#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 0.00 -2.79 1.43 8.01 -1.26 -5.10 117.44 117.73 1j7m n TRP 2 Ca 0.00 0.00 -0.25 0.00 -1.31 0.00 0.00 57.50 55.94 1j7m n TRP 2 Cb 0.00 0.00 0.01 0.00 -2.01 0.00 0.00 31.31 29.31 1j7m n TRP 2 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.69 175.04 1j7m s MET 3 N 1.95 3.15 0.26 -0.99 -1.94 -1.26 -5.04 119.30 115.44 1j7m s MET 3 Ca 0.00 -0.20 0.09 0.00 -1.71 0.00 0.00 55.69 53.86 1j7m s MET 3 Cb 0.00 -2.45 -0.05 0.00 2.01 0.00 0.00 34.83 34.34 1j7m s MET 3 CO 0.00 -0.34 -0.13 -1.12 -0.01 0.00 0.00 175.02 173.42 1j7m s SER 4 N -4.20 3.02 0.29 3.03 0.01 -1.26 -3.29 113.70 111.30 1j7m s SER 4 Ca 0.49 -1.10 0.11 0.00 1.31 0.00 0.00 55.95 56.76 1j7m s SER 4 Cb -0.10 -0.21 -0.05 0.00 0.21 0.00 0.00 66.02 65.86 1j7m s SER 4 CO 0.41 -0.18 -0.16 0.42 0.41 0.00 0.00 173.24 174.15 1j7m s THR 5 N -2.83 2.32 0.00 1.44 -4.23 -1.21 -4.26 115.64 106.87 1j7m s THR 5 Ca 0.28 -2.32 0.00 0.00 -1.18 0.00 0.00 61.69 58.46 1j7m s THR 5 Cb -0.00 -2.39 0.00 0.00 1.34 0.00 0.00 72.50 71.45 1j7m s THR 5 CO 0.11 -0.35 0.00 0.52 -0.54 0.00 0.00 174.62 174.36 1j7m n VAL 6 N -0.65 0.00 0.00 2.29 0.31 -0.92 -4.75 118.33 114.61 1j7m n VAL 6 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1j7m n VAL 6 Cb 0.61 -0.17 0.00 0.00 -0.91 0.00 0.00 33.84 33.37 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 2.07 3.69 2.92 0.00 -1.26 0.12 105.19 117.73 1j7m n GLY 7 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 0.89 1.30 -0.02 0.00 -1.26 -4.55 105.19 101.55 1j7m n GLY 8 Ca 0.00 -0.09 -0.06 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.49 -0.94 -0.05 1.61 2.04 -0.35 -4.92 115.26 112.17 1j7m n ASN 9 Ca 0.00 -2.03 -0.22 0.00 -0.44 0.00 0.00 54.58 51.89 1j7m n ASN 9 Cb 0.00 0.32 -0.13 0.00 -2.53 0.00 0.00 39.78 37.44 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 0.23 0.20 0.00 0.53 4.64 -1.79 -3.47 113.55 113.88 1j7m h SER 10 Ca -0.53 -0.72 0.00 0.00 -0.47 0.00 0.00 61.79 60.07 1j7m h SER 10 Cb 1.42 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 1j7m h SER 10 CO -0.25 1.64 0.00 0.61 -0.87 0.00 0.00 176.83 177.96 1j7m n GLY 11 N 1.67 2.07 0.32 -0.77 0.00 -1.26 -4.04 105.19 103.17 1j7m n GLY 11 Ca -0.31 -0.40 0.03 0.00 0.00 0.00 0.00 46.02 45.34 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 1.61 3.81 -0.02 0.00 -1.26 -4.63 105.19 104.70 1j7m n GLY 12 Ca 0.00 -0.33 -0.37 0.00 0.00 0.00 0.00 46.02 45.32 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 -0.88 3.45 0.63 4.61 0.00 -1.26 -4.81 121.76 123.50 1j7m s ALA 13 Ca 0.09 0.16 -0.06 0.00 0.00 0.00 0.00 51.96 52.16 1j7m s ALA 13 Cb 0.08 -2.80 0.03 0.00 0.00 0.00 0.00 23.12 20.43 1j7m s ALA 13 CO 0.01 0.34 0.93 -1.25 0.00 0.00 0.00 175.76 175.79 1j7m s PRO 14 N -1.71 2.69 0.08 0.00 0.04 -1.21 -3.28 135.00 131.61 1j7m s PRO 14 Ca 0.39 -0.10 -0.29 0.00 0.04 0.00 0.00 61.00 61.05 1j7m s PRO 14 Cb -0.18 -2.24 -0.05 0.00 0.04 0.00 0.00 34.50 32.06 1j7m s PRO 14 CO 0.22 -0.87 0.92 0.00 0.04 0.00 0.00 177.00 177.31 1j7m s VAL 16 N 0.13 5.15 -0.03 0.00 1.01 0.30 -4.95 120.40 122.01 1j7m s VAL 16 Ca 0.46 0.15 0.06 0.00 0.00 0.00 0.00 61.98 62.65 1j7m s VAL 16 Cb -0.22 -3.83 -0.02 0.00 0.00 0.00 0.00 36.38 32.31 1j7m s VAL 16 CO 0.28 -0.08 -0.22 -0.36 0.00 0.00 0.00 175.10 174.71 1j7m s PHE 17 N 2.08 2.46 0.06 5.22 0.08 -1.26 -2.61 117.98 124.01 1j7m s PHE 17 Ca 0.13 -0.38 -0.24 0.00 0.12 0.00 0.00 56.93 56.57 1j7m s PHE 17 Cb -0.16 -1.55 -0.06 0.00 -0.57 0.00 0.00 43.02 40.68 1j7m s PHE 17 CO 0.12 0.01 0.72 -1.25 -0.10 0.00 0.00 175.22 174.73 1j7m s PRO 18 N -0.60 4.46 0.00 0.24 0.05 -1.26 -5.09 135.00 132.80 1j7m s PRO 18 Ca 0.09 1.00 0.00 0.00 0.05 0.00 0.00 61.00 62.15 1j7m s PRO 18 Cb -0.11 -3.33 0.00 0.00 0.05 0.00 0.00 34.50 31.12 1j7m s PRO 18 CO -0.00 0.38 0.00 1.97 0.05 0.00 0.00 177.00 179.40 1j7m n PHE 19 N 2.47 -2.38 -3.70 0.56 1.16 0.37 -4.86 117.46 111.08 1j7m n PHE 19 Ca -0.04 -0.01 -0.12 0.00 -1.87 0.00 0.00 57.45 55.41 1j7m n PHE 19 Cb 0.50 -0.00 -0.12 0.00 -1.61 0.00 0.00 39.48 38.25 1j7m n PHE 19 CO 0.00 0.00 0.00 0.99 -1.87 0.00 0.00 176.76 175.88 1j7m s THR 20 N 0.58 -0.17 -0.09 1.97 2.01 -1.00 0.80 115.64 119.73 1j7m s THR 20 Ca 0.00 0.17 0.04 0.00 0.31 0.00 0.00 61.69 62.21 1j7m s THR 20 Cb -0.00 -0.47 -0.01 0.00 0.01 0.00 0.00 72.50 72.03 1j7m s THR 20 CO 0.00 0.07 -0.21 0.12 -0.69 0.00 0.00 174.62 173.91 1j7m s PHE 21 N 1.67 2.60 -1.13 4.92 5.36 0.15 -1.70 117.98 129.85 1j7m s PHE 21 Ca -0.06 -0.75 -0.07 0.00 -0.96 0.00 0.00 56.93 55.08 1j7m s PHE 21 Cb -0.10 -1.70 0.07 0.00 -0.34 0.00 0.00 43.02 40.95 1j7m s PHE 21 CO -0.10 -0.24 0.18 1.28 -1.46 0.00 0.00 175.22 174.88 1j7m n LEU 22 N 3.21 -0.60 0.00 6.12 7.99 -1.26 0.41 117.00 132.87 1j7m n LEU 22 Ca -0.18 -0.84 0.00 0.00 -0.01 0.00 0.00 56.01 54.98 1j7m n LEU 22 Cb 0.52 -1.06 0.00 0.00 -0.11 0.00 0.00 43.42 42.78 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 3.06 3.47 -0.72 0.00 -1.26 -5.07 105.19 103.15 1j7m n GLY 23 Ca -0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.18 4.38 -0.02 1.61 0.01 0.16 -5.09 114.94 114.82 1j7m s ASN 24 Ca 0.00 -0.18 -0.30 0.00 -0.71 0.00 0.00 52.86 51.67 1j7m s ASN 24 Cb 0.00 -1.45 -0.04 0.00 0.41 0.00 0.00 41.25 40.17 1j7m s ASN 24 CO 0.00 0.24 1.17 -0.54 -1.51 0.00 0.00 177.10 176.46 1j7m s LYS 25 N -0.07 4.40 -0.29 -0.60 1.02 -1.26 0.31 119.74 123.25 1j7m s LYS 25 Ca -0.01 1.67 -0.01 0.00 0.02 0.00 0.00 55.97 57.65 1j7m s LYS 25 Cb -0.14 -3.48 0.05 0.00 -0.52 0.00 0.00 37.83 33.74 1j7m s LYS 25 CO 0.03 -0.35 -0.02 0.71 -0.92 0.00 0.00 175.35 174.80 1j7m s TYR 26 N 1.75 3.28 -0.97 3.18 2.02 0.24 -4.92 117.35 121.93 1j7m s TYR 26 Ca 0.56 -2.00 0.26 0.00 -0.37 0.00 0.00 57.07 55.52 1j7m s TYR 26 Cb -0.26 -2.09 0.64 0.00 -0.40 0.00 0.00 41.96 39.85 1j7m s TYR 26 CO 0.25 -0.83 1.51 0.39 -1.57 0.00 0.00 175.55 175.30 1j7m n GLU 27 N 4.57 0.03 -1.64 -0.62 1.02 -1.26 -0.48 120.64 122.26 1j7m n GLU 27 Ca -0.13 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.02 1j7m n GLU 27 Cb 0.43 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.33 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 -1.56 0.69 -4.79 1.62 3.41 -1.26 -4.80 113.62 106.93 1j7m n SER 28 Ca 0.06 -0.82 -0.29 0.00 -0.26 0.00 0.00 58.87 57.55 1j7m n SER 28 Cb 0.35 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.41 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 -3.20 0.00 -0.12 0.00 -1.32 0.12 -4.94 115.64 106.18 1j7m s THR 30 Ca 0.63 -1.66 0.17 0.00 -1.21 0.00 0.00 61.69 59.61 1j7m s THR 30 Cb -0.15 -2.33 0.26 0.00 -1.51 0.00 0.00 72.50 68.77 1j7m s THR 30 CO 0.54 -0.00 1.13 -1.54 -2.21 0.00 0.00 174.62 172.54 1j7m n SER 31 N -0.33 2.07 -4.78 8.08 3.41 -1.26 0.90 113.62 121.71 1j7m n SER 31 Ca -0.00 -2.97 -0.41 0.00 -0.26 0.00 0.00 58.87 55.23 1j7m n SER 31 Cb 0.64 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 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 -2.55 3.51 0.00 7.33 0.00 -1.26 -1.93 121.76 126.86 1j7m s ALA 32 Ca 0.28 1.57 0.00 0.00 0.00 0.00 0.00 51.96 53.82 1j7m s ALA 32 Cb 0.25 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.76 1j7m s ALA 32 CO 0.02 -1.11 0.00 0.41 0.00 0.00 0.00 175.76 175.08 1j7m n GLY 33 N 0.46 0.81 0.44 0.00 0.00 -1.26 -4.78 105.19 100.87 1j7m n GLY 33 Ca 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.01 1j7m n GLY 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j7m n ARG 34 N -2.00 0.17 -1.23 1.61 1.74 -0.81 -5.00 116.66 111.13 1j7m n ARG 34 Ca 0.00 0.07 -0.08 0.00 -0.77 0.00 0.00 57.85 57.07 1j7m n ARG 34 Cb 0.00 -0.70 -0.03 0.00 -1.02 0.00 0.00 32.46 30.71 1j7m n ARG 34 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1j7m n SER 35 N -3.33 -4.82 0.00 0.55 2.88 -1.03 -4.89 113.62 102.98 1j7m n SER 35 Ca -0.04 0.20 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 1j7m n SER 35 Cb 0.16 -3.03 0.00 0.00 -0.75 0.00 0.00 64.21 60.59 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 -0.43 0.00 0.00 -3.46 5.68 -1.26 -5.09 116.55 111.99 1j7m n ASP 36 Ca -0.08 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.21 1j7m n ASP 36 Cb 0.41 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.39 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 2.86 -0.38 3.67 6.12 0.00 -1.26 -5.10 105.19 111.10 1j7m n GLY 37 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.68 4.17 0.24 1.61 3.01 -1.26 -4.98 119.74 120.84 1j7m s LYS 38 Ca 0.00 2.40 -0.08 0.00 -1.01 0.00 0.00 55.97 57.28 1j7m s LYS 38 Cb 0.00 -3.87 -0.07 0.00 -1.01 0.00 0.00 37.83 32.88 1j7m s LYS 38 CO 0.00 -0.84 0.55 -1.64 0.51 0.00 0.00 175.35 173.93 1j7m s MET 39 N 3.58 3.76 0.00 1.68 -1.94 -1.26 -4.78 119.30 120.33 1j7m s MET 39 Ca 0.79 0.21 0.00 0.00 -1.71 0.00 0.00 55.69 54.98 1j7m s MET 39 Cb -0.40 -2.65 0.00 0.00 2.01 0.00 0.00 34.83 33.80 1j7m s MET 39 CO 0.35 0.29 0.00 -2.67 -0.01 0.00 0.00 175.02 172.98 1j7m n TRP 40 N -0.32 0.00 -3.59 -0.03 4.27 0.26 0.18 117.44 118.21 1j7m n TRP 40 Ca 0.00 0.00 -0.16 0.00 -3.89 0.00 0.00 57.50 53.45 1j7m n TRP 40 Cb 0.53 0.00 -0.07 0.00 -1.36 0.00 0.00 31.31 30.41 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 -0.25 2.92 -1.02 0.00 0.00 -1.26 -1.74 121.76 120.42 1j7m s ALA 42 Ca -0.04 0.57 0.17 0.00 0.00 0.00 0.00 51.96 52.65 1j7m s ALA 42 Cb -0.03 -3.23 0.58 0.00 0.00 0.00 0.00 23.12 20.44 1j7m s ALA 42 CO 0.04 -0.21 1.50 0.25 0.00 0.00 0.00 175.76 177.34 1j7m n THR 43 N -0.83 1.61 -4.05 0.00 -2.24 -0.72 -0.54 114.28 107.51 1j7m n THR 43 Ca 0.08 -1.24 -0.09 0.00 -2.27 0.00 0.00 64.05 60.54 1j7m n THR 43 Cb 0.53 0.20 -0.11 0.00 -2.10 0.00 0.00 70.33 68.85 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 -1.70 0.24 0.11 4.28 -4.23 -1.26 -4.54 115.64 108.54 1j7m s THR 44 Ca 0.43 -1.38 -0.20 0.00 -1.18 0.00 0.00 61.69 59.35 1j7m s THR 44 Cb 0.27 -0.93 -0.08 0.00 1.34 0.00 0.00 72.50 73.10 1j7m s THR 44 CO 0.21 -0.73 1.74 0.00 -0.54 0.00 0.00 174.62 175.30 1j7m h ALA 45 N 3.88 0.24 -3.41 3.99 0.00 -1.90 -3.38 119.26 118.68 1j7m h ALA 45 Ca -0.33 -0.04 -0.69 0.00 0.00 0.00 0.00 54.91 53.85 1j7m h ALA 45 Cb 1.18 -0.08 -0.34 0.00 0.00 0.00 0.00 17.79 18.55 1j7m h ALA 45 CO 0.53 -0.25 -0.66 1.21 0.00 0.00 0.00 179.25 180.08 1j7m s ASN 46 N -5.42 4.99 0.15 0.00 3.84 -1.26 -2.38 114.94 114.85 1j7m s ASN 46 Ca -0.13 -1.53 -0.01 0.00 0.21 0.00 0.00 52.86 51.40 1j7m s ASN 46 Cb 0.08 -1.74 -0.04 0.00 -0.55 0.00 0.00 41.25 38.99 1j7m s ASN 46 CO 0.69 -0.34 1.34 0.22 -2.79 0.00 0.00 177.10 176.22 1j7m h TYR 47 N 7.99 0.46 -1.01 0.43 5.03 -1.51 -2.75 116.97 125.61 1j7m h TYR 47 Ca -0.18 -0.25 0.26 0.00 2.58 0.00 0.00 58.73 61.14 1j7m h TYR 47 Cb 1.06 -0.05 -0.13 0.00 1.55 0.00 0.00 36.73 39.16 1j7m h TYR 47 CO 0.59 1.06 0.60 -0.44 -1.32 0.00 0.00 178.16 178.65 1j7m h ASP 48 N 0.18 0.65 0.12 -2.11 5.19 -1.92 0.64 116.42 119.17 1j7m h ASP 48 Ca -0.06 0.14 -0.36 0.00 -0.62 0.00 0.00 57.03 56.13 1j7m h ASP 48 Cb 1.53 0.04 -0.05 0.00 0.18 0.00 0.00 39.33 41.02 1j7m h ASP 48 CO 0.15 0.08 -2.20 0.47 -3.12 0.00 0.00 179.24 174.61 1j7m n ASP 49 N -4.89 1.32 -0.02 6.45 9.92 -1.24 -4.59 116.55 123.51 1j7m n ASP 49 Ca 0.27 0.08 -0.10 0.00 -0.53 0.00 0.00 54.79 54.52 1j7m n ASP 49 Cb 0.78 -0.10 -0.14 0.00 -0.64 0.00 0.00 41.12 41.02 1j7m n ASP 49 CO 0.00 0.00 0.00 0.44 0.13 0.00 0.00 177.20 177.77 1j7m h ASP 50 N 0.02 0.04 -6.51 -2.24 5.19 -1.17 -3.49 116.42 108.25 1j7m h ASP 50 Ca -0.48 -0.08 -0.51 0.00 -0.62 0.00 0.00 57.03 55.34 1j7m h ASP 50 Cb 2.04 -0.01 -0.08 0.00 0.18 0.00 0.00 39.33 41.46 1j7m h ASP 50 CO 0.01 1.07 -0.86 0.54 -3.12 0.00 0.00 179.24 176.88 1j7m n ARG 51 N -3.09 -3.53 -4.05 3.56 1.74 0.22 -4.97 116.66 106.54 1j7m n ARG 51 Ca -0.17 0.42 -0.33 0.00 -0.77 0.00 0.00 57.85 56.99 1j7m n ARG 51 Cb 1.05 -4.76 -0.15 0.00 -1.02 0.00 0.00 32.46 27.58 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 -6.61 2.95 0.33 5.56 1.02 -1.26 -5.07 119.74 116.65 1j7m s LYS 52 Ca 0.21 -0.88 0.03 0.00 0.02 0.00 0.00 55.97 55.36 1j7m s LYS 52 Cb -0.11 -2.75 -0.04 0.00 -0.52 0.00 0.00 37.83 34.40 1j7m s LYS 52 CO 0.89 -0.28 0.12 1.67 -0.92 0.00 0.00 175.35 176.83 1j7m s TRP 53 N 1.31 1.71 -0.18 3.18 1.48 -1.26 -1.76 118.94 123.41 1j7m s TRP 53 Ca 0.03 -1.24 -0.29 0.00 -1.06 0.00 0.00 56.10 53.55 1j7m s TRP 53 Cb -0.15 -1.03 0.12 0.00 -1.16 0.00 0.00 33.47 31.26 1j7m s TRP 53 CO -0.09 -0.33 0.97 0.20 -4.06 0.00 0.00 176.95 173.65 1j7m s GLY 54 N -3.45 -0.27 0.79 3.67 0.00 -0.71 -1.21 107.32 106.15 1j7m s GLY 54 Ca 0.33 2.14 -0.14 0.00 0.00 0.00 0.00 44.72 47.05 1j7m s GLY 54 CO 0.16 1.25 1.20 -1.36 0.00 0.00 0.00 173.10 174.35 1j7m s PHE 55 N -0.74 1.87 0.48 1.90 0.08 0.33 0.85 117.98 122.74 1j7m s PHE 55 Ca -0.01 1.66 -0.24 0.00 0.12 0.00 0.00 56.93 58.46 1j7m s PHE 55 Cb -0.02 -3.47 -0.07 0.00 -0.57 0.00 0.00 43.02 38.89 1j7m s PHE 55 CO 0.00 -2.78 1.32 0.00 -0.10 0.00 0.00 175.22 173.66 1j7m n PRO 57 N -0.50 0.28 -3.97 0.00 -0.04 -1.26 -4.15 135.00 125.35 1j7m n PRO 57 Ca 0.07 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.23 1j7m n PRO 57 Cb 0.45 -1.37 -0.15 0.00 -0.04 0.00 0.00 33.50 32.39 1j7m n PRO 57 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1j7m s ASP 58 N -1.93 4.56 -0.79 3.54 2.15 -1.26 -4.98 116.67 117.95 1j7m s ASP 58 Ca 0.10 -2.36 -0.02 0.00 0.43 0.00 0.00 52.55 50.70 1j7m s ASP 58 Cb 0.05 -1.56 0.36 0.00 -0.30 0.00 0.00 42.92 41.47 1j7m s ASP 58 CO 0.08 -0.34 2.05 0.00 -0.17 0.00 0.00 175.17 176.79 1j7m n GLN 59 N 3.97 2.72 0.00 4.34 1.13 -1.26 -4.89 117.38 123.39 1j7m n GLN 59 Ca 0.04 -3.42 0.00 0.00 -1.94 0.00 0.00 57.00 51.68 1j7m n GLN 59 Cb 0.39 -2.27 0.00 0.00 0.11 0.00 0.00 30.24 28.47 1j7m n GLN 59 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03