#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fry s SER 2 N 0.00 6.37 -0.43 1.61 0.15 -1.26 -4.95 113.70 115.19 2fry s SER 2 Ca 0.00 2.60 -0.28 0.00 0.70 0.00 0.00 55.95 58.96 2fry s SER 2 Cb 0.00 -2.63 0.02 0.00 -1.71 0.00 0.00 66.02 61.70 2fry s SER 2 CO 0.00 -0.80 1.08 -1.00 1.20 0.00 0.00 173.24 173.72 2fry s HIS 3 N -1.28 2.94 0.28 3.44 3.76 -1.26 -4.65 115.29 118.52 2fry s HIS 3 Ca 0.57 0.81 0.04 0.00 -0.15 0.00 0.00 55.06 56.33 2fry s HIS 3 Cb -0.37 -4.12 -0.06 0.00 1.11 0.00 0.00 32.58 29.14 2fry s HIS 3 CO 0.47 -1.08 0.01 0.08 -0.85 0.00 0.00 174.74 173.37 2fry s VAL 4 N 4.08 1.22 0.09 -0.90 1.01 -1.22 -4.51 120.40 120.18 2fry s VAL 4 Ca 0.45 -2.04 0.05 0.00 0.00 0.00 0.00 61.98 60.45 2fry s VAL 4 Cb -0.09 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.69 2fry s VAL 4 CO 0.26 -0.17 -0.14 0.54 0.00 0.00 0.00 175.10 175.58 2fry s VAL 5 N -3.29 1.21 0.03 2.92 0.11 0.71 0.16 120.40 122.25 2fry s VAL 5 Ca 0.32 -1.48 0.06 0.00 -2.93 0.00 0.00 61.98 57.95 2fry s VAL 5 Cb 0.07 -1.28 -0.03 0.00 -1.53 0.00 0.00 36.38 33.61 2fry s VAL 5 CO 0.12 -0.30 -0.17 -1.58 -3.33 0.00 0.00 175.10 169.84 2fry s GLN 6 N -2.14 2.16 0.17 1.54 0.74 0.33 0.14 119.66 122.59 2fry s GLN 6 Ca 0.03 -0.93 0.09 0.00 0.05 0.00 0.00 55.36 54.60 2fry s GLN 6 Cb -0.08 -2.23 -0.04 0.00 1.10 0.00 0.00 33.01 31.76 2fry s GLN 6 CO 0.02 0.55 -0.14 0.95 -0.55 0.00 0.00 175.29 176.12 2fry s THR 7 N -0.91 2.95 0.00 -0.34 -4.23 0.20 0.89 115.64 114.20 2fry s THR 7 Ca 0.14 -1.69 0.00 0.00 -1.18 0.00 0.00 61.69 58.97 2fry s THR 7 Cb -0.11 -2.43 0.00 0.00 1.34 0.00 0.00 72.50 71.31 2fry s THR 7 CO 0.05 -0.06 0.00 0.00 -0.54 0.00 0.00 174.62 174.07 2fry n LEU 8 N 0.27 0.77 -4.94 4.79 -0.00 -1.24 -4.41 117.00 112.25 2fry n LEU 8 Ca -0.12 0.00 -0.24 0.00 -0.00 0.00 0.00 56.01 55.65 2fry n LEU 8 Cb 0.55 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.94 2fry n LEU 8 CO 0.32 0.01 -0.09 -0.31 -0.00 0.00 0.00 177.39 177.33 2fry s TYR 9 N -1.67 3.43 0.99 1.47 2.02 -1.15 -5.07 117.35 117.37 2fry s TYR 9 Ca 0.00 0.05 -0.11 0.00 -0.37 0.00 0.00 57.07 56.64 2fry s TYR 9 Cb 0.00 -1.61 0.18 0.00 -0.40 0.00 0.00 41.96 40.13 2fry s TYR 9 CO 0.00 0.49 1.07 -0.35 -1.57 0.00 0.00 175.55 175.19 2fry n PRO 10 N -0.88 -0.96 -4.65 -1.71 -0.04 -1.26 -4.91 135.00 120.58 2fry n PRO 10 Ca -0.08 -0.22 -0.33 0.00 -0.04 0.00 0.00 63.50 62.82 2fry n PRO 10 Cb 0.55 -2.30 -0.12 0.00 -0.04 0.00 0.00 33.50 31.59 2fry n PRO 10 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2fry s PHE 11 N -2.57 2.89 -0.13 0.54 0.40 -1.26 -5.04 117.98 112.82 2fry s PHE 11 Ca 0.67 -0.24 -0.00 0.00 -0.60 0.00 0.00 56.93 56.75 2fry s PHE 11 Cb -0.23 -1.79 0.03 0.00 0.51 0.00 0.00 43.02 41.54 2fry s PHE 11 CO 0.60 0.09 -0.08 -1.12 0.70 0.00 0.00 175.22 175.42 2fry s SER 12 N -0.24 2.38 -0.06 1.36 0.01 -1.26 -4.94 113.70 110.96 2fry s SER 12 Ca 0.03 -0.40 -0.03 0.00 1.31 0.00 0.00 55.95 56.86 2fry s SER 12 Cb -0.13 -0.88 -0.04 0.00 0.21 0.00 0.00 66.02 65.18 2fry s SER 12 CO 0.03 -0.13 0.08 -0.44 0.41 0.00 0.00 173.24 173.19 2fry s SER 13 N 1.67 5.81 0.00 2.44 0.01 -1.26 -4.98 113.70 117.39 2fry s SER 13 Ca 0.04 0.25 0.00 0.00 1.31 0.00 0.00 55.95 57.55 2fry s SER 13 Cb -0.13 -1.73 0.00 0.00 0.21 0.00 0.00 66.02 64.36 2fry s SER 13 CO -0.08 0.33 0.00 1.33 0.41 0.00 0.00 173.24 175.23 2fry n VAL 14 N 1.61 0.00 -0.96 3.43 0.24 -1.26 -4.94 118.33 116.46 2fry n VAL 14 Ca -0.16 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 61.85 2fry n VAL 14 Cb 0.53 -0.41 0.22 0.00 -1.47 0.00 0.00 33.84 32.71 2fry n VAL 14 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2fry s THR 15 N -1.62 1.85 0.12 3.34 2.01 -1.26 -4.97 115.64 115.11 2fry s THR 15 Ca 0.00 0.00 -0.08 0.00 0.31 0.00 0.00 61.69 61.92 2fry s THR 15 Cb 0.00 -2.37 -0.17 0.00 0.01 0.00 0.00 72.50 69.97 2fry s THR 15 CO 0.00 0.00 1.30 -0.33 -0.69 0.00 0.00 174.62 174.90 2fry h GLU 16 N -2.36 0.56 -0.09 4.92 5.08 -2.03 -3.29 114.58 117.37 2fry h GLU 16 Ca -0.53 -0.54 -0.00 0.00 -1.00 0.00 0.00 59.36 57.28 2fry h GLU 16 Cb 1.33 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.71 2fry h GLU 16 CO 0.49 1.17 0.04 0.93 -1.00 0.00 0.00 179.01 180.63 2fry h GLU 17 N 0.34 0.13 0.00 2.33 5.08 -2.00 -3.44 114.58 117.03 2fry h GLU 17 Ca -0.08 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 2fry h GLU 17 Cb 1.52 -0.02 0.03 0.00 0.50 0.00 0.00 28.75 30.78 2fry h GLU 17 CO 0.17 0.25 -0.02 0.39 -1.00 0.00 0.00 179.01 178.79 2fry n GLU 18 N -4.93 -1.27 -3.64 2.33 1.02 -1.24 -4.09 120.64 108.82 2fry n GLU 18 Ca -0.06 -0.18 -0.03 0.00 -0.02 0.00 0.00 57.16 56.88 2fry n GLU 18 Cb 0.11 -0.28 -0.02 0.00 -0.02 0.00 0.00 31.44 31.23 2fry n GLU 18 CO 0.00 0.00 0.00 -0.48 1.18 0.00 0.00 177.13 177.83 2fry s LEU 19 N 0.00 -0.04 -0.32 -4.62 -0.00 -1.26 -4.72 118.68 107.72 2fry s LEU 19 Ca 0.08 0.01 -0.12 0.00 -0.00 0.00 0.00 54.13 54.10 2fry s LEU 19 Cb -0.01 1.10 -0.02 0.00 -0.00 0.00 0.00 46.19 47.25 2fry s LEU 19 CO 0.07 -0.05 0.21 0.54 -0.00 0.00 0.00 176.35 177.12 2fry s ASN 20 N -1.86 5.95 0.16 1.48 2.20 -1.26 -4.57 114.94 117.04 2fry s ASN 20 Ca 0.11 -0.33 0.03 0.00 -0.94 0.00 0.00 52.86 51.73 2fry s ASN 20 Cb -0.01 -2.11 -0.05 0.00 -2.00 0.00 0.00 41.25 37.09 2fry s ASN 20 CO -0.04 -0.18 -0.04 0.72 -2.94 0.00 0.00 177.10 174.63 2fry s PHE 21 N 1.71 1.23 -0.35 1.54 -0.12 -1.26 -5.02 117.98 115.71 2fry s PHE 21 Ca 0.06 -0.91 -0.28 0.00 -0.05 0.00 0.00 56.93 55.75 2fry s PHE 21 Cb -0.17 -0.68 -0.03 0.00 -0.63 0.00 0.00 43.02 41.50 2fry s PHE 21 CO 0.10 -0.09 1.99 -1.83 -0.05 0.00 0.00 175.22 175.34 2fry s GLU 22 N -3.85 3.05 -0.14 1.99 -1.05 -1.26 -4.92 118.70 112.53 2fry s GLU 22 Ca 0.21 1.49 -0.29 0.00 -0.15 0.00 0.00 54.97 56.23 2fry s GLU 22 Cb 0.05 -4.31 -0.02 0.00 -0.44 0.00 0.00 34.13 29.40 2fry s GLU 22 CO 0.02 -2.20 1.32 0.21 0.95 0.00 0.00 175.26 175.57 2fry s LYS 23 N 6.32 4.23 0.00 -4.83 2.47 -1.26 -4.82 119.74 121.85 2fry s LYS 23 Ca 0.86 1.75 0.00 0.00 -1.56 0.00 0.00 55.97 57.02 2fry s LYS 23 Cb -0.24 -3.78 0.00 0.00 -1.46 0.00 0.00 37.83 32.36 2fry s LYS 23 CO 0.32 -0.71 0.00 0.41 0.16 0.00 0.00 175.35 175.53 2fry n GLY 24 N 3.68 2.57 0.63 5.54 0.00 -1.26 -5.01 105.19 111.33 2fry n GLY 24 Ca 0.14 -1.93 0.13 0.00 0.00 0.00 0.00 46.02 44.36 2fry n GLY 24 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2fry n GLU 25 N 0.00 1.76 -3.60 1.61 2.13 -1.26 -4.56 120.64 116.72 2fry n GLU 25 Ca 0.00 -1.27 -0.09 0.00 0.66 0.00 0.00 57.16 56.46 2fry n GLU 25 Cb 0.00 -1.47 -0.06 0.00 0.27 0.00 0.00 31.44 30.18 2fry n GLU 25 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 2fry s THR 26 N -2.12 0.00 0.13 6.31 -1.32 -1.26 -0.62 115.64 116.76 2fry s THR 26 Ca 0.30 0.00 -0.00 0.00 -1.21 0.00 0.00 61.69 60.78 2fry s THR 26 Cb 0.20 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 70.15 2fry s THR 26 CO 0.37 0.00 0.03 0.00 -2.21 0.00 0.00 174.62 172.82 2fry s MET 27 N -0.66 0.94 -0.27 7.08 0.23 0.37 -4.81 119.30 122.19 2fry s MET 27 Ca 0.01 -1.44 -0.02 0.00 -1.03 0.00 0.00 55.69 53.20 2fry s MET 27 Cb -0.02 0.11 0.03 0.00 -1.53 0.00 0.00 34.83 33.42 2fry s MET 27 CO -0.02 -0.21 -0.03 -1.83 -2.03 0.00 0.00 175.02 170.90 2fry s GLU 28 N -4.00 2.70 -0.06 3.16 1.03 -1.26 0.25 118.70 120.52 2fry s GLU 28 Ca 0.22 -1.08 -0.19 0.00 0.03 0.00 0.00 54.97 53.95 2fry s GLU 28 Cb 0.07 -3.08 -0.05 0.00 -0.80 0.00 0.00 34.13 30.28 2fry s GLU 28 CO 0.01 -0.48 0.54 0.08 -1.33 0.00 0.00 175.26 174.08 2fry s VAL 29 N 1.31 5.06 0.00 1.83 1.01 -1.26 -3.61 120.40 124.74 2fry s VAL 29 Ca -0.02 1.10 0.00 0.00 0.00 0.00 0.00 61.98 63.06 2fry s VAL 29 Cb -0.18 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.33 2fry s VAL 29 CO -0.03 0.37 0.00 2.30 0.00 0.00 0.00 175.10 177.74 2fry n ILE 30 N 3.19 0.00 -2.42 2.22 -0.00 -1.03 -4.87 119.36 116.45 2fry n ILE 30 Ca -0.07 0.00 -0.42 0.00 -0.00 0.00 0.00 62.75 62.26 2fry n ILE 30 Cb 0.51 -0.06 -0.03 0.00 -0.00 0.00 0.00 39.64 40.07 2fry n ILE 30 CO 0.00 0.00 0.00 -0.70 -0.00 0.00 0.00 176.55 175.85 2fry s GLU 31 N 0.00 4.40 -0.29 6.28 -6.30 -1.26 -5.02 118.70 116.52 2fry s GLU 31 Ca 0.00 1.75 -0.09 0.00 -2.50 0.00 0.00 54.97 54.13 2fry s GLU 31 Cb 0.00 -3.42 -0.02 0.00 0.00 0.00 0.00 34.13 30.69 2fry s GLU 31 CO 0.00 -0.33 0.12 0.15 0.02 0.00 0.00 175.26 175.22 2fry s LYS 32 N 1.47 3.45 -0.55 4.30 3.01 -1.26 -4.45 119.74 125.71 2fry s LYS 32 Ca 0.58 -0.63 -0.09 0.00 -1.01 0.00 0.00 55.97 54.83 2fry s LYS 32 Cb -0.28 -3.47 -0.08 0.00 -1.01 0.00 0.00 37.83 32.99 2fry s LYS 32 CO 0.27 -0.33 1.71 -2.30 0.51 0.00 0.00 175.35 175.21 2fry n PRO 33 N 4.96 1.21 -0.09 -1.68 -0.02 -1.26 -4.39 135.00 133.72 2fry n PRO 33 Ca -0.15 -1.20 -0.17 0.00 -2.02 0.00 0.00 63.50 59.97 2fry n PRO 33 Cb 0.50 -2.39 -0.09 0.00 -0.02 0.00 0.00 33.50 31.49 2fry n PRO 33 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2fry h GLU 34 N 7.36 0.00 0.10 -0.52 5.08 -1.99 -3.40 114.58 121.21 2fry h GLU 34 Ca 0.32 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.43 2fry h GLU 34 Cb 0.23 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 2fry h GLU 34 CO 1.44 0.75 -1.28 -0.97 -1.00 0.00 0.00 179.01 177.96 2fry h ASN 35 N -1.00 0.34 -3.39 1.42 -1.24 -2.05 -3.43 115.58 106.23 2fry h ASN 35 Ca -0.23 -0.84 -0.71 0.00 0.71 0.00 0.00 56.30 55.22 2fry h ASN 35 Cb 1.06 -0.11 -0.31 0.00 0.73 0.00 0.00 38.32 39.69 2fry h ASN 35 CO -0.14 1.56 -0.46 -1.81 -1.29 0.00 0.00 177.43 175.29 2fry s ASP 36 N -6.97 5.55 -0.27 1.15 1.11 -1.26 -5.06 116.67 110.92 2fry s ASP 36 Ca -0.20 -1.87 -0.28 0.00 0.18 0.00 0.00 52.55 50.38 2fry s ASP 36 Cb 0.04 -1.95 -0.03 0.00 1.07 0.00 0.00 42.92 42.05 2fry s ASP 36 CO 0.75 -0.62 1.88 -2.84 1.18 0.00 0.00 175.17 175.53 2fry s PRO 37 N 1.31 3.40 0.00 8.23 0.02 -1.26 -4.57 135.00 142.12 2fry s PRO 37 Ca 0.06 1.67 0.00 0.00 0.02 0.00 0.00 61.00 62.75 2fry s PRO 37 Cb -0.25 -4.21 0.00 0.00 0.02 0.00 0.00 34.50 30.06 2fry s PRO 37 CO -0.01 -1.79 0.00 -1.91 -0.33 0.00 0.00 177.00 172.96 2fry n GLU 38 N 8.35 0.00 -3.74 5.54 2.13 -1.26 -5.13 120.64 126.53 2fry n GLU 38 Ca 0.24 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.96 2fry n GLU 38 Cb 0.46 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.11 2fry n GLU 38 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 2fry s TRP 39 N 0.87 -0.04 0.27 4.31 0.51 -1.26 -5.06 118.94 118.54 2fry s TRP 39 Ca 0.00 -0.32 0.12 0.00 -2.12 0.00 0.00 56.10 53.78 2fry s TRP 39 Cb 0.00 0.17 -0.05 0.00 -0.81 0.00 0.00 33.47 32.78 2fry s TRP 39 CO 0.00 -0.70 -0.17 1.67 -0.51 0.00 0.00 176.95 177.23 2fry s TRP 40 N -3.85 2.35 -0.01 -1.98 -2.14 -1.26 -4.70 118.94 107.37 2fry s TRP 40 Ca 0.06 -0.32 0.01 0.00 2.66 0.00 0.00 56.10 58.52 2fry s TRP 40 Cb 0.02 -1.04 0.00 0.00 -3.10 0.00 0.00 33.47 29.36 2fry s TRP 40 CO -0.09 0.68 -0.03 -1.59 -2.66 0.00 0.00 176.95 173.26 2fry s LYS 41 N -3.45 0.29 0.12 3.25 0.00 -1.26 -0.29 119.74 118.41 2fry s LYS 41 Ca 0.29 -0.10 0.03 0.00 0.00 0.00 0.00 55.97 56.19 2fry s LYS 41 Cb -0.06 -0.31 -0.04 0.00 0.00 0.00 0.00 37.83 37.43 2fry s LYS 41 CO 0.15 0.05 -0.08 0.00 0.00 0.00 0.00 175.35 175.47 2fry s LYS 43 N -3.78 3.93 0.47 0.00 2.36 -1.24 -2.78 119.74 118.70 2fry s LYS 43 Ca 0.14 0.42 0.04 0.00 -2.55 0.00 0.00 55.97 54.02 2fry s LYS 43 Cb 0.04 -3.05 -0.03 0.00 -1.05 0.00 0.00 37.83 33.74 2fry s LYS 43 CO -0.02 0.57 0.10 1.21 1.55 0.00 0.00 175.35 178.76 2fry s ASN 44 N -1.51 4.21 0.00 1.43 3.84 -1.25 -4.55 114.94 117.11 2fry s ASN 44 Ca 0.32 -1.41 0.13 0.00 0.21 0.00 0.00 52.86 52.12 2fry s ASN 44 Cb -0.16 0.09 0.69 0.00 -0.55 0.00 0.00 41.25 41.32 2fry s ASN 44 CO 0.17 -0.73 1.34 0.00 -2.79 0.00 0.00 177.10 175.09 2fry n ALA 45 N -1.27 1.80 1.23 1.71 0.00 -1.26 -1.59 120.51 121.13 2fry n ALA 45 Ca -0.10 -0.07 0.14 0.00 0.00 0.00 0.00 53.44 53.42 2fry n ALA 45 Cb 0.66 -1.22 0.58 0.00 0.00 0.00 0.00 19.45 19.47 2fry n ALA 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2fry n ARG 46 N -1.25 0.34 -0.98 0.00 3.00 -1.26 -4.89 116.66 111.61 2fry n ARG 46 Ca 0.07 -0.09 0.00 0.00 -0.01 0.00 0.00 57.85 57.82 2fry n ARG 46 Cb 0.10 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.06 2fry n ARG 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2fry n GLY 47 N 1.38 0.79 3.14 -0.13 0.00 -0.62 -4.99 105.19 104.76 2fry n GLY 47 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 2fry n GLY 47 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2fry s GLN 48 N -0.07 2.75 -0.24 1.61 1.11 -1.26 -4.92 119.66 118.64 2fry s GLN 48 Ca 0.00 -1.01 -0.10 0.00 0.01 0.00 0.00 55.36 54.25 2fry s GLN 48 Cb 0.00 -2.82 -0.05 0.00 -1.01 0.00 0.00 33.01 29.13 2fry s GLN 48 CO 0.00 -0.37 0.15 0.54 0.01 0.00 0.00 175.29 175.62 2fry s VAL 49 N 1.26 5.35 0.40 1.09 0.11 -1.26 -3.74 120.40 123.61 2fry s VAL 49 Ca -0.00 0.17 0.03 0.00 -2.93 0.00 0.00 61.98 59.25 2fry s VAL 49 Cb -0.16 -3.49 -0.01 0.00 -1.53 0.00 0.00 36.38 31.19 2fry s VAL 49 CO -0.08 0.36 0.10 0.61 -3.33 0.00 0.00 175.10 172.76 2fry n GLY 50 N 4.21 3.37 3.74 6.54 0.00 -1.12 -4.78 105.19 117.15 2fry n GLY 50 Ca -0.15 -2.17 -0.41 0.00 0.00 0.00 0.00 46.02 43.29 2fry n GLY 50 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fry s LEU 51 N 0.00 4.46 -0.00 0.99 1.02 -1.26 -2.69 118.68 121.21 2fry s LEU 51 Ca 0.14 2.18 0.03 0.00 0.02 0.00 0.00 54.13 56.51 2fry s LEU 51 Cb 0.01 -3.61 -0.01 0.00 0.02 0.00 0.00 46.19 42.60 2fry s LEU 51 CO 0.10 -0.32 -0.10 0.54 0.02 0.00 0.00 176.35 176.60 2fry s VAL 52 N -0.14 0.75 -0.37 -1.59 0.11 0.60 -4.65 120.40 115.12 2fry s VAL 52 Ca 0.51 -0.47 -0.29 0.00 -2.93 0.00 0.00 61.98 58.81 2fry s VAL 52 Cb -0.31 -0.64 0.02 0.00 -1.53 0.00 0.00 36.38 33.92 2fry s VAL 52 CO 0.36 0.17 1.10 -2.16 -3.33 0.00 0.00 175.10 171.24 2fry s PRO 53 N -0.34 3.96 0.27 1.54 0.04 -1.26 -4.04 135.00 135.17 2fry s PRO 53 Ca 0.03 0.93 0.16 0.00 0.04 0.00 0.00 61.00 62.16 2fry s PRO 53 Cb -0.04 -3.79 0.89 0.00 0.04 0.00 0.00 34.50 31.60 2fry s PRO 53 CO -0.00 -1.05 1.47 0.36 0.04 0.00 0.00 177.00 177.82 2fry n LYS 54 N 7.17 0.11 0.00 4.56 -0.00 -1.26 -0.95 118.16 127.78 2fry n LYS 54 Ca 0.12 0.59 0.10 0.00 -0.00 0.00 0.00 58.31 59.13 2fry n LYS 54 Cb 0.48 -1.92 0.48 0.00 -0.00 0.00 0.00 35.03 34.06 2fry n LYS 54 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 2fry n ASN 55 N -2.09 0.00 -0.22 -5.58 2.85 -1.26 -2.39 115.26 106.57 2fry n ASN 55 Ca -0.01 0.26 0.06 0.00 -0.11 0.00 0.00 54.58 54.78 2fry n ASN 55 Cb 0.10 -0.40 0.11 0.00 1.24 0.00 0.00 39.78 40.83 2fry n ASN 55 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 2fry n TYR 56 N -1.40 0.18 -4.04 1.20 4.02 -0.13 -5.04 117.16 111.95 2fry n TYR 56 Ca 0.07 -0.76 -0.13 0.00 -0.01 0.00 0.00 57.90 57.07 2fry n TYR 56 Cb 0.21 -0.13 -0.04 0.00 -0.02 0.00 0.00 39.34 39.36 2fry n TYR 56 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 2fry s VAL 57 N -2.05 0.00 -0.12 -0.72 -7.23 -1.01 -2.94 120.40 106.34 2fry s VAL 57 Ca 0.22 -1.50 -0.02 0.00 -1.81 0.00 0.00 61.98 58.86 2fry s VAL 57 Cb 0.18 -2.56 0.04 0.00 0.56 0.00 0.00 36.38 34.59 2fry s VAL 57 CO 0.04 0.00 0.02 0.54 -0.31 0.00 0.00 175.10 175.39 2fry s VAL 58 N -3.23 0.37 0.50 1.32 0.11 0.26 -4.91 120.40 114.83 2fry s VAL 58 Ca 0.27 -0.10 -0.22 0.00 -2.93 0.00 0.00 61.98 59.00 2fry s VAL 58 Cb -0.01 -0.68 -0.06 0.00 -1.53 0.00 0.00 36.38 34.11 2fry s VAL 58 CO 0.16 0.07 1.26 -0.69 -3.33 0.00 0.00 175.10 172.57 2fry s VAL 59 N 1.96 2.58 0.32 2.04 1.01 -1.26 0.12 120.40 127.17 2fry s VAL 59 Ca 0.03 0.44 0.08 0.00 0.00 0.00 0.00 61.98 62.52 2fry s VAL 59 Cb -0.14 -3.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.99 2fry s VAL 59 CO -0.06 -0.01 0.21 -0.76 0.00 0.00 0.00 175.10 174.48 2fry s LEU 60 N -3.29 3.51 0.00 3.92 1.02 0.41 -4.63 118.68 119.62 2fry s LEU 60 Ca 0.68 -0.54 0.00 0.00 0.02 0.00 0.00 54.13 54.29 2fry s LEU 60 Cb -0.34 -2.06 0.00 0.00 0.02 0.00 0.00 46.19 43.80 2fry s LEU 60 CO 0.41 -0.25 0.00 -0.24 0.02 0.00 0.00 176.35 176.29