#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 -3.71 1.43 -0.00 -1.26 -4.98 117.44 108.92 1j7m n TRP 2 Ca 0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 57.50 57.30 1j7m n TRP 2 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 31.31 31.29 1j7m n TRP 2 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 177.69 176.05 1j7m s MET 3 N -0.02 3.00 0.07 5.87 -1.94 -1.26 -5.13 119.30 119.88 1j7m s MET 3 Ca 0.00 -1.09 0.01 0.00 -1.71 0.00 0.00 55.69 52.90 1j7m s MET 3 Cb 0.00 -2.68 0.01 0.00 2.01 0.00 0.00 34.83 34.17 1j7m s MET 3 CO 0.00 0.15 0.09 0.43 -0.01 0.00 0.00 175.02 175.68 1j7m n SER 4 N -1.48 0.39 -4.85 3.03 7.64 -1.26 -4.91 113.62 112.18 1j7m n SER 4 Ca -0.02 -1.19 -0.31 0.00 1.01 0.00 0.00 58.87 58.35 1j7m n SER 4 Cb 0.59 -0.04 -0.03 0.00 -1.01 0.00 0.00 64.21 63.71 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 0.44 4.62 0.19 0.44 -4.23 -1.24 -4.36 115.64 111.49 1j7m s THR 5 Ca 0.07 1.01 0.03 0.00 -1.18 0.00 0.00 61.69 61.61 1j7m s THR 5 Cb -0.01 -3.73 -0.05 0.00 1.34 0.00 0.00 72.50 70.06 1j7m s THR 5 CO 0.04 -0.65 -0.02 0.54 -0.54 0.00 0.00 174.62 173.99 1j7m s VAL 6 N -2.56 0.92 0.00 2.29 0.11 -1.23 -3.50 120.40 116.42 1j7m s VAL 6 Ca 0.56 -2.02 0.00 0.00 -2.93 0.00 0.00 61.98 57.60 1j7m s VAL 6 Cb -0.10 -2.15 0.00 0.00 -1.53 0.00 0.00 36.38 32.60 1j7m s VAL 6 CO 0.32 -0.48 0.00 0.61 -3.33 0.00 0.00 175.10 172.22 1j7m n GLY 7 N -0.30 0.67 7.00 6.54 0.00 -1.26 0.21 105.19 118.06 1j7m n GLY 7 Ca -0.07 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 0.92 0.00 -0.02 0.00 -1.26 -4.25 105.19 100.58 1j7m n GLY 8 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.41 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 -3.58 0.16 -0.06 1.61 2.04 -0.48 -4.80 115.26 110.15 1j7m n ASN 9 Ca 0.00 -0.50 -0.12 0.00 -0.44 0.00 0.00 54.58 53.52 1j7m n ASN 9 Cb 0.00 0.32 -0.11 0.00 -2.53 0.00 0.00 39.78 37.46 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 0.00 -0.01 -5.60 0.53 0.02 -1.75 -3.49 113.55 103.25 1j7m h SER 10 Ca 0.00 -0.80 -0.09 0.00 -0.84 0.00 0.00 61.79 60.07 1j7m h SER 10 Cb 0.09 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.63 1j7m h SER 10 CO 0.00 0.86 -0.29 0.61 -1.14 0.00 0.00 176.83 176.88 1j7m n GLY 11 N 1.46 -1.21 0.00 -3.77 0.00 -1.26 -4.50 105.19 95.91 1j7m n GLY 11 Ca -0.09 0.65 0.00 0.00 0.00 0.00 0.00 46.02 46.58 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 -1.45 4.36 3.75 -0.02 0.00 -1.23 -4.96 105.19 105.64 1j7m n GLY 12 Ca -0.03 -0.80 -0.41 0.00 0.00 0.00 0.00 46.02 44.78 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 3.60 0.70 4.61 0.00 -1.26 -4.11 121.76 125.29 1j7m s ALA 13 Ca 0.00 1.29 -0.15 0.00 0.00 0.00 0.00 51.96 53.10 1j7m s ALA 13 Cb 0.00 -3.54 0.02 0.00 0.00 0.00 0.00 23.12 19.60 1j7m s ALA 13 CO 0.00 -0.70 1.17 -2.14 0.00 0.00 0.00 175.76 174.08 1j7m s PRO 14 N -0.44 2.43 0.17 0.00 0.02 -1.26 -3.73 135.00 132.18 1j7m s PRO 14 Ca 0.58 1.61 -0.30 0.00 0.02 0.00 0.00 61.00 62.91 1j7m s PRO 14 Cb -0.41 -1.88 -0.08 0.00 0.02 0.00 0.00 34.50 32.15 1j7m s PRO 14 CO 0.43 -1.58 1.17 0.00 -0.33 0.00 0.00 177.00 176.69 1j7m s VAL 16 N 0.04 5.06 -0.03 0.00 1.01 0.34 -4.96 120.40 121.86 1j7m s VAL 16 Ca 0.53 0.12 0.07 0.00 0.00 0.00 0.00 61.98 62.70 1j7m s VAL 16 Cb -0.31 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.09 1j7m s VAL 16 CO 0.35 -0.24 -0.23 -0.36 0.00 0.00 0.00 175.10 174.62 1j7m s PHE 17 N 2.27 2.42 0.04 5.22 0.08 -1.26 -2.71 117.98 124.04 1j7m s PHE 17 Ca 0.16 -0.38 -0.22 0.00 0.12 0.00 0.00 56.93 56.61 1j7m s PHE 17 Cb -0.16 -1.53 -0.06 0.00 -0.57 0.00 0.00 43.02 40.70 1j7m s PHE 17 CO 0.13 0.01 0.67 -1.25 -0.10 0.00 0.00 175.22 174.68 1j7m s PRO 18 N -0.63 4.39 0.00 0.24 0.04 -1.26 -5.08 135.00 132.69 1j7m s PRO 18 Ca 0.10 0.89 0.00 0.00 0.04 0.00 0.00 61.00 62.03 1j7m s PRO 18 Cb -0.10 -3.32 0.00 0.00 0.04 0.00 0.00 34.50 31.11 1j7m s PRO 18 CO -0.01 0.40 0.00 1.97 0.04 0.00 0.00 177.00 179.41 1j7m n PHE 19 N 2.48 -2.18 -3.69 0.56 -1.74 0.32 -4.84 117.46 108.37 1j7m n PHE 19 Ca -0.06 0.00 -0.11 0.00 -0.56 0.00 0.00 57.45 56.72 1j7m n PHE 19 Cb 0.50 0.00 -0.12 0.00 1.52 0.00 0.00 39.48 41.39 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 1.02 -0.22 -0.08 1.97 2.01 -1.15 0.31 115.64 119.52 1j7m s THR 20 Ca 0.00 0.16 0.04 0.00 0.31 0.00 0.00 61.69 62.20 1j7m s THR 20 Cb 0.00 -0.53 0.00 0.00 0.01 0.00 0.00 72.50 71.98 1j7m s THR 20 CO 0.00 0.06 -0.20 0.12 -0.69 0.00 0.00 174.62 173.91 1j7m s PHE 21 N 1.78 2.14 -0.76 4.92 5.36 0.13 -2.43 117.98 129.13 1j7m s PHE 21 Ca -0.06 -0.79 -0.08 0.00 -0.96 0.00 0.00 56.93 55.04 1j7m s PHE 21 Cb -0.10 -1.45 0.08 0.00 -0.34 0.00 0.00 43.02 41.20 1j7m s PHE 21 CO -0.11 -0.31 0.23 1.28 -1.46 0.00 0.00 175.22 174.85 1j7m n LEU 22 N 3.44 -0.49 0.00 6.12 4.32 -1.26 -0.16 117.00 128.98 1j7m n LEU 22 Ca -0.20 -0.13 0.00 0.00 -0.02 0.00 0.00 56.01 55.66 1j7m n LEU 22 Cb 0.53 -1.37 0.00 0.00 -1.62 0.00 0.00 43.42 40.96 1j7m n LEU 22 CO 0.26 0.04 0.00 0.61 -1.22 0.00 0.00 177.39 177.09 1j7m n GLY 23 N -0.76 2.52 3.43 -0.72 0.00 -1.26 -5.08 105.19 103.32 1j7m n GLY 23 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.54 4.25 -0.05 1.61 0.01 0.78 -5.09 114.94 114.91 1j7m s ASN 24 Ca 0.00 -0.24 -0.30 0.00 -0.71 0.00 0.00 52.86 51.61 1j7m s ASN 24 Cb 0.00 -1.52 -0.03 0.00 0.41 0.00 0.00 41.25 40.11 1j7m s ASN 24 CO 0.00 0.20 1.07 -0.54 -1.51 0.00 0.00 177.10 176.33 1j7m s LYS 25 N 0.12 4.44 -0.21 -0.60 1.02 -1.26 0.22 119.74 123.47 1j7m s LYS 25 Ca -0.05 1.51 -0.04 0.00 0.02 0.00 0.00 55.97 57.42 1j7m s LYS 25 Cb -0.14 -3.50 -0.01 0.00 -0.52 0.00 0.00 37.83 33.65 1j7m s LYS 25 CO 0.04 -0.28 -0.05 0.71 -0.92 0.00 0.00 175.35 174.86 1j7m s TYR 26 N 1.71 2.95 -0.60 3.18 2.02 0.15 -4.92 117.35 121.84 1j7m s TYR 26 Ca 0.52 -0.88 0.23 0.00 -0.37 0.00 0.00 57.07 56.57 1j7m s TYR 26 Cb -0.22 -2.08 0.00 0.00 -0.40 0.00 0.00 41.96 39.26 1j7m s TYR 26 CO 0.23 -0.50 0.98 0.39 -1.57 0.00 0.00 175.55 175.08 1j7m n GLU 27 N 4.64 0.29 -3.36 -0.62 1.02 -1.26 -0.52 120.64 120.83 1j7m n GLU 27 Ca -0.18 -0.02 -0.14 0.00 -0.02 0.00 0.00 57.16 56.80 1j7m n GLU 27 Cb 0.51 -1.58 -0.04 0.00 -0.02 0.00 0.00 31.44 30.31 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 -1.96 1.19 -4.66 1.62 3.41 -1.26 -4.84 113.62 107.12 1j7m n SER 28 Ca 0.02 -2.23 -0.29 0.00 -0.26 0.00 0.00 58.87 56.11 1j7m n SER 28 Cb 0.44 0.56 0.17 0.00 -0.26 0.00 0.00 64.21 65.12 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 -2.82 0.07 -0.15 0.00 -1.32 -0.22 -4.95 115.64 106.26 1j7m s THR 30 Ca 0.65 -1.49 0.15 0.00 -1.21 0.00 0.00 61.69 59.80 1j7m s THR 30 Cb -0.20 -1.89 0.33 0.00 -1.51 0.00 0.00 72.50 69.23 1j7m s THR 30 CO 0.59 -0.32 1.17 -1.54 -2.21 0.00 0.00 174.62 172.30 1j7m n SER 31 N -0.19 1.98 -4.77 8.08 3.41 -1.26 0.70 113.62 121.56 1j7m n SER 31 Ca -0.07 -3.29 -0.41 0.00 -0.26 0.00 0.00 58.87 54.84 1j7m n SER 31 Cb 0.63 -0.45 -0.02 0.00 -0.26 0.00 0.00 64.21 64.11 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 -2.79 3.51 0.00 7.33 0.00 -1.26 -2.47 121.76 126.09 1j7m s ALA 32 Ca 0.33 1.30 0.00 0.00 0.00 0.00 0.00 51.96 53.59 1j7m s ALA 32 Cb 0.30 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.92 1j7m s ALA 32 CO -0.01 -0.70 0.00 0.41 0.00 0.00 0.00 175.76 175.46 1j7m n GLY 33 N 0.83 1.56 0.01 0.00 0.00 -1.26 -4.81 105.19 101.52 1j7m n GLY 33 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.20 1.61 1.74 -1.03 -4.96 116.66 110.82 1j7m n ARG 34 Ca 0.00 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 57.01 1j7m n ARG 34 Cb 0.00 -0.06 -0.03 0.00 -1.02 0.00 0.00 32.46 31.35 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 -1.62 -4.92 -0.07 0.55 7.64 -1.13 -4.82 113.62 109.26 1j7m n SER 35 Ca 0.00 0.17 -0.13 0.00 1.01 0.00 0.00 58.87 59.92 1j7m n SER 35 Cb 0.00 -3.04 -0.14 0.00 -1.01 0.00 0.00 64.21 60.02 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 -0.53 1.07 0.00 6.43 5.75 -1.26 -5.04 116.55 122.96 1j7m n ASP 36 Ca -0.07 0.12 0.00 0.00 -0.01 0.00 0.00 54.79 54.83 1j7m n ASP 36 Cb 0.41 0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.55 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 1.85 0.37 3.74 6.12 0.00 -1.26 -5.14 105.19 110.87 1j7m n GLY 37 Ca -0.31 0.12 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 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 2.74 0.23 1.61 3.01 -1.26 -5.03 119.74 121.04 1j7m s LYS 38 Ca 0.00 2.00 0.06 0.00 -1.01 0.00 0.00 55.97 57.03 1j7m s LYS 38 Cb 0.00 -1.91 -0.04 0.00 -1.01 0.00 0.00 37.83 34.88 1j7m s LYS 38 CO 0.00 -1.44 0.22 -1.64 0.51 0.00 0.00 175.35 173.00 1j7m s MET 39 N -3.32 3.03 0.00 1.68 -1.94 -1.26 -4.75 119.30 112.73 1j7m s MET 39 Ca 0.80 -0.96 0.00 0.00 -1.71 0.00 0.00 55.69 53.82 1j7m s MET 39 Cb -0.36 -2.65 0.00 0.00 2.01 0.00 0.00 34.83 33.84 1j7m s MET 39 CO 0.38 0.42 0.00 -2.67 -0.01 0.00 0.00 175.02 173.14 1j7m n TRP 40 N -1.07 -0.07 -3.50 -0.03 4.27 0.22 -0.85 117.44 116.40 1j7m n TRP 40 Ca -0.08 0.00 -0.16 0.00 -3.89 0.00 0.00 57.50 53.37 1j7m n TRP 40 Cb 0.57 0.00 -0.05 0.00 -1.36 0.00 0.00 31.31 30.47 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 -1.87 3.39 -1.85 0.00 0.00 -1.26 -0.89 121.76 119.28 1j7m s ALA 42 Ca -0.07 0.01 0.20 0.00 0.00 0.00 0.00 51.96 52.10 1j7m s ALA 42 Cb -0.00 -2.71 0.48 0.00 0.00 0.00 0.00 23.12 20.88 1j7m s ALA 42 CO 0.03 0.37 1.40 0.25 0.00 0.00 0.00 175.76 177.81 1j7m n THR 43 N -0.03 0.80 -4.21 0.00 -2.24 -0.15 -0.51 114.28 107.94 1j7m n THR 43 Ca 0.01 -0.90 -0.18 0.00 -2.27 0.00 0.00 64.05 60.71 1j7m n THR 43 Cb 0.52 0.68 -0.11 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 -1.14 1.22 0.15 4.28 -4.23 -1.25 -4.51 115.64 110.15 1j7m s THR 44 Ca 0.39 -1.54 -0.17 0.00 -1.18 0.00 0.00 61.69 59.19 1j7m s THR 44 Cb 0.21 -1.33 -0.00 0.00 1.34 0.00 0.00 72.50 72.72 1j7m s THR 44 CO 0.28 -0.34 1.76 0.00 -0.54 0.00 0.00 174.62 175.78 1j7m h ALA 45 N 3.86 0.37 -3.43 3.99 0.00 -1.90 -3.36 119.26 118.78 1j7m h ALA 45 Ca -0.40 0.03 -0.68 0.00 0.00 0.00 0.00 54.91 53.85 1j7m h ALA 45 Cb 1.19 -0.01 -0.35 0.00 0.00 0.00 0.00 17.79 18.63 1j7m h ALA 45 CO 0.46 -0.27 -0.66 1.21 0.00 0.00 0.00 179.25 180.00 1j7m s ASN 46 N -5.37 4.97 0.19 0.00 3.84 -1.26 -2.92 114.94 114.40 1j7m s ASN 46 Ca -0.13 -1.71 -0.05 0.00 0.21 0.00 0.00 52.86 51.18 1j7m s ASN 46 Cb 0.11 -1.73 0.12 0.00 -0.55 0.00 0.00 41.25 39.20 1j7m s ASN 46 CO 0.71 -0.38 1.56 0.22 -2.79 0.00 0.00 177.10 176.41 1j7m h TYR 47 N 7.93 0.87 -0.62 0.43 5.03 -1.63 -2.87 116.97 126.11 1j7m h TYR 47 Ca -0.15 -0.25 0.18 0.00 2.58 0.00 0.00 58.73 61.09 1j7m h TYR 47 Cb 1.05 -0.19 -0.02 0.00 1.55 0.00 0.00 36.73 39.11 1j7m h TYR 47 CO 0.57 0.99 0.49 -0.44 -1.32 0.00 0.00 178.16 178.44 1j7m h ASP 48 N 0.61 0.00 0.00 -2.11 3.32 -1.92 0.43 116.42 116.76 1j7m h ASP 48 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1j7m h ASP 48 Cb 0.90 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.45 1j7m h ASP 48 CO 0.08 0.00 0.00 0.47 -1.72 0.00 0.00 179.24 178.07 1j7m n ASP 49 N -4.16 0.00 0.22 6.45 8.00 -1.12 -4.61 116.55 121.33 1j7m n ASP 49 Ca 0.12 0.29 0.12 0.00 0.71 0.00 0.00 54.79 56.03 1j7m n ASP 49 Cb 0.73 -0.47 0.31 0.00 -0.02 0.00 0.00 41.12 41.67 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 0.00 0.00 -6.58 -2.24 5.19 -1.52 -3.48 116.42 107.79 1j7m h ASP 50 Ca 0.00 0.00 -0.52 0.00 -0.62 0.00 0.00 57.03 55.89 1j7m h ASP 50 Cb 0.00 0.00 -0.07 0.00 0.18 0.00 0.00 39.33 39.44 1j7m h ASP 50 CO 0.00 0.10 -0.91 0.54 -3.12 0.00 0.00 179.24 175.85 1j7m n ARG 51 N -3.15 -2.77 -3.95 3.56 5.12 0.15 -4.96 116.66 110.66 1j7m n ARG 51 Ca 0.02 0.35 -0.35 0.00 -1.93 0.00 0.00 57.85 55.95 1j7m n ARG 51 Cb 0.49 -4.32 -0.14 0.00 -1.16 0.00 0.00 32.46 27.33 1j7m n ARG 51 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1j7m s LYS 52 N -6.66 3.14 0.32 5.56 1.02 -1.26 -5.05 119.74 116.81 1j7m s LYS 52 Ca 0.04 -0.77 0.03 0.00 0.02 0.00 0.00 55.97 55.29 1j7m s LYS 52 Cb -0.02 -2.94 -0.05 0.00 -0.52 0.00 0.00 37.83 34.30 1j7m s LYS 52 CO 0.91 -0.27 0.08 1.67 -0.92 0.00 0.00 175.35 176.81 1j7m s TRP 53 N 1.40 1.84 -0.24 3.18 1.48 -1.26 -0.98 118.94 124.37 1j7m s TRP 53 Ca 0.04 -1.06 -0.26 0.00 -1.06 0.00 0.00 56.10 53.76 1j7m s TRP 53 Cb -0.15 -1.18 0.11 0.00 -1.16 0.00 0.00 33.47 31.09 1j7m s TRP 53 CO -0.05 -0.12 0.92 0.20 -4.06 0.00 0.00 176.95 173.85 1j7m s GLY 54 N -3.47 -0.30 0.80 3.67 0.00 -0.07 -1.38 107.32 106.57 1j7m s GLY 54 Ca 0.35 2.30 -0.14 0.00 0.00 0.00 0.00 44.72 47.22 1j7m s GLY 54 CO 0.15 1.60 0.80 0.69 0.00 0.00 0.00 173.10 176.33 1j7m n PHE 55 N 1.94 -0.01 -1.66 1.90 3.72 0.58 0.86 117.46 124.79 1j7m n PHE 55 Ca -0.13 0.35 -0.44 0.00 -0.05 0.00 0.00 57.45 57.18 1j7m n PHE 55 Cb 0.56 -1.98 -0.02 0.00 -0.94 0.00 0.00 39.48 37.11 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 1.21 0.49 -3.31 0.00 -0.04 -1.26 -3.62 135.00 128.46 1j7m n PRO 57 Ca 0.09 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.30 1j7m n PRO 57 Cb 0.33 -1.25 -0.09 0.00 -0.04 0.00 0.00 33.50 32.45 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 -0.75 -0.61 -0.08 3.54 2.03 -1.26 -4.72 116.55 114.69 1j7m n ASP 58 Ca 0.06 -2.47 -0.23 0.00 0.52 0.00 0.00 54.79 52.68 1j7m n ASP 58 Cb 0.03 -0.39 -0.12 0.00 -0.72 0.00 0.00 41.12 39.92 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 2.61 0.65 0.00 -0.67 1.13 -1.24 -5.07 117.38 114.79 1j7m n GLN 59 Ca 0.28 0.33 0.00 0.00 -1.94 0.00 0.00 57.00 55.66 1j7m n GLN 59 Cb 0.49 -1.64 0.00 0.00 0.11 0.00 0.00 30.24 29.21 1j7m n GLN 59 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03