#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 -1.67 0.66 7.02 -1.26 -4.01 117.44 118.18 1j7m n TRP 2 Ca 0.00 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.06 1j7m n TRP 2 Cb 0.00 0.00 -0.01 0.00 -2.42 0.00 0.00 31.31 28.88 1j7m n TRP 2 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1j7m n MET 3 N 0.00 2.67 -1.04 -0.99 0.00 -1.26 -4.82 117.12 111.68 1j7m n MET 3 Ca 0.00 -2.51 0.00 0.00 0.00 0.00 0.00 57.70 55.19 1j7m n MET 3 Cb 0.00 -3.24 0.00 0.00 0.00 0.00 0.00 33.22 29.98 1j7m n MET 3 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 1j7m n SER 4 N 6.34 0.26 -4.75 3.17 7.64 -1.26 -4.85 113.62 120.18 1j7m n SER 4 Ca 0.52 -0.52 -0.31 0.00 1.01 0.00 0.00 58.87 59.57 1j7m n SER 4 Cb 0.39 0.00 0.11 0.00 -1.01 0.00 0.00 64.21 63.70 1j7m n SER 4 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1j7m s THR 5 N -1.33 3.06 0.04 0.44 -4.23 -0.87 -4.33 115.64 108.42 1j7m s THR 5 Ca 0.00 0.34 0.00 0.00 -1.18 0.00 0.00 61.69 60.85 1j7m s THR 5 Cb 0.00 -2.76 0.00 0.00 1.34 0.00 0.00 72.50 71.08 1j7m s THR 5 CO 0.00 -0.45 0.00 0.55 -0.54 0.00 0.00 174.62 174.18 1j7m n VAL 6 N -3.68 0.35 -0.77 2.29 3.14 -1.17 -3.34 118.33 115.15 1j7m n VAL 6 Ca 0.09 0.11 0.00 0.00 -2.96 0.00 0.00 64.34 61.59 1j7m n VAL 6 Cb 0.53 -1.40 0.00 0.00 -1.06 0.00 0.00 33.84 31.92 1j7m n VAL 6 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1j7m n GLY 7 N 2.95 -0.42 3.62 7.55 0.00 -1.26 -4.71 105.19 112.92 1j7m n GLY 7 Ca 0.00 -1.72 0.02 0.00 0.00 0.00 0.00 46.02 44.32 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 5.00 -2.03 0.16 -0.02 0.00 -1.26 -2.94 105.19 104.10 1j7m n GLY 8 Ca 0.00 -1.40 0.11 0.00 0.00 0.00 0.00 46.02 44.72 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 -0.75 1.28 0.07 1.61 2.04 -0.90 -4.45 115.26 114.16 1j7m n ASN 9 Ca 0.00 -1.10 -0.04 0.00 -0.44 0.00 0.00 54.58 53.00 1j7m n ASN 9 Cb 0.07 0.75 -0.02 0.00 -2.53 0.00 0.00 39.78 38.05 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 0.80 -0.21 -4.40 0.53 0.02 -1.71 -3.49 113.55 105.09 1j7m h SER 10 Ca 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1j7m h SER 10 Cb 0.58 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.18 1j7m h SER 10 CO 0.00 0.17 -0.59 0.61 -1.14 0.00 0.00 176.83 175.88 1j7m n GLY 11 N 1.07 -3.37 0.00 -3.77 0.00 -1.25 -4.59 105.19 93.28 1j7m n GLY 11 Ca -0.03 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.29 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 0.32 2.53 3.78 -0.02 0.00 -1.21 -5.01 105.19 105.59 1j7m n GLY 12 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.37 3.15 0.39 4.61 0.00 -1.26 -0.14 121.76 126.14 1j7m s ALA 13 Ca 0.00 0.74 -0.21 0.00 0.00 0.00 0.00 51.96 52.50 1j7m s ALA 13 Cb 0.00 -3.28 -0.10 0.00 0.00 0.00 0.00 23.12 19.73 1j7m s ALA 13 CO 0.00 -0.21 0.91 -1.25 0.00 0.00 0.00 175.76 175.20 1j7m s PRO 14 N -2.29 4.25 0.21 0.00 0.04 -1.26 -2.06 135.00 133.89 1j7m s PRO 14 Ca 0.55 1.07 -0.30 0.00 0.04 0.00 0.00 61.00 62.36 1j7m s PRO 14 Cb -0.24 -2.35 -0.08 0.00 0.04 0.00 0.00 34.50 31.87 1j7m s PRO 14 CO 0.30 0.07 0.93 0.00 0.04 0.00 0.00 177.00 178.34 1j7m s VAL 16 N -0.91 5.34 -0.02 0.00 1.01 -0.06 -4.94 120.40 120.82 1j7m s VAL 16 Ca 0.42 0.27 0.06 0.00 0.00 0.00 0.00 61.98 62.73 1j7m s VAL 16 Cb -0.25 -3.54 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 1j7m s VAL 16 CO 0.31 0.34 -0.20 -0.36 0.00 0.00 0.00 175.10 175.19 1j7m s PHE 17 N 1.03 1.78 0.04 5.22 0.08 -1.26 -2.74 117.98 122.14 1j7m s PHE 17 Ca 0.10 -0.37 -0.23 0.00 0.12 0.00 0.00 56.93 56.55 1j7m s PHE 17 Cb -0.13 -1.16 -0.06 0.00 -0.57 0.00 0.00 43.02 41.10 1j7m s PHE 17 CO 0.05 -0.05 0.69 -1.25 -0.10 0.00 0.00 175.22 174.55 1j7m s PRO 18 N -0.39 4.42 0.07 0.24 0.05 -1.26 -5.08 135.00 133.04 1j7m s PRO 18 Ca 0.06 0.93 0.01 0.00 0.05 0.00 0.00 61.00 62.05 1j7m s PRO 18 Cb -0.08 -3.33 0.01 0.00 0.05 0.00 0.00 34.50 31.14 1j7m s PRO 18 CO -0.00 0.38 0.09 1.97 0.05 0.00 0.00 177.00 179.48 1j7m n PHE 19 N 2.53 -2.69 -3.69 0.56 1.16 0.46 -4.83 117.46 110.96 1j7m n PHE 19 Ca -0.05 -0.25 -0.13 0.00 -1.87 0.00 0.00 57.45 55.15 1j7m n PHE 19 Cb 0.50 -0.06 -0.13 0.00 -1.61 0.00 0.00 39.48 38.18 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 0.46 -0.24 -0.11 1.97 2.01 -1.15 0.57 115.64 119.16 1j7m s THR 20 Ca 0.06 0.22 0.03 0.00 0.31 0.00 0.00 61.69 62.31 1j7m s THR 20 Cb -0.01 -0.42 -0.01 0.00 0.01 0.00 0.00 72.50 72.08 1j7m s THR 20 CO 0.04 0.09 -0.20 0.12 -0.69 0.00 0.00 174.62 173.98 1j7m s PHE 21 N 1.87 2.64 -1.18 4.92 5.36 0.15 -1.88 117.98 129.86 1j7m s PHE 21 Ca -0.04 -0.89 -0.08 0.00 -0.96 0.00 0.00 56.93 54.96 1j7m s PHE 21 Cb -0.11 -1.75 0.08 0.00 -0.34 0.00 0.00 43.02 40.90 1j7m s PHE 21 CO -0.09 -0.33 0.20 1.28 -1.46 0.00 0.00 175.22 174.82 1j7m n LEU 22 N 3.47 -0.62 0.00 6.12 7.99 -1.26 0.27 117.00 132.98 1j7m n LEU 22 Ca -0.19 -0.87 0.00 0.00 -0.01 0.00 0.00 56.01 54.94 1j7m n LEU 22 Cb 0.53 -1.10 0.00 0.00 -0.11 0.00 0.00 43.42 42.74 1j7m n LEU 22 CO 0.29 0.20 0.00 0.61 -1.51 0.00 0.00 177.39 176.97 1j7m n GLY 23 N -1.50 2.01 3.38 -0.72 0.00 -1.26 -5.08 105.19 102.02 1j7m n GLY 23 Ca -0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.55 3.75 -0.09 1.61 0.01 0.14 -5.10 114.94 113.72 1j7m s ASN 24 Ca 0.00 -0.34 -0.29 0.00 -0.71 0.00 0.00 52.86 51.52 1j7m s ASN 24 Cb 0.00 -1.14 -0.02 0.00 0.41 0.00 0.00 41.25 40.50 1j7m s ASN 24 CO 0.00 0.25 0.98 -0.54 -1.51 0.00 0.00 177.10 176.28 1j7m s LYS 25 N -0.16 4.44 -0.18 -0.60 1.02 -1.26 0.32 119.74 123.32 1j7m s LYS 25 Ca -0.02 1.35 -0.02 0.00 0.02 0.00 0.00 55.97 57.31 1j7m s LYS 25 Cb -0.14 -3.52 -0.01 0.00 -0.52 0.00 0.00 37.83 33.64 1j7m s LYS 25 CO 0.03 -0.25 -0.09 0.71 -0.92 0.00 0.00 175.35 174.83 1j7m s TYR 26 N 1.78 2.89 -0.15 3.18 2.02 0.19 -4.93 117.35 122.33 1j7m s TYR 26 Ca 0.48 -0.92 0.22 0.00 -0.37 0.00 0.00 57.07 56.47 1j7m s TYR 26 Cb -0.19 -1.99 -0.14 0.00 -0.40 0.00 0.00 41.96 39.24 1j7m s TYR 26 CO 0.20 -0.46 0.79 0.39 -1.57 0.00 0.00 175.55 174.89 1j7m n GLU 27 N 4.32 0.63 -2.85 -0.62 1.02 -1.26 -0.40 120.64 121.48 1j7m n GLU 27 Ca -0.19 0.01 -0.09 0.00 -0.02 0.00 0.00 57.16 56.87 1j7m n GLU 27 Cb 0.51 -1.70 -0.02 0.00 -0.02 0.00 0.00 31.44 30.20 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 -2.55 1.34 -4.70 1.62 3.41 -1.26 -4.84 113.62 106.65 1j7m n SER 28 Ca -0.03 -1.75 -0.30 0.00 -0.26 0.00 0.00 58.87 56.52 1j7m n SER 28 Cb 0.60 0.31 0.14 0.00 -0.26 0.00 0.00 64.21 65.00 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 -2.78 0.17 -0.12 0.00 -1.32 0.18 -4.91 115.64 106.86 1j7m s THR 30 Ca 0.64 -1.98 0.15 0.00 -1.21 0.00 0.00 61.69 59.29 1j7m s THR 30 Cb -0.20 -2.41 0.29 0.00 -1.51 0.00 0.00 72.50 68.67 1j7m s THR 30 CO 0.58 -0.13 1.15 -1.54 -2.21 0.00 0.00 174.62 172.47 1j7m n SER 31 N -0.27 1.71 -4.76 8.08 3.41 -1.26 0.78 113.62 121.32 1j7m n SER 31 Ca -0.00 -3.04 -0.41 0.00 -0.26 0.00 0.00 58.87 55.15 1j7m n SER 31 Cb 0.65 -0.41 -0.02 0.00 -0.26 0.00 0.00 64.21 64.18 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 -2.29 3.63 0.00 7.33 0.00 -1.26 -1.78 121.76 127.40 1j7m s ALA 32 Ca 0.29 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.67 1j7m s ALA 32 Cb 0.27 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.81 1j7m s ALA 32 CO -0.02 -0.84 0.00 0.41 0.00 0.00 0.00 175.76 175.31 1j7m n GLY 33 N 1.71 2.11 3.77 0.00 0.00 -1.26 -4.99 105.19 106.53 1j7m n GLY 33 Ca 0.05 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.02 2.46 0.00 1.61 0.52 -0.73 -5.04 118.95 117.74 1j7m s ARG 34 Ca 0.00 -1.50 0.00 0.00 -0.52 0.00 0.00 55.73 53.71 1j7m s ARG 34 Cb 0.00 -2.25 0.00 0.00 0.52 0.00 0.00 34.95 33.22 1j7m s ARG 34 CO 0.00 0.08 0.61 -1.13 0.02 0.00 0.00 175.30 174.89 1j7m n SER 35 N -1.22 0.00 0.00 0.23 3.41 -1.26 -4.99 113.62 109.78 1j7m n SER 35 Ca -0.02 -1.37 0.00 0.00 -0.26 0.00 0.00 58.87 57.21 1j7m n SER 35 Cb 0.61 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 1j7m n SER 35 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1j7m n ASP 36 N 0.00 0.00 0.00 4.04 5.68 -1.26 -5.05 116.55 119.96 1j7m n ASP 36 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1j7m n ASP 36 Cb 0.57 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.55 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 2.56 0.00 3.67 6.12 0.00 -1.26 -5.12 105.19 111.16 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 0.00 4.21 0.11 1.61 1.02 -1.26 -5.00 119.74 120.42 1j7m s LYS 38 Ca 0.00 2.12 -0.01 0.00 0.02 0.00 0.00 55.97 58.10 1j7m s LYS 38 Cb 0.00 -3.81 -0.04 0.00 -0.52 0.00 0.00 37.83 33.46 1j7m s LYS 38 CO 0.00 -0.75 0.28 -1.64 -0.92 0.00 0.00 175.35 172.31 1j7m s MET 39 N 3.38 3.48 0.01 1.68 -1.94 -1.26 -4.74 119.30 119.91 1j7m s MET 39 Ca 0.70 -0.39 0.00 0.00 -1.71 0.00 0.00 55.69 54.29 1j7m s MET 39 Cb -0.33 -2.97 -0.00 0.00 2.01 0.00 0.00 34.83 33.54 1j7m s MET 39 CO 0.28 0.54 0.01 -2.67 -0.01 0.00 0.00 175.02 173.17 1j7m n TRP 40 N -0.00 -0.09 -3.55 -0.03 4.27 0.23 -0.21 117.44 118.07 1j7m n TRP 40 Ca -0.05 -0.06 -0.15 0.00 -3.89 0.00 0.00 57.50 53.35 1j7m n TRP 40 Cb 0.52 0.01 -0.06 0.00 -1.36 0.00 0.00 31.31 30.42 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 -1.07 2.93 -2.15 0.00 0.00 -1.26 -1.74 121.76 118.46 1j7m s ALA 42 Ca -0.07 0.73 0.23 0.00 0.00 0.00 0.00 51.96 52.85 1j7m s ALA 42 Cb -0.00 -3.30 0.56 0.00 0.00 0.00 0.00 23.12 20.37 1j7m s ALA 42 CO 0.06 -0.42 1.48 0.25 0.00 0.00 0.00 175.76 177.13 1j7m n THR 43 N -0.66 0.81 -4.24 0.00 -2.24 -0.28 -0.88 114.28 106.78 1j7m n THR 43 Ca 0.08 -0.90 -0.15 0.00 -2.27 0.00 0.00 64.05 60.80 1j7m n THR 43 Cb 0.51 0.69 -0.10 0.00 -2.10 0.00 0.00 70.33 69.32 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 -1.19 1.22 0.27 4.28 -4.23 -1.26 -4.43 115.64 110.30 1j7m s THR 44 Ca 0.45 -1.92 -0.03 0.00 -1.18 0.00 0.00 61.69 59.00 1j7m s THR 44 Cb 0.24 -1.71 0.27 0.00 1.34 0.00 0.00 72.50 72.64 1j7m s THR 44 CO 0.33 -0.63 1.92 0.00 -0.54 0.00 0.00 174.62 175.70 1j7m h ALA 45 N 3.06 1.38 -3.44 3.99 0.00 -1.90 -3.38 119.26 118.97 1j7m h ALA 45 Ca -0.38 -0.05 -0.60 0.00 0.00 0.00 0.00 54.91 53.89 1j7m h ALA 45 Cb 1.19 -0.34 -0.37 0.00 0.00 0.00 0.00 17.79 18.27 1j7m h ALA 45 CO 0.59 0.53 -0.80 1.21 0.00 0.00 0.00 179.25 180.77 1j7m s ASN 46 N -6.05 3.35 0.13 0.00 3.84 -1.26 -2.91 114.94 112.04 1j7m s ASN 46 Ca -0.12 -0.89 -0.12 0.00 0.21 0.00 0.00 52.86 51.94 1j7m s ASN 46 Cb 0.19 -1.16 -0.05 0.00 -0.55 0.00 0.00 41.25 39.67 1j7m s ASN 46 CO 0.81 -0.17 1.46 0.22 -2.79 0.00 0.00 177.10 176.64 1j7m h TYR 47 N 8.00 1.07 -0.79 0.43 3.20 -1.55 -3.14 116.97 124.19 1j7m h TYR 47 Ca -0.26 -0.32 0.18 0.00 3.14 0.00 0.00 58.73 61.48 1j7m h TYR 47 Cb 1.10 -0.22 -0.05 0.00 1.54 0.00 0.00 36.73 39.09 1j7m h TYR 47 CO 0.49 1.14 0.54 -0.44 -1.64 0.00 0.00 178.16 178.25 1j7m h ASP 48 N 0.69 0.28 0.05 -2.11 5.19 -1.95 0.85 116.42 119.42 1j7m h ASP 48 Ca 0.06 0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.49 1j7m h ASP 48 Cb 0.96 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.44 1j7m h ASP 48 CO 0.09 0.13 -0.02 0.44 -3.12 0.00 0.00 179.24 176.76 1j7m h ASP 49 N 0.29 -0.05 1.22 6.45 5.19 -1.90 -3.40 116.42 124.22 1j7m h ASP 49 Ca 0.39 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.80 1j7m h ASP 49 Cb 1.11 0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.63 1j7m h ASP 49 CO -0.10 0.02 -0.66 0.44 -3.12 0.00 0.00 179.24 175.82 1j7m h ASP 50 N -0.17 0.00 -6.72 6.45 5.19 -1.53 -3.49 116.42 116.15 1j7m h ASP 50 Ca -0.01 -0.04 -0.55 0.00 -0.62 0.00 0.00 57.03 55.81 1j7m h ASP 50 Cb 0.05 0.00 -0.07 0.00 0.18 0.00 0.00 39.33 39.49 1j7m h ASP 50 CO 0.01 0.02 -0.95 0.54 -3.12 0.00 0.00 179.24 175.74 1j7m n ARG 51 N -2.64 -1.60 -4.05 3.56 1.74 0.30 -4.96 116.66 109.00 1j7m n ARG 51 Ca 0.02 0.25 -0.34 0.00 -0.77 0.00 0.00 57.85 57.01 1j7m n ARG 51 Cb 0.52 -3.74 -0.15 0.00 -1.02 0.00 0.00 32.46 28.06 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 -6.90 3.01 0.34 5.56 1.02 -1.26 -5.02 119.74 116.48 1j7m s LYS 52 Ca 0.19 -0.83 0.04 0.00 0.02 0.00 0.00 55.97 55.38 1j7m s LYS 52 Cb -0.09 -2.73 -0.06 0.00 -0.52 0.00 0.00 37.83 34.43 1j7m s LYS 52 CO 0.94 -0.25 0.06 1.67 -0.92 0.00 0.00 175.35 176.84 1j7m s TRP 53 N 1.32 2.00 -0.15 3.18 1.48 -1.26 -1.12 118.94 124.38 1j7m s TRP 53 Ca 0.04 -0.95 -0.29 0.00 -1.06 0.00 0.00 56.10 53.83 1j7m s TRP 53 Cb -0.14 -1.32 0.11 0.00 -1.16 0.00 0.00 33.47 30.96 1j7m s TRP 53 CO -0.09 0.03 0.89 0.20 -4.06 0.00 0.00 176.95 173.91 1j7m s GLY 54 N -3.51 -0.36 0.88 3.67 0.00 -0.71 -2.12 107.32 105.15 1j7m s GLY 54 Ca 0.36 1.90 -0.10 0.00 0.00 0.00 0.00 44.72 46.88 1j7m s GLY 54 CO 0.16 1.17 1.12 -1.36 0.00 0.00 0.00 173.10 174.18 1j7m s PHE 55 N -0.85 1.95 0.40 1.90 0.08 -1.15 0.32 117.98 120.63 1j7m s PHE 55 Ca -0.04 1.66 -0.25 0.00 0.12 0.00 0.00 56.93 58.43 1j7m s PHE 55 Cb -0.01 -3.23 -0.08 0.00 -0.57 0.00 0.00 43.02 39.13 1j7m s PHE 55 CO 0.03 -2.51 1.14 0.00 -0.10 0.00 0.00 175.22 173.79 1j7m n PRO 57 N 0.02 2.74 -1.66 0.00 -0.04 -1.26 -4.73 135.00 130.07 1j7m n PRO 57 Ca 0.05 0.00 -0.46 0.00 -0.04 0.00 0.00 63.50 63.04 1j7m n PRO 57 Cb 0.47 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.89 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 2.95 0.00 3.54 2.03 -1.26 -4.94 116.55 118.87 1j7m n ASP 58 Ca 0.00 1.09 0.00 0.00 0.52 0.00 0.00 54.79 56.40 1j7m n ASP 58 Cb 0.00 -1.41 0.00 0.00 -0.72 0.00 0.00 41.12 38.99 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 3.17 0.00 0.00 -0.67 6.02 -1.26 -5.23 117.38 119.41 1j7m n GLN 59 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.15 1j7m n GLN 59 Cb 0.28 -0.40 0.00 0.00 1.02 0.00 0.00 30.24 31.14 1j7m n GLN 59 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46