#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j7m n TRP 2 N 0.00 -1.68 -1.06 7.33 -0.00 -1.26 -4.55 117.44 116.22 1j7m n TRP 2 Ca 0.00 0.91 -0.31 0.00 -0.00 0.00 0.00 57.50 58.10 1j7m n TRP 2 Cb 0.00 -1.75 -0.03 0.00 -0.00 0.00 0.00 31.31 29.53 1j7m n TRP 2 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1j7m n MET 3 N -1.77 2.98 -2.70 5.87 0.00 -1.26 -4.89 117.12 115.35 1j7m n MET 3 Ca 0.00 -1.85 -0.22 0.00 0.00 0.00 0.00 57.70 55.63 1j7m n MET 3 Cb 0.16 -2.62 0.08 0.00 0.00 0.00 0.00 33.22 30.84 1j7m n MET 3 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 1j7m s SER 4 N 2.66 4.70 0.45 3.17 1.04 -1.26 -3.73 113.70 120.73 1j7m s SER 4 Ca 0.57 -0.41 0.07 0.00 0.48 0.00 0.00 55.95 56.66 1j7m s SER 4 Cb 0.15 -0.11 -0.02 0.00 0.10 0.00 0.00 66.02 66.14 1j7m s SER 4 CO -0.05 -1.60 0.30 0.42 0.98 0.00 0.00 173.24 173.29 1j7m s THR 5 N -2.95 2.20 0.00 2.02 -4.23 -1.17 -4.77 115.64 106.74 1j7m s THR 5 Ca 0.63 -1.54 0.00 0.00 -1.18 0.00 0.00 61.69 59.61 1j7m s THR 5 Cb -0.06 -2.74 0.00 0.00 1.34 0.00 0.00 72.50 71.04 1j7m s THR 5 CO 0.42 0.00 0.00 0.52 -0.54 0.00 0.00 174.62 175.02 1j7m n VAL 6 N -1.48 0.00 0.00 2.29 0.31 -1.02 -4.80 118.33 113.63 1j7m n VAL 6 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1j7m n VAL 6 Cb 0.64 -0.32 0.00 0.00 -0.91 0.00 0.00 33.84 33.25 1j7m n VAL 6 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1j7m n GLY 7 N 5.00 2.01 4.15 2.92 0.00 -1.26 0.11 105.19 118.13 1j7m n GLY 7 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 0.69 0.99 -0.02 0.00 -1.26 -4.59 105.19 101.00 1j7m n GLY 8 Ca 0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.35 -0.35 0.02 1.61 2.04 -0.52 -4.92 115.26 111.79 1j7m n ASN 9 Ca 0.00 -1.83 -0.12 0.00 -0.44 0.00 0.00 54.58 52.19 1j7m n ASN 9 Cb 0.00 0.09 -0.14 0.00 -2.53 0.00 0.00 39.78 37.20 1j7m n ASN 9 CO 0.00 0.00 0.00 0.77 -0.44 0.00 0.00 177.26 177.59 1j7m h SER 10 N 0.21 0.16 0.00 0.53 4.64 -1.80 -3.48 113.55 113.81 1j7m h SER 10 Ca -0.37 -0.27 0.00 0.00 -0.47 0.00 0.00 61.79 60.68 1j7m h SER 10 Cb 1.44 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 1j7m h SER 10 CO -0.14 1.24 0.00 0.61 -0.87 0.00 0.00 176.83 177.66 1j7m n GLY 11 N 1.61 2.25 0.34 -0.77 0.00 -1.26 -3.53 105.19 103.83 1j7m n GLY 11 Ca -0.16 -0.15 0.01 0.00 0.00 0.00 0.00 46.02 45.72 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 0.36 3.77 -0.02 0.00 -1.26 -4.54 105.19 103.50 1j7m n GLY 12 Ca 0.00 -0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.35 3.33 0.65 4.61 0.00 -1.23 -4.49 121.76 124.28 1j7m s ALA 13 Ca 0.03 0.48 -0.08 0.00 0.00 0.00 0.00 51.96 52.40 1j7m s ALA 13 Cb 0.03 -3.10 0.02 0.00 0.00 0.00 0.00 23.12 20.07 1j7m s ALA 13 CO 0.00 0.23 0.99 -1.25 0.00 0.00 0.00 175.76 175.73 1j7m s PRO 14 N -1.52 2.75 0.16 0.00 0.04 -1.24 -3.02 135.00 132.16 1j7m s PRO 14 Ca 0.43 0.10 -0.30 0.00 0.04 0.00 0.00 61.00 61.26 1j7m s PRO 14 Cb -0.22 -2.17 -0.07 0.00 0.04 0.00 0.00 34.50 32.08 1j7m s PRO 14 CO 0.27 -0.92 0.96 0.00 0.04 0.00 0.00 177.00 177.34 1j7m s VAL 16 N -0.46 5.03 -0.08 0.00 1.01 0.41 -4.95 120.40 121.37 1j7m s VAL 16 Ca 0.45 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 61.90 1j7m s VAL 16 Cb -0.24 -4.16 -0.03 0.00 0.00 0.00 0.00 36.38 31.95 1j7m s VAL 16 CO 0.31 -0.60 -0.09 -0.36 0.00 0.00 0.00 175.10 174.36 1j7m s PHE 17 N 2.23 2.88 -0.01 5.22 0.08 -1.26 -2.21 117.98 124.90 1j7m s PHE 17 Ca 0.12 -0.10 -0.21 0.00 0.12 0.00 0.00 56.93 56.86 1j7m s PHE 17 Cb -0.19 -1.73 -0.05 0.00 -0.57 0.00 0.00 43.02 40.48 1j7m s PHE 17 CO 0.12 0.22 0.61 -1.25 -0.10 0.00 0.00 175.22 174.82 1j7m s PRO 18 N -0.59 4.34 0.00 0.24 0.05 -1.26 -5.07 135.00 132.72 1j7m s PRO 18 Ca 0.09 0.76 0.00 0.00 0.05 0.00 0.00 61.00 61.89 1j7m s PRO 18 Cb -0.12 -3.36 0.00 0.00 0.05 0.00 0.00 34.50 31.07 1j7m s PRO 18 CO 0.02 0.32 0.00 1.97 0.05 0.00 0.00 177.00 179.36 1j7m n PHE 19 N 2.89 -2.61 -3.71 0.56 -1.74 0.28 -4.77 117.46 108.36 1j7m n PHE 19 Ca -0.06 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.71 1j7m n PHE 19 Cb 0.51 0.00 -0.13 0.00 1.52 0.00 0.00 39.48 41.38 1j7m n PHE 19 CO 0.00 0.00 0.00 0.99 -0.56 0.00 0.00 176.76 177.19 1j7m s THR 20 N 0.89 -0.14 0.02 1.97 2.01 -1.08 0.66 115.64 119.98 1j7m s THR 20 Ca 0.00 0.17 0.05 0.00 0.31 0.00 0.00 61.69 62.22 1j7m s THR 20 Cb 0.00 -0.43 -0.02 0.00 0.01 0.00 0.00 72.50 72.06 1j7m s THR 20 CO 0.00 0.07 -0.14 0.12 -0.69 0.00 0.00 174.62 173.98 1j7m s PHE 21 N 1.58 1.22 -1.08 4.92 5.36 0.43 -2.02 117.98 128.39 1j7m s PHE 21 Ca -0.07 -0.32 -0.14 0.00 -0.96 0.00 0.00 56.93 55.45 1j7m s PHE 21 Cb -0.11 -0.74 0.14 0.00 -0.34 0.00 0.00 43.02 41.97 1j7m s PHE 21 CO -0.09 0.02 0.34 1.28 -1.46 0.00 0.00 175.22 175.31 1j7m n LEU 22 N 2.15 -0.47 0.00 6.12 7.99 -1.26 0.83 117.00 132.36 1j7m n LEU 22 Ca -0.17 -0.55 0.00 0.00 -0.01 0.00 0.00 56.01 55.28 1j7m n LEU 22 Cb 0.55 -1.25 0.00 0.00 -0.11 0.00 0.00 43.42 42.61 1j7m n LEU 22 CO 0.23 0.06 0.00 0.61 -1.51 0.00 0.00 177.39 176.78 1j7m n GLY 23 N -0.80 1.71 3.65 -0.72 0.00 -1.26 -5.05 105.19 102.72 1j7m n GLY 23 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.30 5.34 -0.08 1.61 0.01 0.24 -5.08 114.94 114.69 1j7m s ASN 24 Ca 0.00 0.10 -0.30 0.00 -0.71 0.00 0.00 52.86 51.96 1j7m s ASN 24 Cb 0.00 -1.69 -0.02 0.00 0.41 0.00 0.00 41.25 39.95 1j7m s ASN 24 CO 0.00 0.29 1.05 -0.54 -1.51 0.00 0.00 177.10 176.39 1j7m s LYS 25 N -0.37 4.43 -0.30 -0.60 1.02 -1.26 -0.43 119.74 122.24 1j7m s LYS 25 Ca 0.08 1.46 -0.07 0.00 0.02 0.00 0.00 55.97 57.46 1j7m s LYS 25 Cb -0.12 -3.53 0.01 0.00 -0.52 0.00 0.00 37.83 33.67 1j7m s LYS 25 CO 0.02 -0.30 0.08 0.71 -0.92 0.00 0.00 175.35 174.93 1j7m s TYR 26 N 1.88 3.15 -0.22 3.18 2.02 0.21 -4.90 117.35 122.68 1j7m s TYR 26 Ca 0.51 -1.01 0.22 0.00 -0.37 0.00 0.00 57.07 56.41 1j7m s TYR 26 Cb -0.20 -2.25 -0.02 0.00 -0.40 0.00 0.00 41.96 39.08 1j7m s TYR 26 CO 0.20 -0.59 1.00 0.39 -1.57 0.00 0.00 175.55 174.99 1j7m n GLU 27 N 4.86 0.61 -3.51 -0.62 1.02 -1.26 -0.55 120.64 121.18 1j7m n GLU 27 Ca -0.14 0.12 -0.17 0.00 -0.02 0.00 0.00 57.16 56.94 1j7m n GLU 27 Cb 0.48 -1.81 -0.04 0.00 -0.02 0.00 0.00 31.44 30.04 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 -2.67 1.93 -4.71 1.62 3.41 -1.26 -4.83 113.62 107.10 1j7m n SER 28 Ca -0.01 -2.31 -0.30 0.00 -0.26 0.00 0.00 58.87 55.99 1j7m n SER 28 Cb 0.57 0.43 0.13 0.00 -0.26 0.00 0.00 64.21 65.08 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 -2.84 0.18 -0.10 0.00 -1.32 0.28 -4.93 115.64 106.91 1j7m s THR 30 Ca 0.63 -2.00 0.14 0.00 -1.21 0.00 0.00 61.69 59.25 1j7m s THR 30 Cb -0.19 -2.54 0.24 0.00 -1.51 0.00 0.00 72.50 68.51 1j7m s THR 30 CO 0.57 0.00 1.12 -1.54 -2.21 0.00 0.00 174.62 172.57 1j7m n SER 31 N -0.47 1.60 -4.77 8.08 3.41 -1.26 0.56 113.62 120.77 1j7m n SER 31 Ca 0.02 -2.86 -0.40 0.00 -0.26 0.00 0.00 58.87 55.36 1j7m n SER 31 Cb 0.66 -0.38 -0.02 0.00 -0.26 0.00 0.00 64.21 64.21 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 -2.04 3.45 0.00 7.33 0.00 -1.26 -2.42 121.76 126.82 1j7m s ALA 32 Ca 0.25 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.48 1j7m s ALA 32 Cb 0.23 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.86 1j7m s ALA 32 CO -0.00 -0.71 0.00 0.41 0.00 0.00 0.00 175.76 175.46 1j7m n GLY 33 N 0.74 1.37 3.55 0.00 0.00 -1.26 -4.98 105.19 104.61 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 -0.13 3.21 0.00 1.61 0.52 -1.01 -4.98 118.95 118.16 1j7m s ARG 34 Ca 0.00 -0.52 0.21 0.00 -0.52 0.00 0.00 55.73 54.90 1j7m s ARG 34 Cb 0.00 -2.76 0.21 0.00 0.52 0.00 0.00 34.95 32.91 1j7m s ARG 34 CO 0.00 0.47 1.20 0.45 0.02 0.00 0.00 175.30 177.44 1j7m n SER 35 N 2.82 2.85 0.00 0.23 2.88 -1.26 -4.72 113.62 116.42 1j7m n SER 35 Ca -0.18 -1.89 0.00 0.00 -1.33 0.00 0.00 58.87 55.47 1j7m n SER 35 Cb 0.53 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 1j7m n SER 35 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1j7m n ASP 36 N 1.21 0.00 0.00 -3.46 5.68 -1.26 -5.06 116.55 113.66 1j7m n ASP 36 Ca 0.13 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.42 1j7m n ASP 36 Cb 0.53 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 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 2.64 0.00 3.55 6.12 0.00 -1.26 -5.10 105.19 111.15 1j7m n GLY 37 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 2.15 0.29 1.61 1.02 -1.26 -4.93 119.74 118.62 1j7m s LYS 38 Ca 0.00 1.15 -0.29 0.00 0.02 0.00 0.00 55.97 56.85 1j7m s LYS 38 Cb 0.00 -4.58 -0.10 0.00 -0.52 0.00 0.00 37.83 32.63 1j7m s LYS 38 CO 0.00 -3.30 1.24 -1.64 -0.92 0.00 0.00 175.35 170.73 1j7m s MET 39 N 8.09 4.46 0.00 1.68 -1.94 -1.26 -4.82 119.30 125.51 1j7m s MET 39 Ca 0.91 2.05 0.00 0.00 -1.71 0.00 0.00 55.69 56.94 1j7m s MET 39 Cb -0.16 -3.13 0.00 0.00 2.01 0.00 0.00 34.83 33.55 1j7m s MET 39 CO 0.23 -0.06 0.00 -2.67 -0.01 0.00 0.00 175.02 172.51 1j7m n TRP 40 N 1.24 0.00 -3.58 -0.03 4.27 0.19 -0.21 117.44 119.32 1j7m n TRP 40 Ca 0.01 0.00 -0.17 0.00 -3.89 0.00 0.00 57.50 53.45 1j7m n TRP 40 Cb 0.43 0.00 -0.07 0.00 -1.36 0.00 0.00 31.31 30.31 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 -1.23 3.32 -1.56 0.00 0.00 -1.26 -0.94 121.76 120.09 1j7m s ALA 42 Ca -0.12 0.13 0.19 0.00 0.00 0.00 0.00 51.96 52.17 1j7m s ALA 42 Cb -0.01 -2.84 0.58 0.00 0.00 0.00 0.00 23.12 20.85 1j7m s ALA 42 CO 0.09 0.31 1.49 0.25 0.00 0.00 0.00 175.76 177.89 1j7m n THR 43 N -0.02 1.16 -4.17 0.00 -2.24 0.04 -0.45 114.28 108.61 1j7m n THR 43 Ca 0.02 -1.05 -0.18 0.00 -2.27 0.00 0.00 64.05 60.57 1j7m n THR 43 Cb 0.52 0.42 -0.12 0.00 -2.10 0.00 0.00 70.33 69.06 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 -1.18 1.08 0.22 4.28 -4.23 -1.25 -4.55 115.64 110.00 1j7m s THR 44 Ca 0.43 -1.28 -0.09 0.00 -1.18 0.00 0.00 61.69 59.58 1j7m s THR 44 Cb 0.24 -1.04 0.16 0.00 1.34 0.00 0.00 72.50 73.20 1j7m s THR 44 CO 0.27 -0.23 1.83 0.00 -0.54 0.00 0.00 174.62 175.96 1j7m h ALA 45 N 4.32 0.97 -3.66 3.99 0.00 -1.91 -3.36 119.26 119.61 1j7m h ALA 45 Ca -0.40 -0.00 -0.68 0.00 0.00 0.00 0.00 54.91 53.83 1j7m h ALA 45 Cb 1.19 -0.18 -0.35 0.00 0.00 0.00 0.00 17.79 18.45 1j7m h ALA 45 CO 0.40 0.15 -0.74 1.21 0.00 0.00 0.00 179.25 180.27 1j7m s ASN 46 N -5.68 4.70 0.12 0.00 3.84 -1.26 -2.65 114.94 114.02 1j7m s ASN 46 Ca -0.13 -1.41 -0.03 0.00 0.21 0.00 0.00 52.86 51.51 1j7m s ASN 46 Cb 0.16 -1.64 -0.13 0.00 -0.55 0.00 0.00 41.25 39.09 1j7m s ASN 46 CO 0.77 -0.25 1.27 0.22 -2.79 0.00 0.00 177.10 176.32 1j7m h TYR 47 N 7.88 0.52 -0.95 0.43 3.20 -1.56 -3.19 116.97 123.30 1j7m h TYR 47 Ca -0.19 -0.31 0.22 0.00 3.14 0.00 0.00 58.73 61.60 1j7m h TYR 47 Cb 1.05 -0.05 -0.07 0.00 1.54 0.00 0.00 36.73 39.20 1j7m h TYR 47 CO 0.62 1.16 0.63 -0.44 -1.64 0.00 0.00 178.16 178.48 1j7m h ASP 48 N 0.16 0.40 0.00 -2.11 3.32 -1.91 0.20 116.42 116.47 1j7m h ASP 48 Ca -0.09 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1j7m h ASP 48 Cb 1.68 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 41.21 1j7m h ASP 48 CO 0.17 0.14 0.00 0.47 -1.72 0.00 0.00 179.24 178.30 1j7m n ASP 49 N -4.52 0.00 0.28 6.45 8.00 -1.24 -4.55 116.55 120.97 1j7m n ASP 49 Ca 0.21 0.11 0.19 0.00 0.71 0.00 0.00 54.79 56.00 1j7m n ASP 49 Cb 0.77 -0.16 0.87 0.00 -0.02 0.00 0.00 41.12 42.57 1j7m n ASP 49 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1j7m h ASP 50 N 0.00 0.00 -7.00 -2.24 5.19 -1.63 -3.47 116.42 107.27 1j7m h ASP 50 Ca 0.00 0.00 -0.59 0.00 -0.62 0.00 0.00 57.03 55.82 1j7m h ASP 50 Cb 0.00 0.00 -0.12 0.00 0.18 0.00 0.00 39.33 39.39 1j7m h ASP 50 CO 0.00 0.00 -0.96 0.54 -3.12 0.00 0.00 179.24 175.70 1j7m n ARG 51 N -2.96 -0.61 -3.92 3.56 1.74 0.68 -4.94 116.66 110.21 1j7m n ARG 51 Ca -0.01 0.06 -0.35 0.00 -0.77 0.00 0.00 57.85 56.78 1j7m n ARG 51 Cb 0.19 -2.92 -0.14 0.00 -1.02 0.00 0.00 32.46 28.57 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 -7.32 3.27 0.35 5.56 1.02 -1.26 -5.06 119.74 116.29 1j7m s LYS 52 Ca 0.22 -0.69 0.03 0.00 0.02 0.00 0.00 55.97 55.55 1j7m s LYS 52 Cb -0.12 -2.98 -0.05 0.00 -0.52 0.00 0.00 37.83 34.16 1j7m s LYS 52 CO 0.95 -0.23 0.09 1.67 -0.92 0.00 0.00 175.35 176.91 1j7m s TRP 53 N 1.45 1.84 -0.20 3.18 1.48 -1.26 -0.78 118.94 124.65 1j7m s TRP 53 Ca 0.05 -1.11 -0.28 0.00 -1.06 0.00 0.00 56.10 53.70 1j7m s TRP 53 Cb -0.15 -1.19 0.10 0.00 -1.16 0.00 0.00 33.47 31.07 1j7m s TRP 53 CO -0.04 -0.15 0.86 0.20 -4.06 0.00 0.00 176.95 173.76 1j7m s GLY 54 N -3.51 -0.37 0.81 3.67 0.00 -0.11 -1.43 107.32 106.36 1j7m s GLY 54 Ca 0.31 2.05 -0.13 0.00 0.00 0.00 0.00 44.72 46.96 1j7m s GLY 54 CO 0.15 1.43 1.18 -1.36 0.00 0.00 0.00 173.10 174.49 1j7m s PHE 55 N -0.37 1.90 0.32 1.90 0.08 0.31 0.76 117.98 122.88 1j7m s PHE 55 Ca -0.02 1.67 -0.28 0.00 0.12 0.00 0.00 56.93 58.42 1j7m s PHE 55 Cb -0.03 -3.41 -0.10 0.00 -0.57 0.00 0.00 43.02 38.92 1j7m s PHE 55 CO 0.01 -2.67 1.19 0.00 -0.10 0.00 0.00 175.22 173.66 1j7m n PRO 57 N 0.82 2.93 -1.73 0.00 -0.04 -1.26 -4.65 135.00 131.07 1j7m n PRO 57 Ca 0.00 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.28 1j7m n PRO 57 Cb 0.44 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.82 1j7m n PRO 57 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1j7m s ASP 58 N -1.72 4.08 0.16 3.54 1.11 -1.26 -4.68 116.67 117.91 1j7m s ASP 58 Ca 0.00 -0.63 0.26 0.00 0.18 0.00 0.00 52.55 52.36 1j7m s ASP 58 Cb 0.00 -2.57 0.84 0.00 1.07 0.00 0.00 42.92 42.26 1j7m s ASP 58 CO 0.00 -3.89 1.76 0.00 1.18 0.00 0.00 175.17 174.21 1j7m n GLN 59 N 8.54 0.21 0.00 8.23 10.64 -1.26 -5.27 117.38 138.47 1j7m n GLN 59 Ca 0.44 0.16 0.13 0.00 -1.83 0.00 0.00 57.00 55.90 1j7m n GLN 59 Cb 0.45 -1.73 0.34 0.00 -0.86 0.00 0.00 30.24 28.44 1j7m n GLN 59 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64