#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 0.92 -2.82 7.33 2.14 -1.26 -4.89 117.44 118.86 1j7m n TRP 2 Ca 0.00 -0.36 -0.41 0.00 2.07 0.00 0.00 57.50 58.80 1j7m n TRP 2 Cb 0.00 -0.18 -0.04 0.00 -0.81 0.00 0.00 31.31 30.28 1j7m n TRP 2 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1j7m s MET 3 N -1.75 4.52 0.48 -2.67 0.23 -1.26 -5.02 119.30 113.83 1j7m s MET 3 Ca 0.30 1.24 0.04 0.00 -1.03 0.00 0.00 55.69 56.25 1j7m s MET 3 Cb 0.20 -3.46 0.02 0.00 -1.53 0.00 0.00 34.83 30.06 1j7m s MET 3 CO 0.14 -0.02 0.67 -1.12 -2.03 0.00 0.00 175.02 172.66 1j7m s SER 4 N 0.94 5.48 0.71 -1.18 0.01 -1.26 -4.07 113.70 114.34 1j7m s SER 4 Ca 0.47 -0.17 -0.02 0.00 1.31 0.00 0.00 55.95 57.54 1j7m s SER 4 Cb -0.20 -0.83 0.12 0.00 0.21 0.00 0.00 66.02 65.32 1j7m s SER 4 CO 0.25 -0.94 0.99 0.42 0.41 0.00 0.00 173.24 174.36 1j7m s THR 5 N -2.56 2.19 0.00 1.44 -4.23 -0.40 -4.67 115.64 107.40 1j7m s THR 5 Ca 0.55 -0.56 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 1j7m s THR 5 Cb -0.10 -2.63 0.00 0.00 1.34 0.00 0.00 72.50 71.11 1j7m s THR 5 CO 0.36 0.00 0.00 0.52 -0.54 0.00 0.00 174.62 174.96 1j7m n VAL 6 N -2.83 0.00 0.00 2.29 0.31 -0.98 -4.77 118.33 112.34 1j7m n VAL 6 Ca 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.47 1j7m n VAL 6 Cb 0.60 -0.31 0.00 0.00 -0.91 0.00 0.00 33.84 33.22 1j7m n VAL 6 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1j7m n GLY 7 N 5.00 1.75 7.00 2.92 0.00 -1.26 0.14 105.19 120.73 1j7m n GLY 7 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 0.89 0.00 -0.02 0.00 -1.26 -4.57 105.19 100.23 1j7m n GLY 8 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.46 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 -3.78 0.00 -0.01 1.61 2.04 -0.60 -4.87 115.26 109.65 1j7m n ASN 9 Ca 0.00 -1.00 -0.20 0.00 -0.44 0.00 0.00 54.58 52.94 1j7m n ASN 9 Cb 0.00 0.00 -0.14 0.00 -2.53 0.00 0.00 39.78 37.11 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 0.28 0.00 0.53 0.02 -1.80 -3.49 113.55 109.10 1j7m h SER 10 Ca 0.00 -0.85 0.00 0.00 -0.84 0.00 0.00 61.79 60.10 1j7m h SER 10 Cb 0.76 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.21 1j7m h SER 10 CO 0.00 1.46 0.00 0.61 -1.14 0.00 0.00 176.83 177.76 1j7m n GLY 11 N 1.66 1.37 1.45 -3.77 0.00 -1.26 -4.32 105.19 100.32 1j7m n GLY 11 Ca -0.21 -0.55 -0.08 0.00 0.00 0.00 0.00 46.02 45.19 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 2.90 3.76 -0.02 0.00 -1.26 -3.56 105.19 107.01 1j7m n GLY 12 Ca 0.00 -0.40 -0.33 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.98 3.51 0.60 4.61 0.00 -1.26 -4.80 121.76 123.45 1j7m s ALA 13 Ca 0.17 -0.86 -0.04 0.00 0.00 0.00 0.00 51.96 51.22 1j7m s ALA 13 Cb 0.14 -1.55 0.03 0.00 0.00 0.00 0.00 23.12 21.73 1j7m s ALA 13 CO 0.02 0.67 0.89 -1.25 0.00 0.00 0.00 175.76 176.09 1j7m s PRO 14 N -1.55 2.66 -0.04 0.00 0.04 -1.26 -1.27 135.00 133.57 1j7m s PRO 14 Ca 0.21 -0.25 -0.27 0.00 0.04 0.00 0.00 61.00 60.72 1j7m s PRO 14 Cb -0.12 -2.31 -0.03 0.00 0.04 0.00 0.00 34.50 32.08 1j7m s PRO 14 CO 0.11 -0.82 0.84 0.00 0.04 0.00 0.00 177.00 177.17 1j7m s VAL 16 N 0.97 5.12 -0.10 0.00 1.01 -0.00 -4.96 120.40 122.44 1j7m s VAL 16 Ca 0.44 -0.18 -0.02 0.00 0.00 0.00 0.00 61.98 62.22 1j7m s VAL 16 Cb -0.19 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 1j7m s VAL 16 CO 0.22 -0.29 0.00 -0.36 0.00 0.00 0.00 175.10 174.68 1j7m s PHE 17 N 2.09 3.15 -0.02 5.22 0.08 -1.26 -2.04 117.98 125.20 1j7m s PHE 17 Ca 0.12 0.13 -0.24 0.00 0.12 0.00 0.00 56.93 57.07 1j7m s PHE 17 Cb -0.17 -1.82 -0.04 0.00 -0.57 0.00 0.00 43.02 40.42 1j7m s PHE 17 CO 0.13 0.40 0.71 -1.25 -0.10 0.00 0.00 175.22 175.10 1j7m s PRO 18 N -0.68 4.44 -0.23 0.24 0.05 -1.26 -5.07 135.00 132.48 1j7m s PRO 18 Ca 0.11 0.92 -0.10 0.00 0.05 0.00 0.00 61.00 61.98 1j7m s PRO 18 Cb -0.12 -3.40 -0.05 0.00 0.05 0.00 0.00 34.50 30.98 1j7m s PRO 18 CO 0.02 0.18 0.16 -0.59 0.05 0.00 0.00 177.00 176.82 1j7m s PHE 19 N 0.37 3.34 -0.22 0.56 -0.71 0.41 -4.72 117.98 117.01 1j7m s PHE 19 Ca 0.37 0.26 -0.18 0.00 -1.04 0.00 0.00 56.93 56.33 1j7m s PHE 19 Cb -0.19 -2.25 -0.03 0.00 -1.21 0.00 0.00 43.02 39.35 1j7m s PHE 19 CO 0.20 0.12 0.53 0.99 -1.34 0.00 0.00 175.22 175.72 1j7m s THR 20 N 0.88 5.08 -0.12 -4.49 2.01 -0.96 0.88 115.64 118.92 1j7m s THR 20 Ca 0.08 0.95 0.01 0.00 0.31 0.00 0.00 61.69 63.03 1j7m s THR 20 Cb -0.13 -3.85 -0.01 0.00 0.01 0.00 0.00 72.50 68.52 1j7m s THR 20 CO 0.03 0.13 -0.15 0.12 -0.69 0.00 0.00 174.62 174.06 1j7m s PHE 21 N 1.93 2.76 -1.31 4.92 5.36 0.15 -1.79 117.98 130.01 1j7m s PHE 21 Ca 0.23 -0.71 -0.09 0.00 -0.96 0.00 0.00 56.93 55.40 1j7m s PHE 21 Cb -0.15 -1.82 0.09 0.00 -0.34 0.00 0.00 43.02 40.80 1j7m s PHE 21 CO 0.09 -0.25 0.22 1.28 -1.46 0.00 0.00 175.22 175.11 1j7m n LEU 22 N 3.51 -0.69 0.00 6.12 7.99 -1.26 -0.08 117.00 132.60 1j7m n LEU 22 Ca -0.18 -0.97 0.00 0.00 -0.01 0.00 0.00 56.01 54.85 1j7m n LEU 22 Cb 0.53 -1.22 0.00 0.00 -0.11 0.00 0.00 43.42 42.62 1j7m n LEU 22 CO 0.30 0.22 0.00 0.61 -1.51 0.00 0.00 177.39 177.01 1j7m n GLY 23 N -1.59 2.95 3.47 -0.72 0.00 -1.26 -5.08 105.19 102.97 1j7m n GLY 23 Ca -0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.69 4.47 -0.05 1.61 0.01 0.89 -5.08 114.94 116.08 1j7m s ASN 24 Ca 0.00 -0.18 -0.30 0.00 -0.71 0.00 0.00 52.86 51.68 1j7m s ASN 24 Cb 0.00 -1.55 -0.03 0.00 0.41 0.00 0.00 41.25 40.08 1j7m s ASN 24 CO 0.00 0.22 1.09 -0.54 -1.51 0.00 0.00 177.10 176.36 1j7m s LYS 25 N 0.06 4.42 -0.24 -0.60 1.02 -1.26 0.33 119.74 123.48 1j7m s LYS 25 Ca -0.02 1.54 -0.05 0.00 0.02 0.00 0.00 55.97 57.46 1j7m s LYS 25 Cb -0.14 -3.51 -0.01 0.00 -0.52 0.00 0.00 37.83 33.66 1j7m s LYS 25 CO 0.03 -0.31 -0.01 0.71 -0.92 0.00 0.00 175.35 174.86 1j7m s TYR 26 N 1.80 3.02 -0.82 3.18 2.02 0.25 -4.91 117.35 121.90 1j7m s TYR 26 Ca 0.53 -0.93 0.25 0.00 -0.37 0.00 0.00 57.07 56.55 1j7m s TYR 26 Cb -0.22 -2.15 0.41 0.00 -0.40 0.00 0.00 41.96 39.60 1j7m s TYR 26 CO 0.22 -0.54 1.34 0.39 -1.57 0.00 0.00 175.55 175.40 1j7m n GLU 27 N 4.82 0.15 -2.29 -0.62 -0.58 -1.26 -0.45 120.64 120.41 1j7m n GLU 27 Ca -0.17 0.03 -0.03 0.00 -0.42 0.00 0.00 57.16 56.58 1j7m n GLU 27 Cb 0.50 -1.58 -0.01 0.00 -0.57 0.00 0.00 31.44 29.78 1j7m n GLU 27 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1j7m n SER 28 N -1.79 0.36 -4.71 1.62 3.41 -1.26 -4.89 113.62 106.34 1j7m n SER 28 Ca 0.04 -1.27 -0.29 0.00 -0.26 0.00 0.00 58.87 57.08 1j7m n SER 28 Cb 0.39 0.18 0.14 0.00 -0.26 0.00 0.00 64.21 64.66 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 -2.96 0.00 -0.10 0.00 -1.32 0.31 -4.94 115.64 106.63 1j7m s THR 30 Ca 0.64 -1.80 0.14 0.00 -1.21 0.00 0.00 61.69 59.45 1j7m s THR 30 Cb -0.18 -2.43 0.23 0.00 -1.51 0.00 0.00 72.50 68.62 1j7m s THR 30 CO 0.57 0.00 1.12 -1.54 -2.21 0.00 0.00 174.62 172.56 1j7m n SER 31 N -0.47 1.70 -4.74 8.08 3.41 -1.26 0.10 113.62 120.44 1j7m n SER 31 Ca 0.01 -2.85 -0.42 0.00 -0.26 0.00 0.00 58.87 55.36 1j7m n SER 31 Cb 0.64 -0.38 -0.02 0.00 -0.26 0.00 0.00 64.21 64.19 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 -2.12 3.83 0.00 7.33 0.00 -1.26 -0.97 121.76 128.57 1j7m s ALA 32 Ca 0.25 1.58 0.00 0.00 0.00 0.00 0.00 51.96 53.78 1j7m s ALA 32 Cb 0.22 -3.67 0.00 0.00 0.00 0.00 0.00 23.12 19.67 1j7m s ALA 32 CO 0.01 -0.96 0.00 0.41 0.00 0.00 0.00 175.76 175.23 1j7m n GLY 33 N 2.97 2.35 0.04 0.00 0.00 -1.26 -4.79 105.19 104.50 1j7m n GLY 33 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 -2.64 1.61 1.74 -0.34 -4.98 116.66 110.06 1j7m n ARG 34 Ca 0.00 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.93 1j7m n ARG 34 Cb 0.00 -0.02 -0.00 0.00 -1.02 0.00 0.00 32.46 31.41 1j7m n ARG 34 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1j7m n SER 35 N -1.38 -4.18 -0.09 0.55 3.41 -0.14 -4.80 113.62 106.99 1j7m n SER 35 Ca 0.00 0.05 -0.12 0.00 -0.26 0.00 0.00 58.87 58.54 1j7m n SER 35 Cb 0.00 -3.51 -0.10 0.00 -0.26 0.00 0.00 64.21 60.34 1j7m n SER 35 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1j7m n ASP 36 N -1.95 2.20 0.00 4.04 5.75 -1.26 -5.06 116.55 120.27 1j7m n ASP 36 Ca -0.13 -0.07 0.00 0.00 -0.01 0.00 0.00 54.79 54.58 1j7m n ASP 36 Cb 0.61 0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.71 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 2.45 -1.17 3.74 6.12 0.00 -1.26 -5.14 105.19 109.94 1j7m n GLY 37 Ca -0.31 0.48 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 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 4.47 0.22 1.61 3.01 -1.26 -5.03 119.74 122.76 1j7m s LYS 38 Ca 0.00 1.93 -0.04 0.00 -1.01 0.00 0.00 55.97 56.86 1j7m s LYS 38 Cb 0.00 -3.21 -0.05 0.00 -1.01 0.00 0.00 37.83 33.56 1j7m s LYS 38 CO 0.00 -0.10 0.45 -1.64 0.51 0.00 0.00 175.35 174.57 1j7m s MET 39 N -0.43 3.60 0.00 1.68 -1.94 -1.26 -4.78 119.30 116.16 1j7m s MET 39 Ca 0.53 -0.13 0.00 0.00 -1.71 0.00 0.00 55.69 54.37 1j7m s MET 39 Cb -0.34 -2.77 0.00 0.00 2.01 0.00 0.00 34.83 33.73 1j7m s MET 39 CO 0.38 0.35 0.00 -2.67 -0.01 0.00 0.00 175.02 173.08 1j7m n TRP 40 N -0.54 0.00 -3.59 -0.03 4.27 0.28 -0.24 117.44 117.60 1j7m n TRP 40 Ca -0.03 0.00 -0.16 0.00 -3.89 0.00 0.00 57.50 53.43 1j7m n TRP 40 Cb 0.53 0.00 -0.07 0.00 -1.36 0.00 0.00 31.31 30.42 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 -0.25 3.00 -1.71 0.00 0.00 -1.26 -1.30 121.76 120.24 1j7m s ALA 42 Ca -0.04 0.32 0.20 0.00 0.00 0.00 0.00 51.96 52.44 1j7m s ALA 42 Cb -0.03 -3.16 0.56 0.00 0.00 0.00 0.00 23.12 20.49 1j7m s ALA 42 CO 0.05 -0.19 1.47 0.25 0.00 0.00 0.00 175.76 177.33 1j7m n THR 43 N -1.26 0.99 -4.15 0.00 -2.24 -0.46 -0.82 114.28 106.34 1j7m n THR 43 Ca 0.07 -1.00 -0.15 0.00 -2.27 0.00 0.00 64.05 60.71 1j7m n THR 43 Cb 0.54 0.51 -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 -1.00 0.91 0.23 4.28 -4.23 -1.26 -4.50 115.64 110.06 1j7m s THR 44 Ca 0.42 -1.46 -0.06 0.00 -1.18 0.00 0.00 61.69 59.41 1j7m s THR 44 Cb 0.22 -1.16 0.20 0.00 1.34 0.00 0.00 72.50 73.11 1j7m s THR 44 CO 0.29 -0.45 1.85 0.00 -0.54 0.00 0.00 174.62 175.77 1j7m h ALA 45 N 3.90 1.13 -3.73 3.99 0.00 -1.87 -3.37 119.26 119.30 1j7m h ALA 45 Ca -0.38 -0.01 -0.66 0.00 0.00 0.00 0.00 54.91 53.86 1j7m h ALA 45 Cb 1.19 -0.23 -0.37 0.00 0.00 0.00 0.00 17.79 18.38 1j7m h ALA 45 CO 0.48 0.27 -0.81 1.21 0.00 0.00 0.00 179.25 180.40 1j7m s ASN 46 N -5.77 4.18 0.16 0.00 3.84 -1.26 -2.27 114.94 113.82 1j7m s ASN 46 Ca -0.13 -1.27 0.04 0.00 0.21 0.00 0.00 52.86 51.72 1j7m s ASN 46 Cb 0.18 -1.49 -0.05 0.00 -0.55 0.00 0.00 41.25 39.34 1j7m s ASN 46 CO 0.79 -0.17 1.35 0.22 -2.79 0.00 0.00 177.10 176.50 1j7m h TYR 47 N 7.82 0.19 -0.86 0.43 5.03 -1.52 -3.20 116.97 124.85 1j7m h TYR 47 Ca -0.22 -0.11 0.22 0.00 2.58 0.00 0.00 58.73 61.19 1j7m h TYR 47 Cb 1.06 -0.02 -0.05 0.00 1.55 0.00 0.00 36.73 39.27 1j7m h TYR 47 CO 0.60 0.97 0.59 -0.44 -1.32 0.00 0.00 178.16 178.56 1j7m h ASP 48 N 0.06 0.23 0.00 -2.11 3.32 -1.94 0.21 116.42 116.19 1j7m h ASP 48 Ca -0.04 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1j7m h ASP 48 Cb 1.58 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 41.11 1j7m h ASP 48 CO 0.13 0.09 0.00 0.47 -1.72 0.00 0.00 179.24 178.21 1j7m n ASP 49 N -4.42 0.00 0.22 6.45 8.00 -1.23 -4.62 116.55 120.95 1j7m n ASP 49 Ca 0.18 0.21 0.07 0.00 0.71 0.00 0.00 54.79 55.96 1j7m n ASP 49 Cb 0.78 -0.42 0.51 0.00 -0.02 0.00 0.00 41.12 41.97 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 -6.71 -2.24 5.19 -1.61 -3.47 116.42 107.59 1j7m h ASP 50 Ca 0.00 0.00 -0.54 0.00 -0.62 0.00 0.00 57.03 55.87 1j7m h ASP 50 Cb 0.00 0.00 -0.10 0.00 0.18 0.00 0.00 39.33 39.41 1j7m h ASP 50 CO 0.00 0.24 -0.92 0.54 -3.12 0.00 0.00 179.24 175.98 1j7m n ARG 51 N -3.93 -2.24 -4.04 3.56 1.74 0.75 -4.96 116.66 107.55 1j7m n ARG 51 Ca -0.02 0.28 -0.34 0.00 -0.77 0.00 0.00 57.85 57.01 1j7m n ARG 51 Cb 0.32 -4.08 -0.15 0.00 -1.02 0.00 0.00 32.46 27.53 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 -6.85 3.06 0.36 5.56 1.02 -1.26 -5.06 119.74 116.56 1j7m s LYS 52 Ca 0.05 -0.81 0.04 0.00 0.02 0.00 0.00 55.97 55.27 1j7m s LYS 52 Cb -0.02 -2.76 -0.05 0.00 -0.52 0.00 0.00 37.83 34.47 1j7m s LYS 52 CO 0.93 -0.24 0.07 1.67 -0.92 0.00 0.00 175.35 176.85 1j7m s TRP 53 N 1.34 1.96 -0.12 3.18 1.48 -1.26 -1.35 118.94 124.17 1j7m s TRP 53 Ca 0.04 -1.00 -0.29 0.00 -1.06 0.00 0.00 56.10 53.79 1j7m s TRP 53 Cb -0.14 -1.31 0.08 0.00 -1.16 0.00 0.00 33.47 30.93 1j7m s TRP 53 CO -0.09 -0.01 0.74 0.20 -4.06 0.00 0.00 176.95 173.74 1j7m s GLY 54 N -3.55 -0.51 0.84 3.67 0.00 -0.42 -1.56 107.32 105.78 1j7m s GLY 54 Ca 0.32 1.62 -0.11 0.00 0.00 0.00 0.00 44.72 46.55 1j7m s GLY 54 CO 0.15 1.18 1.15 -1.36 0.00 0.00 0.00 173.10 174.22 1j7m s PHE 55 N -0.78 1.92 0.17 1.90 0.08 0.36 0.72 117.98 122.36 1j7m s PHE 55 Ca -0.07 1.70 -0.31 0.00 0.12 0.00 0.00 56.93 58.37 1j7m s PHE 55 Cb -0.01 -3.32 -0.10 0.00 -0.57 0.00 0.00 43.02 39.02 1j7m s PHE 55 CO 0.06 -2.55 1.54 0.00 -0.10 0.00 0.00 175.22 174.17 1j7m n PRO 57 N 3.73 0.94 -2.94 0.00 -0.04 -1.26 -3.82 135.00 131.62 1j7m n PRO 57 Ca 0.13 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.32 1j7m n PRO 57 Cb 0.39 -1.07 -0.04 0.00 -0.04 0.00 0.00 33.50 32.74 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 -0.42 4.23 0.00 3.54 2.03 -1.26 -5.03 116.55 119.64 1j7m n ASP 58 Ca 0.00 -3.64 0.00 0.00 0.52 0.00 0.00 54.79 51.67 1j7m n ASP 58 Cb 0.03 -0.56 0.00 0.00 -0.72 0.00 0.00 41.12 39.88 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 -0.22 2.58 0.00 -0.67 1.13 -1.25 -5.10 117.38 113.85 1j7m n GLN 59 Ca 0.31 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.37 1j7m n GLN 59 Cb 0.42 0.00 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