#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 2.95 -0.08 1.43 -0.11 -1.26 -5.00 118.94 116.87 1j7m s TRP 2 Ca 0.00 -1.24 -0.17 0.00 1.22 0.00 0.00 56.10 55.91 1j7m s TRP 2 Cb 0.00 -4.41 -0.05 0.00 -1.50 0.00 0.00 33.47 27.51 1j7m s TRP 2 CO 0.00 -1.62 0.45 -1.64 -4.62 0.00 0.00 176.95 169.52 1j7m s MET 3 N 3.36 4.22 0.36 5.86 -1.94 -1.26 -5.08 119.30 124.83 1j7m s MET 3 Ca 0.37 0.43 0.04 0.00 -1.71 0.00 0.00 55.69 54.81 1j7m s MET 3 Cb -0.03 -3.37 -0.05 0.00 2.01 0.00 0.00 34.83 33.39 1j7m s MET 3 CO -0.09 0.32 0.08 -1.12 -0.01 0.00 0.00 175.02 174.20 1j7m s SER 4 N 0.09 2.62 0.46 3.03 0.01 -1.26 -4.21 113.70 114.44 1j7m s SER 4 Ca 0.25 -1.49 0.07 0.00 1.31 0.00 0.00 55.95 56.08 1j7m s SER 4 Cb -0.16 0.14 -0.01 0.00 0.21 0.00 0.00 66.02 66.20 1j7m s SER 4 CO 0.11 -0.73 0.31 0.42 0.41 0.00 0.00 173.24 173.76 1j7m s THR 5 N -3.24 2.20 0.26 1.44 -4.23 -1.08 -4.89 115.64 106.08 1j7m s THR 5 Ca 0.31 -1.53 0.05 0.00 -1.18 0.00 0.00 61.69 59.34 1j7m s THR 5 Cb 0.06 -2.73 -0.05 0.00 1.34 0.00 0.00 72.50 71.12 1j7m s THR 5 CO 0.14 0.00 -0.04 0.54 -0.54 0.00 0.00 174.62 174.73 1j7m s VAL 6 N -2.62 1.38 0.00 2.29 0.11 -1.17 -4.44 120.40 115.95 1j7m s VAL 6 Ca 0.40 -2.08 0.00 0.00 -2.93 0.00 0.00 61.98 57.37 1j7m s VAL 6 Cb -0.00 -2.39 0.00 0.00 -1.53 0.00 0.00 36.38 32.46 1j7m s VAL 6 CO 0.23 -0.32 0.00 0.61 -3.33 0.00 0.00 175.10 172.29 1j7m n GLY 7 N -0.50 0.95 7.00 6.54 0.00 -1.26 0.22 105.19 118.14 1j7m n GLY 7 Ca -0.05 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.33 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 1.49 1.21 -0.02 0.00 -1.26 -4.29 105.19 102.32 1j7m n GLY 8 Ca 0.00 -0.47 0.02 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.11 0.49 -0.02 1.61 2.04 -0.99 -4.93 115.26 111.36 1j7m n ASN 9 Ca 0.00 -1.96 -0.02 0.00 -0.44 0.00 0.00 54.58 52.15 1j7m n ASN 9 Cb 0.00 -0.18 -0.01 0.00 -2.53 0.00 0.00 39.78 37.06 1j7m n ASN 9 CO 0.00 0.00 0.00 -1.20 -0.44 0.00 0.00 177.26 175.62 1j7m n SER 10 N 0.32 0.73 0.00 0.53 7.64 -1.25 -4.98 113.62 116.62 1j7m n SER 10 Ca -0.00 0.12 0.00 0.00 1.01 0.00 0.00 58.87 59.99 1j7m n SER 10 Cb 0.98 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 63.75 1j7m n SER 10 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1j7m n GLY 11 N 2.26 2.07 0.04 0.23 0.00 -1.26 -4.12 105.19 104.41 1j7m n GLY 11 Ca -0.04 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.28 3.77 -0.02 0.00 -1.26 -2.65 105.19 103.75 1j7m n GLY 12 Ca 0.00 -0.35 -0.39 0.00 0.00 0.00 0.00 46.02 45.28 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 -3.14 3.45 0.60 4.61 0.00 -1.26 -4.77 121.76 121.25 1j7m s ALA 13 Ca 0.06 0.30 -0.02 0.00 0.00 0.00 0.00 51.96 52.30 1j7m s ALA 13 Cb 0.15 -2.92 0.04 0.00 0.00 0.00 0.00 23.12 20.39 1j7m s ALA 13 CO 0.75 0.25 0.86 -1.25 0.00 0.00 0.00 175.76 176.37 1j7m s PRO 14 N -0.88 2.47 0.29 0.00 0.04 -1.26 -3.19 135.00 132.47 1j7m s PRO 14 Ca 0.35 -0.55 -0.28 0.00 0.04 0.00 0.00 61.00 60.56 1j7m s PRO 14 Cb -0.22 -2.37 -0.09 0.00 0.04 0.00 0.00 34.50 31.85 1j7m s PRO 14 CO 0.24 -0.87 0.95 0.00 0.04 0.00 0.00 177.00 177.37 1j7m s VAL 16 N -1.41 3.23 0.17 0.00 1.01 0.94 -4.93 120.40 119.42 1j7m s VAL 16 Ca 0.46 -3.37 -0.13 0.00 0.00 0.00 0.00 61.98 58.94 1j7m s VAL 16 Cb -0.23 -3.14 -0.07 0.00 0.00 0.00 0.00 36.38 32.95 1j7m s VAL 16 CO 0.28 -0.88 0.55 -0.36 0.00 0.00 0.00 175.10 174.69 1j7m s PHE 17 N -0.46 3.56 0.01 5.22 0.08 -1.26 -2.69 117.98 122.44 1j7m s PHE 17 Ca 0.19 1.02 -0.26 0.00 0.12 0.00 0.00 56.93 58.00 1j7m s PHE 17 Cb -0.19 -2.35 -0.04 0.00 -0.57 0.00 0.00 43.02 39.86 1j7m s PHE 17 CO -0.04 0.39 0.82 -1.25 -0.10 0.00 0.00 175.22 175.03 1j7m s PRO 18 N -2.16 4.52 0.00 0.24 0.05 -1.26 -5.03 135.00 131.36 1j7m s PRO 18 Ca 0.40 1.14 0.00 0.00 0.05 0.00 0.00 61.00 62.59 1j7m s PRO 18 Cb -0.14 -3.41 0.00 0.00 0.05 0.00 0.00 34.50 31.00 1j7m s PRO 18 CO 0.20 0.14 0.00 1.97 0.05 0.00 0.00 177.00 179.35 1j7m n PHE 19 N 3.32 -2.86 -3.67 0.56 -1.74 0.22 -4.75 117.46 108.53 1j7m n PHE 19 Ca 0.00 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.79 1j7m n PHE 19 Cb 0.51 0.00 -0.11 0.00 1.52 0.00 0.00 39.48 41.40 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 0.19 -0.37 0.26 1.97 2.01 -1.17 -0.54 115.64 117.98 1j7m s THR 20 Ca 0.00 0.15 0.02 0.00 0.31 0.00 0.00 61.69 62.17 1j7m s THR 20 Cb 0.00 -0.61 0.05 0.00 0.01 0.00 0.00 72.50 71.95 1j7m s THR 20 CO 0.00 0.06 0.35 0.49 -0.69 0.00 0.00 174.62 174.84 1j7m n PHE 21 N 4.93 -2.95 0.00 4.92 3.72 0.55 -2.47 117.46 126.16 1j7m n PHE 21 Ca -0.14 -0.77 0.00 0.00 -0.05 0.00 0.00 57.45 56.49 1j7m n PHE 21 Cb 0.52 -0.25 0.00 0.00 -0.94 0.00 0.00 39.48 38.81 1j7m n PHE 21 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1j7m n LEU 22 N 0.00 0.00 0.00 4.37 7.99 -1.26 -2.51 117.00 125.59 1j7m n LEU 22 Ca 0.06 -0.14 0.00 0.00 -0.01 0.00 0.00 56.01 55.92 1j7m n LEU 22 Cb 0.23 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.54 1j7m n LEU 22 CO 0.15 -0.16 0.00 0.61 -1.51 0.00 0.00 177.39 176.49 1j7m n GLY 23 N 2.13 0.77 2.86 -0.72 0.00 -1.26 -5.12 105.19 103.85 1j7m n GLY 23 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.08 0.36 -0.08 1.61 0.01 -1.04 -5.12 114.94 110.59 1j7m s ASN 24 Ca 0.00 -0.04 -0.26 0.00 -0.71 0.00 0.00 52.86 51.85 1j7m s ASN 24 Cb 0.00 -0.13 -0.03 0.00 0.41 0.00 0.00 41.25 41.50 1j7m s ASN 24 CO 0.00 -0.04 0.84 -0.54 -1.51 0.00 0.00 177.10 175.85 1j7m s LYS 25 N 0.51 4.43 -0.34 -0.60 1.02 -1.26 -0.33 119.74 123.17 1j7m s LYS 25 Ca -0.05 1.11 -0.08 0.00 0.02 0.00 0.00 55.97 56.97 1j7m s LYS 25 Cb -0.08 -3.49 0.03 0.00 -0.52 0.00 0.00 37.83 33.77 1j7m s LYS 25 CO -0.01 -0.11 0.13 0.71 -0.92 0.00 0.00 175.35 175.16 1j7m s TYR 26 N 1.33 3.23 -0.75 3.18 2.02 0.30 -4.90 117.35 121.76 1j7m s TYR 26 Ca 0.43 -1.20 0.25 0.00 -0.37 0.00 0.00 57.07 56.18 1j7m s TYR 26 Cb -0.18 -2.32 0.54 0.00 -0.40 0.00 0.00 41.96 39.60 1j7m s TYR 26 CO 0.19 -0.68 1.48 0.39 -1.57 0.00 0.00 175.55 175.37 1j7m n GLU 27 N 4.88 0.21 -3.83 -0.62 1.02 -1.26 0.69 120.64 121.73 1j7m n GLU 27 Ca -0.13 0.09 -0.18 0.00 -0.02 0.00 0.00 57.16 56.93 1j7m n GLU 27 Cb 0.46 -1.66 -0.06 0.00 -0.02 0.00 0.00 31.44 30.16 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 -1.98 0.26 -4.75 1.62 3.41 -1.26 -4.73 113.62 106.19 1j7m n SER 28 Ca 0.04 -2.72 -0.34 0.00 -0.26 0.00 0.00 58.87 55.59 1j7m n SER 28 Cb 0.41 1.08 0.06 0.00 -0.26 0.00 0.00 64.21 65.50 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 -2.01 0.61 -0.05 0.00 -1.32 -0.56 -4.94 115.64 107.38 1j7m s THR 30 Ca 0.72 -2.00 0.07 0.00 -1.21 0.00 0.00 61.69 59.28 1j7m s THR 30 Cb -0.26 -2.46 0.11 0.00 -1.51 0.00 0.00 72.50 68.37 1j7m s THR 30 CO 0.41 0.00 1.00 -1.54 -2.21 0.00 0.00 174.62 172.28 1j7m n SER 31 N -1.12 1.09 -4.74 8.08 3.41 -1.26 -0.18 113.62 118.89 1j7m n SER 31 Ca -0.03 -2.29 -0.34 0.00 -0.26 0.00 0.00 58.87 55.95 1j7m n SER 31 Cb 0.65 -0.24 0.08 0.00 -0.26 0.00 0.00 64.21 64.44 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 -1.18 2.21 0.00 7.33 0.00 -1.26 -2.33 121.76 126.53 1j7m s ALA 32 Ca 0.12 0.77 0.00 0.00 0.00 0.00 0.00 51.96 52.85 1j7m s ALA 32 Cb 0.10 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.80 1j7m s ALA 32 CO 0.01 -1.70 0.00 0.41 0.00 0.00 0.00 175.76 174.48 1j7m n GLY 33 N 0.11 0.76 0.85 0.00 0.00 -1.26 -4.69 105.19 100.96 1j7m n GLY 33 Ca 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.13 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 0.10 -1.09 1.61 1.74 -1.10 -5.03 116.66 110.89 1j7m n ARG 34 Ca 0.00 0.04 -0.03 0.00 -0.77 0.00 0.00 57.85 57.09 1j7m n ARG 34 Cb 0.00 -0.63 -0.01 0.00 -1.02 0.00 0.00 32.46 30.79 1j7m n ARG 34 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1j7m n SER 35 N -3.58 -4.29 0.00 0.55 7.64 -0.98 -4.92 113.62 108.04 1j7m n SER 35 Ca -0.03 0.08 0.00 0.00 1.01 0.00 0.00 58.87 59.93 1j7m n SER 35 Cb 0.10 -2.08 0.00 0.00 -1.01 0.00 0.00 64.21 61.22 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 -0.15 0.00 0.00 6.43 5.68 -1.26 -5.07 116.55 122.18 1j7m n ASP 36 Ca -0.03 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.26 1j7m n ASP 36 Cb 0.26 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.24 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 2.82 0.07 3.61 6.12 0.00 -1.26 -5.09 105.19 111.46 1j7m n GLY 37 Ca 0.00 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.80 3.47 0.34 1.61 3.01 -1.26 -4.97 119.74 121.14 1j7m s LYS 38 Ca 0.00 1.68 -0.16 0.00 -1.01 0.00 0.00 55.97 56.48 1j7m s LYS 38 Cb 0.00 -4.19 -0.09 0.00 -1.01 0.00 0.00 37.83 32.54 1j7m s LYS 38 CO 0.00 -1.70 0.77 -1.64 0.51 0.00 0.00 175.35 173.29 1j7m s MET 39 N 5.45 4.04 0.08 1.68 -1.94 -1.26 -4.81 119.30 122.55 1j7m s MET 39 Ca 0.82 0.74 0.01 0.00 -1.71 0.00 0.00 55.69 55.55 1j7m s MET 39 Cb -0.26 -2.39 -0.00 0.00 2.01 0.00 0.00 34.83 34.18 1j7m s MET 39 CO 0.33 0.13 0.03 -2.67 -0.01 0.00 0.00 175.02 172.83 1j7m n TRP 40 N -0.41 0.02 -3.67 -0.03 4.27 0.74 -0.51 117.44 117.85 1j7m n TRP 40 Ca 0.04 -0.54 -0.12 0.00 -3.89 0.00 0.00 57.50 52.99 1j7m n TRP 40 Cb 0.53 0.00 -0.08 0.00 -1.36 0.00 0.00 31.31 30.40 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 0.60 3.17 -0.78 0.00 0.00 -1.26 -1.09 121.76 122.39 1j7m s ALA 42 Ca -0.02 0.68 0.15 0.00 0.00 0.00 0.00 51.96 52.77 1j7m s ALA 42 Cb -0.05 -3.26 0.71 0.00 0.00 0.00 0.00 23.12 20.53 1j7m s ALA 42 CO -0.03 -0.10 1.60 0.25 0.00 0.00 0.00 175.76 177.48 1j7m n THR 43 N 0.28 2.08 -3.91 0.00 -2.24 -0.01 -0.04 114.28 110.45 1j7m n THR 43 Ca 0.03 -1.18 -0.11 0.00 -2.27 0.00 0.00 64.05 60.53 1j7m n THR 43 Cb 0.49 -0.09 -0.12 0.00 -2.10 0.00 0.00 70.33 68.51 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 -2.19 0.07 0.47 4.28 -4.23 -1.26 -4.56 115.64 108.22 1j7m s THR 44 Ca 0.49 -0.54 0.20 0.00 -1.18 0.00 0.00 61.69 60.66 1j7m s THR 44 Cb 0.34 -0.24 0.38 0.00 1.34 0.00 0.00 72.50 74.32 1j7m s THR 44 CO 0.19 -0.30 1.95 0.00 -0.54 0.00 0.00 174.62 175.93 1j7m h ALA 45 N 5.06 2.30 -3.17 3.99 0.00 -1.86 -3.37 119.26 122.20 1j7m h ALA 45 Ca -0.29 -0.01 -0.58 0.00 0.00 0.00 0.00 54.91 54.03 1j7m h ALA 45 Cb 1.20 -0.02 -0.36 0.00 0.00 0.00 0.00 17.79 18.62 1j7m h ALA 45 CO 0.43 -0.48 -0.83 1.21 0.00 0.00 0.00 179.25 179.58 1j7m s ASN 46 N -6.05 2.52 -0.13 0.00 3.84 -1.26 -3.06 114.94 110.79 1j7m s ASN 46 Ca -0.07 -0.44 -0.13 0.00 0.21 0.00 0.00 52.86 52.43 1j7m s ASN 46 Cb 0.20 -1.09 -0.25 0.00 -0.55 0.00 0.00 41.25 39.56 1j7m s ASN 46 CO 0.75 -0.05 0.41 0.22 -2.79 0.00 0.00 177.10 175.65 1j7m h TYR 47 N 7.90 0.37 -1.38 0.43 5.03 -1.68 -3.24 116.97 124.41 1j7m h TYR 47 Ca -0.35 -0.27 0.41 0.00 2.58 0.00 0.00 58.73 61.09 1j7m h TYR 47 Cb 1.14 -0.01 -0.08 0.00 1.55 0.00 0.00 36.73 39.33 1j7m h TYR 47 CO 0.47 1.64 0.97 -0.44 -1.32 0.00 0.00 178.16 179.48 1j7m h ASP 48 N -0.30 0.10 0.00 -2.11 5.19 -1.84 0.54 116.42 118.01 1j7m h ASP 48 Ca -0.36 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.08 1j7m h ASP 48 Cb 1.78 0.02 0.00 0.00 0.18 0.00 0.00 39.33 41.31 1j7m h ASP 48 CO 0.02 -0.02 -0.40 0.47 -3.12 0.00 0.00 179.24 176.18 1j7m n ASP 49 N -4.27 1.13 0.26 6.45 8.00 -1.26 -4.61 116.55 122.25 1j7m n ASP 49 Ca 0.32 0.40 0.15 0.00 0.71 0.00 0.00 54.79 56.37 1j7m n ASP 49 Cb 1.42 -0.70 0.52 0.00 -0.02 0.00 0.00 41.12 42.34 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 -0.61 0.00 -6.93 -2.24 3.32 -1.55 -3.47 116.42 104.93 1j7m h ASP 50 Ca 0.00 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.46 1j7m h ASP 50 Cb 0.40 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.82 1j7m h ASP 50 CO 0.00 0.02 -0.96 0.54 -1.72 0.00 0.00 179.24 177.11 1j7m n ARG 51 N -3.11 -1.21 -4.06 3.56 1.74 0.19 -4.95 116.66 108.81 1j7m n ARG 51 Ca 0.02 0.15 -0.33 0.00 -0.77 0.00 0.00 57.85 56.91 1j7m n ARG 51 Cb 0.38 -3.55 -0.15 0.00 -1.02 0.00 0.00 32.46 28.12 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 -7.21 2.90 0.35 5.56 1.02 -1.26 -5.05 119.74 116.05 1j7m s LYS 52 Ca 0.12 -0.90 0.03 0.00 0.02 0.00 0.00 55.97 55.24 1j7m s LYS 52 Cb -0.06 -2.73 -0.04 0.00 -0.52 0.00 0.00 37.83 34.48 1j7m s LYS 52 CO 0.97 -0.29 0.11 1.67 -0.92 0.00 0.00 175.35 176.89 1j7m s TRP 53 N 1.29 1.78 -0.29 3.18 1.48 -1.26 -0.83 118.94 124.30 1j7m s TRP 53 Ca 0.02 -1.19 -0.22 0.00 -1.06 0.00 0.00 56.10 53.65 1j7m s TRP 53 Cb -0.15 -1.12 0.14 0.00 -1.16 0.00 0.00 33.47 31.18 1j7m s TRP 53 CO -0.09 -0.25 1.05 0.20 -4.06 0.00 0.00 176.95 173.80 1j7m s GLY 54 N -3.50 -0.06 0.89 3.67 0.00 -0.25 -2.36 107.32 105.70 1j7m s GLY 54 Ca 0.31 2.89 -0.11 0.00 0.00 0.00 0.00 44.72 47.81 1j7m s GLY 54 CO 0.15 2.08 1.17 -1.36 0.00 0.00 0.00 173.10 175.14 1j7m s PHE 55 N 0.56 1.65 0.29 1.90 0.08 0.61 0.12 117.98 123.20 1j7m s PHE 55 Ca -0.00 1.77 0.06 0.00 0.12 0.00 0.00 56.93 58.87 1j7m s PHE 55 Cb -0.05 -3.39 -0.02 0.00 -0.57 0.00 0.00 43.02 38.99 1j7m s PHE 55 CO -0.10 -2.85 0.40 0.00 -0.10 0.00 0.00 175.22 172.57 1j7m n PRO 57 N -1.50 2.53 -1.34 0.00 -0.04 -1.26 -4.82 135.00 128.57 1j7m n PRO 57 Ca -0.04 0.00 -0.56 0.00 -0.04 0.00 0.00 63.50 62.85 1j7m n PRO 57 Cb 0.58 0.00 -0.10 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 1.33 0.09 3.54 2.03 -1.26 -4.82 116.55 117.45 1j7m n ASP 58 Ca 0.00 0.59 -0.02 0.00 0.52 0.00 0.00 54.79 55.88 1j7m n ASP 58 Cb 0.00 -1.05 -0.05 0.00 -0.72 0.00 0.00 41.12 39.30 1j7m n ASP 58 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 1j7m h GLN 59 N 10.24 0.00 0.00 -0.67 4.20 -2.00 -3.54 115.11 123.33 1j7m h GLN 59 Ca -0.18 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.53 1j7m h GLN 59 Cb 1.38 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.16 1j7m h GLN 59 CO 1.06 0.66 0.00 0.41 -0.67 0.00 0.00 178.83 180.29