#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 3.62 0.00 0.66 -0.11 -1.26 -5.03 118.94 116.83 1j7m s TRP 2 Ca 0.00 1.50 0.00 0.00 1.22 0.00 0.00 56.10 58.82 1j7m s TRP 2 Cb 0.00 -2.98 0.00 0.00 -1.50 0.00 0.00 33.47 28.99 1j7m s TRP 2 CO 0.00 0.03 0.00 -1.33 -4.62 0.00 0.00 176.95 171.03 1j7m n MET 3 N 3.86 0.00 -1.03 5.86 2.81 -1.26 -5.04 117.12 122.31 1j7m n MET 3 Ca 0.03 0.00 -0.35 0.00 -1.81 0.00 0.00 57.70 55.57 1j7m n MET 3 Cb 0.51 0.00 0.08 0.00 -0.71 0.00 0.00 33.22 33.10 1j7m n MET 3 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1j7m n SER 4 N 0.00 -2.38 -4.11 7.83 7.64 -1.26 -4.78 113.62 116.55 1j7m n SER 4 Ca 0.00 0.43 -0.30 0.00 1.01 0.00 0.00 58.87 60.01 1j7m n SER 4 Cb 0.00 -1.13 0.22 0.00 -1.01 0.00 0.00 64.21 62.29 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 -2.12 1.74 0.19 0.44 -4.23 -1.07 -4.94 115.64 105.65 1j7m s THR 5 Ca 0.58 0.00 0.03 0.00 -1.18 0.00 0.00 61.69 61.12 1j7m s THR 5 Cb -0.28 -2.49 -0.05 0.00 1.34 0.00 0.00 72.50 71.03 1j7m s THR 5 CO 0.66 0.00 -0.03 0.54 -0.54 0.00 0.00 174.62 175.24 1j7m s VAL 6 N -2.99 1.00 0.00 2.29 0.11 -1.24 -4.57 120.40 114.99 1j7m s VAL 6 Ca 0.69 -2.03 0.00 0.00 -2.93 0.00 0.00 61.98 57.71 1j7m s VAL 6 Cb -0.13 -2.13 0.00 0.00 -1.53 0.00 0.00 36.38 32.59 1j7m s VAL 6 CO 0.57 -0.49 0.00 0.61 -3.33 0.00 0.00 175.10 172.45 1j7m n GLY 7 N -0.31 1.50 7.00 6.54 0.00 -1.26 0.20 105.19 118.87 1j7m n GLY 7 Ca -0.07 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 1.18 0.00 -0.02 0.00 -1.26 -4.50 105.19 100.59 1j7m n GLY 8 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.79 0.00 -2.89 1.61 2.04 -0.46 -4.87 115.26 107.90 1j7m n ASN 9 Ca 0.00 -0.52 -0.35 0.00 -0.44 0.00 0.00 54.58 53.27 1j7m n ASN 9 Cb 0.00 0.00 -0.01 0.00 -2.53 0.00 0.00 39.78 37.24 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 0.00 7.14 -4.55 0.53 7.64 -1.01 -4.95 113.62 118.42 1j7m n SER 10 Ca 0.00 -3.48 -0.27 0.00 1.01 0.00 0.00 58.87 56.12 1j7m n SER 10 Cb 0.13 -1.18 -0.05 0.00 -1.01 0.00 0.00 64.21 62.10 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 0.35 0.03 0.00 0.23 0.00 -1.26 -1.04 105.19 103.50 1j7m n GLY 11 Ca 0.52 0.53 0.00 0.00 0.00 0.00 0.00 46.02 47.07 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 6.32 1.12 3.73 -0.02 0.00 -1.26 -5.04 105.19 110.04 1j7m n GLY 12 Ca 0.42 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.10 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 -0.41 3.42 0.72 4.61 0.00 -0.21 -4.78 121.76 125.11 1j7m s ALA 13 Ca 0.00 -0.85 -0.07 0.00 0.00 0.00 0.00 51.96 51.04 1j7m s ALA 13 Cb 0.00 -1.51 0.07 0.00 0.00 0.00 0.00 23.12 21.68 1j7m s ALA 13 CO 0.00 0.64 1.02 -1.25 0.00 0.00 0.00 175.76 176.17 1j7m s PRO 14 N -1.35 2.09 0.34 0.00 0.04 -1.26 -2.58 135.00 132.27 1j7m s PRO 14 Ca 0.18 -0.32 -0.27 0.00 0.04 0.00 0.00 61.00 60.63 1j7m s PRO 14 Cb -0.12 -2.17 -0.09 0.00 0.04 0.00 0.00 34.50 32.16 1j7m s PRO 14 CO 0.08 -1.30 1.07 0.00 0.04 0.00 0.00 177.00 176.89 1j7m s VAL 16 N -1.40 3.43 -0.01 0.00 1.01 0.32 -4.94 120.40 118.80 1j7m s VAL 16 Ca 0.51 -0.67 0.05 0.00 0.00 0.00 0.00 61.98 61.87 1j7m s VAL 16 Cb -0.27 -2.67 -0.03 0.00 0.00 0.00 0.00 36.38 33.41 1j7m s VAL 16 CO 0.34 0.27 -0.15 -0.36 0.00 0.00 0.00 175.10 175.20 1j7m s PHE 17 N 1.45 2.66 0.11 5.22 0.08 -1.26 -2.69 117.98 123.54 1j7m s PHE 17 Ca 0.03 -0.19 -0.26 0.00 0.12 0.00 0.00 56.93 56.63 1j7m s PHE 17 Cb -0.16 -1.57 -0.07 0.00 -0.57 0.00 0.00 43.02 40.66 1j7m s PHE 17 CO -0.02 0.22 0.82 -1.25 -0.10 0.00 0.00 175.22 174.89 1j7m s PRO 18 N -1.02 4.59 -0.14 0.24 0.05 -1.26 -5.06 135.00 132.39 1j7m s PRO 18 Ca 0.13 1.20 -0.04 0.00 0.05 0.00 0.00 61.00 62.34 1j7m s PRO 18 Cb -0.11 -3.33 -0.03 0.00 0.05 0.00 0.00 34.50 31.08 1j7m s PRO 18 CO 0.03 0.38 -0.00 -0.59 0.05 0.00 0.00 177.00 176.86 1j7m s PHE 19 N -0.46 3.12 -0.21 0.56 -0.71 0.69 -4.73 117.98 116.23 1j7m s PHE 19 Ca 0.40 -0.07 -0.16 0.00 -1.04 0.00 0.00 56.93 56.06 1j7m s PHE 19 Cb -0.22 -1.95 -0.04 0.00 -1.21 0.00 0.00 43.02 39.60 1j7m s PHE 19 CO 0.26 0.15 0.40 0.99 -1.34 0.00 0.00 175.22 175.68 1j7m s THR 20 N 0.04 5.19 -0.03 -4.49 2.01 -0.53 0.51 115.64 118.33 1j7m s THR 20 Ca 0.02 0.70 0.05 0.00 0.31 0.00 0.00 61.69 62.78 1j7m s THR 20 Cb -0.13 -3.73 -0.01 0.00 0.01 0.00 0.00 72.50 68.64 1j7m s THR 20 CO 0.02 0.23 -0.19 0.12 -0.69 0.00 0.00 174.62 174.11 1j7m s PHE 21 N 1.44 1.82 -1.34 4.92 5.36 0.10 -2.51 117.98 127.78 1j7m s PHE 21 Ca 0.19 -0.45 -0.02 0.00 -0.96 0.00 0.00 56.93 55.69 1j7m s PHE 21 Cb -0.15 -1.20 0.02 0.00 -0.34 0.00 0.00 43.02 41.35 1j7m s PHE 21 CO 0.08 -0.11 0.04 1.28 -1.46 0.00 0.00 175.22 175.05 1j7m n LEU 22 N 2.88 -0.81 0.00 6.12 7.99 -1.26 0.08 117.00 132.00 1j7m n LEU 22 Ca -0.17 -1.09 0.00 0.00 -0.01 0.00 0.00 56.01 54.75 1j7m n LEU 22 Cb 0.53 -1.35 0.00 0.00 -0.11 0.00 0.00 43.42 42.49 1j7m n LEU 22 CO 0.24 0.38 0.00 0.61 -1.51 0.00 0.00 177.39 177.11 1j7m n GLY 23 N -2.25 1.84 3.58 -0.72 0.00 -1.26 -5.04 105.19 101.35 1j7m n GLY 23 Ca -0.25 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.50 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 -3.28 4.35 -0.23 1.61 0.01 0.11 -5.10 114.94 112.41 1j7m s ASN 24 Ca 0.00 -0.53 -0.17 0.00 -0.71 0.00 0.00 52.86 51.46 1j7m s ASN 24 Cb 0.00 -0.78 -0.03 0.00 0.41 0.00 0.00 41.25 40.85 1j7m s ASN 24 CO 0.00 0.11 0.46 -0.54 -1.51 0.00 0.00 177.10 175.62 1j7m s LYS 25 N -2.76 4.12 -0.21 -0.60 1.02 -1.26 0.01 119.74 120.05 1j7m s LYS 25 Ca 0.25 0.26 -0.05 0.00 0.02 0.00 0.00 55.97 56.45 1j7m s LYS 25 Cb -0.09 -3.60 -0.02 0.00 -0.52 0.00 0.00 37.83 33.60 1j7m s LYS 25 CO 0.15 -0.20 -0.02 0.71 -0.92 0.00 0.00 175.35 175.07 1j7m s TYR 26 N 1.82 2.99 -0.12 3.18 1.51 0.18 -4.93 117.35 121.98 1j7m s TYR 26 Ca 0.20 -0.71 0.22 0.00 -1.01 0.00 0.00 57.07 55.77 1j7m s TYR 26 Cb -0.15 -2.11 -0.19 0.00 -0.11 0.00 0.00 41.96 39.40 1j7m s TYR 26 CO 0.09 -0.42 0.70 0.39 -1.11 0.00 0.00 175.55 175.20 1j7m n GLU 27 N 4.60 0.64 -3.22 -0.62 1.02 -1.26 -0.23 120.64 121.57 1j7m n GLU 27 Ca -0.18 -0.03 -0.14 0.00 -0.02 0.00 0.00 57.16 56.80 1j7m n GLU 27 Cb 0.51 -1.66 -0.03 0.00 -0.02 0.00 0.00 31.44 30.24 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 -2.50 1.59 -4.56 1.62 3.41 -1.26 -4.90 113.62 107.02 1j7m n SER 28 Ca -0.05 -2.07 -0.28 0.00 -0.26 0.00 0.00 58.87 56.21 1j7m n SER 28 Cb 0.62 0.40 0.21 0.00 -0.26 0.00 0.00 64.21 65.18 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 0.01 -0.09 0.00 -1.32 0.30 -4.94 115.64 106.83 1j7m s THR 30 Ca 0.67 -1.54 0.13 0.00 -1.21 0.00 0.00 61.69 59.75 1j7m s THR 30 Cb -0.21 -2.21 0.20 0.00 -1.51 0.00 0.00 72.50 68.78 1j7m s THR 30 CO 0.60 -0.05 1.09 -1.54 -2.21 0.00 0.00 174.62 172.52 1j7m n SER 31 N -0.33 2.05 -4.76 8.08 3.41 -1.26 0.73 113.62 121.53 1j7m n SER 31 Ca -0.02 -2.74 -0.41 0.00 -0.26 0.00 0.00 58.87 55.45 1j7m n SER 31 Cb 0.63 -0.31 -0.01 0.00 -0.26 0.00 0.00 64.21 64.25 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 -2.21 3.64 0.00 7.33 0.00 -1.26 -2.06 121.76 127.20 1j7m s ALA 32 Ca 0.22 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.67 1j7m s ALA 32 Cb 0.19 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.72 1j7m s ALA 32 CO 0.02 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.28 1j7m n GLY 33 N 1.52 0.82 0.10 0.00 0.00 -1.26 -4.83 105.19 101.54 1j7m n GLY 33 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 0.00 -2.37 1.61 1.74 -0.88 -5.02 116.66 109.74 1j7m n ARG 34 Ca 0.00 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 56.96 1j7m n ARG 34 Cb 0.00 -0.08 0.00 0.00 -1.02 0.00 0.00 32.46 31.36 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 -1.63 -3.84 0.00 0.55 7.64 -1.12 -4.95 113.62 110.27 1j7m n SER 35 Ca 0.00 -0.06 0.00 0.00 1.01 0.00 0.00 58.87 59.82 1j7m n SER 35 Cb 0.00 -2.95 0.00 0.00 -1.01 0.00 0.00 64.21 60.25 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 -0.34 0.00 0.00 6.43 5.68 -1.26 -5.08 116.55 121.98 1j7m n ASP 36 Ca -0.11 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.18 1j7m n ASP 36 Cb 0.59 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.57 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 3.78 0.16 3.79 6.12 0.00 -1.26 -5.13 105.19 112.66 1j7m n GLY 37 Ca 0.00 -0.09 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.00 4.49 0.09 1.61 -0.14 -1.26 -5.07 119.74 118.46 1j7m s LYS 38 Ca 0.00 1.17 0.02 0.00 -1.36 0.00 0.00 55.97 55.80 1j7m s LYS 38 Cb 0.00 -2.90 -0.04 0.00 -1.68 0.00 0.00 37.83 33.21 1j7m s LYS 38 CO 0.00 0.36 0.16 -1.64 -0.76 0.00 0.00 175.35 173.47 1j7m s MET 39 N -1.88 3.14 0.00 1.68 -1.94 -1.26 -4.76 119.30 114.29 1j7m s MET 39 Ca 0.46 -0.61 0.00 0.00 -1.71 0.00 0.00 55.69 53.82 1j7m s MET 39 Cb -0.19 -2.85 -0.00 0.00 2.01 0.00 0.00 34.83 33.80 1j7m s MET 39 CO 0.24 0.57 0.00 -2.67 -0.01 0.00 0.00 175.02 173.14 1j7m n TRP 40 N 0.19 -0.00 -3.64 -0.03 4.27 0.22 0.07 117.44 118.52 1j7m n TRP 40 Ca -0.07 -0.02 -0.15 0.00 -3.89 0.00 0.00 57.50 53.36 1j7m n TRP 40 Cb 0.52 0.00 -0.07 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 -0.76 3.06 -0.93 0.00 0.00 -1.26 -1.03 121.76 120.83 1j7m s ALA 42 Ca -0.08 0.41 0.18 0.00 0.00 0.00 0.00 51.96 52.47 1j7m s ALA 42 Cb -0.03 -3.15 0.76 0.00 0.00 0.00 0.00 23.12 20.70 1j7m s ALA 42 CO 0.06 0.13 1.67 0.25 0.00 0.00 0.00 175.76 177.87 1j7m n THR 43 N -0.52 2.07 -3.91 0.00 -2.24 -0.18 -0.52 114.28 108.97 1j7m n THR 43 Ca 0.06 -1.25 -0.10 0.00 -2.27 0.00 0.00 64.05 60.49 1j7m n THR 43 Cb 0.54 0.03 -0.10 0.00 -2.10 0.00 0.00 70.33 68.70 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 -2.07 0.12 0.25 4.28 -4.23 -1.26 -4.56 115.64 108.17 1j7m s THR 44 Ca 0.53 -0.95 -0.04 0.00 -1.18 0.00 0.00 61.69 60.04 1j7m s THR 44 Cb 0.35 -0.69 0.24 0.00 1.34 0.00 0.00 72.50 73.74 1j7m s THR 44 CO 0.23 -0.52 1.88 0.00 -0.54 0.00 0.00 174.62 175.67 1j7m h ALA 45 N 3.93 1.29 -3.78 3.99 0.00 -1.85 -3.37 119.26 119.48 1j7m h ALA 45 Ca -0.32 -0.03 -0.67 0.00 0.00 0.00 0.00 54.91 53.89 1j7m h ALA 45 Cb 1.19 -0.30 -0.37 0.00 0.00 0.00 0.00 17.79 18.31 1j7m h ALA 45 CO 0.46 0.42 -0.76 1.21 0.00 0.00 0.00 179.25 180.58 1j7m s ASN 46 N -5.89 4.59 0.10 0.00 3.84 -1.26 -1.45 114.94 114.87 1j7m s ASN 46 Ca -0.13 -1.61 -0.12 0.00 0.21 0.00 0.00 52.86 51.21 1j7m s ASN 46 Cb 0.19 -1.59 -0.15 0.00 -0.55 0.00 0.00 41.25 39.15 1j7m s ASN 46 CO 0.81 -0.26 1.30 0.22 -2.79 0.00 0.00 177.10 176.38 1j7m h TYR 47 N 7.75 1.06 -1.01 0.43 3.20 -1.65 -2.87 116.97 123.89 1j7m h TYR 47 Ca -0.15 -0.48 0.23 0.00 3.14 0.00 0.00 58.73 61.48 1j7m h TYR 47 Cb 1.04 -0.16 -0.10 0.00 1.54 0.00 0.00 36.73 39.04 1j7m h TYR 47 CO 0.59 1.31 0.63 -0.44 -1.64 0.00 0.00 178.16 178.60 1j7m h ASP 48 N 0.53 0.61 0.15 -2.11 3.32 -1.94 0.97 116.42 117.94 1j7m h ASP 48 Ca -0.06 0.10 -0.36 0.00 0.02 0.00 0.00 57.03 56.73 1j7m h ASP 48 Cb 1.42 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.95 1j7m h ASP 48 CO 0.16 0.15 -2.03 0.47 -1.72 0.00 0.00 179.24 176.28 1j7m n ASP 49 N -4.73 1.96 0.01 6.45 9.92 -1.24 -4.51 116.55 124.42 1j7m n ASP 49 Ca 0.25 0.19 0.02 0.00 -0.53 0.00 0.00 54.79 54.72 1j7m n ASP 49 Cb 0.74 -0.71 -0.10 0.00 -0.64 0.00 0.00 41.12 40.40 1j7m n ASP 49 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1j7m n ASP 50 N -3.41 0.57 -4.19 -2.24 8.00 -1.08 -5.00 116.55 109.20 1j7m n ASP 50 Ca -0.32 0.24 -0.29 0.00 0.71 0.00 0.00 54.79 55.13 1j7m n ASP 50 Cb 1.04 0.68 -0.07 0.00 -0.02 0.00 0.00 41.12 42.75 1j7m n ASP 50 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1j7m n ARG 51 N -2.72 -1.84 -4.05 -1.24 1.74 0.33 -4.96 116.66 103.92 1j7m n ARG 51 Ca -0.11 0.21 -0.34 0.00 -0.77 0.00 0.00 57.85 56.85 1j7m n ARG 51 Cb 0.79 -3.98 -0.15 0.00 -1.02 0.00 0.00 32.46 28.10 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 -7.07 3.14 0.29 5.56 1.02 -1.26 -5.07 119.74 116.35 1j7m s LYS 52 Ca 0.03 -0.75 0.03 0.00 0.02 0.00 0.00 55.97 55.30 1j7m s LYS 52 Cb -0.02 -2.74 -0.06 0.00 -0.52 0.00 0.00 37.83 34.50 1j7m s LYS 52 CO 0.96 -0.20 0.06 1.67 -0.92 0.00 0.00 175.35 176.92 1j7m s TRP 53 N 1.35 1.77 -0.16 3.18 1.48 -1.26 -1.01 118.94 124.28 1j7m s TRP 53 Ca 0.05 -1.03 -0.28 0.00 -1.06 0.00 0.00 56.10 53.78 1j7m s TRP 53 Cb -0.14 -1.10 0.08 0.00 -1.16 0.00 0.00 33.47 31.15 1j7m s TRP 53 CO -0.09 -0.11 0.74 0.20 -4.06 0.00 0.00 176.95 173.63 1j7m s GLY 54 N -3.40 -0.51 0.86 3.67 0.00 -0.20 -1.35 107.32 106.39 1j7m s GLY 54 Ca 0.36 1.73 -0.10 0.00 0.00 0.00 0.00 44.72 46.70 1j7m s GLY 54 CO 0.14 1.32 1.13 -1.36 0.00 0.00 0.00 173.10 174.33 1j7m s PHE 55 N -0.50 1.93 0.66 1.90 0.08 0.54 0.11 117.98 122.69 1j7m s PHE 55 Ca -0.05 1.71 -0.14 0.00 0.12 0.00 0.00 56.93 58.57 1j7m s PHE 55 Cb -0.02 -3.26 -0.00 0.00 -0.57 0.00 0.00 43.02 39.17 1j7m s PHE 55 CO 0.05 -2.49 1.09 0.00 -0.10 0.00 0.00 175.22 173.77 1j7m n PRO 57 N -2.51 0.00 -2.65 0.00 -0.01 -1.26 -4.23 135.00 124.33 1j7m n PRO 57 Ca 0.09 0.00 -0.42 0.00 -0.01 0.00 0.00 63.50 63.17 1j7m n PRO 57 Cb 0.52 0.00 -0.03 0.00 -0.01 0.00 0.00 33.50 33.98 1j7m n PRO 57 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 175.50 175.83 1j7m s ASP 58 N -1.56 6.23 0.00 2.55 -1.08 -1.26 -4.82 116.67 116.73 1j7m s ASP 58 Ca 0.00 -0.47 0.00 0.00 -0.52 0.00 0.00 52.55 51.56 1j7m s ASP 58 Cb 0.00 -2.52 0.00 0.00 -1.46 0.00 0.00 42.92 38.94 1j7m s ASP 58 CO 0.00 -1.64 0.00 0.00 0.52 0.00 0.00 175.17 174.05 1j7m n GLN 59 N 8.68 0.00 0.00 4.34 1.13 -1.26 -5.13 117.38 125.14 1j7m n GLN 59 Ca 0.02 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.08 1j7m n GLN 59 Cb 0.48 -0.06 0.00 0.00 0.11 0.00 0.00 30.24 30.77 1j7m n GLN 59 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03