#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 3.48 0.68 7.33 0.23 -1.26 -5.09 118.94 124.32 1j7m s TRP 2 Ca 0.00 0.38 -0.11 0.00 -2.03 0.00 0.00 56.10 54.34 1j7m s TRP 2 Cb 0.00 -1.90 0.00 0.00 0.03 0.00 0.00 33.47 31.60 1j7m s TRP 2 CO 0.00 0.26 1.06 -1.64 0.96 0.00 0.00 176.95 177.59 1j7m s MET 3 N -3.71 3.04 0.68 4.98 -1.94 -1.26 -4.87 119.30 116.23 1j7m s MET 3 Ca 0.40 0.80 -0.15 0.00 -1.71 0.00 0.00 55.69 55.03 1j7m s MET 3 Cb -0.10 -2.01 0.01 0.00 2.01 0.00 0.00 34.83 34.74 1j7m s MET 3 CO 0.31 -0.98 1.14 -1.12 -0.01 0.00 0.00 175.02 174.36 1j7m s SER 4 N -3.99 4.80 0.74 3.03 0.01 -1.26 -4.26 113.70 112.77 1j7m s SER 4 Ca 0.57 2.10 -0.09 0.00 1.31 0.00 0.00 55.95 59.85 1j7m s SER 4 Cb -0.13 -2.56 0.06 0.00 0.21 0.00 0.00 66.02 63.60 1j7m s SER 4 CO 0.54 -1.84 1.07 0.42 0.41 0.00 0.00 173.24 173.85 1j7m s THR 5 N -2.24 2.26 0.23 1.44 -4.23 -1.11 -4.75 115.64 107.24 1j7m s THR 5 Ca 0.69 -0.13 0.05 0.00 -1.18 0.00 0.00 61.69 61.11 1j7m s THR 5 Cb -0.23 -3.03 -0.05 0.00 1.34 0.00 0.00 72.50 70.53 1j7m s THR 5 CO 0.43 -0.04 -0.05 0.54 -0.54 0.00 0.00 174.62 174.96 1j7m s VAL 6 N -3.36 1.30 0.00 2.29 0.11 -1.19 -4.83 120.40 114.71 1j7m s VAL 6 Ca 0.60 -2.08 0.00 0.00 -2.93 0.00 0.00 61.98 57.57 1j7m s VAL 6 Cb -0.11 -2.27 0.00 0.00 -1.53 0.00 0.00 36.38 32.47 1j7m s VAL 6 CO 0.47 -0.41 0.00 0.61 -3.33 0.00 0.00 175.10 172.44 1j7m n GLY 7 N -0.43 1.30 7.00 6.54 0.00 -1.26 0.24 105.19 118.58 1j7m n GLY 7 Ca -0.06 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.29 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 1.26 -0.02 0.00 -1.26 -4.57 105.19 101.52 1j7m n GLY 8 Ca 0.00 -0.57 -0.02 0.00 0.00 0.00 0.00 46.02 45.43 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 -3.69 -0.06 0.27 1.61 2.04 -0.30 -4.92 115.26 110.21 1j7m n ASN 9 Ca 0.00 -2.00 -0.12 0.00 -0.44 0.00 0.00 54.58 52.02 1j7m n ASN 9 Cb 0.00 0.02 -0.05 0.00 -2.53 0.00 0.00 39.78 37.22 1j7m n ASN 9 CO 0.00 0.00 0.00 0.77 -0.44 0.00 0.00 177.26 177.59 1j7m h SER 10 N 0.49 -0.63 -0.52 0.53 4.64 -1.78 -3.46 113.55 112.81 1j7m h SER 10 Ca -0.41 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1j7m h SER 10 Cb 1.63 0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.89 1j7m h SER 10 CO -0.11 -0.23 0.00 0.61 -0.87 0.00 0.00 176.83 176.24 1j7m n GLY 11 N -0.12 0.57 0.54 -0.77 0.00 -1.26 -4.55 105.19 99.61 1j7m n GLY 11 Ca -0.09 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.26 0.84 3.82 -0.02 0.00 -1.26 -5.08 105.19 103.22 1j7m n GLY 12 Ca 0.00 -0.21 -0.36 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.00 3.69 0.74 4.61 0.00 -1.26 -4.87 121.76 122.67 1j7m s ALA 13 Ca 0.00 -0.71 -0.07 0.00 0.00 0.00 0.00 51.96 51.18 1j7m s ALA 13 Cb 0.00 -1.80 0.08 0.00 0.00 0.00 0.00 23.12 21.40 1j7m s ALA 13 CO 0.00 0.62 1.05 -1.25 0.00 0.00 0.00 175.76 176.18 1j7m s PRO 14 N -1.09 2.00 0.44 0.00 0.04 -1.26 -2.76 135.00 132.37 1j7m s PRO 14 Ca 0.16 -0.32 -0.22 0.00 0.04 0.00 0.00 61.00 60.66 1j7m s PRO 14 Cb -0.12 -2.14 -0.09 0.00 0.04 0.00 0.00 34.50 32.19 1j7m s PRO 14 CO 0.05 -1.38 1.03 0.00 0.04 0.00 0.00 177.00 176.74 1j7m s VAL 16 N -1.86 3.01 -0.06 0.00 1.01 0.01 -4.92 120.40 117.60 1j7m s VAL 16 Ca 0.63 -0.81 0.03 0.00 0.00 0.00 0.00 61.98 61.83 1j7m s VAL 16 Cb -0.18 -2.45 -0.02 0.00 0.00 0.00 0.00 36.38 33.73 1j7m s VAL 16 CO 0.23 0.31 -0.14 -0.36 0.00 0.00 0.00 175.10 175.13 1j7m s PHE 17 N 1.38 2.71 -0.03 5.22 0.08 -1.26 -2.14 117.98 123.94 1j7m s PHE 17 Ca 0.03 -0.21 -0.24 0.00 0.12 0.00 0.00 56.93 56.63 1j7m s PHE 17 Cb -0.15 -1.65 -0.04 0.00 -0.57 0.00 0.00 43.02 40.61 1j7m s PHE 17 CO -0.05 0.15 0.72 -1.25 -0.10 0.00 0.00 175.22 174.68 1j7m s PRO 18 N -0.63 4.44 -0.20 0.24 0.05 -1.26 -5.07 135.00 132.57 1j7m s PRO 18 Ca 0.09 0.93 -0.11 0.00 0.05 0.00 0.00 61.00 61.97 1j7m s PRO 18 Cb -0.11 -3.41 -0.05 0.00 0.05 0.00 0.00 34.50 30.98 1j7m s PRO 18 CO 0.01 0.16 0.15 -0.59 0.05 0.00 0.00 177.00 176.78 1j7m s PHE 19 N 0.46 3.39 -0.22 0.56 -0.71 0.41 -4.70 117.98 117.18 1j7m s PHE 19 Ca 0.38 0.34 -0.18 0.00 -1.04 0.00 0.00 56.93 56.42 1j7m s PHE 19 Cb -0.19 -2.20 -0.03 0.00 -1.21 0.00 0.00 43.02 39.39 1j7m s PHE 19 CO 0.20 0.24 0.52 0.99 -1.34 0.00 0.00 175.22 175.83 1j7m s THR 20 N 0.53 5.09 -0.11 -4.49 2.01 -0.99 0.68 115.64 118.36 1j7m s THR 20 Ca 0.09 0.95 0.03 0.00 0.31 0.00 0.00 61.69 63.06 1j7m s THR 20 Cb -0.12 -3.84 -0.01 0.00 0.01 0.00 0.00 72.50 68.54 1j7m s THR 20 CO -0.00 0.15 -0.20 0.12 -0.69 0.00 0.00 174.62 174.00 1j7m s PHE 21 N 1.83 2.65 -1.26 4.92 5.36 0.14 -1.93 117.98 129.69 1j7m s PHE 21 Ca 0.23 -0.91 -0.02 0.00 -0.96 0.00 0.00 56.93 55.28 1j7m s PHE 21 Cb -0.15 -1.76 0.02 0.00 -0.34 0.00 0.00 43.02 40.79 1j7m s PHE 21 CO 0.09 -0.35 0.05 1.28 -1.46 0.00 0.00 175.22 174.83 1j7m n LEU 22 N 3.52 -0.75 0.00 6.12 7.99 -1.26 -0.19 117.00 132.43 1j7m n LEU 22 Ca -0.19 -1.01 0.00 0.00 -0.01 0.00 0.00 56.01 54.80 1j7m n LEU 22 Cb 0.53 -1.26 0.00 0.00 -0.11 0.00 0.00 43.42 42.58 1j7m n LEU 22 CO 0.29 0.34 0.00 0.61 -1.51 0.00 0.00 177.39 177.12 1j7m n GLY 23 N -2.13 3.43 3.39 -0.72 0.00 -1.26 -5.07 105.19 102.82 1j7m n GLY 23 Ca -0.23 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.02 3.88 -0.07 1.61 0.01 0.73 -5.09 114.94 114.98 1j7m s ASN 24 Ca 0.00 -0.32 -0.30 0.00 -0.71 0.00 0.00 52.86 51.54 1j7m s ASN 24 Cb 0.00 -1.29 -0.02 0.00 0.41 0.00 0.00 41.25 40.35 1j7m s ASN 24 CO 0.00 0.23 1.10 -0.54 -1.51 0.00 0.00 177.10 176.38 1j7m s LYS 25 N -0.04 4.39 -0.24 -0.60 1.02 -1.26 0.25 119.74 123.27 1j7m s LYS 25 Ca -0.04 1.54 -0.04 0.00 0.02 0.00 0.00 55.97 57.45 1j7m s LYS 25 Cb -0.14 -3.54 -0.00 0.00 -0.52 0.00 0.00 37.83 33.63 1j7m s LYS 25 CO 0.04 -0.36 -0.01 0.71 -0.92 0.00 0.00 175.35 174.80 1j7m s TYR 26 N 2.03 3.01 -0.30 3.18 2.02 0.22 -4.91 117.35 122.60 1j7m s TYR 26 Ca 0.52 -0.95 0.23 0.00 -0.37 0.00 0.00 57.07 56.50 1j7m s TYR 26 Cb -0.22 -2.14 0.06 0.00 -0.40 0.00 0.00 41.96 39.26 1j7m s TYR 26 CO 0.21 -0.55 1.11 0.93 -1.57 0.00 0.00 175.55 175.68 1j7m h GLU 27 N 8.14 0.00 0.00 -0.62 5.08 -1.92 0.12 114.58 125.37 1j7m h GLU 27 Ca -0.39 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.47 1j7m h GLU 27 Cb 1.15 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.29 1j7m h GLU 27 CO 0.60 0.00 -0.41 -1.13 -1.00 0.00 0.00 179.01 177.07 1j7m n SER 28 N -2.63 1.75 -4.57 1.42 3.41 -1.26 -4.88 113.62 106.86 1j7m n SER 28 Ca 0.01 -2.90 -0.28 0.00 -0.26 0.00 0.00 58.87 55.43 1j7m n SER 28 Cb 0.53 0.74 0.20 0.00 -0.26 0.00 0.00 64.21 65.42 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 -2.85 0.00 -0.09 0.00 -1.32 -0.09 -4.96 115.64 106.32 1j7m s THR 30 Ca 0.67 -1.65 0.13 0.00 -1.21 0.00 0.00 61.69 59.63 1j7m s THR 30 Cb -0.20 -2.44 0.20 0.00 -1.51 0.00 0.00 72.50 68.56 1j7m s THR 30 CO 0.59 0.00 1.10 -1.54 -2.21 0.00 0.00 174.62 172.56 1j7m n SER 31 N -0.75 1.70 -4.75 8.08 3.41 -1.26 0.48 113.62 120.53 1j7m n SER 31 Ca 0.01 -2.75 -0.42 0.00 -0.26 0.00 0.00 58.87 55.45 1j7m n SER 31 Cb 0.63 -0.35 -0.01 0.00 -0.26 0.00 0.00 64.21 64.21 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 -1.02 2.60 -0.14 7.33 0.00 -1.26 -1.40 120.51 126.62 1j7m n ALA 32 Ca 0.11 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1j7m n ALA 32 Cb 0.64 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.62 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 2.04 1.84 0.00 0.00 0.00 -1.26 -4.78 105.19 103.04 1j7m n GLY 33 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 -2.65 1.61 1.74 -0.58 -4.99 116.66 109.79 1j7m n ARG 34 Ca 0.00 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.92 1j7m n ARG 34 Cb 0.00 0.00 0.02 0.00 -1.02 0.00 0.00 32.46 31.46 1j7m n ARG 34 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1j7m n SER 35 N 0.00 -4.73 -0.08 0.55 2.88 -0.49 -4.89 113.62 106.86 1j7m n SER 35 Ca 0.00 -0.15 -0.08 0.00 -1.33 0.00 0.00 58.87 57.31 1j7m n SER 35 Cb 0.00 -3.67 -0.13 0.00 -0.75 0.00 0.00 64.21 59.67 1j7m n SER 35 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1j7m n ASP 36 N -1.15 1.07 0.00 -3.46 5.75 -1.26 -5.02 116.55 112.47 1j7m n ASP 36 Ca -0.11 -0.01 0.00 0.00 -0.01 0.00 0.00 54.79 54.67 1j7m n ASP 36 Cb 0.60 0.84 0.00 0.00 -1.03 0.00 0.00 41.12 41.53 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 2.03 1.98 3.68 6.12 0.00 -1.26 -5.12 105.19 112.61 1j7m n GLY 37 Ca -0.27 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.15 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 4.36 0.19 1.61 -0.14 -1.26 -5.03 119.74 119.47 1j7m s LYS 38 Ca 0.00 1.42 -0.14 0.00 -1.36 0.00 0.00 55.97 55.89 1j7m s LYS 38 Cb 0.00 -3.58 -0.07 0.00 -1.68 0.00 0.00 37.83 32.50 1j7m s LYS 38 CO 0.00 -0.44 0.58 -1.64 -0.76 0.00 0.00 175.35 173.10 1j7m s MET 39 N 2.44 3.97 0.00 1.68 -1.94 -1.26 -4.76 119.30 119.42 1j7m s MET 39 Ca 0.48 0.49 0.00 0.00 -1.71 0.00 0.00 55.69 54.95 1j7m s MET 39 Cb -0.18 -2.81 0.00 0.00 2.01 0.00 0.00 34.83 33.85 1j7m s MET 39 CO 0.15 0.40 0.00 -2.67 -0.01 0.00 0.00 175.02 172.89 1j7m n TRP 40 N 0.47 0.00 -3.61 -0.03 4.27 0.18 0.40 117.44 119.12 1j7m n TRP 40 Ca -0.03 0.00 -0.15 0.00 -3.89 0.00 0.00 57.50 53.43 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 -0.17 2.99 -1.20 0.00 0.00 -1.26 -1.24 121.76 120.88 1j7m s ALA 42 Ca -0.04 0.39 0.18 0.00 0.00 0.00 0.00 51.96 52.49 1j7m s ALA 42 Cb -0.03 -3.17 0.61 0.00 0.00 0.00 0.00 23.12 20.53 1j7m s ALA 42 CO 0.04 -0.14 1.52 0.25 0.00 0.00 0.00 175.76 177.43 1j7m n THR 43 N -1.07 1.53 -4.10 0.00 -2.24 -0.00 -0.81 114.28 107.59 1j7m n THR 43 Ca 0.08 -1.18 -0.14 0.00 -2.27 0.00 0.00 64.05 60.53 1j7m n THR 43 Cb 0.54 0.25 -0.12 0.00 -2.10 0.00 0.00 70.33 68.90 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 -1.58 0.63 0.34 4.28 -4.23 -1.26 -4.62 115.64 109.20 1j7m s THR 44 Ca 0.45 -1.04 0.06 0.00 -1.18 0.00 0.00 61.69 59.97 1j7m s THR 44 Cb 0.27 -0.67 0.30 0.00 1.34 0.00 0.00 72.50 73.75 1j7m s THR 44 CO 0.24 -0.30 1.90 0.00 -0.54 0.00 0.00 174.62 175.91 1j7m h ALA 45 N 4.61 1.70 -3.59 3.99 0.00 -1.88 -3.36 119.26 120.73 1j7m h ALA 45 Ca -0.36 -0.00 -0.61 0.00 0.00 0.00 0.00 54.91 53.93 1j7m h ALA 45 Cb 1.20 -0.18 -0.38 0.00 0.00 0.00 0.00 17.79 18.43 1j7m h ALA 45 CO 0.41 0.11 -0.79 1.21 0.00 0.00 0.00 179.25 180.19 1j7m s ASN 46 N -5.94 3.75 0.14 0.00 3.84 -1.26 -2.34 114.94 113.13 1j7m s ASN 46 Ca -0.10 -1.10 -0.02 0.00 0.21 0.00 0.00 52.86 51.85 1j7m s ASN 46 Cb 0.21 -1.21 -0.07 0.00 -0.55 0.00 0.00 41.25 39.63 1j7m s ASN 46 CO 0.79 -0.21 1.32 0.22 -2.79 0.00 0.00 177.10 176.43 1j7m h TYR 47 N 7.95 0.47 -0.65 0.43 3.20 -1.54 -3.22 116.97 123.61 1j7m h TYR 47 Ca -0.21 -0.26 0.17 0.00 3.14 0.00 0.00 58.73 61.57 1j7m h TYR 47 Cb 1.08 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 39.26 1j7m h TYR 47 CO 0.51 1.09 0.46 -0.44 -1.64 0.00 0.00 178.16 178.14 1j7m h ASP 48 N 0.17 0.11 0.00 -2.11 3.32 -1.94 0.50 116.42 116.47 1j7m h ASP 48 Ca -0.07 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 56.96 1j7m h ASP 48 Cb 1.58 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 41.11 1j7m h ASP 48 CO 0.15 0.05 -0.56 0.44 -1.72 0.00 0.00 179.24 177.61 1j7m h ASP 49 N 0.11 0.00 1.23 6.45 3.32 -1.92 -3.42 116.42 122.19 1j7m h ASP 49 Ca 0.31 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1j7m h ASP 49 Cb 1.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.64 1j7m h ASP 49 CO -0.04 0.83 -0.70 0.44 -1.72 0.00 0.00 179.24 178.05 1j7m h ASP 50 N -1.00 0.00 -6.74 6.45 5.19 -1.56 -3.48 116.42 115.27 1j7m h ASP 50 Ca -0.04 -0.03 -0.55 0.00 -0.62 0.00 0.00 57.03 55.79 1j7m h ASP 50 Cb 0.57 0.00 -0.12 0.00 0.18 0.00 0.00 39.33 39.96 1j7m h ASP 50 CO -0.03 0.01 -0.92 0.54 -3.12 0.00 0.00 179.24 175.73 1j7m n ARG 51 N -2.70 -2.34 -3.79 3.56 1.74 0.18 -4.94 116.66 108.36 1j7m n ARG 51 Ca 0.01 0.28 -0.37 0.00 -0.77 0.00 0.00 57.85 57.01 1j7m n ARG 51 Cb 0.53 -4.18 -0.13 0.00 -1.02 0.00 0.00 32.46 27.66 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 3.28 0.38 5.56 1.02 -1.26 -5.03 119.74 116.79 1j7m s LYS 52 Ca 0.04 -0.72 0.04 0.00 0.02 0.00 0.00 55.97 55.35 1j7m s LYS 52 Cb -0.02 -3.28 -0.05 0.00 -0.52 0.00 0.00 37.83 33.96 1j7m s LYS 52 CO 0.94 -0.33 0.07 1.67 -0.92 0.00 0.00 175.35 176.77 1j7m s TRP 53 N 1.52 1.97 -0.28 3.18 1.48 -1.26 -0.82 118.94 124.72 1j7m s TRP 53 Ca 0.04 -1.01 -0.24 0.00 -1.06 0.00 0.00 56.10 53.83 1j7m s TRP 53 Cb -0.16 -1.35 0.12 0.00 -1.16 0.00 0.00 33.47 30.92 1j7m s TRP 53 CO 0.01 0.00 1.01 0.20 -4.06 0.00 0.00 176.95 174.12 1j7m s GLY 54 N -3.60 -0.15 0.74 3.67 0.00 -0.37 -1.15 107.32 106.45 1j7m s GLY 54 Ca 0.29 2.72 -0.15 0.00 0.00 0.00 0.00 44.72 47.57 1j7m s GLY 54 CO 0.14 1.95 0.97 0.69 0.00 0.00 0.00 173.10 176.85 1j7m n PHE 55 N 2.49 0.65 -2.21 1.90 3.72 0.66 0.66 117.46 125.32 1j7m n PHE 55 Ca -0.13 0.39 -0.38 0.00 -0.05 0.00 0.00 57.45 57.28 1j7m n PHE 55 Cb 0.56 -2.07 -0.01 0.00 -0.94 0.00 0.00 39.48 37.02 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 -0.38 1.50 -1.15 0.00 -0.04 -1.26 -4.36 135.00 129.30 1j7m n PRO 57 Ca 0.07 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.47 1j7m n PRO 57 Cb 0.47 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.91 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 -5.69 -1.52 3.54 2.03 -1.26 -4.87 116.55 108.78 1j7m n ASP 58 Ca 0.00 0.13 -0.04 0.00 0.52 0.00 0.00 54.79 55.40 1j7m n ASP 58 Cb 0.00 -3.65 -0.01 0.00 -0.72 0.00 0.00 41.12 36.74 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 -0.10 0.15 0.00 -0.67 6.02 -1.26 -5.27 117.38 116.25 1j7m n GLN 59 Ca -0.05 -0.75 0.00 0.00 -0.01 0.00 0.00 57.00 56.19 1j7m n GLN 59 Cb 0.52 0.68 0.00 0.00 1.02 0.00 0.00 30.24 32.46 1j7m n GLN 59 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46