#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 3.43 0.62 1.43 0.52 -1.26 -5.09 118.94 118.59 1j7m s TRP 2 Ca 0.00 1.24 -0.05 0.00 0.02 0.00 0.00 56.10 57.31 1j7m s TRP 2 Cb 0.00 -2.59 0.13 0.00 -1.15 0.00 0.00 33.47 29.87 1j7m s TRP 2 CO 0.00 -0.13 0.84 -1.33 0.02 0.00 0.00 176.95 176.35 1j7m n MET 3 N -1.12 -0.35 -1.72 4.98 2.81 -1.26 -4.99 117.12 115.48 1j7m n MET 3 Ca 0.04 -1.81 -0.30 0.00 -1.81 0.00 0.00 57.70 53.82 1j7m n MET 3 Cb 0.54 -0.70 0.17 0.00 -0.71 0.00 0.00 33.22 32.52 1j7m n MET 3 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1j7m s SER 4 N -4.25 3.00 0.48 7.83 0.15 -1.26 -4.36 113.70 115.28 1j7m s SER 4 Ca 0.52 0.51 0.09 0.00 0.70 0.00 0.00 55.95 57.76 1j7m s SER 4 Cb -0.02 -0.73 0.04 0.00 -1.71 0.00 0.00 66.02 63.59 1j7m s SER 4 CO 0.35 -2.82 0.63 0.42 1.20 0.00 0.00 173.24 173.02 1j7m s THR 5 N -3.60 2.64 0.13 6.45 -4.23 -1.10 -4.79 115.64 111.14 1j7m s THR 5 Ca 0.70 -1.03 0.02 0.00 -1.18 0.00 0.00 61.69 60.20 1j7m s THR 5 Cb -0.08 -2.67 -0.04 0.00 1.34 0.00 0.00 72.50 71.05 1j7m s THR 5 CO 0.53 0.00 -0.06 0.54 -0.54 0.00 0.00 174.62 175.09 1j7m s VAL 6 N -2.48 0.80 0.00 2.29 0.11 -1.23 -4.87 120.40 115.02 1j7m s VAL 6 Ca 0.57 -1.97 0.00 0.00 -2.93 0.00 0.00 61.98 57.64 1j7m s VAL 6 Cb -0.08 -1.82 0.00 0.00 -1.53 0.00 0.00 36.38 32.96 1j7m s VAL 6 CO 0.35 -0.76 0.00 0.61 -3.33 0.00 0.00 175.10 171.97 1j7m n GLY 7 N -0.12 0.77 7.00 6.54 0.00 -1.26 0.22 105.19 118.34 1j7m n GLY 7 Ca -0.10 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.14 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 0.38 -0.02 0.00 -1.26 -4.42 105.19 101.06 1j7m n GLY 8 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.87 0.00 0.02 1.61 2.04 -0.42 -4.92 115.26 110.72 1j7m n ASN 9 Ca 0.00 -1.69 -0.01 0.00 -0.44 0.00 0.00 54.58 52.44 1j7m n ASN 9 Cb 0.00 -0.14 -0.01 0.00 -2.53 0.00 0.00 39.78 37.11 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 0.00 -0.07 0.00 0.53 4.64 -1.76 -3.48 113.55 113.42 1j7m h SER 10 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1j7m h SER 10 Cb 1.28 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1j7m h SER 10 CO 0.00 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 1j7m n GLY 11 N 1.22 2.78 1.14 -0.77 0.00 -1.26 -4.61 105.19 103.69 1j7m n GLY 11 Ca -0.01 -0.74 0.02 0.00 0.00 0.00 0.00 46.02 45.29 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 0.82 3.76 -0.02 0.00 -1.26 -4.81 105.19 103.68 1j7m n GLY 12 Ca 0.00 -0.53 -0.34 0.00 0.00 0.00 0.00 46.02 45.15 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 3.52 0.59 4.61 0.00 -1.26 -4.88 121.76 124.34 1j7m s ALA 13 Ca 0.21 -0.84 -0.03 0.00 0.00 0.00 0.00 51.96 51.30 1j7m s ALA 13 Cb 0.25 -1.57 0.03 0.00 0.00 0.00 0.00 23.12 21.82 1j7m s ALA 13 CO -0.11 0.66 0.86 -1.25 0.00 0.00 0.00 175.76 175.92 1j7m s PRO 14 N -1.48 2.66 0.29 0.00 0.04 -1.26 -2.70 135.00 132.54 1j7m s PRO 14 Ca 0.20 -0.34 -0.29 0.00 0.04 0.00 0.00 61.00 60.61 1j7m s PRO 14 Cb -0.12 -2.34 -0.09 0.00 0.04 0.00 0.00 34.50 31.98 1j7m s PRO 14 CO 0.10 -0.77 1.03 0.00 0.04 0.00 0.00 177.00 177.40 1j7m s VAL 16 N -1.26 3.48 0.03 0.00 1.01 0.44 -4.94 120.40 119.15 1j7m s VAL 16 Ca 0.45 -0.83 0.07 0.00 0.00 0.00 0.00 61.98 61.67 1j7m s VAL 16 Cb -0.28 -2.78 -0.03 0.00 0.00 0.00 0.00 36.38 33.29 1j7m s VAL 16 CO 0.35 0.14 -0.19 -0.36 0.00 0.00 0.00 175.10 175.04 1j7m s PHE 17 N 1.42 2.54 0.03 5.22 0.08 -1.26 -2.82 117.98 123.20 1j7m s PHE 17 Ca 0.02 -0.27 -0.26 0.00 0.12 0.00 0.00 56.93 56.54 1j7m s PHE 17 Cb -0.17 -1.48 -0.05 0.00 -0.57 0.00 0.00 43.02 40.75 1j7m s PHE 17 CO -0.01 0.22 0.79 -1.25 -0.10 0.00 0.00 175.22 174.87 1j7m s PRO 18 N -1.29 4.51 0.29 0.24 0.05 -1.26 -5.06 135.00 132.47 1j7m s PRO 18 Ca 0.14 1.10 0.07 0.00 0.05 0.00 0.00 61.00 62.35 1j7m s PRO 18 Cb -0.10 -3.39 -0.03 0.00 0.05 0.00 0.00 34.50 31.03 1j7m s PRO 18 CO 0.04 0.22 0.32 -0.59 0.05 0.00 0.00 177.00 177.04 1j7m s PHE 19 N 0.17 3.13 -0.17 0.56 -0.12 0.46 -4.82 117.98 117.19 1j7m s PHE 19 Ca 0.40 -0.17 0.01 0.00 -0.05 0.00 0.00 56.93 57.12 1j7m s PHE 19 Cb -0.20 -1.68 0.01 0.00 -0.63 0.00 0.00 43.02 40.52 1j7m s PHE 19 CO 0.23 0.29 -0.19 0.99 -0.05 0.00 0.00 175.22 176.49 1j7m s THR 20 N -2.16 2.25 -0.07 -4.49 2.01 -1.06 0.82 115.64 112.94 1j7m s THR 20 Ca 0.38 -0.89 0.05 0.00 0.31 0.00 0.00 61.69 61.54 1j7m s THR 20 Cb -0.08 -1.94 -0.01 0.00 0.01 0.00 0.00 72.50 70.49 1j7m s THR 20 CO 0.28 0.53 -0.25 0.12 -0.69 0.00 0.00 174.62 174.61 1j7m s PHE 21 N 1.08 2.48 -1.34 4.92 5.36 -0.19 -1.40 117.98 128.89 1j7m s PHE 21 Ca -0.00 -0.82 -0.06 0.00 -0.96 0.00 0.00 56.93 55.09 1j7m s PHE 21 Cb -0.14 -1.63 0.06 0.00 -0.34 0.00 0.00 43.02 40.97 1j7m s PHE 21 CO -0.07 -0.28 0.16 1.28 -1.46 0.00 0.00 175.22 174.85 1j7m n LEU 22 N 3.12 -0.74 0.00 6.12 7.99 -1.26 0.42 117.00 132.64 1j7m n LEU 22 Ca -0.18 -1.03 0.00 0.00 -0.01 0.00 0.00 56.01 54.79 1j7m n LEU 22 Cb 0.52 -1.29 0.00 0.00 -0.11 0.00 0.00 43.42 42.54 1j7m n LEU 22 CO 0.26 0.28 0.00 0.61 -1.51 0.00 0.00 177.39 177.04 1j7m n GLY 23 N -1.86 1.32 3.69 -0.72 0.00 -1.26 -5.05 105.19 101.31 1j7m n GLY 23 Ca -0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.14 4.89 -0.13 1.61 0.01 0.17 -5.11 114.94 113.23 1j7m s ASN 24 Ca 0.00 -0.38 -0.15 0.00 -0.71 0.00 0.00 52.86 51.62 1j7m s ASN 24 Cb 0.00 -1.07 -0.05 0.00 0.41 0.00 0.00 41.25 40.54 1j7m s ASN 24 CO 0.00 0.07 0.36 -0.54 -1.51 0.00 0.00 177.10 175.47 1j7m s LYS 25 N -3.11 4.23 -0.26 -0.60 -0.14 -1.26 -1.02 119.74 117.56 1j7m s LYS 25 Ca 0.29 0.23 0.02 0.00 -1.36 0.00 0.00 55.97 55.14 1j7m s LYS 25 Cb -0.09 -3.40 0.07 0.00 -1.68 0.00 0.00 37.83 32.73 1j7m s LYS 25 CO 0.20 0.27 -0.04 0.71 -0.76 0.00 0.00 175.35 175.73 1j7m s TYR 26 N 0.32 2.79 -0.64 3.18 2.02 0.24 -4.92 117.35 120.35 1j7m s TYR 26 Ca 0.20 -2.11 0.23 0.00 -0.37 0.00 0.00 57.07 55.02 1j7m s TYR 26 Cb -0.14 -1.90 0.10 0.00 -0.40 0.00 0.00 41.96 39.61 1j7m s TYR 26 CO 0.07 -0.84 1.07 0.39 -1.57 0.00 0.00 175.55 174.67 1j7m n GLU 27 N 4.55 0.27 -3.83 -0.62 1.02 -1.26 -0.40 120.64 120.37 1j7m n GLU 27 Ca -0.09 0.01 -0.20 0.00 -0.02 0.00 0.00 57.16 56.86 1j7m n GLU 27 Cb 0.43 -1.60 -0.05 0.00 -0.02 0.00 0.00 31.44 30.20 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 -1.95 1.59 -4.62 1.62 3.41 -1.26 -4.85 113.62 107.56 1j7m n SER 28 Ca 0.02 -2.62 -0.29 0.00 -0.26 0.00 0.00 58.87 55.73 1j7m n SER 28 Cb 0.43 0.65 0.20 0.00 -0.26 0.00 0.00 64.21 65.23 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 -2.81 0.01 -0.06 0.00 -1.32 0.43 -4.95 115.64 106.95 1j7m s THR 30 Ca 0.66 -1.77 0.09 0.00 -1.21 0.00 0.00 61.69 59.46 1j7m s THR 30 Cb -0.20 -2.32 0.13 0.00 -1.51 0.00 0.00 72.50 68.60 1j7m s THR 30 CO 0.60 -0.07 1.03 -1.54 -2.21 0.00 0.00 174.62 172.43 1j7m n SER 31 N -0.28 1.81 -4.69 8.08 3.41 -1.26 0.11 113.62 120.79 1j7m n SER 31 Ca -0.00 -2.42 -0.43 0.00 -0.26 0.00 0.00 58.87 55.76 1j7m n SER 31 Cb 0.64 -0.21 -0.02 0.00 -0.26 0.00 0.00 64.21 64.36 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 -0.84 1.41 0.00 7.33 0.00 -1.26 -0.99 120.51 126.17 1j7m n ALA 32 Ca 0.07 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1j7m n ALA 32 Cb 0.49 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.64 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 1.61 2.44 0.00 0.00 0.00 -1.26 -4.74 105.19 103.23 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 -1.84 0.00 -1.33 1.61 1.74 -0.42 -4.95 116.66 111.47 1j7m n ARG 34 Ca 0.00 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.97 1j7m n ARG 34 Cb 0.00 -0.09 -0.05 0.00 -1.02 0.00 0.00 32.46 31.30 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 -1.21 -5.38 -0.03 0.55 7.64 -0.16 -4.81 113.62 110.22 1j7m n SER 35 Ca 0.00 0.28 -0.15 0.00 1.01 0.00 0.00 58.87 60.01 1j7m n SER 35 Cb 0.00 -3.88 -0.14 0.00 -1.01 0.00 0.00 64.21 59.18 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 -0.94 1.42 0.00 6.43 5.75 -1.26 -5.03 116.55 122.92 1j7m n ASP 36 Ca -0.11 0.22 0.00 0.00 -0.01 0.00 0.00 54.79 54.89 1j7m n ASP 36 Cb 0.54 -0.32 0.00 0.00 -1.03 0.00 0.00 41.12 40.31 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 1.84 -0.66 3.74 6.12 0.00 -1.26 -5.13 105.19 109.83 1j7m n GLY 37 Ca -0.28 0.36 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 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 4.19 0.17 1.61 3.01 -1.26 -5.02 119.74 122.45 1j7m s LYS 38 Ca 0.00 2.44 -0.02 0.00 -1.01 0.00 0.00 55.97 57.38 1j7m s LYS 38 Cb 0.00 -3.08 -0.05 0.00 -1.01 0.00 0.00 37.83 33.70 1j7m s LYS 38 CO 0.00 -0.54 0.38 -1.64 0.51 0.00 0.00 175.35 174.06 1j7m s MET 39 N -0.22 3.55 0.00 1.68 -1.94 -1.26 -4.77 119.30 116.34 1j7m s MET 39 Ca 0.63 -0.25 0.00 0.00 -1.71 0.00 0.00 55.69 54.36 1j7m s MET 39 Cb -0.45 -2.85 0.00 0.00 2.01 0.00 0.00 34.83 33.54 1j7m s MET 39 CO 0.44 0.43 0.00 -2.67 -0.01 0.00 0.00 175.02 173.21 1j7m n TRP 40 N -0.34 0.00 -3.56 -0.03 4.27 0.29 -0.28 117.44 117.80 1j7m n TRP 40 Ca -0.04 0.00 -0.17 0.00 -3.89 0.00 0.00 57.50 53.40 1j7m n TRP 40 Cb 0.53 0.00 -0.06 0.00 -1.36 0.00 0.00 31.31 30.41 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 -1.16 3.28 -1.66 0.00 0.00 -1.26 -0.76 121.76 120.20 1j7m s ALA 42 Ca -0.11 0.17 0.20 0.00 0.00 0.00 0.00 51.96 52.22 1j7m s ALA 42 Cb -0.01 -2.88 0.59 0.00 0.00 0.00 0.00 23.12 20.82 1j7m s ALA 42 CO 0.09 0.28 1.50 0.25 0.00 0.00 0.00 175.76 177.88 1j7m n THR 43 N -0.10 1.10 -4.13 0.00 -2.24 -0.29 -0.42 114.28 108.21 1j7m n THR 43 Ca 0.03 -1.03 -0.15 0.00 -2.27 0.00 0.00 64.05 60.63 1j7m n THR 43 Cb 0.53 0.45 -0.11 0.00 -2.10 0.00 0.00 70.33 69.09 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 -1.11 0.82 0.33 4.28 -4.23 -1.26 -4.50 115.64 109.97 1j7m s THR 44 Ca 0.44 -1.29 0.05 0.00 -1.18 0.00 0.00 61.69 59.72 1j7m s THR 44 Cb 0.24 -0.94 0.30 0.00 1.34 0.00 0.00 72.50 73.44 1j7m s THR 44 CO 0.29 -0.37 1.90 0.00 -0.54 0.00 0.00 174.62 175.89 1j7m h ALA 45 N 4.20 1.69 -3.52 3.99 0.00 -1.89 -3.37 119.26 120.37 1j7m h ALA 45 Ca -0.38 -0.00 -0.61 0.00 0.00 0.00 0.00 54.91 53.92 1j7m h ALA 45 Cb 1.19 -0.19 -0.38 0.00 0.00 0.00 0.00 17.79 18.42 1j7m h ALA 45 CO 0.43 0.13 -0.80 1.21 0.00 0.00 0.00 179.25 180.23 1j7m s ASN 46 N -5.93 3.55 0.14 0.00 3.84 -1.26 -2.57 114.94 112.71 1j7m s ASN 46 Ca -0.10 -1.00 -0.06 0.00 0.21 0.00 0.00 52.86 51.90 1j7m s ASN 46 Cb 0.21 -1.17 -0.05 0.00 -0.55 0.00 0.00 41.25 39.69 1j7m s ASN 46 CO 0.79 -0.19 1.36 0.22 -2.79 0.00 0.00 177.10 176.49 1j7m h TYR 47 N 7.98 0.75 -0.80 0.43 5.03 -1.39 -3.04 116.97 125.94 1j7m h TYR 47 Ca -0.22 -0.35 0.15 0.00 2.58 0.00 0.00 58.73 60.89 1j7m h TYR 47 Cb 1.09 -0.11 -0.06 0.00 1.55 0.00 0.00 36.73 39.20 1j7m h TYR 47 CO 0.50 1.14 0.53 -0.44 -1.32 0.00 0.00 178.16 178.56 1j7m h ASP 48 N 0.36 0.47 0.00 -2.11 3.32 -1.91 0.55 116.42 117.09 1j7m h ASP 48 Ca -0.05 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1j7m h ASP 48 Cb 1.40 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.88 1j7m h ASP 48 CO 0.15 0.24 0.00 0.47 -1.72 0.00 0.00 179.24 178.38 1j7m n ASP 49 N -4.50 0.00 0.18 6.45 9.92 -1.20 -4.50 116.55 122.90 1j7m n ASP 49 Ca 0.15 0.51 0.12 0.00 -0.53 0.00 0.00 54.79 55.05 1j7m n ASP 49 Cb 0.51 -0.43 0.19 0.00 -0.64 0.00 0.00 41.12 40.76 1j7m n ASP 49 CO 0.00 0.00 0.00 0.44 0.13 0.00 0.00 177.20 177.77 1j7m h ASP 50 N 0.00 0.00 -6.64 -2.24 3.32 -1.55 -3.48 116.42 105.82 1j7m h ASP 50 Ca 0.00 -0.01 -0.53 0.00 0.02 0.00 0.00 57.03 56.51 1j7m h ASP 50 Cb 0.00 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 1j7m h ASP 50 CO 0.00 0.00 -0.95 0.54 -1.72 0.00 0.00 179.24 177.11 1j7m n ARG 51 N -2.86 -1.46 -4.20 3.56 1.74 0.19 -4.97 116.66 108.66 1j7m n ARG 51 Ca 0.04 0.27 -0.33 0.00 -0.77 0.00 0.00 57.85 57.06 1j7m n ARG 51 Cb 0.51 -3.69 -0.16 0.00 -1.02 0.00 0.00 32.46 28.10 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 -6.78 3.02 0.32 5.56 1.02 -1.26 -5.05 119.74 116.57 1j7m s LYS 52 Ca 0.28 -0.82 0.04 0.00 0.02 0.00 0.00 55.97 55.48 1j7m s LYS 52 Cb -0.13 -2.57 -0.06 0.00 -0.52 0.00 0.00 37.83 34.55 1j7m s LYS 52 CO 0.92 -0.18 0.06 1.67 -0.92 0.00 0.00 175.35 176.90 1j7m s TRP 53 N 1.22 1.94 -0.26 3.18 1.48 -1.26 -1.13 118.94 124.11 1j7m s TRP 53 Ca 0.03 -0.96 -0.25 0.00 -1.06 0.00 0.00 56.10 53.86 1j7m s TRP 53 Cb -0.13 -1.26 0.09 0.00 -1.16 0.00 0.00 33.47 31.00 1j7m s TRP 53 CO -0.11 -0.00 0.82 0.20 -4.06 0.00 0.00 176.95 173.80 1j7m s GLY 54 N -3.48 -0.42 0.77 3.67 0.00 0.06 -1.31 107.32 106.62 1j7m s GLY 54 Ca 0.36 2.19 -0.15 0.00 0.00 0.00 0.00 44.72 47.12 1j7m s GLY 54 CO 0.15 1.72 1.14 0.69 0.00 0.00 0.00 173.10 176.81 1j7m n PHE 55 N 2.42 1.18 -2.14 1.90 3.72 0.61 0.12 117.46 125.26 1j7m n PHE 55 Ca -0.14 0.40 -0.39 0.00 -0.05 0.00 0.00 57.45 57.28 1j7m n PHE 55 Cb 0.55 -2.12 -0.01 0.00 -0.94 0.00 0.00 39.48 36.97 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 0.05 2.93 -1.43 0.00 -0.04 -1.26 -4.77 135.00 130.48 1j7m n PRO 57 Ca 0.04 0.00 -0.48 0.00 -0.04 0.00 0.00 63.50 63.02 1j7m n PRO 57 Cb 0.45 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.82 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 1.54 -4.75 3.54 2.03 -1.26 -4.90 116.55 112.75 1j7m n ASP 58 Ca 0.00 0.29 -0.40 0.00 0.52 0.00 0.00 54.79 55.20 1j7m n ASP 58 Cb 0.00 -1.17 -0.05 0.00 -0.72 0.00 0.00 41.12 39.18 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 7.02 4.54 0.00 -0.67 -1.52 -1.26 -5.24 119.66 122.53 1j7m s GLN 59 Ca 1.15 1.14 0.00 0.00 -1.95 0.00 0.00 55.36 55.70 1j7m s GLN 59 Cb -0.96 -3.36 0.00 0.00 -0.22 0.00 0.00 33.01 28.47 1j7m s GLN 59 CO 0.49 0.30 0.00 0.41 -0.25 0.00 0.00 175.29 176.24