#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j7m s TRP 2 N 0.00 3.58 0.55 7.33 1.48 -1.26 -5.05 118.94 125.57 1j7m s TRP 2 Ca 0.00 1.72 0.08 0.00 -1.06 0.00 0.00 56.10 56.83 1j7m s TRP 2 Cb 0.00 -3.23 0.08 0.00 -1.16 0.00 0.00 33.47 29.15 1j7m s TRP 2 CO 0.00 -0.46 0.65 -1.33 -4.06 0.00 0.00 176.95 171.75 1j7m n MET 3 N 1.06 0.65 -4.28 3.25 2.81 -1.26 -5.04 117.12 114.31 1j7m n MET 3 Ca -0.00 -3.09 -0.18 0.00 -1.81 0.00 0.00 57.70 52.61 1j7m n MET 3 Cb 0.46 -0.05 -0.11 0.00 -0.71 0.00 0.00 33.22 32.81 1j7m n MET 3 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 1j7m s SER 4 N -4.34 2.18 0.54 7.83 0.01 -1.26 -3.28 113.70 115.38 1j7m s SER 4 Ca 0.49 -0.89 0.06 0.00 1.31 0.00 0.00 55.95 56.93 1j7m s SER 4 Cb -0.04 -0.09 0.04 0.00 0.21 0.00 0.00 66.02 66.14 1j7m s SER 4 CO 0.31 -0.16 0.43 0.42 0.41 0.00 0.00 173.24 174.65 1j7m s THR 5 N -2.44 1.75 0.23 1.44 -4.23 -1.16 -4.90 115.64 106.32 1j7m s THR 5 Ca 0.14 -1.45 0.03 0.00 -1.18 0.00 0.00 61.69 59.23 1j7m s THR 5 Cb -0.03 -2.20 -0.05 0.00 1.34 0.00 0.00 72.50 71.56 1j7m s THR 5 CO 0.04 0.00 -0.01 0.54 -0.54 0.00 0.00 174.62 174.65 1j7m s VAL 6 N -2.75 1.02 0.00 2.29 0.11 -1.22 -4.96 120.40 114.90 1j7m s VAL 6 Ca 0.37 -2.03 0.00 0.00 -2.93 0.00 0.00 61.98 57.39 1j7m s VAL 6 Cb -0.02 -2.32 0.00 0.00 -1.53 0.00 0.00 36.38 32.50 1j7m s VAL 6 CO 0.23 -0.34 0.00 0.61 -3.33 0.00 0.00 175.10 172.27 1j7m n GLY 7 N -0.40 1.28 7.00 6.54 0.00 -1.26 0.23 105.19 118.58 1j7m n GLY 7 Ca -0.05 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.38 1j7m n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j7m n GLY 8 N 0.00 0.91 0.45 -0.02 0.00 -1.26 -4.48 105.19 100.79 1j7m n GLY 8 Ca 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1j7m n GLY 8 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1j7m n ASN 9 N -3.40 0.00 0.06 1.61 2.04 -0.72 -4.88 115.26 109.97 1j7m n ASN 9 Ca 0.00 -1.54 -0.05 0.00 -0.44 0.00 0.00 54.58 52.55 1j7m n ASN 9 Cb 0.00 -0.11 -0.09 0.00 -2.53 0.00 0.00 39.78 37.05 1j7m n ASN 9 CO 0.00 0.00 0.00 0.28 -0.44 0.00 0.00 177.26 177.10 1j7m h SER 10 N 0.00 0.00 0.00 0.53 0.02 -1.81 -3.48 113.55 108.81 1j7m h SER 10 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1j7m h SER 10 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1j7m h SER 10 CO 0.00 0.89 0.00 0.61 -1.14 0.00 0.00 176.83 177.19 1j7m n GLY 11 N 1.35 2.26 2.39 -3.77 0.00 -1.26 -4.24 105.19 101.92 1j7m n GLY 11 Ca -0.02 -0.09 -0.21 0.00 0.00 0.00 0.00 46.02 45.70 1j7m n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j7m n GLY 12 N 0.00 4.12 3.11 -0.02 0.00 -1.26 -4.78 105.19 106.36 1j7m n GLY 12 Ca 0.00 -1.99 -0.19 0.00 0.00 0.00 0.00 46.02 43.84 1j7m n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j7m s ALA 13 N -2.66 1.03 0.77 4.61 0.00 -1.26 -5.00 121.76 119.24 1j7m s ALA 13 Ca 0.42 -0.73 -0.07 0.00 0.00 0.00 0.00 51.96 51.59 1j7m s ALA 13 Cb 0.32 -0.16 0.12 0.00 0.00 0.00 0.00 23.12 23.40 1j7m s ALA 13 CO -0.10 0.19 1.07 -1.25 0.00 0.00 0.00 175.76 175.68 1j7m s PRO 14 N -0.98 1.66 -0.08 0.00 0.04 -1.20 -3.00 135.00 131.42 1j7m s PRO 14 Ca 0.01 -0.58 -0.25 0.00 0.04 0.00 0.00 61.00 60.21 1j7m s PRO 14 Cb -0.07 -2.15 -0.03 0.00 0.04 0.00 0.00 34.50 32.29 1j7m s PRO 14 CO 0.01 -1.57 0.78 0.00 0.04 0.00 0.00 177.00 176.25 1j7m s VAL 16 N 1.20 4.99 -0.03 0.00 1.01 -0.04 -4.97 120.40 122.56 1j7m s VAL 16 Ca 0.40 -0.38 0.02 0.00 0.00 0.00 0.00 61.98 62.02 1j7m s VAL 16 Cb -0.18 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.02 1j7m s VAL 16 CO 0.18 -0.58 -0.06 -0.36 0.00 0.00 0.00 175.10 174.28 1j7m s PHE 17 N 2.35 2.94 0.18 5.22 0.08 -1.26 -2.62 117.98 124.87 1j7m s PHE 17 Ca 0.14 0.01 -0.27 0.00 0.12 0.00 0.00 56.93 56.93 1j7m s PHE 17 Cb -0.18 -1.67 -0.08 0.00 -0.57 0.00 0.00 43.02 40.52 1j7m s PHE 17 CO 0.13 0.37 0.84 -1.25 -0.10 0.00 0.00 175.22 175.21 1j7m s PRO 18 N -1.13 4.67 -0.12 0.24 0.05 -1.26 -5.07 135.00 132.37 1j7m s PRO 18 Ca 0.15 1.28 -0.04 0.00 0.05 0.00 0.00 61.00 62.44 1j7m s PRO 18 Cb -0.11 -3.28 -0.03 0.00 0.05 0.00 0.00 34.50 31.12 1j7m s PRO 18 CO 0.05 0.52 0.02 -0.59 0.05 0.00 0.00 177.00 177.05 1j7m s PHE 19 N -1.03 3.19 -0.27 0.56 -0.71 0.15 -4.81 117.98 115.07 1j7m s PHE 19 Ca 0.38 0.10 -0.14 0.00 -1.04 0.00 0.00 56.93 56.24 1j7m s PHE 19 Cb -0.24 -1.90 -0.04 0.00 -1.21 0.00 0.00 43.02 39.63 1j7m s PHE 19 CO 0.28 0.33 0.33 0.99 -1.34 0.00 0.00 175.22 175.80 1j7m s THR 20 N -0.37 5.21 -0.09 -4.49 2.01 -0.72 0.38 115.64 117.57 1j7m s THR 20 Ca 0.08 0.47 0.03 0.00 0.31 0.00 0.00 61.69 62.58 1j7m s THR 20 Cb -0.12 -3.65 -0.02 0.00 0.01 0.00 0.00 72.50 68.72 1j7m s THR 20 CO 0.02 0.19 -0.18 0.12 -0.69 0.00 0.00 174.62 174.08 1j7m s PHE 21 N 1.94 2.65 -1.14 4.92 5.36 0.36 -2.30 117.98 129.78 1j7m s PHE 21 Ca 0.13 -0.58 -0.07 0.00 -0.96 0.00 0.00 56.93 55.45 1j7m s PHE 21 Cb -0.16 -1.71 0.07 0.00 -0.34 0.00 0.00 43.02 40.89 1j7m s PHE 21 CO 0.10 -0.13 0.18 1.28 -1.46 0.00 0.00 175.22 175.19 1j7m n LEU 22 N 3.05 -0.60 0.00 6.12 7.99 -1.26 0.26 117.00 132.55 1j7m n LEU 22 Ca -0.18 -0.85 0.00 0.00 -0.01 0.00 0.00 56.01 54.98 1j7m n LEU 22 Cb 0.52 -1.07 0.00 0.00 -0.11 0.00 0.00 43.42 42.77 1j7m n LEU 22 CO 0.28 0.20 0.00 0.61 -1.51 0.00 0.00 177.39 176.97 1j7m n GLY 23 N -1.52 0.43 3.56 -0.72 0.00 -1.26 -5.08 105.19 100.60 1j7m n GLY 23 Ca -0.08 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.68 1j7m n GLY 23 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1j7m s ASN 24 N -2.00 4.15 -0.23 1.61 0.01 0.14 -5.11 114.94 113.52 1j7m s ASN 24 Ca 0.00 -0.68 -0.18 0.00 -0.71 0.00 0.00 52.86 51.28 1j7m s ASN 24 Cb 0.00 -0.65 -0.03 0.00 0.41 0.00 0.00 41.25 40.98 1j7m s ASN 24 CO 0.00 0.07 0.53 -0.54 -1.51 0.00 0.00 177.10 175.65 1j7m s LYS 25 N -3.10 4.14 -0.28 -0.60 -0.14 -1.26 -0.48 119.74 118.01 1j7m s LYS 25 Ca 0.27 0.40 -0.01 0.00 -1.36 0.00 0.00 55.97 55.26 1j7m s LYS 25 Cb -0.08 -3.60 0.04 0.00 -1.68 0.00 0.00 37.83 32.51 1j7m s LYS 25 CO 0.16 -0.25 -0.02 0.71 -0.76 0.00 0.00 175.35 175.18 1j7m s TYR 26 N 1.98 3.22 -1.12 3.18 1.51 0.16 -4.92 117.35 121.35 1j7m s TYR 26 Ca 0.23 -1.83 0.25 0.00 -1.01 0.00 0.00 57.07 54.71 1j7m s TYR 26 Cb -0.15 -2.08 0.45 0.00 -0.11 0.00 0.00 41.96 40.07 1j7m s TYR 26 CO 0.09 -0.79 1.38 0.39 -1.11 0.00 0.00 175.55 175.51 1j7m n GLU 27 N 4.62 0.14 -1.31 -0.62 1.02 -1.26 0.34 120.64 123.57 1j7m n GLU 27 Ca -0.14 -0.09 0.00 0.00 -0.02 0.00 0.00 57.16 56.91 1j7m n GLU 27 Cb 0.44 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.36 1j7m n GLU 27 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1j7m n SER 28 N -1.36 0.11 -4.73 1.62 3.41 -1.26 -4.84 113.62 106.57 1j7m n SER 28 Ca 0.06 -0.66 -0.29 0.00 -0.26 0.00 0.00 58.87 57.73 1j7m n SER 28 Cb 0.34 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.43 1j7m n SER 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1j7m s THR 30 N -3.03 0.00 -0.08 0.00 -1.32 -0.20 -4.95 115.64 106.06 1j7m s THR 30 Ca 0.64 -1.66 0.11 0.00 -1.21 0.00 0.00 61.69 59.57 1j7m s THR 30 Cb -0.17 -2.44 0.18 0.00 -1.51 0.00 0.00 72.50 68.56 1j7m s THR 30 CO 0.56 0.00 1.08 -1.54 -2.21 0.00 0.00 174.62 172.51 1j7m n SER 31 N -0.75 1.51 -4.77 8.08 3.41 -1.26 0.71 113.62 120.55 1j7m n SER 31 Ca 0.01 -2.64 -0.41 0.00 -0.26 0.00 0.00 58.87 55.57 1j7m n SER 31 Cb 0.63 -0.33 -0.01 0.00 -0.26 0.00 0.00 64.21 64.24 1j7m n SER 31 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1j7m s ALA 32 N -1.79 3.56 0.00 7.33 0.00 -1.26 -2.29 121.76 127.31 1j7m s ALA 32 Ca 0.19 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.63 1j7m s ALA 32 Cb 0.17 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.72 1j7m s ALA 32 CO 0.02 -0.92 0.00 0.41 0.00 0.00 0.00 175.76 175.26 1j7m n GLY 33 N 0.69 0.73 3.73 0.00 0.00 -1.26 -4.98 105.19 104.10 1j7m n GLY 33 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 1j7m n GLY 33 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1j7m s ARG 34 N -0.33 3.02 0.00 1.61 0.52 -0.97 -4.99 118.95 117.81 1j7m s ARG 34 Ca 0.00 -0.44 0.12 0.00 -0.52 0.00 0.00 55.73 54.90 1j7m s ARG 34 Cb 0.00 -2.83 0.08 0.00 0.52 0.00 0.00 34.95 32.71 1j7m s ARG 34 CO 0.00 0.68 0.85 0.43 0.02 0.00 0.00 175.30 177.29 1j7m n SER 35 N 1.70 1.89 0.00 0.23 7.64 -1.26 -4.82 113.62 119.01 1j7m n SER 35 Ca -0.16 -1.45 0.00 0.00 1.01 0.00 0.00 58.87 58.27 1j7m n SER 35 Cb 0.53 0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.83 1j7m n SER 35 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1j7m n ASP 36 N 0.51 0.00 0.00 6.43 5.68 -1.26 -5.06 116.55 122.85 1j7m n ASP 36 Ca 0.07 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.36 1j7m n ASP 36 Cb 0.30 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.28 1j7m n ASP 36 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1j7m n GLY 37 N 2.79 0.00 3.62 6.12 0.00 -1.26 -5.11 105.19 111.35 1j7m n GLY 37 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1j7m n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j7m s LYS 38 N 0.00 3.81 0.50 1.61 -0.14 -1.26 -4.99 119.74 119.27 1j7m s LYS 38 Ca 0.00 1.34 -0.20 0.00 -1.36 0.00 0.00 55.97 55.74 1j7m s LYS 38 Cb 0.00 -3.96 -0.08 0.00 -1.68 0.00 0.00 37.83 32.11 1j7m s LYS 38 CO 0.00 -1.26 1.06 -1.64 -0.76 0.00 0.00 175.35 172.75 1j7m s MET 39 N 4.48 3.71 0.00 1.68 -1.94 -1.26 -4.82 119.30 121.14 1j7m s MET 39 Ca 0.62 1.42 0.00 0.00 -1.71 0.00 0.00 55.69 56.02 1j7m s MET 39 Cb -0.19 -2.08 0.00 0.00 2.01 0.00 0.00 34.83 34.57 1j7m s MET 39 CO 0.27 -0.52 0.00 -2.67 -0.01 0.00 0.00 175.02 172.09 1j7m n TRP 40 N -1.03 0.00 -3.48 -0.03 4.27 0.22 0.51 117.44 117.89 1j7m n TRP 40 Ca 0.10 0.00 -0.16 0.00 -3.89 0.00 0.00 57.50 53.55 1j7m n TRP 40 Cb 0.52 0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 30.43 1j7m n TRP 40 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1j7m s ALA 42 N -2.16 3.55 -1.38 0.00 0.00 -1.26 -0.40 121.76 120.11 1j7m s ALA 42 Ca -0.06 -0.07 0.19 0.00 0.00 0.00 0.00 51.96 52.02 1j7m s ALA 42 Cb -0.00 -2.58 0.70 0.00 0.00 0.00 0.00 23.12 21.24 1j7m s ALA 42 CO 0.01 0.43 1.61 0.25 0.00 0.00 0.00 175.76 178.06 1j7m n THR 43 N 0.81 1.60 -4.06 0.00 -2.24 -0.08 -0.86 114.28 109.45 1j7m n THR 43 Ca -0.05 -1.12 -0.13 0.00 -2.27 0.00 0.00 64.05 60.48 1j7m n THR 43 Cb 0.52 0.22 -0.12 0.00 -2.10 0.00 0.00 70.33 68.84 1j7m n THR 43 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1j7m s THR 44 N -1.63 0.43 0.18 4.28 -4.23 -1.26 -4.53 115.64 108.87 1j7m s THR 44 Ca 0.51 -0.83 -0.15 0.00 -1.18 0.00 0.00 61.69 60.04 1j7m s THR 44 Cb 0.31 -0.48 0.11 0.00 1.34 0.00 0.00 72.50 73.78 1j7m s THR 44 CO 0.27 -0.28 1.68 0.00 -0.54 0.00 0.00 174.62 175.75 1j7m h ALA 45 N 4.90 0.40 -3.34 3.99 0.00 -1.88 -3.35 119.26 119.98 1j7m h ALA 45 Ca -0.33 0.14 -0.68 0.00 0.00 0.00 0.00 54.91 54.04 1j7m h ALA 45 Cb 1.20 0.26 -0.31 0.00 0.00 0.00 0.00 17.79 18.93 1j7m h ALA 45 CO 0.43 -0.40 -0.70 1.21 0.00 0.00 0.00 179.25 179.79 1j7m s ASN 46 N -5.25 4.79 0.10 0.00 3.84 -1.26 -1.76 114.94 115.40 1j7m s ASN 46 Ca -0.14 -1.07 -0.13 0.00 0.21 0.00 0.00 52.86 51.73 1j7m s ASN 46 Cb 0.15 -1.73 -0.15 0.00 -0.55 0.00 0.00 41.25 38.97 1j7m s ASN 46 CO 0.72 -0.22 1.31 0.22 -2.79 0.00 0.00 177.10 176.34 1j7m h TYR 47 N 8.05 1.07 -1.07 0.43 3.20 -1.60 -3.23 116.97 123.82 1j7m h TYR 47 Ca -0.26 -0.46 0.29 0.00 3.14 0.00 0.00 58.73 61.43 1j7m h TYR 47 Cb 1.08 -0.17 -0.10 0.00 1.54 0.00 0.00 36.73 39.09 1j7m h TYR 47 CO 0.60 1.30 0.69 -0.44 -1.64 0.00 0.00 178.16 178.67 1j7m h ASP 48 N 0.54 0.40 0.00 -2.11 3.32 -1.94 0.76 116.42 117.39 1j7m h ASP 48 Ca -0.05 0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1j7m h ASP 48 Cb 1.37 0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.95 1j7m h ASP 48 CO 0.15 0.05 -0.00 0.44 -1.72 0.00 0.00 179.24 178.16 1j7m h ASP 49 N 0.34 0.00 1.42 6.45 5.19 -1.93 -3.40 116.42 124.49 1j7m h ASP 49 Ca 0.62 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.97 1j7m h ASP 49 Cb 1.65 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 41.15 1j7m h ASP 49 CO -0.30 0.08 -0.27 0.44 -3.12 0.00 0.00 179.24 176.08 1j7m h ASP 50 N -0.16 0.00 -6.69 6.45 5.19 -1.57 -3.48 116.42 116.16 1j7m h ASP 50 Ca 0.00 0.00 -0.54 0.00 -0.62 0.00 0.00 57.03 55.87 1j7m h ASP 50 Cb 0.00 0.00 -0.10 0.00 0.18 0.00 0.00 39.33 39.41 1j7m h ASP 50 CO 0.00 0.27 -0.92 0.54 -3.12 0.00 0.00 179.24 176.01 1j7m n ARG 51 N -3.24 -2.38 -3.90 3.56 1.74 0.26 -4.95 116.66 107.76 1j7m n ARG 51 Ca 0.02 0.29 -0.35 0.00 -0.77 0.00 0.00 57.85 57.04 1j7m n ARG 51 Cb 0.57 -4.15 -0.14 0.00 -1.02 0.00 0.00 32.46 27.72 1j7m n ARG 51 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1j7m s LYS 52 N -6.83 3.11 0.32 5.56 1.02 -1.26 -5.03 119.74 116.63 1j7m s LYS 52 Ca 0.03 -0.81 0.04 0.00 0.02 0.00 0.00 55.97 55.25 1j7m s LYS 52 Cb -0.01 -3.07 -0.06 0.00 -0.52 0.00 0.00 37.83 34.16 1j7m s LYS 52 CO 0.93 -0.32 0.05 1.67 -0.92 0.00 0.00 175.35 176.75 1j7m s TRP 53 N 1.42 1.98 -0.26 3.18 1.48 -1.26 -0.90 118.94 124.58 1j7m s TRP 53 Ca 0.03 -0.94 -0.22 0.00 -1.06 0.00 0.00 56.10 53.92 1j7m s TRP 53 Cb -0.16 -1.29 0.07 0.00 -1.16 0.00 0.00 33.47 30.93 1j7m s TRP 53 CO -0.03 0.03 0.68 0.20 -4.06 0.00 0.00 176.95 173.78 1j7m s GLY 54 N -3.49 -0.54 0.88 3.67 0.00 0.47 -1.75 107.32 106.55 1j7m s GLY 54 Ca 0.36 2.05 -0.12 0.00 0.00 0.00 0.00 44.72 47.01 1j7m s GLY 54 CO 0.15 1.84 1.03 0.69 0.00 0.00 0.00 173.10 176.82 1j7m n PHE 55 N 3.11 0.60 -3.40 1.90 3.72 0.64 0.10 117.46 124.12 1j7m n PHE 55 Ca -0.16 0.38 -0.33 0.00 -0.05 0.00 0.00 57.45 57.29 1j7m n PHE 55 Cb 0.56 -2.00 -0.05 0.00 -0.94 0.00 0.00 39.48 37.04 1j7m n PHE 55 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1j7m n PRO 57 N 0.14 0.00 -1.56 0.00 -0.04 -1.26 -4.65 135.00 127.64 1j7m n PRO 57 Ca -0.01 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.05 1j7m n PRO 57 Cb 0.52 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.94 1j7m n PRO 57 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1j7m n ASP 58 N 0.00 2.51 -0.05 3.54 2.03 -1.26 -4.76 116.55 118.56 1j7m n ASP 58 Ca 0.00 -0.17 0.11 0.00 0.52 0.00 0.00 54.79 55.25 1j7m n ASP 58 Cb 0.00 -1.52 0.01 0.00 -0.72 0.00 0.00 41.12 38.89 1j7m n ASP 58 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1j7m n GLN 59 N 8.84 0.13 0.00 -0.67 6.02 -1.26 -5.14 117.38 125.30 1j7m n GLN 59 Ca 0.37 -0.10 0.00 0.00 -0.01 0.00 0.00 57.00 57.26 1j7m n GLN 59 Cb 0.46 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.23 1j7m n GLN 59 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46