#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 -3.60 -1.74 1.43 8.01 -1.26 -4.82 117.44 115.46 1j7m n TRP 2 Ca 0.00 2.08 -0.42 0.00 -1.31 0.00 0.00 57.50 57.85 1j7m n TRP 2 Cb 0.00 -3.45 -0.00 0.00 -2.01 0.00 0.00 31.31 25.84 1j7m n TRP 2 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1j7m n MET 3 N 1.33 3.01 0.00 -0.99 0.00 -1.26 -4.95 117.12 114.26 1j7m n MET 3 Ca -0.33 -2.64 0.00 0.00 0.00 0.00 0.00 57.70 54.73 1j7m n MET 3 Cb 0.51 -3.21 0.00 0.00 0.00 0.00 0.00 33.22 30.52 1j7m n MET 3 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 1j7m n SER 4 N 5.64 0.00 -4.99 3.17 7.64 -1.26 -4.70 113.62 119.12 1j7m n SER 4 Ca 0.54 0.00 -0.21 0.00 1.01 0.00 0.00 58.87 60.20 1j7m n SER 4 Cb 0.37 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.61 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 0.00 2.07 0.13 0.44 -4.23 -1.21 -4.90 115.64 107.94 1j7m s THR 5 Ca 0.00 -1.16 0.04 0.00 -1.18 0.00 0.00 61.69 59.39 1j7m s THR 5 Cb 0.00 -2.23 -0.04 0.00 1.34 0.00 0.00 72.50 71.57 1j7m s THR 5 CO 0.00 0.00 -0.09 0.54 -0.54 0.00 0.00 174.62 174.53 1j7m s VAL 6 N -2.67 1.00 0.00 2.29 0.11 -1.25 -4.97 120.40 114.91 1j7m s VAL 6 Ca 0.53 -1.97 0.00 0.00 -2.93 0.00 0.00 61.98 57.60 1j7m s VAL 6 Cb -0.05 -1.74 0.00 0.00 -1.53 0.00 0.00 36.38 33.06 1j7m s VAL 6 CO 0.33 -0.76 0.00 0.61 -3.33 0.00 0.00 175.10 171.95 1j7m n GLY 7 N -0.06 0.91 7.00 6.54 0.00 -1.26 0.19 105.19 118.51 1j7m n GLY 7 Ca -0.11 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.17 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 1.33 1.03 -0.02 0.00 -1.26 -4.53 105.19 101.74 1j7m n GLY 8 Ca 0.00 -0.44 -0.05 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.36 -0.63 0.10 1.61 2.04 -0.30 -4.92 115.26 110.79 1j7m n ASN 9 Ca 0.00 -1.93 -0.14 0.00 -0.44 0.00 0.00 54.58 52.07 1j7m n ASN 9 Cb 0.00 0.18 -0.12 0.00 -2.53 0.00 0.00 39.78 37.32 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 0.15 0.39 0.00 0.53 4.64 -1.80 -3.47 113.55 113.98 1j7m h SER 10 Ca -0.47 -0.39 0.00 0.00 -0.47 0.00 0.00 61.79 60.45 1j7m h SER 10 Cb 1.45 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1j7m h SER 10 CO -0.21 1.29 0.00 0.61 -0.87 0.00 0.00 176.83 177.65 1j7m n GLY 11 N 1.41 2.08 1.18 -0.77 0.00 -1.26 -4.03 105.19 103.80 1j7m n GLY 11 Ca -0.07 -0.33 -0.02 0.00 0.00 0.00 0.00 46.02 45.59 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 0.71 3.88 -0.02 0.00 -1.26 -4.86 105.19 103.63 1j7m n GLY 12 Ca 0.00 -0.33 -0.34 0.00 0.00 0.00 0.00 46.02 45.34 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 3.88 0.59 4.61 0.00 -1.26 -4.84 121.76 124.75 1j7m s ALA 13 Ca 0.13 -0.74 -0.05 0.00 0.00 0.00 0.00 51.96 51.31 1j7m s ALA 13 Cb 0.15 -1.86 0.02 0.00 0.00 0.00 0.00 23.12 21.43 1j7m s ALA 13 CO -0.07 0.70 0.88 -1.25 0.00 0.00 0.00 175.76 176.03 1j7m s PRO 14 N -1.65 2.77 -0.26 0.00 0.04 -1.26 -3.29 135.00 131.34 1j7m s PRO 14 Ca 0.23 -0.18 -0.28 0.00 0.04 0.00 0.00 61.00 60.81 1j7m s PRO 14 Cb -0.12 -2.31 0.01 0.00 0.04 0.00 0.00 34.50 32.12 1j7m s PRO 14 CO 0.14 -0.75 1.00 0.00 0.04 0.00 0.00 177.00 177.43 1j7m s VAL 16 N 3.26 4.67 -0.09 0.00 1.01 0.05 -4.94 120.40 124.36 1j7m s VAL 16 Ca 0.42 1.60 0.02 0.00 0.00 0.00 0.00 61.98 64.02 1j7m s VAL 16 Cb -0.14 -4.28 -0.02 0.00 0.00 0.00 0.00 36.38 31.94 1j7m s VAL 16 CO 0.09 -0.30 -0.14 -0.36 0.00 0.00 0.00 175.10 174.39 1j7m s PHE 17 N 3.25 2.74 0.07 5.22 0.08 -1.26 -2.10 117.98 125.99 1j7m s PHE 17 Ca 0.40 -0.45 -0.23 0.00 0.12 0.00 0.00 56.93 56.76 1j7m s PHE 17 Cb -0.14 -1.74 -0.06 0.00 -0.57 0.00 0.00 43.02 40.51 1j7m s PHE 17 CO 0.12 -0.05 0.71 -1.25 -0.10 0.00 0.00 175.22 174.65 1j7m s PRO 18 N -0.14 4.44 -0.20 0.24 0.05 -1.26 -5.04 135.00 133.09 1j7m s PRO 18 Ca -0.01 0.98 -0.09 0.00 0.05 0.00 0.00 61.00 61.93 1j7m s PRO 18 Cb -0.14 -3.31 -0.05 0.00 0.05 0.00 0.00 34.50 31.05 1j7m s PRO 18 CO 0.03 0.43 0.12 -0.59 0.05 0.00 0.00 177.00 177.04 1j7m s PHE 19 N -0.53 3.36 -0.16 0.56 -0.71 0.96 -4.72 117.98 116.74 1j7m s PHE 19 Ca 0.35 0.25 -0.19 0.00 -1.04 0.00 0.00 56.93 56.30 1j7m s PHE 19 Cb -0.21 -2.15 -0.04 0.00 -1.21 0.00 0.00 43.02 39.42 1j7m s PHE 19 CO 0.22 0.23 0.51 0.99 -1.34 0.00 0.00 175.22 175.83 1j7m s THR 20 N 0.44 5.14 0.01 -4.49 2.01 -0.60 0.64 115.64 118.80 1j7m s THR 20 Ca 0.07 0.98 0.04 0.00 0.31 0.00 0.00 61.69 63.08 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 -0.01 0.24 -0.12 0.12 -0.69 0.00 0.00 174.62 174.17 1j7m s PHE 21 N 1.16 1.05 -1.64 4.92 5.36 0.52 -1.72 117.98 127.63 1j7m s PHE 21 Ca 0.26 -0.25 -0.21 0.00 -0.96 0.00 0.00 56.93 55.76 1j7m s PHE 21 Cb -0.15 -0.65 0.21 0.00 -0.34 0.00 0.00 43.02 42.08 1j7m s PHE 21 CO 0.10 -0.00 0.52 1.28 -1.46 0.00 0.00 175.22 175.66 1j7m n LEU 22 N 2.45 -0.72 0.00 6.12 7.99 -1.26 0.49 117.00 132.07 1j7m n LEU 22 Ca -0.16 -1.03 0.00 0.00 -0.01 0.00 0.00 56.01 54.81 1j7m n LEU 22 Cb 0.56 -1.49 0.00 0.00 -0.11 0.00 0.00 43.42 42.38 1j7m n LEU 22 CO 0.24 0.09 0.00 0.61 -1.51 0.00 0.00 177.39 176.82 1j7m n GLY 23 N -0.98 1.49 3.56 -0.72 0.00 -1.26 -5.04 105.19 102.23 1j7m n GLY 23 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 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 4.64 -0.21 1.61 0.01 0.18 -5.08 114.94 113.03 1j7m s ASN 24 Ca 0.00 -0.05 -0.28 0.00 -0.71 0.00 0.00 52.86 51.82 1j7m s ASN 24 Cb 0.00 -1.28 0.00 0.00 0.41 0.00 0.00 41.25 40.38 1j7m s ASN 24 CO 0.00 0.32 0.97 -0.54 -1.51 0.00 0.00 177.10 176.34 1j7m s LYS 25 N -0.58 4.27 -0.44 -0.60 1.02 -1.26 -0.35 119.74 121.80 1j7m s LYS 25 Ca 0.09 1.24 -0.11 0.00 0.02 0.00 0.00 55.97 57.21 1j7m s LYS 25 Cb -0.12 -3.62 0.08 0.00 -0.52 0.00 0.00 37.83 33.65 1j7m s LYS 25 CO 0.02 -0.53 0.31 0.71 -0.92 0.00 0.00 175.35 174.93 1j7m s TYR 26 N 2.85 3.31 -1.08 3.18 2.02 0.21 -4.89 117.35 122.95 1j7m s TYR 26 Ca 0.42 -1.35 0.27 0.00 -0.37 0.00 0.00 57.07 56.04 1j7m s TYR 26 Cb -0.16 -3.06 0.95 0.00 -0.40 0.00 0.00 41.96 39.30 1j7m s TYR 26 CO 0.09 -0.84 1.72 0.39 -1.57 0.00 0.00 175.55 175.34 1j7m n GLU 27 N 5.01 0.09 -1.53 -0.62 1.02 -1.26 -0.03 120.64 123.31 1j7m n GLU 27 Ca -0.11 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 1j7m n GLU 27 Cb 0.43 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.35 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 -1.43 0.24 -4.59 1.62 3.41 -1.26 -4.81 113.62 106.79 1j7m n SER 28 Ca 0.07 -0.77 -0.29 0.00 -0.26 0.00 0.00 58.87 57.63 1j7m n SER 28 Cb 0.33 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 64.46 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 -3.02 0.00 -0.09 0.00 -1.32 0.85 -4.94 115.64 107.12 1j7m s THR 30 Ca 0.66 -1.49 0.12 0.00 -1.21 0.00 0.00 61.69 59.77 1j7m s THR 30 Cb -0.17 -2.37 0.20 0.00 -1.51 0.00 0.00 72.50 68.65 1j7m s THR 30 CO 0.57 0.00 1.10 -1.54 -2.21 0.00 0.00 174.62 172.54 1j7m n SER 31 N -0.66 1.51 -4.77 8.08 3.41 -1.26 0.47 113.62 120.40 1j7m n SER 31 Ca -0.01 -2.73 -0.39 0.00 -0.26 0.00 0.00 58.87 55.48 1j7m n SER 31 Cb 0.62 -0.35 -0.00 0.00 -0.26 0.00 0.00 64.21 64.22 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 -1.87 3.25 0.00 7.33 0.00 -1.26 -2.58 121.76 126.63 1j7m s ALA 32 Ca 0.21 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.43 1j7m s ALA 32 Cb 0.19 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.81 1j7m s ALA 32 CO 0.01 -0.86 0.00 0.41 0.00 0.00 0.00 175.76 175.32 1j7m n GLY 33 N 0.65 1.17 3.73 0.00 0.00 -1.26 -4.97 105.19 104.52 1j7m n GLY 33 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 1j7m n GLY 33 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1j7m s ARG 34 N -0.21 3.85 0.00 1.61 0.52 -1.07 -4.95 118.95 118.70 1j7m s ARG 34 Ca 0.00 -0.25 0.17 0.00 -0.52 0.00 0.00 55.73 55.13 1j7m s ARG 34 Cb 0.00 -3.25 0.17 0.00 0.52 0.00 0.00 34.95 32.39 1j7m s ARG 34 CO 0.00 0.44 1.08 -1.13 0.02 0.00 0.00 175.30 175.71 1j7m n SER 35 N 3.04 2.52 0.00 0.23 3.41 -1.26 -4.72 113.62 116.84 1j7m n SER 35 Ca -0.17 -1.74 0.00 0.00 -0.26 0.00 0.00 58.87 56.70 1j7m n SER 35 Cb 0.53 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 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 0.97 0.00 0.00 4.04 5.75 -1.26 -5.07 116.55 120.98 1j7m n ASP 36 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.89 1j7m n ASP 36 Cb 0.43 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.52 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 2.69 0.22 3.75 6.12 0.00 -1.26 -5.14 105.19 111.56 1j7m n GLY 37 Ca 0.00 -0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1j7m n GLY 37 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1j7m n LYS 38 N 0.00 2.06 -3.81 1.61 4.01 -1.26 -4.99 118.16 115.78 1j7m n LYS 38 Ca 0.00 0.74 -0.31 0.00 -0.51 0.00 0.00 58.31 58.23 1j7m n LYS 38 Cb 0.00 -2.57 -0.04 0.00 -0.51 0.00 0.00 35.03 31.91 1j7m n LYS 38 CO 0.00 0.00 0.00 -1.64 -1.11 0.00 0.00 177.40 174.65 1j7m s MET 39 N -2.50 3.52 0.06 1.97 -1.94 -1.26 -4.73 119.30 114.42 1j7m s MET 39 Ca 0.64 -0.28 0.01 0.00 -1.71 0.00 0.00 55.69 54.35 1j7m s MET 39 Cb -0.45 -2.96 -0.00 0.00 2.01 0.00 0.00 34.83 33.43 1j7m s MET 39 CO 0.56 0.55 0.06 -2.67 -0.01 0.00 0.00 175.02 173.50 1j7m n TRP 40 N 0.21 -0.21 -3.67 -0.03 4.27 0.18 -0.49 117.44 117.70 1j7m n TRP 40 Ca -0.04 -0.52 -0.12 0.00 -3.89 0.00 0.00 57.50 52.93 1j7m n TRP 40 Cb 0.51 0.06 -0.08 0.00 -1.36 0.00 0.00 31.31 30.44 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 0.65 2.70 -2.16 0.00 0.00 -1.26 -1.81 121.76 119.87 1j7m s ALA 42 Ca -0.03 0.71 0.22 0.00 0.00 0.00 0.00 51.96 52.87 1j7m s ALA 42 Cb -0.05 -3.32 0.52 0.00 0.00 0.00 0.00 23.12 20.27 1j7m s ALA 42 CO -0.04 -0.75 1.45 0.25 0.00 0.00 0.00 175.76 176.67 1j7m n THR 43 N -1.45 0.75 -4.54 0.00 -2.24 -0.71 -0.77 114.28 105.32 1j7m n THR 43 Ca 0.11 -0.88 -0.23 0.00 -2.27 0.00 0.00 64.05 60.79 1j7m n THR 43 Cb 0.52 0.74 -0.14 0.00 -2.10 0.00 0.00 70.33 69.35 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 -1.23 1.30 0.15 4.28 -4.23 -1.25 -4.47 115.64 110.20 1j7m s THR 44 Ca 0.43 -0.96 -0.17 0.00 -1.18 0.00 0.00 61.69 59.80 1j7m s THR 44 Cb 0.24 -1.14 0.04 0.00 1.34 0.00 0.00 72.50 72.97 1j7m s THR 44 CO 0.32 0.16 1.70 0.00 -0.54 0.00 0.00 174.62 176.26 1j7m h ALA 45 N 5.15 0.27 -3.18 3.99 0.00 -1.88 -3.34 119.26 120.27 1j7m h ALA 45 Ca -0.39 0.10 -0.69 0.00 0.00 0.00 0.00 54.91 53.93 1j7m h ALA 45 Cb 1.17 0.18 -0.33 0.00 0.00 0.00 0.00 17.79 18.81 1j7m h ALA 45 CO 0.45 -0.42 -0.58 1.21 0.00 0.00 0.00 179.25 179.91 1j7m s ASN 46 N -5.24 5.22 0.22 0.00 3.84 -1.26 -1.55 114.94 116.17 1j7m s ASN 46 Ca -0.13 -1.73 0.10 0.00 0.21 0.00 0.00 52.86 51.30 1j7m s ASN 46 Cb 0.13 -1.82 0.12 0.00 -0.55 0.00 0.00 41.25 39.12 1j7m s ASN 46 CO 0.70 -0.46 1.47 0.22 -2.79 0.00 0.00 177.10 176.24 1j7m h TYR 47 N 8.09 0.00 -0.88 0.43 3.20 -1.46 -2.93 116.97 123.42 1j7m h TYR 47 Ca -0.17 0.00 0.10 0.00 3.14 0.00 0.00 58.73 61.81 1j7m h TYR 47 Cb 1.06 0.00 -0.06 0.00 1.54 0.00 0.00 36.73 39.26 1j7m h TYR 47 CO 0.58 0.75 0.57 -0.44 -1.64 0.00 0.00 178.16 177.97 1j7m h ASP 48 N 0.00 0.76 0.00 -2.11 3.32 -1.90 0.41 116.42 116.90 1j7m h ASP 48 Ca -0.01 0.03 -0.12 0.00 0.02 0.00 0.00 57.03 56.95 1j7m h ASP 48 Cb 1.39 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.79 1j7m h ASP 48 CO 0.10 0.44 -0.72 0.44 -1.72 0.00 0.00 179.24 177.77 1j7m h ASP 49 N 0.83 0.00 0.04 6.45 5.19 -1.90 -3.41 116.42 123.62 1j7m h ASP 49 Ca 0.41 -0.52 -0.12 0.00 -0.62 0.00 0.00 57.03 56.19 1j7m h ASP 49 Cb 0.47 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.99 1j7m h ASP 49 CO -0.18 1.18 -0.49 0.44 -3.12 0.00 0.00 179.24 177.07 1j7m h ASP 50 N -1.00 0.36 -4.69 6.45 3.32 -1.49 -3.48 116.42 115.89 1j7m h ASP 50 Ca -0.18 -0.84 -0.38 0.00 0.02 0.00 0.00 57.03 55.65 1j7m h ASP 50 Cb 1.00 -0.11 0.09 0.00 0.22 0.00 0.00 39.33 40.53 1j7m h ASP 50 CO -0.11 1.17 -0.59 0.54 -1.72 0.00 0.00 179.24 178.52 1j7m n ARG 51 N -4.32 -5.68 -3.70 3.56 5.12 0.14 -4.99 116.66 106.78 1j7m n ARG 51 Ca -0.11 0.82 -0.37 0.00 -1.93 0.00 0.00 57.85 56.26 1j7m n ARG 51 Cb 0.64 -5.61 -0.12 0.00 -1.16 0.00 0.00 32.46 26.21 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 -5.85 3.53 0.38 5.56 3.01 -1.26 -5.06 119.74 120.04 1j7m s LYS 52 Ca 0.38 -0.58 0.04 0.00 -1.01 0.00 0.00 55.97 54.80 1j7m s LYS 52 Cb -0.17 -3.44 -0.04 0.00 -1.01 0.00 0.00 37.83 33.17 1j7m s LYS 52 CO 0.48 -0.29 0.09 1.67 0.51 0.00 0.00 175.35 177.81 1j7m s TRP 53 N 1.62 1.85 -0.12 3.18 1.48 -1.26 -1.73 118.94 123.96 1j7m s TRP 53 Ca 0.06 -1.14 -0.25 0.00 -1.06 0.00 0.00 56.10 53.71 1j7m s TRP 53 Cb -0.16 -1.23 0.06 0.00 -1.16 0.00 0.00 33.47 30.98 1j7m s TRP 53 CO 0.05 -0.15 0.61 0.20 -4.06 0.00 0.00 176.95 173.61 1j7m s GLY 54 N -3.58 -0.48 0.92 3.67 0.00 -0.75 -1.15 107.32 105.95 1j7m s GLY 54 Ca 0.27 1.38 -0.11 0.00 0.00 0.00 0.00 44.72 46.27 1j7m s GLY 54 CO 0.14 1.09 1.09 -1.36 0.00 0.00 0.00 173.10 174.06 1j7m s PHE 55 N -0.58 2.09 0.81 1.90 0.08 0.51 0.51 117.98 123.30 1j7m s PHE 55 Ca -0.07 1.39 -0.11 0.00 0.12 0.00 0.00 56.93 58.27 1j7m s PHE 55 Cb -0.02 -3.17 0.08 0.00 -0.57 0.00 0.00 43.02 39.33 1j7m s PHE 55 CO 0.06 -2.59 1.09 0.00 -0.10 0.00 0.00 175.22 173.68 1j7m n PRO 57 N -3.64 2.66 -1.69 0.00 -0.04 -1.26 -4.73 135.00 126.30 1j7m n PRO 57 Ca 0.09 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.12 1j7m n PRO 57 Cb 0.53 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.97 1j7m n PRO 57 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1j7m s ASP 58 N -1.98 6.17 0.30 3.54 2.15 -1.26 -4.98 116.67 120.62 1j7m s ASP 58 Ca 0.00 2.39 0.10 0.00 0.43 0.00 0.00 52.55 55.47 1j7m s ASP 58 Cb 0.00 -2.52 -0.06 0.00 -0.30 0.00 0.00 42.92 40.04 1j7m s ASP 58 CO 0.00 -1.31 -0.14 -1.10 -0.17 0.00 0.00 175.17 172.45 1j7m s GLN 59 N 4.99 1.71 0.00 4.34 -0.21 -1.26 -5.24 119.66 123.99 1j7m s GLN 59 Ca 0.90 -1.83 0.00 0.00 0.02 0.00 0.00 55.36 54.45 1j7m s GLN 59 Cb -0.39 -1.65 0.00 0.00 1.00 0.00 0.00 33.01 31.97 1j7m s GLN 59 CO 0.39 0.21 0.33 0.41 -2.12 0.00 0.00 175.29 174.51