#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rlb n GLY 6 N 0.00 2.47 0.00 1.09 0.00 -1.26 -5.06 105.19 102.43 1rlb n GLY 6 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1rlb n GLY 6 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1rlb n GLU 7 N 0.00 0.00 0.07 1.61 2.13 -1.26 -4.85 120.64 118.34 1rlb n GLU 7 Ca 0.00 0.00 0.02 0.00 0.66 0.00 0.00 57.16 57.84 1rlb n GLU 7 Cb 0.00 0.00 0.13 0.00 0.27 0.00 0.00 31.44 31.84 1rlb n GLU 7 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1rlb n SER 8 N 0.00 0.13 -4.56 4.31 7.64 -1.26 -4.71 113.62 115.17 1rlb n SER 8 Ca 0.00 0.37 -0.39 0.00 1.01 0.00 0.00 58.87 59.86 1rlb n SER 8 Cb 0.00 -0.33 -0.03 0.00 -1.01 0.00 0.00 64.21 62.84 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 -2.84 2.65 -0.30 1.43 1.02 -1.26 -4.63 119.74 115.82 1rlb s LYS 9 Ca -0.01 0.85 -0.10 0.00 0.02 0.00 0.00 55.97 56.73 1rlb s LYS 9 Cb 0.01 -4.39 0.18 0.00 -0.52 0.00 0.00 37.83 33.12 1rlb s LYS 9 CO 0.04 -2.69 1.01 0.00 -0.92 0.00 0.00 175.35 172.80 1rlb h PRO 11 N 7.55 -0.35 -6.56 0.00 0.13 -1.82 -3.42 132.00 127.54 1rlb h PRO 11 Ca -0.10 0.02 -0.47 0.00 -0.87 0.00 0.00 66.00 64.58 1rlb h PRO 11 Cb 1.18 0.08 0.01 0.00 0.13 0.00 0.00 31.00 32.40 1rlb h PRO 11 CO -0.08 -0.23 -0.17 -1.17 -0.23 0.00 0.00 178.00 176.12 1rlb s LEU 12 N -6.87 3.95 -0.29 1.56 2.96 -1.26 0.10 118.68 118.83 1rlb s LEU 12 Ca -0.07 0.44 -0.18 0.00 -0.22 0.00 0.00 54.13 54.10 1rlb s LEU 12 Cb 0.02 -3.31 0.18 0.00 0.50 0.00 0.00 46.19 43.59 1rlb s LEU 12 CO 0.24 -0.36 1.19 -0.32 -1.32 0.00 0.00 176.35 175.78 1rlb s MET 13 N -4.36 0.17 0.04 1.98 1.75 -0.91 -4.48 119.30 113.48 1rlb s MET 13 Ca 0.41 0.28 0.08 0.00 -1.25 0.00 0.00 55.69 55.21 1rlb s MET 13 Cb -0.10 0.05 -0.03 0.00 2.84 0.00 0.00 34.83 37.59 1rlb s MET 13 CO 0.37 -0.03 -0.24 0.08 -0.65 0.00 0.00 175.02 174.54 1rlb s VAL 14 N 0.93 1.93 -0.02 10.11 1.01 -1.23 -0.40 120.40 132.72 1rlb s VAL 14 Ca -0.05 -1.28 -0.01 0.00 0.00 0.00 0.00 61.98 60.64 1rlb s VAL 14 Cb -0.03 -1.66 0.01 0.00 0.00 0.00 0.00 36.38 34.71 1rlb s VAL 14 CO -0.12 0.32 0.05 -0.75 0.00 0.00 0.00 175.10 174.60 1rlb s LYS 15 N -1.15 0.02 -0.01 2.72 2.20 -0.37 -0.86 119.74 122.30 1rlb s LYS 15 Ca 0.10 0.12 0.02 0.00 -0.36 0.00 0.00 55.97 55.85 1rlb s LYS 15 Cb -0.09 -0.08 -0.00 0.00 -1.51 0.00 0.00 37.83 36.14 1rlb s LYS 15 CO 0.02 -0.07 -0.06 0.08 -0.36 0.00 0.00 175.35 174.95 1rlb s VAL 16 N 0.45 0.51 0.07 4.02 1.01 -1.20 0.02 120.40 125.27 1rlb s VAL 16 Ca -0.04 -0.27 0.05 0.00 0.00 0.00 0.00 61.98 61.72 1rlb s VAL 16 Cb -0.05 -0.43 -0.03 0.00 0.00 0.00 0.00 36.38 35.87 1rlb s VAL 16 CO -0.01 0.14 -0.14 -0.76 0.00 0.00 0.00 175.10 174.33 1rlb s LEU 17 N -0.14 2.27 -0.54 3.92 1.43 -0.86 -1.56 118.68 123.19 1rlb s LEU 17 Ca 0.02 -0.60 -0.17 0.00 -1.03 0.00 0.00 54.13 52.36 1rlb s LEU 17 Cb -0.03 -0.50 0.11 0.00 0.03 0.00 0.00 46.19 45.80 1rlb s LEU 17 CO -0.00 -0.07 0.55 -0.62 0.23 0.00 0.00 176.35 176.43 1rlb s ASP 18 N -1.67 6.18 0.00 2.29 -1.08 0.46 -1.70 116.67 121.16 1rlb s ASP 18 Ca -0.02 -1.57 0.19 0.00 -0.52 0.00 0.00 52.55 50.63 1rlb s ASP 18 Cb -0.10 -2.24 1.12 0.00 -1.46 0.00 0.00 42.92 40.25 1rlb s ASP 18 CO 0.02 -0.90 1.55 0.00 0.52 0.00 0.00 175.17 176.36 1rlb n ALA 19 N 5.60 2.18 -0.10 3.66 0.00 0.39 -2.79 120.51 129.45 1rlb n ALA 19 Ca -0.12 -0.12 -0.17 0.00 0.00 0.00 0.00 53.44 53.03 1rlb n ALA 19 Cb 0.42 -1.31 -0.13 0.00 0.00 0.00 0.00 19.45 18.42 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 -1.04 1.53 1.14 0.00 0.31 -1.25 -4.65 118.33 114.37 1rlb n VAL 20 Ca 0.14 -0.62 0.13 0.00 -0.01 0.00 0.00 64.34 63.97 1rlb n VAL 20 Cb 0.08 -1.36 0.22 0.00 -0.91 0.00 0.00 33.84 31.86 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 -3.24 2.03 -2.52 5.55 1.74 -1.23 -4.97 116.66 114.02 1rlb n ARG 21 Ca -0.41 -1.56 -0.14 0.00 -0.77 0.00 0.00 57.85 54.96 1rlb n ARG 21 Cb 1.02 -1.47 0.01 0.00 -1.02 0.00 0.00 32.46 31.00 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 1.31 -0.15 3.61 -0.13 0.00 -1.12 -5.02 105.19 103.68 1rlb n GLY 22 Ca 0.15 -0.25 -0.09 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.61 -0.09 -0.05 1.61 1.04 -1.22 -5.00 113.70 107.39 1rlb s SER 23 Ca 0.10 -0.92 -0.39 0.00 0.48 0.00 0.00 55.95 55.23 1rlb s SER 23 Cb -0.05 0.60 -0.19 0.00 0.10 0.00 0.00 66.02 66.48 1rlb s SER 23 CO 0.13 -1.16 1.06 -2.65 0.98 0.00 0.00 173.24 171.60 1rlb n PRO 24 N -0.39 0.00 -2.67 4.02 -0.02 -1.26 -0.40 135.00 134.28 1rlb n PRO 24 Ca -0.02 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.03 1rlb n PRO 24 Cb 0.62 -1.42 -0.01 0.00 -0.02 0.00 0.00 33.50 32.67 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 0.27 3.32 0.55 3.55 0.00 -0.60 -4.68 121.76 124.18 1rlb s ALA 25 Ca 0.88 -2.85 -0.20 0.00 0.00 0.00 0.00 51.96 49.79 1rlb s ALA 25 Cb -1.23 -4.48 -0.05 0.00 0.00 0.00 0.00 23.12 17.36 1rlb s ALA 25 CO 0.56 -3.25 1.18 0.42 0.00 0.00 0.00 175.76 174.67 1rlb s ILE 26 N 3.77 2.89 -1.38 0.00 1.01 -1.26 -4.26 121.20 121.97 1rlb s ILE 26 Ca 0.49 0.57 -0.04 0.00 0.00 0.00 0.00 60.65 61.66 1rlb s ILE 26 Cb 0.01 -3.24 0.03 0.00 0.01 0.00 0.00 42.46 39.27 1rlb s ILE 26 CO 0.01 -0.10 0.78 0.59 0.00 0.00 0.00 174.94 176.22 1rlb n ASN 27 N -1.31 -2.26 -4.80 3.58 5.03 0.37 -4.94 115.26 110.93 1rlb n ASN 27 Ca 0.12 -0.81 -0.38 0.00 0.87 0.00 0.00 54.58 54.38 1rlb n ASN 27 Cb 0.50 -3.99 -0.06 0.00 -1.02 0.00 0.00 39.78 35.21 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 -3.57 5.15 -0.48 2.41 1.01 -1.26 -4.78 120.40 118.88 1rlb s VAL 28 Ca 0.20 0.75 -0.19 0.00 0.00 0.00 0.00 61.98 62.74 1rlb s VAL 28 Cb -0.10 -3.69 0.04 0.00 0.00 0.00 0.00 36.38 32.63 1rlb s VAL 28 CO 0.82 0.50 0.61 0.00 0.00 0.00 0.00 175.10 177.03 1rlb s ALA 29 N -0.44 3.38 -0.30 5.51 0.00 -1.25 -1.48 121.76 127.17 1rlb s ALA 29 Ca 0.22 -1.57 -0.10 0.00 0.00 0.00 0.00 51.96 50.50 1rlb s ALA 29 Cb -0.15 -3.31 -0.03 0.00 0.00 0.00 0.00 23.12 19.63 1rlb s ALA 29 CO 0.10 -1.91 0.17 0.08 0.00 0.00 0.00 175.76 174.20 1rlb s VAL 30 N 2.64 4.92 -0.09 0.00 1.01 0.09 -0.68 120.40 128.29 1rlb s VAL 30 Ca 0.17 -0.14 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 1rlb s VAL 30 Cb -0.18 -3.42 -0.03 0.00 0.00 0.00 0.00 36.38 32.75 1rlb s VAL 30 CO 0.14 0.16 -0.04 -1.00 0.00 0.00 0.00 175.10 174.36 1rlb s HIS 31 N 1.68 3.02 -0.15 5.22 3.76 0.11 0.30 115.29 129.23 1rlb s HIS 31 Ca 0.06 0.01 0.01 0.00 -0.15 0.00 0.00 55.06 54.99 1rlb s HIS 31 Cb -0.16 -1.78 0.00 0.00 1.11 0.00 0.00 32.58 31.75 1rlb s HIS 31 CO 0.08 0.30 -0.18 0.08 -0.85 0.00 0.00 174.74 174.17 1rlb s VAL 32 N -0.61 2.41 0.30 -0.90 1.01 0.27 0.55 120.40 123.44 1rlb s VAL 32 Ca 0.09 -0.86 0.06 0.00 0.00 0.00 0.00 61.98 61.28 1rlb s VAL 32 Cb -0.12 -2.00 -0.02 0.00 0.00 0.00 0.00 36.38 34.24 1rlb s VAL 32 CO 0.02 0.53 0.36 -0.36 0.00 0.00 0.00 175.10 175.65 1rlb s PHE 33 N 0.83 3.14 -0.19 5.22 0.40 0.13 -1.09 117.98 126.44 1rlb s PHE 33 Ca -0.06 -0.17 -0.05 0.00 -0.60 0.00 0.00 56.93 56.05 1rlb s PHE 33 Cb -0.15 -1.75 0.07 0.00 0.51 0.00 0.00 43.02 41.70 1rlb s PHE 33 CO -0.01 0.23 0.14 0.50 0.70 0.00 0.00 175.22 176.77 1rlb s ARG 34 N -4.03 0.11 0.56 0.44 3.52 -0.63 -1.78 118.95 117.14 1rlb s ARG 34 Ca 0.40 0.00 -0.20 0.00 -0.13 0.00 0.00 55.73 55.80 1rlb s ARG 34 Cb -0.08 -1.58 -0.06 0.00 -1.56 0.00 0.00 34.95 31.66 1rlb s ARG 34 CO 0.29 -0.68 1.02 1.17 -0.81 0.00 0.00 175.30 176.29 1rlb n LYS 35 N 5.29 1.10 0.00 5.12 4.81 -1.02 -1.99 118.16 131.47 1rlb n LYS 35 Ca -0.06 0.41 0.00 0.00 -0.87 0.00 0.00 58.31 57.79 1rlb n LYS 35 Cb 0.49 -2.19 0.00 0.00 0.02 0.00 0.00 35.03 33.35 1rlb n LYS 35 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1rlb n ALA 36 N -1.38 0.00 -0.16 3.14 0.00 -0.37 -4.70 120.51 117.04 1rlb n ALA 36 Ca 0.12 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.60 1rlb n ALA 36 Cb 0.45 0.00 0.32 0.00 0.00 0.00 0.00 19.45 20.22 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 0.51 1.60 -0.08 0.00 0.00 -1.94 -3.35 119.26 116.01 1rlb h ALA 37 Ca 0.00 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.73 1rlb h ALA 37 Cb 0.00 -0.24 -0.26 0.00 0.00 0.00 0.00 17.79 17.29 1rlb h ALA 37 CO 0.00 0.33 -0.85 -0.40 0.00 0.00 0.00 179.25 178.33 1rlb n ASP 38 N -4.45 1.50 -1.16 0.00 5.75 -1.26 -4.94 116.55 111.99 1rlb n ASP 38 Ca 0.08 -2.75 -0.04 0.00 -0.01 0.00 0.00 54.79 52.07 1rlb n ASP 38 Cb 0.11 -0.40 0.01 0.00 -1.03 0.00 0.00 41.12 39.82 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 -0.21 -2.52 -4.00 -1.12 8.00 -1.26 -5.05 116.55 110.40 1rlb n ASP 39 Ca 0.13 -0.10 -0.31 0.00 0.71 0.00 0.00 54.79 55.22 1rlb n ASP 39 Cb 0.95 -1.29 -0.15 0.00 -0.02 0.00 0.00 41.12 40.62 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 -3.06 1.84 -0.70 -3.53 2.01 -1.26 -4.98 115.64 105.96 1rlb s THR 40 Ca 0.07 -1.46 -0.26 0.00 0.31 0.00 0.00 61.69 60.35 1rlb s THR 40 Cb -0.03 -2.05 -0.02 0.00 0.01 0.00 0.00 72.50 70.41 1rlb s THR 40 CO 0.13 -0.10 1.83 0.26 -0.69 0.00 0.00 174.62 176.04 1rlb s TRP 41 N 1.24 1.76 0.21 4.92 0.52 -1.26 -1.23 118.94 125.11 1rlb s TRP 41 Ca -0.06 0.64 -0.30 0.00 0.02 0.00 0.00 56.10 56.40 1rlb s TRP 41 Cb -0.19 -4.13 -0.08 0.00 -1.15 0.00 0.00 33.47 27.91 1rlb s TRP 41 CO -0.06 -2.14 1.05 -1.21 0.02 0.00 0.00 176.95 174.60 1rlb s GLU 42 N 6.89 4.68 -0.45 4.98 2.02 -0.84 -4.89 118.70 131.09 1rlb s GLU 42 Ca 0.65 1.66 -0.45 0.00 0.02 0.00 0.00 54.97 56.86 1rlb s GLU 42 Cb -0.10 -3.26 -0.19 0.00 0.10 0.00 0.00 34.13 30.68 1rlb s GLU 42 CO 0.14 0.23 1.74 -2.30 0.02 0.00 0.00 175.26 175.09 1rlb n PRO 43 N 1.90 0.30 0.00 0.39 -0.02 -1.26 -1.60 135.00 134.70 1rlb n PRO 43 Ca 0.01 0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 1rlb n PRO 43 Cb 0.46 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.27 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 5.08 0.00 -4.34 6.00 7.35 -0.63 -4.78 117.46 126.14 1rlb n PHE 44 Ca 0.34 0.00 -0.17 0.00 -0.76 0.00 0.00 57.45 56.86 1rlb n PHE 44 Cb -0.00 0.00 -0.10 0.00 0.35 0.00 0.00 39.48 39.72 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 -4.92 1.85 0.16 3.13 0.00 -0.25 -4.96 121.76 116.78 1rlb s ALA 45 Ca 0.00 -1.88 -0.12 0.00 0.00 0.00 0.00 51.96 49.96 1rlb s ALA 45 Cb 0.00 0.85 0.01 0.00 0.00 0.00 0.00 23.12 23.98 1rlb s ALA 45 CO 0.00 -0.39 0.36 -1.12 0.00 0.00 0.00 175.76 174.61 1rlb s SER 46 N -3.34 -0.07 0.00 0.00 0.01 -1.26 0.96 113.70 110.00 1rlb s SER 46 Ca 0.35 -0.67 0.00 0.00 1.31 0.00 0.00 55.95 56.94 1rlb s SER 46 Cb 0.08 0.47 0.00 0.00 0.21 0.00 0.00 66.02 66.78 1rlb s SER 46 CO 0.13 -0.92 0.00 0.61 0.41 0.00 0.00 173.24 173.47 1rlb n GLY 47 N -0.23 -1.21 3.17 3.44 0.00 0.15 -4.98 105.19 105.52 1rlb n GLY 47 Ca -0.10 -0.86 -0.22 0.00 0.00 0.00 0.00 46.02 44.84 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 -0.56 1.11 0.03 1.61 1.02 -1.25 -0.73 119.74 120.98 1rlb s LYS 48 Ca 0.00 -0.76 -0.28 0.00 0.02 0.00 0.00 55.97 54.95 1rlb s LYS 48 Cb 0.00 -1.14 -0.04 0.00 -0.52 0.00 0.00 37.83 36.12 1rlb s LYS 48 CO 0.00 0.29 0.88 0.95 -0.92 0.00 0.00 175.35 176.55 1rlb s THR 49 N -0.73 4.76 0.28 2.17 -4.23 -0.55 -4.40 115.64 112.94 1rlb s THR 49 Ca 0.04 1.86 -0.05 0.00 -1.18 0.00 0.00 61.69 62.37 1rlb s THR 49 Cb -0.08 -4.23 0.07 0.00 1.34 0.00 0.00 72.50 69.61 1rlb s THR 49 CO 0.01 0.27 0.24 -1.54 -0.54 0.00 0.00 174.62 173.05 1rlb n SER 50 N 3.32 -1.42 0.33 3.99 3.41 -0.10 -0.48 113.62 122.67 1rlb n SER 50 Ca 0.02 -0.58 0.21 0.00 -0.26 0.00 0.00 58.87 58.26 1rlb n SER 50 Cb 0.50 -0.22 1.14 0.00 -0.26 0.00 0.00 64.21 65.37 1rlb n SER 50 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1rlb h GLU 51 N 0.00 0.00 -0.56 4.33 4.39 -1.97 0.31 114.58 121.09 1rlb h GLU 51 Ca -0.09 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.61 1rlb h GLU 51 Cb 0.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 1rlb h GLU 51 CO 0.06 0.00 0.00 -1.13 -1.16 0.00 0.00 179.01 176.78 1rlb n SER 52 N -3.23 4.19 -1.39 1.42 3.41 -1.26 -4.92 113.62 111.84 1rlb n SER 52 Ca -0.03 -2.36 -0.14 0.00 -0.26 0.00 0.00 58.87 56.08 1rlb n SER 52 Cb 0.09 -0.49 -0.03 0.00 -0.26 0.00 0.00 64.21 63.52 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 0.89 0.39 3.60 5.00 0.00 0.11 -4.87 105.19 110.31 1rlb n GLY 53 Ca 0.22 -0.33 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 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 -4.14 3.73 0.28 1.61 2.02 -1.25 -3.22 118.70 117.73 1rlb s GLU 54 Ca 0.00 -0.41 -0.14 0.00 0.02 0.00 0.00 54.97 54.44 1rlb s GLU 54 Cb 0.00 -3.05 -0.08 0.00 0.10 0.00 0.00 34.13 31.09 1rlb s GLU 54 CO 0.00 0.33 0.69 -1.17 0.02 0.00 0.00 175.26 175.13 1rlb s LEU 55 N 0.17 4.13 -0.22 1.80 0.20 -0.03 -0.92 118.68 123.80 1rlb s LEU 55 Ca 0.02 1.22 -0.09 0.00 0.69 0.00 0.00 54.13 55.97 1rlb s LEU 55 Cb -0.13 -3.91 0.09 0.00 -0.43 0.00 0.00 46.19 41.81 1rlb s LEU 55 CO 0.01 -0.14 0.48 -1.00 -0.29 0.00 0.00 176.35 175.42 1rlb s HIS 56 N -1.87 -0.87 0.00 5.38 3.76 -1.26 -3.58 115.29 116.85 1rlb s HIS 56 Ca 0.51 1.67 0.00 0.00 -0.15 0.00 0.00 55.06 57.08 1rlb s HIS 56 Cb -0.11 0.41 0.00 0.00 1.11 0.00 0.00 32.58 33.99 1rlb s HIS 56 CO 0.19 -0.49 0.00 0.41 -0.85 0.00 0.00 174.74 174.00 1rlb n GLY 57 N 5.06 0.80 0.12 -2.22 0.00 -1.26 -4.99 105.19 102.69 1rlb n GLY 57 Ca -0.13 -0.36 0.12 0.00 0.00 0.00 0.00 46.02 45.66 1rlb n GLY 57 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1rlb h LEU 58 N 0.00 0.00 -7.81 0.99 3.38 -1.93 -3.49 115.31 106.45 1rlb h LEU 58 Ca 0.00 -0.05 0.16 0.00 0.09 0.00 0.00 57.88 58.08 1rlb h LEU 58 Cb 0.91 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.61 1rlb h LEU 58 CO 0.00 0.03 0.53 0.28 0.09 0.00 0.00 178.44 179.37 1rlb s THR 59 N -3.16 0.00 0.14 0.22 -1.32 -1.26 -4.77 115.64 105.48 1rlb s THR 59 Ca 0.08 -0.63 0.06 0.00 -1.21 0.00 0.00 61.69 59.99 1rlb s THR 59 Cb 0.11 -2.48 -0.04 0.00 -1.51 0.00 0.00 72.50 68.58 1rlb s THR 59 CO 0.66 0.00 -0.00 0.42 -2.21 0.00 0.00 174.62 173.49 1rlb s THR 60 N -2.66 3.84 0.33 5.08 -4.23 -1.26 -4.61 115.64 112.13 1rlb s THR 60 Ca 0.17 -1.24 0.06 0.00 -1.18 0.00 0.00 61.69 59.51 1rlb s THR 60 Cb -0.02 -2.88 0.31 0.00 1.34 0.00 0.00 72.50 71.24 1rlb s THR 60 CO 0.04 -0.01 1.85 -0.33 -0.54 0.00 0.00 174.62 175.64 1rlb h GLU 61 N 3.02 0.77 0.00 3.99 5.08 -2.01 0.10 114.58 125.54 1rlb h GLU 61 Ca -0.47 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 1rlb h GLU 61 Cb 1.19 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.26 1rlb h GLU 61 CO 0.58 0.51 0.00 -1.91 -1.00 0.00 0.00 179.01 177.19 1rlb n GLU 62 N -4.59 0.04 -0.03 2.33 4.07 -1.26 -2.63 120.64 118.56 1rlb n GLU 62 Ca 0.18 0.07 0.05 0.00 -0.06 0.00 0.00 57.16 57.41 1rlb n GLU 62 Cb 0.44 -1.55 -0.16 0.00 -0.06 0.00 0.00 31.44 30.10 1rlb n GLU 62 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 1rlb n GLN 63 N -1.62 0.67 -2.60 5.31 3.00 -0.44 -4.79 117.38 116.91 1rlb n GLN 63 Ca 0.06 -0.15 -0.41 0.00 -0.01 0.00 0.00 57.00 56.49 1rlb n GLN 63 Cb 0.33 -1.51 -0.03 0.00 0.00 0.00 0.00 30.24 29.02 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 -3.22 2.46 0.18 1.08 5.36 0.23 -4.93 117.98 119.13 1rlb s PHE 64 Ca -0.08 -0.48 0.04 0.00 -0.96 0.00 0.00 56.93 55.45 1rlb s PHE 64 Cb 0.12 -4.61 -0.03 0.00 -0.34 0.00 0.00 43.02 38.15 1rlb s PHE 64 CO 0.88 -1.96 0.28 0.14 -1.46 0.00 0.00 175.22 173.10 1rlb s VAL 65 N 5.14 5.15 0.15 3.12 -7.23 -1.26 -4.91 120.40 120.56 1rlb s VAL 65 Ca 0.38 -0.85 -0.31 0.00 -1.81 0.00 0.00 61.98 59.39 1rlb s VAL 65 Cb -0.05 -3.69 -0.10 0.00 0.56 0.00 0.00 36.38 33.09 1rlb s VAL 65 CO 0.03 -0.16 1.65 -1.61 -0.31 0.00 0.00 175.10 174.70 1rlb s GLU 66 N -3.43 4.18 0.00 4.82 2.02 -1.26 -4.66 118.70 120.37 1rlb s GLU 66 Ca 0.34 2.44 0.00 0.00 0.02 0.00 0.00 54.97 57.77 1rlb s GLU 66 Cb -0.10 -3.26 0.00 0.00 0.10 0.00 0.00 34.13 30.86 1rlb s GLU 66 CO 0.28 -0.69 0.00 0.41 0.02 0.00 0.00 175.26 175.28 1rlb n GLY 67 N 3.90 -0.69 3.73 -1.39 0.00 -1.26 -5.00 105.19 104.49 1rlb n GLY 67 Ca 0.15 -1.23 -0.41 0.00 0.00 0.00 0.00 46.02 44.52 1rlb n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rlb s ILE 68 N -2.00 3.42 0.51 -0.61 1.01 -1.26 0.32 121.20 122.59 1rlb s ILE 68 Ca 0.00 1.13 0.01 0.00 0.00 0.00 0.00 60.65 61.79 1rlb s ILE 68 Cb 0.00 -3.72 -0.01 0.00 0.01 0.00 0.00 42.46 38.74 1rlb s ILE 68 CO 0.00 0.15 0.01 -0.31 0.00 0.00 0.00 174.94 174.80 1rlb s TYR 69 N 0.31 1.84 -0.19 3.97 1.51 -0.05 -2.44 117.35 122.30 1rlb s TYR 69 Ca 0.57 -0.96 -0.05 0.00 -1.01 0.00 0.00 57.07 55.62 1rlb s TYR 69 Cb -0.35 -1.62 0.10 0.00 -0.11 0.00 0.00 41.96 39.98 1rlb s TYR 69 CO 0.36 0.20 0.33 0.21 -1.11 0.00 0.00 175.55 175.54 1rlb s LYS 70 N -3.89 0.26 -0.16 -0.62 2.20 -0.73 -0.25 119.74 116.54 1rlb s LYS 70 Ca 0.06 0.68 -0.09 0.00 -0.36 0.00 0.00 55.97 56.25 1rlb s LYS 70 Cb 0.01 -0.25 -0.05 0.00 -1.51 0.00 0.00 37.83 36.04 1rlb s LYS 70 CO 0.03 -0.44 0.16 0.08 -0.36 0.00 0.00 175.35 174.82 1rlb s VAL 71 N 2.49 5.43 -0.25 4.02 1.01 -0.65 0.23 120.40 132.68 1rlb s VAL 71 Ca 0.05 0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.29 1rlb s VAL 71 Cb -0.14 -3.46 0.06 0.00 0.00 0.00 0.00 36.38 32.85 1rlb s VAL 71 CO -0.12 0.52 -0.06 -0.70 0.00 0.00 0.00 175.10 174.73 1rlb s GLU 72 N -0.27 1.78 -0.33 2.72 2.12 0.19 0.30 118.70 125.21 1rlb s GLU 72 Ca 0.12 -1.13 -0.20 0.00 0.36 0.00 0.00 54.97 54.12 1rlb s GLU 72 Cb -0.12 -2.69 -0.01 0.00 0.26 0.00 0.00 34.13 31.58 1rlb s GLU 72 CO 0.02 -0.61 0.59 0.42 -0.54 0.00 0.00 175.26 175.14 1rlb s ILE 73 N 1.29 4.95 -0.87 -3.70 1.01 -0.26 0.04 121.20 123.67 1rlb s ILE 73 Ca -0.06 0.63 -0.25 0.00 0.00 0.00 0.00 60.65 60.98 1rlb s ILE 73 Cb -0.19 -4.00 -0.00 0.00 0.01 0.00 0.00 42.46 38.27 1rlb s ILE 73 CO -0.06 -0.20 1.68 -0.62 0.00 0.00 0.00 174.94 175.74 1rlb s ASP 74 N 1.72 5.74 0.00 3.58 2.15 0.15 -1.82 116.67 128.18 1rlb s ASP 74 Ca 0.23 -0.73 0.00 0.00 0.43 0.00 0.00 52.55 52.48 1rlb s ASP 74 Cb -0.15 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 39.91 1rlb s ASP 74 CO 0.13 -2.16 0.00 0.35 -0.17 0.00 0.00 175.17 173.32 1rlb n THR 75 N 7.24 0.00 -0.09 1.71 -2.24 -1.26 -3.80 114.28 115.84 1rlb n THR 75 Ca 0.30 0.42 0.07 0.00 -2.27 0.00 0.00 64.05 62.56 1rlb n THR 75 Cb 0.49 -1.27 0.13 0.00 -2.10 0.00 0.00 70.33 67.59 1rlb n THR 75 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1rlb n LYS 76 N -1.77 -0.02 -0.05 -0.78 4.81 -1.20 0.79 118.16 119.94 1rlb n LYS 76 Ca 0.00 0.41 -0.08 0.00 -0.87 0.00 0.00 58.31 57.77 1rlb n LYS 76 Cb 0.00 -0.69 -0.02 0.00 0.02 0.00 0.00 35.03 34.34 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 -0.12 -0.50 3.14 0.02 -1.92 0.29 113.55 114.47 1rlb h SER 77 Ca 0.21 0.06 0.09 0.00 -0.84 0.00 0.00 61.79 61.31 1rlb h SER 77 Cb 0.50 0.10 -0.10 0.00 0.14 0.00 0.00 62.40 63.04 1rlb h SER 77 CO -0.24 -0.03 -0.34 0.22 -1.14 0.00 0.00 176.83 175.30 1rlb h TYR 78 N 0.06 -0.94 0.00 3.45 3.20 0.28 -0.70 116.97 122.32 1rlb h TYR 78 Ca 0.11 0.07 -0.06 0.00 3.14 0.00 0.00 58.73 61.99 1rlb h TYR 78 Cb 0.15 0.48 -0.01 0.00 1.54 0.00 0.00 36.73 38.90 1rlb h TYR 78 CO -0.20 -0.38 -0.28 -1.49 -1.64 0.00 0.00 178.16 174.16 1rlb h TRP 79 N -0.21 0.00 0.43 -3.82 -0.00 -1.28 -3.21 115.95 107.86 1rlb h TRP 79 Ca 0.20 0.00 -0.02 0.00 -0.00 0.00 0.00 58.89 59.07 1rlb h TRP 79 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.71 1rlb h TRP 79 CO -0.60 0.28 -0.21 0.87 -0.00 0.00 0.00 178.44 178.79 1rlb h LYS 80 N 0.00 -0.55 -0.24 0.49 1.79 0.11 -1.26 116.57 116.90 1rlb h LYS 80 Ca -0.00 0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1rlb h LYS 80 Cb 0.78 0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.55 1rlb h LYS 80 CO 0.04 -0.37 0.00 0.00 -1.08 0.00 0.00 179.45 178.04 1rlb n ALA 81 N -2.57 1.39 -0.54 3.86 0.00 -0.32 -0.46 120.51 121.87 1rlb n ALA 81 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1rlb n ALA 81 Cb 0.23 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.68 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 0.34 0.26 0.00 0.00 7.94 -1.16 -5.03 117.00 119.35 1rlb n LEU 82 Ca 0.00 -0.29 0.00 0.00 -1.11 0.00 0.00 56.01 54.61 1rlb n LEU 82 Cb 0.06 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.01 1rlb n LEU 82 CO 0.00 0.07 0.00 0.61 -1.11 0.00 0.00 177.39 176.96 1rlb n GLY 83 N 0.06 0.62 3.67 -3.96 0.00 0.39 -5.05 105.19 100.93 1rlb n GLY 83 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.31 4.78 -0.77 -0.61 1.09 -0.49 -5.03 121.20 117.85 1rlb s ILE 84 Ca 0.00 -0.05 -0.26 0.00 -1.10 0.00 0.00 60.65 59.24 1rlb s ILE 84 Cb 0.00 -3.12 0.04 0.00 -1.06 0.00 0.00 42.46 38.31 1rlb s ILE 84 CO 0.00 0.50 1.28 -0.44 -0.10 0.00 0.00 174.94 176.18 1rlb s SER 85 N 0.02 6.21 0.64 3.58 0.01 -1.26 -3.93 113.70 118.96 1rlb s SER 85 Ca 0.06 -0.63 -0.08 0.00 1.31 0.00 0.00 55.95 56.61 1rlb s SER 85 Cb -0.12 -2.55 0.02 0.00 0.21 0.00 0.00 66.02 63.57 1rlb s SER 85 CO 0.01 -1.76 0.97 -2.16 0.41 0.00 0.00 173.24 170.70 1rlb s PRO 86 N 5.50 2.83 0.20 12.44 0.04 -1.26 -5.00 135.00 149.74 1rlb s PRO 86 Ca 0.35 0.11 0.15 0.00 0.04 0.00 0.00 61.00 61.65 1rlb s PRO 86 Cb -0.08 -2.19 -0.02 0.00 0.04 0.00 0.00 34.50 32.25 1rlb s PRO 86 CO 0.11 -0.85 1.25 0.35 0.04 0.00 0.00 177.00 177.90 1rlb h PHE 87 N -0.36 0.00 -3.50 0.56 3.57 -1.71 -3.48 116.94 112.03 1rlb h PHE 87 Ca -0.45 0.00 -0.64 0.00 3.53 0.00 0.00 57.97 60.40 1rlb h PHE 87 Cb 1.26 0.00 -0.22 0.00 2.79 0.00 0.00 35.95 39.78 1rlb h PHE 87 CO 0.47 0.58 -0.64 -1.01 -2.23 0.00 0.00 178.31 175.48 1rlb s HIS 88 N -2.92 3.08 0.39 0.41 3.76 -1.26 -4.98 115.29 113.77 1rlb s HIS 88 Ca 0.02 -0.39 0.14 0.00 -0.15 0.00 0.00 55.06 54.67 1rlb s HIS 88 Cb 0.08 -2.15 0.98 0.00 1.11 0.00 0.00 32.58 32.60 1rlb s HIS 88 CO 0.77 -0.25 1.86 0.93 -0.85 0.00 0.00 174.74 177.20 1rlb h GLU 89 N 7.72 0.50 0.00 1.40 4.39 -1.99 -3.17 114.58 123.42 1rlb h GLU 89 Ca -0.37 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.30 1rlb h GLU 89 Cb 1.18 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 1rlb h GLU 89 CO 0.61 0.33 0.00 -2.39 -1.16 0.00 0.00 179.01 176.40 1rlb n HIS 90 N -4.54 0.00 -4.41 4.33 1.44 -1.26 -4.38 115.22 106.40 1rlb n HIS 90 Ca 0.19 0.00 -0.31 0.00 -2.01 0.00 0.00 57.72 55.59 1rlb n HIS 90 Cb 0.61 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.61 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 2.91 -0.04 1.59 0.00 -0.76 -4.88 121.76 118.58 1rlb s ALA 91 Ca 0.00 -1.15 -0.01 0.00 0.00 0.00 0.00 51.96 50.80 1rlb s ALA 91 Cb 0.00 -0.95 0.03 0.00 0.00 0.00 0.00 23.12 22.20 1rlb s ALA 91 CO 0.00 0.62 0.07 -1.21 0.00 0.00 0.00 175.76 175.24 1rlb s GLU 92 N -1.74 -0.00 -0.71 0.00 2.02 -1.26 -1.10 118.70 115.92 1rlb s GLU 92 Ca 0.18 0.27 -0.04 0.00 0.02 0.00 0.00 54.97 55.41 1rlb s GLU 92 Cb -0.11 -0.25 0.18 0.00 0.10 0.00 0.00 34.13 34.05 1rlb s GLU 92 CO 0.10 -0.18 0.55 0.08 0.02 0.00 0.00 175.26 175.82 1rlb s VAL 93 N 1.22 4.02 -0.19 2.63 1.01 0.15 -4.94 120.40 124.30 1rlb s VAL 93 Ca -0.08 -3.15 -0.29 0.00 0.00 0.00 0.00 61.98 58.46 1rlb s VAL 93 Cb -0.12 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.68 1rlb s VAL 93 CO -0.04 -0.94 1.04 -0.69 0.00 0.00 0.00 175.10 174.47 1rlb s VAL 94 N -0.36 4.68 -0.17 2.92 1.01 -1.26 -1.64 120.40 125.58 1rlb s VAL 94 Ca 0.20 2.00 -0.08 0.00 0.00 0.00 0.00 61.98 64.10 1rlb s VAL 94 Cb -0.16 -4.29 0.07 0.00 0.00 0.00 0.00 36.38 31.99 1rlb s VAL 94 CO -0.06 -0.12 0.39 0.72 0.00 0.00 0.00 175.10 176.03 1rlb s PHE 95 N 2.84 -0.64 -0.06 5.22 -0.71 0.66 -4.96 117.98 120.33 1rlb s PHE 95 Ca 0.46 1.31 -0.29 0.00 -1.04 0.00 0.00 56.93 57.37 1rlb s PHE 95 Cb -0.16 0.24 -0.07 0.00 -1.21 0.00 0.00 43.02 41.82 1rlb s PHE 95 CO 0.10 -0.38 1.88 0.99 -1.34 0.00 0.00 175.22 176.47 1rlb s THR 96 N 1.87 3.24 0.00 -4.49 2.01 -1.26 -0.87 115.64 116.15 1rlb s THR 96 Ca -0.06 0.29 0.00 0.00 0.31 0.00 0.00 61.69 62.23 1rlb s THR 96 Cb -0.10 -3.21 0.00 0.00 0.01 0.00 0.00 72.50 69.20 1rlb s THR 96 CO -0.12 -0.06 0.00 0.00 -0.69 0.00 0.00 174.62 173.75 1rlb n ALA 97 N 8.18 0.00 0.00 7.40 0.00 0.15 -4.81 120.51 131.42 1rlb n ALA 97 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.65 1rlb n ALA 97 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 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 0.00 0.00 0.00 3.02 -1.26 -4.67 115.26 112.35 1rlb n ASN 98 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1rlb n ASN 98 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 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 -0.05 0.00 -0.78 6.41 9.92 -1.26 -1.03 116.55 129.75 1rlb n ASP 99 Ca 0.00 0.95 0.00 0.00 -0.53 0.00 0.00 54.79 55.21 1rlb n ASP 99 Cb 0.00 -0.45 0.00 0.00 -0.64 0.00 0.00 41.12 40.03 1rlb n ASP 99 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1rlb n SER 100 N -2.68 1.66 0.00 -2.24 7.64 -1.26 -4.87 113.62 111.88 1rlb n SER 100 Ca 0.00 -1.56 0.00 0.00 1.01 0.00 0.00 58.87 58.32 1rlb n SER 100 Cb 0.00 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 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 0.39 2.32 3.57 0.23 0.00 -0.20 -4.94 105.19 106.56 1rlb n GLY 101 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 3.90 0.47 1.61 0.05 -1.26 -4.82 135.00 134.95 1rlb s PRO 102 Ca 0.00 -1.82 0.29 0.00 0.05 0.00 0.00 61.00 59.52 1rlb s PRO 102 Cb 0.00 -5.49 1.36 0.00 0.05 0.00 0.00 34.50 30.42 1rlb s PRO 102 CO 0.00 -2.24 1.76 -0.09 0.05 0.00 0.00 177.00 176.48 1rlb h ARG 103 N 8.06 0.17 -4.91 4.56 9.65 -1.93 -3.44 114.38 126.54 1rlb h ARG 103 Ca 0.39 -0.01 -0.69 0.00 -1.10 0.00 0.00 59.98 58.57 1rlb h ARG 103 Cb 0.90 -0.04 -0.18 0.00 -1.39 0.00 0.00 29.97 29.26 1rlb h ARG 103 CO 1.45 0.11 -0.08 1.03 2.80 0.00 0.00 179.97 185.28 1rlb s ARG 104 N -5.21 3.12 -0.16 0.20 1.81 -0.97 -4.56 118.95 113.18 1rlb s ARG 104 Ca -0.07 -0.82 -0.07 0.00 -1.72 0.00 0.00 55.73 53.06 1rlb s ARG 104 Cb 0.25 -4.03 -0.04 0.00 -0.45 0.00 0.00 34.95 30.68 1rlb s ARG 104 CO 0.81 -1.03 0.07 0.71 -0.68 0.00 0.00 175.30 175.18 1rlb s TYR 105 N 2.36 3.31 -0.07 -0.53 1.51 0.11 0.08 117.35 124.11 1rlb s TYR 105 Ca 0.14 0.18 -0.02 0.00 -1.01 0.00 0.00 57.07 56.36 1rlb s TYR 105 Cb -0.18 -2.02 0.03 0.00 -0.11 0.00 0.00 41.96 39.68 1rlb s TYR 105 CO 0.13 0.30 0.04 0.99 -1.11 0.00 0.00 175.55 175.90 1rlb s THR 106 N -0.04 0.12 -0.42 -0.71 2.01 -0.69 -2.14 115.64 113.77 1rlb s THR 106 Ca 0.07 0.21 -0.08 0.00 0.31 0.00 0.00 61.69 62.19 1rlb s THR 106 Cb -0.12 -0.38 0.09 0.00 0.01 0.00 0.00 72.50 72.10 1rlb s THR 106 CO 0.01 0.16 0.26 -0.63 -0.69 0.00 0.00 174.62 173.72 1rlb s ILE 107 N 2.07 4.10 0.11 1.82 1.09 0.46 -0.84 121.20 130.01 1rlb s ILE 107 Ca 0.04 -1.52 -0.02 0.00 -1.10 0.00 0.00 60.65 58.05 1rlb s ILE 107 Cb -0.13 -3.56 -0.05 0.00 -1.06 0.00 0.00 42.46 37.66 1rlb s ILE 107 CO -0.05 -0.55 0.31 0.00 -0.10 0.00 0.00 174.94 174.55 1rlb s ALA 108 N 1.38 3.88 0.15 9.38 0.00 0.29 -1.24 121.76 135.61 1rlb s ALA 108 Ca 0.04 -0.70 0.06 0.00 0.00 0.00 0.00 51.96 51.36 1rlb s ALA 108 Cb -0.23 -1.99 -0.04 0.00 0.00 0.00 0.00 23.12 20.85 1rlb s ALA 108 CO 0.01 0.72 -0.13 0.00 0.00 0.00 0.00 175.76 176.36 1rlb s ALA 109 N -1.62 1.65 -0.09 0.00 0.00 0.10 -1.43 121.76 120.38 1rlb s ALA 109 Ca 0.38 -1.47 -0.02 0.00 0.00 0.00 0.00 51.96 50.86 1rlb s ALA 109 Cb -0.12 -0.04 0.03 0.00 0.00 0.00 0.00 23.12 22.99 1rlb s ALA 109 CO 0.26 0.03 0.02 -1.17 0.00 0.00 0.00 175.76 174.91 1rlb s LEU 110 N -2.93 0.59 -0.25 0.00 2.96 0.12 -2.03 118.68 117.14 1rlb s LEU 110 Ca 0.15 -0.19 -0.09 0.00 -0.22 0.00 0.00 54.13 53.79 1rlb s LEU 110 Cb -0.01 -0.41 -0.04 0.00 0.50 0.00 0.00 46.19 46.23 1rlb s LEU 110 CO 0.03 -0.23 0.11 -0.76 -1.32 0.00 0.00 176.35 174.19 1rlb s LEU 111 N 1.99 3.66 0.41 -0.68 1.43 -0.69 -0.24 118.68 124.58 1rlb s LEU 111 Ca 0.04 -0.11 0.03 0.00 -1.03 0.00 0.00 54.13 53.06 1rlb s LEU 111 Cb -0.13 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 1rlb s LEU 111 CO -0.06 -0.02 0.07 -0.44 0.23 0.00 0.00 176.35 176.14 1rlb s SER 112 N 1.54 3.12 0.11 2.29 0.01 -1.18 -0.46 113.70 119.12 1rlb s SER 112 Ca 0.06 -1.57 -0.24 0.00 1.31 0.00 0.00 55.95 55.51 1rlb s SER 112 Cb -0.15 0.29 -0.08 0.00 0.21 0.00 0.00 66.02 66.28 1rlb s SER 112 CO 0.06 -0.79 1.68 -0.65 0.41 0.00 0.00 173.24 173.94 1rlb h PRO 113 N 1.76 -0.24 -1.13 12.44 0.11 -1.99 -3.39 132.00 139.56 1rlb h PRO 113 Ca -0.39 0.02 -0.58 0.00 0.11 0.00 0.00 66.00 65.15 1rlb h PRO 113 Cb 1.27 0.05 -0.42 0.00 0.11 0.00 0.00 31.00 32.02 1rlb h PRO 113 CO 0.66 -0.16 -0.67 0.66 -0.21 0.00 0.00 178.00 178.28 1rlb n TYR 114 N -5.27 3.06 0.00 0.65 4.02 -1.26 -1.74 117.16 116.63 1rlb n TYR 114 Ca -0.06 -2.64 0.00 0.00 -0.01 0.00 0.00 57.90 55.19 1rlb n TYR 114 Cb 0.19 -0.29 0.00 0.00 -0.02 0.00 0.00 39.34 39.22 1rlb n TYR 114 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1rlb n SER 115 N -0.61 0.00 -3.58 7.72 2.88 -1.26 -5.04 113.62 113.72 1rlb n SER 115 Ca 0.43 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.86 1rlb n SER 115 Cb 0.80 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.23 1rlb n SER 115 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 1rlb s TYR 116 N -2.00 -0.33 0.10 0.66 1.13 -1.26 -3.13 117.35 112.52 1rlb s TYR 116 Ca 0.00 0.04 0.04 0.00 -1.41 0.00 0.00 57.07 55.74 1rlb s TYR 116 Cb 0.00 0.45 -0.04 0.00 -1.10 0.00 0.00 41.96 41.28 1rlb s TYR 116 CO 0.00 -0.86 -0.11 -1.12 -2.51 0.00 0.00 175.55 170.96 1rlb s SER 117 N -2.81 1.55 0.04 -0.18 0.01 0.67 -4.98 113.70 108.00 1rlb s SER 117 Ca 0.04 -0.81 -0.20 0.00 1.31 0.00 0.00 55.95 56.30 1rlb s SER 117 Cb -0.01 -0.01 0.04 0.00 0.21 0.00 0.00 66.02 66.26 1rlb s SER 117 CO -0.09 -0.24 0.45 0.28 0.41 0.00 0.00 173.24 174.05 1rlb s THR 118 N -2.37 0.05 -0.07 1.44 -1.32 -1.26 0.12 115.64 112.22 1rlb s THR 118 Ca 0.06 -0.38 -0.07 0.00 -1.21 0.00 0.00 61.69 60.09 1rlb s THR 118 Cb -0.03 -0.96 0.02 0.00 -1.51 0.00 0.00 72.50 70.02 1rlb s THR 118 CO 0.01 -0.21 0.20 -0.89 -2.21 0.00 0.00 174.62 171.52 1rlb s THR 119 N -2.46 0.01 -0.16 5.08 2.01 -0.51 -5.02 115.64 114.59 1rlb s THR 119 Ca -0.05 -0.05 -0.07 0.00 0.31 0.00 0.00 61.69 61.83 1rlb s THR 119 Cb -0.01 -0.31 -0.04 0.00 0.01 0.00 0.00 72.50 72.15 1rlb s THR 119 CO -0.02 -0.03 0.08 0.00 -0.69 0.00 0.00 174.62 173.96 1rlb s ALA 120 N -0.00 3.54 -0.19 7.40 0.00 -1.26 -0.55 121.76 130.70 1rlb s ALA 120 Ca -0.01 -0.72 -0.00 0.00 0.00 0.00 0.00 51.96 51.23 1rlb s ALA 120 Cb -0.02 -1.92 0.05 0.00 0.00 0.00 0.00 23.12 21.23 1rlb s ALA 120 CO 0.00 0.32 -0.06 0.08 0.00 0.00 0.00 175.76 176.11 1rlb s VAL 121 N -0.09 1.26 -0.27 0.00 1.01 -0.02 -4.99 120.40 117.30 1rlb s VAL 121 Ca 0.08 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.20 1rlb s VAL 121 Cb -0.12 -1.46 0.02 0.00 0.00 0.00 0.00 36.38 34.83 1rlb s VAL 121 CO 0.01 0.06 -0.01 -0.69 0.00 0.00 0.00 175.10 174.47 1rlb s VAL 122 N 1.55 3.22 -0.08 2.92 1.01 -1.26 -1.70 120.40 126.07 1rlb s VAL 122 Ca -0.01 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.00 1rlb s VAL 122 Cb -0.16 -2.68 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 1rlb s VAL 122 CO -0.07 0.11 -0.12 0.42 0.00 0.00 0.00 175.10 175.44 1rlb s THR 123 N 1.37 3.23 0.09 3.92 -4.23 0.11 -5.01 115.64 115.12 1rlb s THR 123 Ca 0.00 -0.64 -0.31 0.00 -1.18 0.00 0.00 61.69 59.56 1rlb s THR 123 Cb -0.17 -2.31 -0.06 0.00 1.34 0.00 0.00 72.50 71.30 1rlb s THR 123 CO -0.02 0.57 1.23 0.21 -0.54 0.00 0.00 174.62 176.07 1rlb s ASN 124 N -0.42 7.04 0.00 3.99 3.84 -1.26 -2.30 114.94 125.83 1rlb s ASN 124 Ca 0.05 2.10 0.00 0.00 0.21 0.00 0.00 52.86 55.22 1rlb s ASN 124 Cb -0.12 -2.58 0.00 0.00 -0.55 0.00 0.00 41.25 37.99 1rlb s ASN 124 CO 0.02 -0.48 0.54 -0.81 -2.79 0.00 0.00 177.10 173.58 1rlb n PRO 125 N 3.69 0.00 -2.70 0.43 -0.04 -1.26 -4.60 135.00 130.52 1rlb n PRO 125 Ca 0.09 0.45 -0.07 0.00 -0.04 0.00 0.00 63.50 63.93 1rlb n PRO 125 Cb 0.45 -1.04 0.09 0.00 -0.04 0.00 0.00 33.50 32.96 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 -1.07 0.76 -0.88 0.54 5.02 -1.26 -5.11 118.16 116.15 1rlb n LYS 126 Ca 0.00 -1.49 0.00 0.00 -2.02 0.00 0.00 58.31 54.80 1rlb n LYS 126 Cb 0.00 -0.55 0.00 0.00 -0.02 0.00 0.00 35.03 34.46 1rlb n LYS 126 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27