116.54 1rlb h GLU 51 Ca -0.41 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.27 1rlb h GLU 51 Cb 1.33 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 1rlb h GLU 51 CO 0.25 0.28 0.00 -1.13 -1.16 0.00 0.00 179.01 177.25 1rlb n SER 52 N -4.53 4.34 -0.45 1.42 3.41 -1.26 -4.86 113.62 111.68 1rlb n SER 52 Ca 0.20 -2.55 -0.06 0.00 -0.26 0.00 0.00 58.87 56.20 1rlb n SER 52 Cb 0.70 -0.58 -0.03 0.00 -0.26 0.00 0.00 64.21 64.04 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 0.74 0.76 3.27 5.00 0.00 -0.33 -4.92 105.19 109.71 1rlb n GLY 53 Ca 0.21 -0.26 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.06 3.24 0.18 1.61 2.02 -1.26 -2.84 118.70 119.59 1rlb s GLU 54 Ca 0.00 -0.74 -0.26 0.00 0.02 0.00 0.00 54.97 54.00 1rlb s GLU 54 Cb 0.00 -2.66 -0.08 0.00 0.10 0.00 0.00 34.13 31.49 1rlb s GLU 54 CO 0.00 0.01 0.80 -1.17 0.02 0.00 0.00 175.26 174.92 1rlb s LEU 55 N 0.85 4.59 -0.25 1.80 0.20 -1.06 -3.15 118.68 121.65 1rlb s LEU 55 Ca -0.04 1.69 -0.03 0.00 0.69 0.00 0.00 54.13 56.44 1rlb s LEU 55 Cb -0.15 -3.38 0.14 0.00 -0.43 0.00 0.00 46.19 42.37 1rlb s LEU 55 CO -0.00 0.19 0.43 -1.00 -0.29 0.00 0.00 176.35 175.67 1rlb s HIS 56 N -1.18 -1.01 0.00 5.38 3.76 -1.26 -3.85 115.29 117.13 1rlb s HIS 56 Ca 0.37 1.07 0.00 0.00 -0.15 0.00 0.00 55.06 56.35 1rlb s HIS 56 Cb -0.23 0.16 0.00 0.00 1.11 0.00 0.00 32.58 33.62 1rlb s HIS 56 CO 0.27 -0.75 0.00 0.41 -0.85 0.00 0.00 174.74 173.82 1rlb n GLY 57 N 5.38 0.38 0.00 -2.22 0.00 -1.26 -5.05 105.19 102.42 1rlb n GLY 57 Ca -0.03 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 0.00 0.00 -3.63 0.99 4.77 -1.26 -5.03 117.00 112.84 1rlb n LEU 58 Ca 0.00 -0.01 0.04 0.00 -0.03 0.00 0.00 56.01 56.01 1rlb n LEU 58 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1rlb n LEU 58 CO 0.00 0.01 1.20 0.28 -1.33 0.00 0.00 177.39 177.56 1rlb s THR 59 N 0.00 0.00 0.33 -5.08 -1.32 -1.26 -4.75 115.64 103.56 1rlb s THR 59 Ca 0.00 -0.03 0.10 0.00 -1.21 0.00 0.00 61.69 60.55 1rlb s THR 59 Cb 0.00 -2.14 -0.06 0.00 -1.51 0.00 0.00 72.50 68.79 1rlb s THR 59 CO 0.00 0.00 -0.12 0.42 -2.21 0.00 0.00 174.62 172.71 1rlb s THR 60 N -2.06 2.33 0.24 5.08 -4.23 -1.26 -4.69 115.64 111.04 1rlb s THR 60 Ca 0.17 -2.26 -0.07 0.00 -1.18 0.00 0.00 61.69 58.35 1rlb s THR 60 Cb 0.06 -2.55 0.22 0.00 1.34 0.00 0.00 72.50 71.57 1rlb s THR 60 CO -0.06 -0.26 1.90 -0.33 -0.54 0.00 0.00 174.62 175.33 1rlb h GLU 61 N 2.09 1.16 0.00 3.99 5.08 -2.00 0.43 114.58 125.33 1rlb h GLU 61 Ca -0.41 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 57.83 1rlb h GLU 61 Cb 1.25 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 30.23 1rlb h GLU 61 CO 0.67 0.77 -0.20 1.49 -1.00 0.00 0.00 179.01 180.74 1rlb h GLU 62 N 1.20 0.00 -0.00 2.33 4.57 -2.06 -3.02 114.58 117.59 1rlb h GLU 62 Ca 0.34 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.52 1rlb h GLU 62 Cb -0.09 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.50 1rlb h GLU 62 CO -0.09 0.20 -0.29 1.04 -1.18 0.00 0.00 179.01 178.70 1rlb n GLN 63 N -3.54 0.57 -3.50 1.92 3.00 0.12 -4.73 117.38 111.23 1rlb n GLN 63 Ca -0.01 -0.31 -0.42 0.00 -0.01 0.00 0.00 57.00 56.25 1rlb n GLN 63 Cb 0.35 -1.49 -0.09 0.00 0.00 0.00 0.00 30.24 29.01 1rlb n GLN 63 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.06 177.18 1rlb s PHE 64 N -2.64 3.28 0.03 1.08 5.36 0.45 -4.80 117.98 120.75 1rlb s PHE 64 Ca 0.21 -1.14 0.03 0.00 -0.96 0.00 0.00 56.93 55.07 1rlb s PHE 64 Cb 0.19 -2.97 -0.04 0.00 -0.34 0.00 0.00 43.02 39.86 1rlb s PHE 64 CO 0.56 -0.79 0.00 0.14 -1.46 0.00 0.00 175.22 173.67 1rlb s VAL 65 N 1.55 4.11 -0.82 3.12 -7.23 -1.26 -4.92 120.40 114.95 1rlb s VAL 65 Ca 0.03 -0.74 -0.26 0.00 -1.81 0.00 0.00 61.98 59.21 1rlb s VAL 65 Cb -0.23 -2.88 -0.18 0.00 0.56 0.00 0.00 36.38 33.65 1rlb s VAL 65 CO 0.05 0.29 2.52 -0.62 -0.31 0.00 0.00 175.10 177.03 1rlb n GLU 66 N 1.10 0.37 -3.90 4.82 1.02 -1.25 -4.69 120.64 118.11 1rlb n GLU 66 Ca -0.13 -0.07 -0.09 0.00 -0.02 0.00 0.00 57.16 56.85 1rlb n GLU 66 Cb 0.52 -2.23 -0.02 0.00 -0.02 0.00 0.00 31.44 29.69 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 9.06 0.35 -0.62 0.62 0.00 -1.26 -4.97 107.32 110.49 1rlb s GLY 67 Ca 1.20 -0.69 -0.25 0.00 0.00 0.00 0.00 44.72 44.98 1rlb s GLY 67 CO 0.39 -0.37 1.06 -0.42 0.00 0.00 0.00 173.10 173.77 1rlb s ILE 68 N -3.42 4.16 0.49 0.90 1.01 -1.26 -1.05 121.20 122.03 1rlb s ILE 68 Ca 0.17 0.27 -0.03 0.00 0.00 0.00 0.00 60.65 61.06 1rlb s ILE 68 Cb -0.04 -4.69 -0.01 0.00 0.01 0.00 0.00 42.46 37.73 1rlb s ILE 68 CO 0.10 -1.40 0.75 -0.31 0.00 0.00 0.00 174.94 174.08 1rlb s TYR 69 N 4.54 3.31 -0.03 3.97 1.51 0.21 -2.52 117.35 128.35 1rlb s TYR 69 Ca 0.32 0.47 0.01 0.00 -1.01 0.00 0.00 57.07 56.86 1rlb s TYR 69 Cb -0.12 -2.41 0.01 0.00 -0.11 0.00 0.00 41.96 39.34 1rlb s TYR 69 CO 0.17 -0.45 -0.04 0.21 -1.11 0.00 0.00 175.55 174.33 1rlb s LYS 70 N -4.70 0.63 -0.13 -0.62 2.20 0.04 -1.72 119.74 115.44 1rlb s LYS 70 Ca 0.49 -0.11 -0.03 0.00 -0.36 0.00 0.00 55.97 55.96 1rlb s LYS 70 Cb -0.10 -0.66 -0.03 0.00 -1.51 0.00 0.00 37.83 35.53 1rlb s LYS 70 CO 0.41 -0.02 -0.03 0.08 -0.36 0.00 0.00 175.35 175.43 1rlb s VAL 71 N 0.59 3.99 -0.22 4.02 1.01 -0.70 -0.79 120.40 128.31 1rlb s VAL 71 Ca -0.07 -0.34 -0.01 0.00 0.00 0.00 0.00 61.98 61.56 1rlb s VAL 71 Cb -0.11 -2.72 0.06 0.00 0.00 0.00 0.00 36.38 33.62 1rlb s VAL 71 CO -0.00 0.53 -0.01 -0.70 0.00 0.00 0.00 175.10 174.92 1rlb s GLU 72 N -0.09 1.14 -0.06 2.72 2.12 -0.57 0.01 118.70 123.97 1rlb s GLU 72 Ca 0.02 -0.74 -0.26 0.00 0.36 0.00 0.00 54.97 54.35 1rlb s GLU 72 Cb -0.13 -2.36 -0.03 0.00 0.26 0.00 0.00 34.13 31.87 1rlb s GLU 72 CO 0.02 -0.64 0.81 0.42 -0.54 0.00 0.00 175.26 175.34 1rlb s ILE 73 N 1.61 4.96 -1.09 -3.70 1.01 0.31 -0.06 121.20 124.25 1rlb s ILE 73 Ca -0.03 1.67 -0.22 0.00 0.00 0.00 0.00 60.65 62.07 1rlb s ILE 73 Cb -0.18 -4.14 0.02 0.00 0.01 0.00 0.00 42.46 38.16 1rlb s ILE 73 CO -0.08 0.18 1.68 -0.62 0.00 0.00 0.00 174.94 176.11 1rlb s ASP 74 N 0.92 6.13 -0.07 3.58 -1.08 -1.01 -1.12 116.67 124.03 1rlb s ASP 74 Ca 0.42 -1.58 -0.23 0.00 -0.52 0.00 0.00 52.55 50.65 1rlb s ASP 74 Cb -0.19 -2.57 -0.18 0.00 -1.46 0.00 0.00 42.92 38.52 1rlb s ASP 74 CO 0.20 -1.87 0.89 0.71 0.52 0.00 0.00 175.17 175.62 1rlb h THR 75 N 6.50 1.11 -0.40 1.71 1.35 -1.88 -3.33 112.91 117.97 1rlb h THR 75 Ca 0.25 -1.38 0.08 0.00 -0.55 0.00 0.00 66.41 64.81 1rlb h THR 75 Cb 0.96 1.91 -0.09 0.00 -1.73 0.00 0.00 68.15 69.21 1rlb h THR 75 CO 1.37 0.31 -0.23 0.50 -0.25 0.00 0.00 175.52 177.21 1rlb h LYS 76 N -0.82 -0.16 -0.15 4.72 3.64 -1.65 0.18 116.57 122.34 1rlb h LYS 76 Ca -0.01 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.42 1rlb h LYS 76 Cb 0.59 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.44 1rlb h LYS 76 CO 0.02 -0.10 0.24 0.77 -2.27 0.00 0.00 179.45 178.10 1rlb h SER 77 N -0.16 0.00 -0.12 4.20 0.02 -1.87 0.18 113.55 115.79 1rlb h SER 77 Ca 0.19 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.12 1rlb h SER 77 Cb 0.47 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.00 1rlb h SER 77 CO -0.50 0.00 0.00 0.22 -1.14 0.00 0.00 176.83 175.41 1rlb h TYR 78 N 0.00 0.23 0.12 3.45 3.20 -0.75 -2.94 116.97 120.29 1rlb h TYR 78 Ca 0.07 -0.04 -0.30 0.00 3.14 0.00 0.00 58.73 61.60 1rlb h TYR 78 Cb 0.54 -0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.75 1rlb h TYR 78 CO 0.00 0.44 -1.49 -1.49 -1.64 0.00 0.00 178.16 173.99 1rlb h TRP 79 N -0.05 0.47 -0.45 -3.82 4.06 -0.48 -3.23 115.95 112.45 1rlb h TRP 79 Ca 0.03 -0.35 0.08 0.00 2.06 0.00 0.00 58.89 60.72 1rlb h TRP 79 Cb 0.35 -0.02 -0.07 0.00 -1.00 0.00 0.00 29.16 28.43 1rlb h TRP 79 CO 0.03 1.37 0.07 0.87 -3.56 0.00 0.00 178.44 177.22 1rlb h LYS 80 N 0.07 0.19 -3.23 0.49 1.57 -1.05 -1.47 116.57 113.15 1rlb h LYS 80 Ca -0.23 -0.01 -0.71 0.00 -1.87 0.00 0.00 60.65 57.83 1rlb h LYS 80 Cb 2.01 -0.04 -0.06 0.00 0.08 0.00 0.00 32.23 34.22 1rlb h LYS 80 CO 0.17 0.13 3.02 0.00 -0.57 0.00 0.00 179.45 182.19 1rlb n ALA 81 N -2.52 6.53 -0.09 3.86 0.00 -1.11 -0.53 120.51 126.65 1rlb n ALA 81 Ca 0.04 -3.89 0.00 0.00 0.00 0.00 0.00 53.44 49.59 1rlb n ALA 81 Cb 0.22 -3.20 0.00 0.00 0.00 0.00 0.00 19.45 16.48 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 3.77 0.00 0.00 0.00 7.94 -0.99 -4.93 117.00 122.79 1rlb n LEU 82 Ca 0.62 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.52 1rlb n LEU 82 Cb 0.30 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.25 1rlb n LEU 82 CO 0.82 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.71 1rlb n GLY 83 N 0.00 0.66 3.25 -3.96 0.00 0.31 -5.06 105.19 100.39 1rlb n GLY 83 Ca 0.00 -0.74 -0.30 0.00 0.00 0.00 0.00 46.02 44.98 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 1.90 -0.73 -0.61 1.01 -1.05 -5.02 121.20 114.70 1rlb s ILE 84 Ca 0.00 -1.00 -0.24 0.00 0.00 0.00 0.00 60.65 59.41 1rlb s ILE 84 Cb 0.00 -1.59 0.06 0.00 0.01 0.00 0.00 42.46 40.94 1rlb s ILE 84 CO 0.00 0.53 1.12 -0.44 0.00 0.00 0.00 174.94 176.15 1rlb s SER 85 N -0.33 6.21 1.04 3.58 0.01 -1.26 -3.71 113.70 119.24 1rlb s SER 85 Ca 0.02 -0.89 -0.03 0.00 1.31 0.00 0.00 55.95 56.36 1rlb s SER 85 Cb -0.11 -2.48 0.05 0.00 0.21 0.00 0.00 66.02 63.69 1rlb s SER 85 CO 0.01 -1.57 0.18 -0.81 0.41 0.00 0.00 173.24 171.47 1rlb n PRO 86 N 8.30 -1.26 -0.07 12.44 -0.04 -1.26 -5.00 135.00 148.12 1rlb n PRO 86 Ca 0.02 -0.29 -0.11 0.00 -0.04 0.00 0.00 63.50 63.09 1rlb n PRO 86 Cb 0.47 -0.26 -0.07 0.00 -0.04 0.00 0.00 33.50 33.60 1rlb n PRO 86 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1rlb n PHE 87 N -2.84 0.00 -3.11 0.54 7.35 -0.81 -4.96 117.46 113.63 1rlb n PHE 87 Ca 0.02 0.00 -0.39 0.00 -0.76 0.00 0.00 57.45 56.32 1rlb n PHE 87 Cb 0.10 -0.56 -0.06 0.00 0.35 0.00 0.00 39.48 39.31 1rlb n PHE 87 CO 0.00 0.00 0.00 -1.01 -0.76 0.00 0.00 176.76 174.99 1rlb s HIS 88 N -2.29 3.80 0.40 -5.13 3.76 -1.26 -4.89 115.29 109.68 1rlb s HIS 88 Ca -0.20 1.40 0.08 0.00 -0.15 0.00 0.00 55.06 56.19 1rlb s HIS 88 Cb 0.05 -2.67 0.84 0.00 1.11 0.00 0.00 32.58 31.92 1rlb s HIS 88 CO 0.33 0.45 2.00 0.93 -0.85 0.00 0.00 174.74 177.60 1rlb h GLU 89 N 4.95 0.40 0.00 1.40 4.39 -1.98 -3.31 114.58 120.43 1rlb h GLU 89 Ca -0.47 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.18 1rlb h GLU 89 Cb 1.21 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.78 1rlb h GLU 89 CO 0.67 0.36 0.00 -2.39 -1.16 0.00 0.00 179.01 176.49 1rlb n HIS 90 N -4.40 0.00 -4.59 4.33 1.44 -1.26 -3.75 115.22 107.00 1rlb n HIS 90 Ca 0.01 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.39 1rlb n HIS 90 Cb 0.15 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.15 1rlb n HIS 90 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1rlb s ALA 91 N -2.00 2.97 0.06 1.59 0.00 -0.28 -4.81 121.76 119.29 1rlb s ALA 91 Ca 0.00 -0.94 0.08 0.00 0.00 0.00 0.00 51.96 51.10 1rlb s ALA 91 Cb 0.00 -1.18 -0.03 0.00 0.00 0.00 0.00 23.12 21.91 1rlb s ALA 91 CO 0.00 0.59 -0.23 -1.21 0.00 0.00 0.00 175.76 174.90 1rlb s GLU 92 N -1.02 1.48 -0.34 0.00 2.02 -1.26 0.11 118.70 119.70 1rlb s GLU 92 Ca 0.14 -1.07 0.02 0.00 0.02 0.00 0.00 54.97 54.08 1rlb s GLU 92 Cb -0.11 -1.68 0.10 0.00 0.10 0.00 0.00 34.13 32.54 1rlb s GLU 92 CO 0.03 0.42 0.08 0.08 0.02 0.00 0.00 175.26 175.90 1rlb s VAL 93 N -0.88 1.70 -0.32 2.63 1.01 0.10 -4.97 120.40 119.68 1rlb s VAL 93 Ca 0.09 -2.02 -0.12 0.00 0.00 0.00 0.00 61.98 59.94 1rlb s VAL 93 Cb -0.09 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 33.99 1rlb s VAL 93 CO 0.03 -0.65 0.21 0.68 0.00 0.00 0.00 175.10 175.37 1rlb s VAL 94 N 1.12 5.22 0.02 2.92 -7.23 -1.26 -1.72 120.40 119.47 1rlb s VAL 94 Ca 0.11 -0.10 0.01 0.00 -1.81 0.00 0.00 61.98 60.19 1rlb s VAL 94 Cb -0.19 -3.61 -0.02 0.00 0.56 0.00 0.00 36.38 33.13 1rlb s VAL 94 CO -0.14 0.09 -0.03 0.72 -0.31 0.00 0.00 175.10 175.43 1rlb s PHE 95 N 1.73 0.30 0.28 2.82 -0.71 -0.70 -4.99 117.98 116.70 1rlb s PHE 95 Ca 0.06 -0.38 -0.23 0.00 -1.04 0.00 0.00 56.93 55.35 1rlb s PHE 95 Cb -0.17 -0.20 -0.09 0.00 -1.21 0.00 0.00 43.02 41.35 1rlb s PHE 95 CO 0.10 -0.11 0.84 0.99 -1.34 0.00 0.00 175.22 175.70 1rlb s THR 96 N -1.03 4.39 0.00 -4.49 2.01 -1.26 0.68 115.64 115.94 1rlb s THR 96 Ca -0.10 1.55 0.00 0.00 0.31 0.00 0.00 61.69 63.45 1rlb s THR 96 Cb -0.07 -3.92 0.00 0.00 0.01 0.00 0.00 72.50 68.52 1rlb s THR 96 CO -0.00 0.15 0.00 0.00 -0.69 0.00 0.00 174.62 174.07 1rlb n ALA 97 N 0.57 0.00 -0.57 7.40 0.00 -0.21 -4.89 120.51 122.80 1rlb n ALA 97 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1rlb n ALA 97 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 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 -0.42 -0.08 0.00 3.02 -1.26 -4.50 115.26 112.02 1rlb n ASN 98 Ca 0.00 -0.36 -0.15 0.00 -0.03 0.00 0.00 54.58 54.04 1rlb n ASN 98 Cb 0.00 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.03 1rlb n ASN 98 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1rlb n ASP 99 N 2.23 1.20 -1.35 6.41 8.00 -1.26 -3.90 116.55 127.89 1rlb n ASP 99 Ca 0.00 0.06 0.01 0.00 0.71 0.00 0.00 54.79 55.57 1rlb n ASP 99 Cb 0.11 0.01 0.27 0.00 -0.02 0.00 0.00 41.12 41.48 1rlb n ASP 99 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1rlb n SER 100 N -3.10 3.98 0.00 -2.24 3.41 -1.26 -4.98 113.62 109.43 1rlb n SER 100 Ca -0.34 -3.24 0.00 0.00 -0.26 0.00 0.00 58.87 55.02 1rlb n SER 100 Cb 1.06 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 64.38 1rlb n SER 100 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rlb n GLY 101 N -0.48 2.61 3.33 5.00 0.00 -1.26 -4.93 105.19 109.45 1rlb n GLY 101 Ca 0.31 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.93 1rlb n GLY 101 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rlb n PRO 102 N -1.52 0.97 0.02 1.61 -0.04 -1.26 -4.81 135.00 129.97 1rlb n PRO 102 Ca 0.00 -1.69 0.02 0.00 -0.04 0.00 0.00 63.50 61.79 1rlb n PRO 102 Cb 0.00 -3.00 0.09 0.00 -0.04 0.00 0.00 33.50 30.54 1rlb n PRO 102 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1rlb n ARG 103 N 7.57 0.02 -3.29 0.54 1.74 -1.26 -4.56 116.66 117.42 1rlb n ARG 103 Ca 0.47 0.52 -0.39 0.00 -0.77 0.00 0.00 57.85 57.68 1rlb n ARG 103 Cb 0.42 -1.57 -0.07 0.00 -1.02 0.00 0.00 32.46 30.22 1rlb n ARG 103 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1rlb s ARG 104 N -3.07 4.16 -0.07 5.56 3.52 -0.71 -4.48 118.95 123.87 1rlb s ARG 104 Ca -0.00 0.33 0.02 0.00 -0.13 0.00 0.00 55.73 55.94 1rlb s ARG 104 Cb 0.01 -3.57 0.02 0.00 -1.56 0.00 0.00 34.95 29.85 1rlb s ARG 104 CO 0.03 -0.15 -0.11 0.71 -0.81 0.00 0.00 175.30 174.97 1rlb s TYR 105 N 1.64 1.46 -0.07 5.12 1.51 -0.72 -0.89 117.35 125.39 1rlb s TYR 105 Ca 0.22 -0.57 0.02 0.00 -1.01 0.00 0.00 57.07 55.73 1rlb s TYR 105 Cb -0.15 -1.09 0.02 0.00 -0.11 0.00 0.00 41.96 40.62 1rlb s TYR 105 CO 0.09 -0.31 -0.12 0.99 -1.11 0.00 0.00 175.55 175.09 1rlb s THR 106 N 0.83 1.12 -0.14 -0.71 2.01 -1.04 -1.66 115.64 116.05 1rlb s THR 106 Ca -0.12 -0.45 -0.02 0.00 0.31 0.00 0.00 61.69 61.42 1rlb s THR 106 Cb -0.15 -1.05 -0.02 0.00 0.01 0.00 0.00 72.50 71.29 1rlb s THR 106 CO 0.02 0.36 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.59 1rlb s ILE 107 N 0.83 3.41 -0.07 1.82 -1.09 0.81 -1.03 121.20 125.87 1rlb s ILE 107 Ca -0.11 -0.53 0.02 0.00 -2.23 0.00 0.00 60.65 57.79 1rlb s ILE 107 Cb -0.15 -2.46 0.02 0.00 -1.58 0.00 0.00 42.46 38.28 1rlb s ILE 107 CO 0.02 0.51 -0.11 0.00 -1.23 0.00 0.00 174.94 174.12 1rlb s ALA 108 N 0.38 1.27 0.27 9.38 0.00 -0.54 -0.93 121.76 131.59 1rlb s ALA 108 Ca -0.08 -0.44 0.11 0.00 0.00 0.00 0.00 51.96 51.55 1rlb s ALA 108 Cb -0.15 -0.63 -0.05 0.00 0.00 0.00 0.00 23.12 22.29 1rlb s ALA 108 CO 0.04 0.01 -0.10 0.00 0.00 0.00 0.00 175.76 175.72 1rlb s ALA 109 N 0.86 2.97 -0.15 0.00 0.00 -0.79 -0.79 121.76 123.86 1rlb s ALA 109 Ca -0.11 -1.76 -0.04 0.00 0.00 0.00 0.00 51.96 50.05 1rlb s ALA 109 Cb -0.15 -0.53 0.06 0.00 0.00 0.00 0.00 23.12 22.50 1rlb s ALA 109 CO 0.01 0.27 0.10 -1.17 0.00 0.00 0.00 175.76 174.98 1rlb s LEU 110 N -3.60 0.25 -0.04 0.00 2.96 0.26 -2.28 118.68 116.24 1rlb s LEU 110 Ca 0.31 -0.44 -0.08 0.00 -0.22 0.00 0.00 54.13 53.70 1rlb s LEU 110 Cb -0.06 -0.15 -0.05 0.00 0.50 0.00 0.00 46.19 46.44 1rlb s LEU 110 CO 0.18 -0.33 0.24 -0.76 -1.32 0.00 0.00 176.35 174.36 1rlb s LEU 111 N 2.17 4.40 -0.01 -0.68 1.43 -0.20 -2.21 118.68 123.58 1rlb s LEU 111 Ca 0.03 0.59 -0.24 0.00 -1.03 0.00 0.00 54.13 53.48 1rlb s LEU 111 Cb -0.15 -2.43 0.05 0.00 0.03 0.00 0.00 46.19 43.69 1rlb s LEU 111 CO -0.08 0.33 0.53 -0.44 0.23 0.00 0.00 176.35 176.92 1rlb s SER 112 N -1.34 -0.47 0.06 2.29 0.01 -0.93 -0.84 113.70 112.48 1rlb s SER 112 Ca 0.22 0.37 -0.12 0.00 1.31 0.00 0.00 55.95 57.73 1rlb s SER 112 Cb -0.13 0.47 -0.03 0.00 0.21 0.00 0.00 66.02 66.54 1rlb s SER 112 CO 0.11 -0.61 0.88 -2.65 0.41 0.00 0.00 173.24 171.38 1rlb n PRO 113 N 0.82 -0.18 -0.41 12.44 -0.02 -1.26 -2.73 135.00 143.66 1rlb n PRO 113 Ca -0.19 0.87 0.08 0.00 -2.02 0.00 0.00 63.50 62.23 1rlb n PRO 113 Cb 0.58 -1.28 0.27 0.00 -0.02 0.00 0.00 33.50 33.05 1rlb n PRO 113 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1rlb n TYR 114 N -3.98 1.00 -3.87 6.00 4.02 -1.26 -1.92 117.16 117.14 1rlb n TYR 114 Ca 0.01 -0.61 -0.10 0.00 -0.01 0.00 0.00 57.90 57.19 1rlb n TYR 114 Cb 0.10 -0.16 -0.08 0.00 -0.02 0.00 0.00 39.34 39.18 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 -1.15 0.09 -0.06 7.72 0.15 -1.10 -4.93 113.70 114.42 1rlb s SER 115 Ca 0.40 -0.49 -0.29 0.00 0.70 0.00 0.00 55.95 56.26 1rlb s SER 115 Cb 0.26 0.29 0.10 0.00 -1.71 0.00 0.00 66.02 64.96 1rlb s SER 115 CO 0.20 -0.60 0.83 -0.72 1.20 0.00 0.00 173.24 174.15 1rlb s TYR 116 N -2.99 -0.48 0.06 3.44 -0.85 -1.26 -2.19 117.35 113.08 1rlb s TYR 116 Ca -0.02 0.70 0.01 0.00 -0.52 0.00 0.00 57.07 57.24 1rlb s TYR 116 Cb 0.01 0.46 -0.03 0.00 0.38 0.00 0.00 41.96 42.78 1rlb s TYR 116 CO -0.06 -0.52 -0.06 -1.12 -1.52 0.00 0.00 175.55 172.27 1rlb s SER 117 N -1.54 0.79 -0.13 -0.18 0.01 -0.94 -4.95 113.70 106.75 1rlb s SER 117 Ca -0.03 -0.82 -0.09 0.00 1.31 0.00 0.00 55.95 56.31 1rlb s SER 117 Cb -0.00 0.11 0.04 0.00 0.21 0.00 0.00 66.02 66.37 1rlb s SER 117 CO 0.01 -0.41 0.33 0.28 0.41 0.00 0.00 173.24 173.86 1rlb s THR 118 N -2.84 -0.02 0.07 1.44 -1.32 -1.26 -0.57 115.64 111.15 1rlb s THR 118 Ca 0.01 0.06 0.07 0.00 -1.21 0.00 0.00 61.69 60.63 1rlb s THR 118 Cb 0.00 -0.48 -0.03 0.00 -1.51 0.00 0.00 72.50 70.48 1rlb s THR 118 CO -0.04 0.03 -0.19 0.28 -2.21 0.00 0.00 174.62 172.48 1rlb s THR 119 N 0.77 1.54 0.06 5.08 -1.32 0.03 -4.98 115.64 116.82 1rlb s THR 119 Ca -0.05 -1.33 0.01 0.00 -1.21 0.00 0.00 61.69 59.11 1rlb s THR 119 Cb -0.06 -1.39 -0.04 0.00 -1.51 0.00 0.00 72.50 69.50 1rlb s THR 119 CO -0.05 0.01 0.16 0.00 -2.21 0.00 0.00 174.62 172.53 1rlb s ALA 120 N -1.02 3.86 -0.36 11.08 0.00 -1.26 -1.46 121.76 132.59 1rlb s ALA 120 Ca 0.05 -0.89 0.01 0.00 0.00 0.00 0.00 51.96 51.12 1rlb s ALA 120 Cb -0.09 -1.70 0.14 0.00 0.00 0.00 0.00 23.12 21.47 1rlb s ALA 120 CO 0.03 0.80 0.23 0.08 0.00 0.00 0.00 175.76 176.89 1rlb s VAL 121 N -1.45 0.16 -0.48 0.00 1.01 -0.20 -4.99 120.40 114.45 1rlb s VAL 121 Ca 0.33 -1.83 -0.24 0.00 0.00 0.00 0.00 61.98 60.24 1rlb s VAL 121 Cb -0.13 -1.13 0.03 0.00 0.00 0.00 0.00 36.38 35.15 1rlb s VAL 121 CO 0.25 -1.02 0.85 -0.69 0.00 0.00 0.00 175.10 174.49 1rlb s VAL 122 N 0.94 4.55 -0.07 2.92 1.01 -1.26 -2.48 120.40 126.01 1rlb s VAL 122 Ca 0.20 0.46 0.04 0.00 0.00 0.00 0.00 61.98 62.69 1rlb s VAL 122 Cb -0.19 -4.40 -0.00 0.00 0.00 0.00 0.00 36.38 31.79 1rlb s VAL 122 CO -0.02 -0.83 -0.20 0.42 0.00 0.00 0.00 175.10 174.46 1rlb s THR 123 N 3.54 1.72 0.25 3.92 -4.23 -0.07 -5.03 115.64 115.74 1rlb s THR 123 Ca 0.32 -0.85 -0.30 0.00 -1.18 0.00 0.00 61.69 59.68 1rlb s THR 123 Cb -0.12 -1.49 -0.09 0.00 1.34 0.00 0.00 72.50 72.15 1rlb s THR 123 CO 0.23 0.49 1.19 0.21 -0.54 0.00 0.00 174.62 176.19 1rlb s ASN 124 N 0.19 7.08 0.00 3.99 3.84 -1.26 -1.73 114.94 127.05 1rlb s ASN 124 Ca -0.10 2.34 0.00 0.00 0.21 0.00 0.00 52.86 55.31 1rlb s ASN 124 Cb -0.15 -2.62 0.00 0.00 -0.55 0.00 0.00 41.25 37.93 1rlb s ASN 124 CO 0.05 -0.33 0.00 -2.65 -2.79 0.00 0.00 177.10 171.38 1rlb n PRO 125 N 1.75 0.00 -2.95 0.43 -0.02 -1.26 -4.71 135.00 128.24 1rlb n PRO 125 Ca 0.02 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.36 1rlb n PRO 125 Cb 0.44 -0.24 0.01 0.00 -0.02 0.00 0.00 33.50 33.69 1rlb n PRO 125 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1rlb n LYS 126 N 0.00 1.04 -0.91 -0.52 5.02 -1.26 -5.10 118.16 116.43 1rlb n LYS 126 Ca 0.00 -3.11 0.00 0.00 -2.02 0.00 0.00 58.31 53.18 1rlb n LYS 126 Cb 0.00 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 33.61 1rlb n LYS 126 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27