#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 2.61 0.54 7.33 -0.11 -1.26 -5.00 118.94 123.06 1j7m s TRP 2 Ca 0.00 0.67 0.08 0.00 1.22 0.00 0.00 56.10 58.07 1j7m s TRP 2 Cb 0.00 -4.40 0.07 0.00 -1.50 0.00 0.00 33.47 27.64 1j7m s TRP 2 CO 0.00 -1.60 0.75 -1.64 -4.62 0.00 0.00 176.95 169.83 1j7m s MET 3 N 4.72 2.41 0.00 5.86 -1.94 -1.26 -5.14 119.30 123.95 1j7m s MET 3 Ca 0.53 -1.43 0.00 0.00 -1.71 0.00 0.00 55.69 53.09 1j7m s MET 3 Cb -0.10 -2.64 0.00 0.00 2.01 0.00 0.00 34.83 34.10 1j7m s MET 3 CO 0.32 -0.74 0.00 0.43 -0.01 0.00 0.00 175.02 175.01 1j7m n SER 4 N -2.20 0.75 -4.88 3.03 7.64 -1.26 -4.58 113.62 112.12 1j7m n SER 4 Ca 0.13 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.79 1j7m n SER 4 Cb 0.61 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.78 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 1.72 2.46 0.08 0.44 -4.23 -1.25 -4.62 115.64 110.24 1j7m s THR 5 Ca 0.00 -1.38 0.00 0.00 -1.18 0.00 0.00 61.69 59.14 1j7m s THR 5 Cb 0.00 -2.84 -0.04 0.00 1.34 0.00 0.00 72.50 70.96 1j7m s THR 5 CO 0.00 0.00 -0.04 0.54 -0.54 0.00 0.00 174.62 174.58 1j7m s VAL 6 N -2.54 0.42 0.00 2.29 0.11 -1.24 -4.98 120.40 114.47 1j7m s VAL 6 Ca 0.46 -1.88 0.00 0.00 -2.93 0.00 0.00 61.98 57.63 1j7m s VAL 6 Cb -0.03 -1.66 0.00 0.00 -1.53 0.00 0.00 36.38 33.16 1j7m s VAL 6 CO 0.27 -0.88 0.00 0.61 -3.33 0.00 0.00 175.10 171.77 1j7m n GLY 7 N 0.01 0.67 7.00 6.54 0.00 -1.26 0.20 105.19 118.35 1j7m n GLY 7 Ca -0.12 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.10 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 1.19 0.00 -0.02 0.00 -1.26 -4.38 105.19 100.71 1j7m n GLY 8 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.27 0.00 -2.29 1.61 6.94 -0.20 -4.91 115.26 114.15 1j7m n ASN 9 Ca 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 54.58 54.50 1j7m n ASN 9 Cb 0.00 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.41 1j7m n ASN 9 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1j7m n SER 10 N 0.00 -0.84 0.00 0.53 7.64 -1.24 -4.19 113.62 115.51 1j7m n SER 10 Ca 0.00 0.11 0.00 0.00 1.01 0.00 0.00 58.87 59.99 1j7m n SER 10 Cb 0.00 -0.81 0.00 0.00 -1.01 0.00 0.00 64.21 62.39 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 -0.47 0.42 1.05 0.23 0.00 -1.26 -1.43 105.19 103.73 1j7m n GLY 11 Ca 0.02 0.66 -0.07 0.00 0.00 0.00 0.00 46.02 46.63 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 0.54 3.78 -0.02 0.00 -1.26 -4.98 105.19 103.24 1j7m n GLY 12 Ca 0.00 -0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 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 0.00 3.12 0.47 4.61 0.00 -0.52 -4.39 121.76 125.05 1j7m s ALA 13 Ca 0.00 0.80 -0.21 0.00 0.00 0.00 0.00 51.96 52.55 1j7m s ALA 13 Cb 0.02 -3.31 -0.09 0.00 0.00 0.00 0.00 23.12 19.73 1j7m s ALA 13 CO -0.00 -0.32 1.02 -2.14 0.00 0.00 0.00 175.76 174.32 1j7m s PRO 14 N -2.38 3.92 0.08 0.00 0.02 -1.26 -3.80 135.00 131.58 1j7m s PRO 14 Ca 0.57 1.32 -0.31 0.00 0.02 0.00 0.00 61.00 62.61 1j7m s PRO 14 Cb -0.25 -2.15 -0.07 0.00 0.02 0.00 0.00 34.50 32.05 1j7m s PRO 14 CO 0.32 -0.33 1.29 0.00 -0.33 0.00 0.00 177.00 177.95 1j7m s VAL 16 N 1.11 5.34 0.03 0.00 1.01 0.16 -4.92 120.40 123.14 1j7m s VAL 16 Ca 0.61 0.17 0.09 0.00 0.00 0.00 0.00 61.98 62.85 1j7m s VAL 16 Cb -0.33 -3.45 -0.03 0.00 0.00 0.00 0.00 36.38 32.57 1j7m s VAL 16 CO 0.30 0.41 -0.26 -0.36 0.00 0.00 0.00 175.10 175.18 1j7m s PHE 17 N 0.61 2.32 0.00 5.22 0.08 -1.26 -2.77 117.98 122.18 1j7m s PHE 17 Ca 0.07 -0.42 -0.26 0.00 0.12 0.00 0.00 56.93 56.45 1j7m s PHE 17 Cb -0.12 -1.42 -0.04 0.00 -0.57 0.00 0.00 43.02 40.87 1j7m s PHE 17 CO 0.00 0.08 0.80 -1.25 -0.10 0.00 0.00 175.22 174.76 1j7m s PRO 18 N -1.09 4.50 -0.19 0.24 0.05 -1.26 -5.05 135.00 132.21 1j7m s PRO 18 Ca 0.11 1.11 -0.09 0.00 0.05 0.00 0.00 61.00 62.18 1j7m s PRO 18 Cb -0.10 -3.41 -0.05 0.00 0.05 0.00 0.00 34.50 30.99 1j7m s PRO 18 CO 0.01 0.13 0.13 -0.59 0.05 0.00 0.00 177.00 176.73 1j7m s PHE 19 N 0.48 3.43 -0.21 0.56 -0.12 0.49 -4.69 117.98 117.93 1j7m s PHE 19 Ca 0.42 0.35 -0.18 0.00 -0.05 0.00 0.00 56.93 57.47 1j7m s PHE 19 Cb -0.20 -2.12 -0.03 0.00 -0.63 0.00 0.00 43.02 40.04 1j7m s PHE 19 CO 0.23 0.35 0.49 0.99 -0.05 0.00 0.00 175.22 177.23 1j7m s THR 20 N 0.14 5.12 0.03 -4.49 2.01 -0.61 0.44 115.64 118.28 1j7m s THR 20 Ca 0.09 0.89 0.07 0.00 0.31 0.00 0.00 61.69 63.04 1j7m s THR 20 Cb -0.11 -3.82 -0.02 0.00 0.01 0.00 0.00 72.50 68.56 1j7m s THR 20 CO -0.01 0.18 -0.19 0.12 -0.69 0.00 0.00 174.62 174.03 1j7m s PHE 21 N 1.67 1.71 -0.92 4.92 5.36 0.02 -1.47 117.98 129.27 1j7m s PHE 21 Ca 0.23 -0.36 -0.12 0.00 -0.96 0.00 0.00 56.93 55.72 1j7m s PHE 21 Cb -0.15 -1.03 0.12 0.00 -0.34 0.00 0.00 43.02 41.61 1j7m s PHE 21 CO 0.09 0.06 0.29 1.28 -1.46 0.00 0.00 175.22 175.49 1j7m n LEU 22 N 1.98 -0.40 0.00 6.12 7.99 -1.26 0.95 117.00 132.38 1j7m n LEU 22 Ca -0.17 -0.38 0.00 0.00 -0.01 0.00 0.00 56.01 55.45 1j7m n LEU 22 Cb 0.54 -1.24 0.00 0.00 -0.11 0.00 0.00 43.42 42.61 1j7m n LEU 22 CO 0.23 0.05 0.00 0.61 -1.51 0.00 0.00 177.39 176.77 1j7m n GLY 23 N -0.76 1.19 3.60 -0.72 0.00 -1.26 -5.05 105.19 102.20 1j7m n GLY 23 Ca 0.06 0.00 -0.34 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 -3.05 4.92 -0.25 1.61 0.01 0.27 -5.08 114.94 113.37 1j7m s ASN 24 Ca 0.00 0.02 -0.29 0.00 -0.71 0.00 0.00 52.86 51.88 1j7m s ASN 24 Cb 0.00 -1.43 0.01 0.00 0.41 0.00 0.00 41.25 40.24 1j7m s ASN 24 CO 0.00 0.32 1.10 -0.54 -1.51 0.00 0.00 177.10 176.47 1j7m s LYS 25 N -0.57 4.19 -0.40 -0.60 -0.14 -1.26 -0.80 119.74 120.15 1j7m s LYS 25 Ca 0.09 1.33 -0.12 0.00 -1.36 0.00 0.00 55.97 55.91 1j7m s LYS 25 Cb -0.12 -3.70 0.04 0.00 -1.68 0.00 0.00 37.83 32.38 1j7m s LYS 25 CO 0.02 -0.74 0.26 0.71 -0.76 0.00 0.00 175.35 174.84 1j7m s TYR 26 N 3.43 3.26 -0.48 3.18 2.02 0.17 -4.89 117.35 124.04 1j7m s TYR 26 Ca 0.47 -0.98 0.23 0.00 -0.37 0.00 0.00 57.07 56.42 1j7m s TYR 26 Cb -0.15 -2.67 0.21 0.00 -0.40 0.00 0.00 41.96 38.95 1j7m s TYR 26 CO 0.11 -0.69 1.22 0.93 -1.57 0.00 0.00 175.55 175.55 1j7m h GLU 27 N 8.52 0.00 -5.09 -0.62 5.08 -1.92 0.14 114.58 120.70 1j7m h GLU 27 Ca -0.26 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.58 1j7m h GLU 27 Cb 1.10 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.22 1j7m h GLU 27 CO 0.73 0.00 -0.55 -1.54 -1.00 0.00 0.00 179.01 176.65 1j7m s SER 28 N -4.73 2.58 0.97 1.42 1.04 -1.26 -4.87 113.70 108.85 1j7m s SER 28 Ca 0.04 -1.57 -0.11 0.00 0.48 0.00 0.00 55.95 54.79 1j7m s SER 28 Cb 0.12 0.31 0.18 0.00 0.10 0.00 0.00 66.02 66.72 1j7m s SER 28 CO 0.75 -0.82 1.11 0.00 0.98 0.00 0.00 173.24 175.25 1j7m s THR 30 N -2.64 0.06 -0.03 0.00 -1.32 0.93 -4.94 115.64 107.71 1j7m s THR 30 Ca 0.67 -2.00 0.04 0.00 -1.21 0.00 0.00 61.69 59.18 1j7m s THR 30 Cb -0.23 -2.48 0.06 0.00 -1.51 0.00 0.00 72.50 68.35 1j7m s THR 30 CO 0.60 0.00 0.89 -1.54 -2.21 0.00 0.00 174.62 172.36 1j7m n SER 31 N -1.56 0.73 -4.77 8.08 3.41 -1.26 0.69 113.62 118.94 1j7m n SER 31 Ca 0.06 -1.94 -0.41 0.00 -0.26 0.00 0.00 58.87 56.32 1j7m n SER 31 Cb 0.62 -0.16 -0.00 0.00 -0.26 0.00 0.00 64.21 64.41 1j7m n SER 31 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1j7m n ALA 32 N -0.35 2.48 -0.36 7.33 0.00 -1.26 -1.58 120.51 126.77 1j7m n ALA 32 Ca 0.03 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.82 1j7m n ALA 32 Cb 0.57 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.58 1j7m n ALA 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j7m n GLY 33 N 0.77 1.64 0.19 0.00 0.00 -1.26 -4.77 105.19 101.76 1j7m n GLY 33 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.28 1.61 1.74 -0.66 -5.01 116.66 109.06 1j7m n ARG 34 Ca 0.00 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.86 1j7m n ARG 34 Cb 0.00 -0.11 0.06 0.00 -1.02 0.00 0.00 32.46 31.39 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 -1.76 -6.11 -0.03 0.55 7.64 -0.61 -4.87 113.62 108.43 1j7m n SER 35 Ca 0.00 -0.40 -0.03 0.00 1.01 0.00 0.00 58.87 59.45 1j7m n SER 35 Cb 0.00 -4.82 -0.04 0.00 -1.01 0.00 0.00 64.21 58.34 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 -2.59 3.72 0.00 6.43 5.75 -1.26 -5.04 116.55 123.56 1j7m n ASP 36 Ca -0.05 -0.01 0.00 0.00 -0.01 0.00 0.00 54.79 54.72 1j7m n ASP 36 Cb 0.59 0.45 0.00 0.00 -1.03 0.00 0.00 41.12 41.13 1j7m n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1j7m n GLY 37 N 2.81 4.41 3.61 6.12 0.00 -1.26 -5.09 105.19 115.79 1j7m n GLY 37 Ca -0.09 -0.70 -0.43 0.00 0.00 0.00 0.00 46.02 44.81 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 3.61 0.26 1.61 1.02 -1.26 -5.00 119.74 119.98 1j7m s LYS 38 Ca 0.00 1.12 -0.18 0.00 0.02 0.00 0.00 55.97 56.93 1j7m s LYS 38 Cb 0.00 -4.03 -0.09 0.00 -0.52 0.00 0.00 37.83 33.19 1j7m s LYS 38 CO 0.00 -1.52 0.74 -1.64 -0.92 0.00 0.00 175.35 172.01 1j7m s MET 39 N 4.91 4.17 0.00 1.68 -1.94 -1.26 -4.82 119.30 122.03 1j7m s MET 39 Ca 0.64 0.81 0.00 0.00 -1.71 0.00 0.00 55.69 55.43 1j7m s MET 39 Cb -0.16 -2.70 0.00 0.00 2.01 0.00 0.00 34.83 33.98 1j7m s MET 39 CO 0.31 0.30 0.00 -2.67 -0.01 0.00 0.00 175.02 172.95 1j7m n TRP 40 N 0.30 0.00 -3.57 -0.03 4.27 0.22 -0.21 117.44 118.41 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 0.52 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 -0.45 2.96 -2.09 0.00 0.00 -1.26 -1.87 121.76 119.04 1j7m s ALA 42 Ca -0.06 0.42 0.20 0.00 0.00 0.00 0.00 51.96 52.52 1j7m s ALA 42 Cb -0.02 -3.18 0.54 0.00 0.00 0.00 0.00 23.12 20.45 1j7m s ALA 42 CO 0.06 -0.19 1.45 0.25 0.00 0.00 0.00 175.76 177.34 1j7m n THR 43 N -1.09 0.74 -4.18 0.00 -2.24 -0.56 -0.66 114.28 106.29 1j7m n THR 43 Ca 0.08 -0.79 -0.14 0.00 -2.27 0.00 0.00 64.05 60.93 1j7m n THR 43 Cb 0.53 0.50 -0.11 0.00 -2.10 0.00 0.00 70.33 69.16 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 -1.26 0.94 0.48 4.28 -4.23 -1.26 -4.26 115.64 110.33 1j7m s THR 44 Ca 0.41 -1.66 0.18 0.00 -1.18 0.00 0.00 61.69 59.44 1j7m s THR 44 Cb 0.22 -1.38 0.24 0.00 1.34 0.00 0.00 72.50 72.92 1j7m s THR 44 CO 0.29 -0.57 2.07 0.00 -0.54 0.00 0.00 174.62 175.87 1j7m h ALA 45 N 3.53 1.72 -3.41 3.99 0.00 -1.85 -3.39 119.26 119.85 1j7m h ALA 45 Ca -0.37 -0.09 -0.60 0.00 0.00 0.00 0.00 54.91 53.85 1j7m h ALA 45 Cb 1.19 -0.02 -0.37 0.00 0.00 0.00 0.00 17.79 18.59 1j7m h ALA 45 CO 0.53 0.13 -0.80 1.21 0.00 0.00 0.00 179.25 180.32 1j7m s ASN 46 N -6.84 3.26 -0.00 0.00 3.84 -1.26 -1.57 114.94 112.37 1j7m s ASN 46 Ca -0.04 -0.84 0.13 0.00 0.21 0.00 0.00 52.86 52.31 1j7m s ASN 46 Cb 0.16 -1.13 -0.21 0.00 -0.55 0.00 0.00 41.25 39.53 1j7m s ASN 46 CO 0.66 -0.17 0.77 0.22 -2.79 0.00 0.00 177.10 175.79 1j7m h TYR 47 N 8.02 0.00 -0.97 0.43 3.20 -1.44 -3.16 116.97 123.04 1j7m h TYR 47 Ca -0.26 0.00 0.17 0.00 3.14 0.00 0.00 58.73 61.78 1j7m h TYR 47 Cb 1.10 0.00 -0.09 0.00 1.54 0.00 0.00 36.73 39.28 1j7m h TYR 47 CO 0.49 0.91 0.61 -0.44 -1.64 0.00 0.00 178.16 178.09 1j7m h ASP 48 N 0.00 0.75 0.00 -2.11 3.32 -1.86 0.16 116.42 116.68 1j7m h ASP 48 Ca -0.23 0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.89 1j7m h ASP 48 Cb 1.90 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 41.38 1j7m h ASP 48 CO 0.08 0.32 -0.39 0.47 -1.72 0.00 0.00 179.24 178.00 1j7m n ASP 49 N -4.66 1.12 0.23 6.45 8.00 -1.26 -4.57 116.55 121.86 1j7m n ASP 49 Ca 0.21 0.40 0.07 0.00 0.71 0.00 0.00 54.79 56.18 1j7m n ASP 49 Cb 0.52 -0.70 0.56 0.00 -0.02 0.00 0.00 41.12 41.48 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 -6.88 -2.24 5.19 -1.62 -3.47 116.42 106.79 1j7m h ASP 50 Ca 0.00 0.00 -0.58 0.00 -0.62 0.00 0.00 57.03 55.83 1j7m h ASP 50 Cb 0.39 0.00 -0.16 0.00 0.18 0.00 0.00 39.33 39.74 1j7m h ASP 50 CO 0.00 0.18 -0.94 0.54 -3.12 0.00 0.00 179.24 175.91 1j7m n ARG 51 N -4.08 -1.78 -3.96 3.56 1.74 0.55 -4.95 116.66 107.73 1j7m n ARG 51 Ca -0.02 0.20 -0.34 0.00 -0.77 0.00 0.00 57.85 56.92 1j7m n ARG 51 Cb 0.26 -3.97 -0.14 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 -7.09 2.98 0.41 5.56 1.02 -1.26 -5.03 119.74 116.33 1j7m s LYS 52 Ca 0.04 -0.88 0.04 0.00 0.02 0.00 0.00 55.97 55.19 1j7m s LYS 52 Cb -0.02 -2.95 -0.03 0.00 -0.52 0.00 0.00 37.83 34.30 1j7m s LYS 52 CO 0.96 -0.33 0.11 1.67 -0.92 0.00 0.00 175.35 176.84 1j7m s TRP 53 N 1.36 1.82 -0.24 3.18 1.48 -1.26 -1.50 118.94 123.78 1j7m s TRP 53 Ca 0.02 -1.21 -0.28 0.00 -1.06 0.00 0.00 56.10 53.57 1j7m s TRP 53 Cb -0.16 -1.22 0.15 0.00 -1.16 0.00 0.00 33.47 31.09 1j7m s TRP 53 CO -0.05 -0.21 1.16 0.20 -4.06 0.00 0.00 176.95 173.99 1j7m s GLY 54 N -3.62 -0.06 0.94 3.67 0.00 -0.78 -1.03 107.32 106.44 1j7m s GLY 54 Ca 0.24 2.61 -0.10 0.00 0.00 0.00 0.00 44.72 47.47 1j7m s GLY 54 CO 0.14 1.40 1.12 0.69 0.00 0.00 0.00 173.10 176.45 1j7m n PHE 55 N 1.20 0.64 -1.73 1.90 3.72 0.54 0.71 117.46 124.44 1j7m n PHE 55 Ca -0.09 0.35 -0.42 0.00 -0.05 0.00 0.00 57.45 57.25 1j7m n PHE 55 Cb 0.57 -1.97 -0.02 0.00 -0.94 0.00 0.00 39.48 37.12 1j7m n PHE 55 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1j7m n PRO 57 N 2.43 0.42 -3.80 0.00 -0.04 -1.26 -4.61 135.00 128.13 1j7m n PRO 57 Ca 0.10 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.28 1j7m n PRO 57 Cb 0.36 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 33.83 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 -1.03 -3.04 -4.73 3.54 2.03 -1.26 -4.95 116.55 107.11 1j7m n ASP 58 Ca 0.00 -0.85 -0.33 0.00 0.52 0.00 0.00 54.79 54.13 1j7m n ASP 58 Cb 0.00 -1.11 -0.08 0.00 -0.72 0.00 0.00 41.12 39.21 1j7m n ASP 58 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1j7m s GLN 59 N -5.87 2.93 0.00 -0.67 -0.21 -1.26 -5.23 119.66 109.35 1j7m s GLN 59 Ca 0.23 -0.53 0.18 0.00 0.02 0.00 0.00 55.36 55.26 1j7m s GLN 59 Cb -0.13 -2.77 0.14 0.00 1.00 0.00 0.00 33.01 31.26 1j7m s GLN 59 CO 0.67 0.64 1.08 0.41 -2.12 0.00 0.00 175.29 175.97