#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x3p s VAL 2 N 0.00 -0.02 -0.21 0.00 -7.23 -1.26 -5.15 120.40 106.53 1x3p s VAL 2 Ca 0.00 0.07 -0.07 0.00 -1.81 0.00 0.00 61.98 60.18 1x3p s VAL 2 Cb 0.00 -0.46 -0.03 0.00 0.56 0.00 0.00 36.38 36.45 1x3p s VAL 2 CO 0.00 0.03 0.05 0.00 -0.31 0.00 0.00 175.10 174.87 1x3p s ALA 3 N 0.83 3.20 0.00 1.32 0.00 -1.26 -4.96 121.76 120.89 1x3p s ALA 3 Ca -0.05 -0.95 0.00 0.00 0.00 0.00 0.00 51.96 50.95 1x3p s ALA 3 Cb -0.06 -1.93 0.00 0.00 0.00 0.00 0.00 23.12 21.13 1x3p s ALA 3 CO -0.06 -0.15 0.00 0.39 0.00 0.00 0.00 175.76 175.94 1x3p n GLU 4 N 4.23 0.00 -4.17 0.00 4.71 -1.26 -5.07 120.64 119.09 1x3p n GLU 4 Ca -0.17 0.00 -0.13 0.00 -0.01 0.00 0.00 57.16 56.86 1x3p n GLU 4 Cb 0.52 0.00 -0.10 0.00 -1.01 0.00 0.00 31.44 30.84 1x3p n GLU 4 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 1x3p s SER 5 N -3.63 1.30 -0.21 1.62 0.01 -1.26 -4.80 113.70 106.72 1x3p s SER 5 Ca 0.00 -0.89 -0.04 0.00 1.31 0.00 0.00 55.95 56.33 1x3p s SER 5 Cb 0.00 0.05 0.11 0.00 0.21 0.00 0.00 66.02 66.39 1x3p s SER 5 CO 0.00 -0.35 0.37 0.68 0.41 0.00 0.00 173.24 174.35 1x3p s VAL 6 N -2.93 -0.59 -0.43 3.43 -7.23 -1.22 -3.15 120.40 108.28 1x3p s VAL 6 Ca 0.08 0.05 0.08 0.00 -1.81 0.00 0.00 61.98 60.38 1x3p s VAL 6 Cb 0.00 -0.72 0.33 0.00 0.56 0.00 0.00 36.38 36.56 1x3p s VAL 6 CO -0.02 -0.03 0.98 2.30 -0.31 0.00 0.00 175.10 178.02 1x3p n ILE 7 N 5.37 -0.06 -3.81 -0.62 -5.35 -1.26 -4.94 119.36 108.69 1x3p n ILE 7 Ca -0.06 -2.58 -0.22 0.00 -0.27 0.00 0.00 62.75 59.62 1x3p n ILE 7 Cb 0.50 0.87 -0.17 0.00 -1.74 0.00 0.00 39.64 39.10 1x3p n ILE 7 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1x3p s GLY 8 N -1.67 0.45 0.01 3.28 0.00 -0.89 -4.84 107.32 103.66 1x3p s GLY 8 Ca 0.28 -0.09 -0.17 0.00 0.00 0.00 0.00 44.72 44.74 1x3p s GLY 8 CO -0.06 1.07 0.37 1.25 0.00 0.00 0.00 173.10 175.72 1x3p s LYS 9 N 1.85 0.80 0.00 2.90 2.20 -1.26 -2.77 119.74 123.46 1x3p s LYS 9 Ca 0.03 -0.27 0.15 0.00 -0.36 0.00 0.00 55.97 55.51 1x3p s LYS 9 Cb -0.12 0.36 0.57 0.00 -1.51 0.00 0.00 37.83 37.12 1x3p s LYS 9 CO -0.05 -0.25 1.41 -2.13 -0.36 0.00 0.00 175.35 173.98 1x3p n ARG 10 N 0.87 1.56 0.00 4.03 3.00 0.10 -4.87 116.66 121.36 1x3p n ARG 10 Ca -0.20 -0.85 0.00 0.00 -0.00 0.00 0.00 57.85 56.80 1x3p n ARG 10 Cb 0.58 -1.29 0.00 0.00 0.00 0.00 0.00 32.46 31.75 1x3p n ARG 10 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1x3p n VAL 11 N 0.12 0.00 -2.61 5.15 0.31 -1.26 -4.60 118.33 115.44 1x3p n VAL 11 Ca 0.12 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 64.23 1x3p n VAL 11 Cb 0.24 0.00 0.06 0.00 -0.91 0.00 0.00 33.84 33.23 1x3p n VAL 11 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1x3p s GLY 12 N 0.00 1.80 -1.21 2.92 0.00 -1.26 -4.96 107.32 104.61 1x3p s GLY 12 Ca 0.00 -1.45 -0.04 0.00 0.00 0.00 0.00 44.72 43.23 1x3p s GLY 12 CO 0.00 -1.07 2.17 1.34 0.00 0.00 0.00 173.10 175.54 1x3p n ASP 13 N -2.52 7.79 0.00 1.64 -0.08 -1.26 -4.42 116.55 117.70 1x3p n ASP 13 Ca 0.10 -3.36 0.00 0.00 -1.51 0.00 0.00 54.79 50.02 1x3p n ASP 13 Cb 0.60 -1.28 0.00 0.00 2.34 0.00 0.00 41.12 42.78 1x3p n ASP 13 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1x3p n ASP 14 N 1.01 0.00 -0.91 1.67 9.92 -1.26 -5.05 116.55 121.93 1x3p n ASP 14 Ca 0.56 0.00 -0.01 0.00 -0.53 0.00 0.00 54.79 54.81 1x3p n ASP 14 Cb 0.25 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.71 1x3p n ASP 14 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1x3p n GLY 15 N 2.64 0.75 2.35 0.44 0.00 -1.26 -4.95 105.19 105.15 1x3p n GLY 15 Ca 0.00 -0.21 -0.15 0.00 0.00 0.00 0.00 46.02 45.66 1x3p n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1x3p n LYS 16 N 0.12 0.99 -2.27 1.61 5.02 -1.26 -5.13 118.16 117.25 1x3p n LYS 16 Ca -0.07 -2.99 -0.26 0.00 -2.02 0.00 0.00 58.31 52.96 1x3p n LYS 16 Cb 0.76 -1.50 0.14 0.00 -0.02 0.00 0.00 35.03 34.41 1x3p n LYS 16 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1x3p s THR 17 N -1.75 2.09 0.00 -0.18 -1.32 -1.26 -4.25 115.64 108.97 1x3p s THR 17 Ca 0.35 -0.31 0.00 0.00 -1.21 0.00 0.00 61.69 60.52 1x3p s THR 17 Cb 0.34 -2.78 0.00 0.00 -1.51 0.00 0.00 72.50 68.55 1x3p s THR 17 CO -0.07 0.00 0.00 -0.38 -2.21 0.00 0.00 174.62 171.96 1x3p n ILE 18 N -3.24 0.00 -3.66 5.08 5.41 -1.26 -4.89 119.36 116.80 1x3p n ILE 18 Ca 0.14 0.00 -0.11 0.00 1.00 0.00 0.00 62.75 63.78 1x3p n ILE 18 Cb 0.60 -0.29 -0.06 0.00 -0.71 0.00 0.00 39.64 39.19 1x3p n ILE 18 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1x3p s GLU 19 N -1.94 0.98 0.15 0.38 2.02 -1.26 -4.87 118.70 114.16 1x3p s GLU 19 Ca 0.00 -0.56 -0.25 0.00 0.02 0.00 0.00 54.97 54.18 1x3p s GLU 19 Cb 0.00 0.43 -0.08 0.00 0.10 0.00 0.00 34.13 34.59 1x3p s GLU 19 CO 0.00 -0.36 0.76 1.52 0.02 0.00 0.00 175.26 177.20 1x3p s TYR 20 N -3.18 3.89 -0.23 1.61 -0.85 -1.26 0.02 117.35 117.35 1x3p s TYR 20 Ca -0.01 1.59 -0.05 0.00 -0.52 0.00 0.00 57.07 58.08 1x3p s TYR 20 Cb 0.01 -2.75 0.11 0.00 0.38 0.00 0.00 41.96 39.71 1x3p s TYR 20 CO -0.07 0.50 0.43 -0.51 -1.52 0.00 0.00 175.55 174.38 1x3p s LEU 21 N -1.05 -0.72 -0.31 -3.49 1.43 -1.12 -4.54 118.68 108.88 1x3p s LEU 21 Ca 0.35 0.77 -0.09 0.00 -1.03 0.00 0.00 54.13 54.13 1x3p s LEU 21 Cb -0.23 1.39 -0.01 0.00 0.03 0.00 0.00 46.19 47.38 1x3p s LEU 21 CO 0.25 -0.25 0.14 -0.69 0.23 0.00 0.00 176.35 176.03 1x3p s VAL 22 N 2.63 4.56 -0.29 -1.59 1.01 -1.08 -2.10 120.40 123.53 1x3p s VAL 22 Ca 0.04 -0.41 0.03 0.00 0.00 0.00 0.00 61.98 61.64 1x3p s VAL 22 Cb -0.13 -3.31 0.08 0.00 0.00 0.00 0.00 36.38 33.01 1x3p s VAL 22 CO -0.15 0.09 -0.03 -0.54 0.00 0.00 0.00 175.10 174.47 1x3p s LYS 23 N 1.61 1.76 0.00 2.72 -0.14 -1.26 -0.79 119.74 123.64 1x3p s LYS 23 Ca 0.05 -1.49 0.00 0.00 -1.36 0.00 0.00 55.97 53.17 1x3p s LYS 23 Cb -0.17 -2.92 0.00 0.00 -1.68 0.00 0.00 37.83 33.06 1x3p s LYS 23 CO 0.06 -0.74 0.00 0.91 -0.76 0.00 0.00 175.35 174.82 1x3p n TRP 24 N 4.42 -1.31 0.62 3.18 5.03 -1.19 -3.39 117.44 124.81 1x3p n TRP 24 Ca -0.06 0.00 0.04 0.00 3.03 0.00 0.00 57.50 60.51 1x3p n TRP 24 Cb 0.42 0.00 0.16 0.00 -1.03 0.00 0.00 31.31 30.86 1x3p n TRP 24 CO 0.00 0.00 0.00 -2.37 -0.03 0.00 0.00 177.69 175.29 1x3p n THR 25 N -2.12 0.77 -0.01 -0.99 5.66 -1.26 -3.54 114.28 112.80 1x3p n THR 25 Ca 0.00 -0.51 0.03 0.00 -3.05 0.00 0.00 64.05 60.52 1x3p n THR 25 Cb 0.00 -0.07 -0.05 0.00 -1.55 0.00 0.00 70.33 68.66 1x3p n THR 25 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1x3p n ASP 26 N 0.36 3.49 -2.14 1.09 9.92 -1.26 -5.00 116.55 123.00 1x3p n ASP 26 Ca 0.11 0.00 -0.04 0.00 -0.53 0.00 0.00 54.79 54.34 1x3p n ASP 26 Cb 0.45 1.25 0.00 0.00 -0.64 0.00 0.00 41.12 42.18 1x3p n ASP 26 CO 0.00 0.00 0.00 0.23 0.13 0.00 0.00 177.20 177.56 1x3p n MET 27 N -1.77 -1.11 -0.52 -1.24 2.81 -1.23 -5.02 117.12 109.04 1x3p n MET 27 Ca -0.02 1.26 -0.00 0.00 -1.81 0.00 0.00 57.70 57.13 1x3p n MET 27 Cb 0.21 -3.49 -0.00 0.00 -0.71 0.00 0.00 33.22 29.24 1x3p n MET 27 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1x3p n SER 28 N -0.44 -0.01 -2.88 7.83 7.64 -1.26 -5.05 113.62 119.45 1x3p n SER 28 Ca 0.05 -1.38 -0.02 0.00 1.01 0.00 0.00 58.87 58.54 1x3p n SER 28 Cb 0.23 -0.07 -0.02 0.00 -1.01 0.00 0.00 64.21 63.34 1x3p n SER 28 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1x3p n ASP 29 N 0.00 -4.73 0.00 6.43 -0.08 -1.26 -5.00 116.55 111.91 1x3p n ASP 29 Ca -0.00 1.10 0.00 0.00 -1.51 0.00 0.00 54.79 54.38 1x3p n ASP 29 Cb 0.58 -3.31 0.00 0.00 2.34 0.00 0.00 41.12 40.73 1x3p n ASP 29 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1x3p n ALA 30 N 1.96 0.00 -2.96 -1.67 0.00 0.03 -5.03 120.51 112.84 1x3p n ALA 30 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1x3p n ALA 30 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.76 1x3p n ALA 30 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1x3p n THR 31 N -0.70 0.00 -3.69 0.00 -1.04 -1.24 -4.97 114.28 102.65 1x3p n THR 31 Ca 0.00 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 61.86 1x3p n THR 31 Cb 0.00 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.43 1x3p n THR 31 CO 0.00 0.00 0.00 0.26 -0.64 0.00 0.00 175.07 174.69 1x3p s TRP 32 N 3.13 -0.36 0.00 -1.42 0.52 -1.26 -2.64 118.94 116.91 1x3p s TRP 32 Ca 0.00 0.63 0.00 0.00 0.02 0.00 0.00 56.10 56.75 1x3p s TRP 32 Cb 0.00 0.19 0.00 0.00 -1.15 0.00 0.00 33.47 32.51 1x3p s TRP 32 CO 0.00 -0.43 0.00 0.39 0.02 0.00 0.00 176.95 176.93 1x3p n GLU 33 N 1.38 0.00 0.00 4.98 1.02 -1.21 -4.49 120.64 122.33 1x3p n GLU 33 Ca -0.20 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.94 1x3p n GLU 33 Cb 0.56 -0.06 0.00 0.00 -0.02 0.00 0.00 31.44 31.92 1x3p n GLU 33 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1x3p n PRO 34 N -0.35 0.00 -0.34 3.49 -0.02 -1.25 -1.71 135.00 134.83 1x3p n PRO 34 Ca 0.00 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.43 1x3p n PRO 34 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.43 1x3p n PRO 34 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1x3p n GLN 35 N 0.00 0.73 -2.92 -0.52 7.27 -1.26 -4.29 117.38 116.39 1x3p n GLN 35 Ca 0.00 -0.43 -0.10 0.00 0.07 0.00 0.00 57.00 56.54 1x3p n GLN 35 Cb 0.00 -1.75 -0.02 0.00 2.41 0.00 0.00 30.24 30.88 1x3p n GLN 35 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1x3p s ASP 36 N 2.89 -0.74 -0.29 1.69 2.15 -0.69 -4.93 116.67 116.75 1x3p s ASP 36 Ca 0.22 -2.05 -0.02 0.00 0.43 0.00 0.00 52.55 51.13 1x3p s ASP 36 Cb 0.10 1.33 0.13 0.00 -0.30 0.00 0.00 42.92 44.18 1x3p s ASP 36 CO -0.00 -0.08 2.25 -3.20 -0.17 0.00 0.00 175.17 173.97 1x3p n ASN 37 N 2.94 6.28 -2.01 -0.34 4.05 -1.26 -4.38 115.26 120.53 1x3p n ASN 37 Ca 0.21 -2.98 -0.22 0.00 0.45 0.00 0.00 54.58 52.03 1x3p n ASN 37 Cb 0.54 -1.12 0.09 0.00 1.23 0.00 0.00 39.78 40.52 1x3p n ASN 37 CO 0.00 0.00 0.00 0.55 -3.05 0.00 0.00 177.26 174.76 1x3p n VAL 38 N 0.70 2.95 0.00 3.44 3.14 -1.26 -4.55 118.33 122.74 1x3p n VAL 38 Ca 0.31 -1.90 0.00 0.00 -2.96 0.00 0.00 64.34 59.79 1x3p n VAL 38 Cb 0.58 -1.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.37 1x3p n VAL 38 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 1x3p n ASP 39 N -0.43 0.00 -0.85 6.55 8.00 -1.26 -5.05 116.55 123.51 1x3p n ASP 39 Ca 0.45 0.00 -0.00 0.00 0.71 0.00 0.00 54.79 55.94 1x3p n ASP 39 Cb 0.92 0.00 0.05 0.00 -0.02 0.00 0.00 41.12 42.07 1x3p n ASP 39 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1x3p n SER 40 N 0.00 2.12 0.05 -2.24 3.41 -1.26 -1.07 113.62 114.62 1x3p n SER 40 Ca 0.00 -2.17 0.00 0.00 -0.26 0.00 0.00 58.87 56.44 1x3p n SER 40 Cb 0.00 -0.53 0.00 0.00 -0.26 0.00 0.00 64.21 63.42 1x3p n SER 40 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1x3p n THR 41 N 0.14 0.97 -0.01 6.66 -1.04 -1.26 -4.67 114.28 115.08 1x3p n THR 41 Ca 0.06 0.32 -0.05 0.00 -2.04 0.00 0.00 64.05 62.34 1x3p n THR 41 Cb 0.48 -1.43 -0.12 0.00 -1.82 0.00 0.00 70.33 67.44 1x3p n THR 41 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1x3p n LEU 42 N -3.33 0.79 -0.06 -4.42 4.77 -1.26 -4.29 117.00 109.20 1x3p n LEU 42 Ca 0.00 0.36 -0.04 0.00 -0.03 0.00 0.00 56.01 56.30 1x3p n LEU 42 Cb 0.00 0.15 -0.01 0.00 -2.33 0.00 0.00 43.42 41.23 1x3p n LEU 42 CO 0.00 0.29 -0.30 0.52 -1.33 0.00 0.00 177.39 176.57 1x3p n VAL 43 N -2.95 1.21 -0.31 4.08 0.31 -1.09 -4.16 118.33 115.43 1x3p n VAL 43 Ca -0.15 0.26 0.31 0.00 -0.01 0.00 0.00 64.34 64.74 1x3p n VAL 43 Cb 0.97 -2.27 0.47 0.00 -0.91 0.00 0.00 33.84 32.10 1x3p n VAL 43 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1x3p n LEU 44 N -4.28 0.00 0.18 7.52 0.00 -0.24 0.18 117.00 120.36 1x3p n LEU 44 Ca -0.06 0.72 -0.08 0.00 0.00 0.00 0.00 56.01 56.59 1x3p n LEU 44 Cb 0.23 -0.28 -0.04 0.00 0.00 0.00 0.00 43.42 43.33 1x3p n LEU 44 CO 0.09 -0.72 0.28 -0.07 0.00 0.00 0.00 177.39 176.98 1x3p h LEU 45 N 0.00 -0.42 -2.11 -1.96 3.38 -1.75 1.81 115.31 114.27 1x3p h LEU 45 Ca 0.54 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.52 1x3p h LEU 45 Cb 2.76 0.11 0.00 0.00 0.09 0.00 0.00 40.66 43.62 1x3p h LEU 45 CO -0.01 -0.14 0.00 1.88 0.09 0.00 0.00 178.44 180.26 1x3p h TYR 46 N -0.82 0.00 -0.00 1.13 -1.99 -0.04 0.15 116.97 115.40 1x3p h TYR 46 Ca -0.05 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.68 1x3p h TYR 46 Cb 0.38 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.11 1x3p h TYR 46 CO 0.04 0.00 -0.48 0.94 -0.00 0.00 0.00 178.16 178.66 1x3p n GLN 47 N -2.93 0.32 -0.04 4.88 0.00 0.46 -3.47 117.38 116.59 1x3p n GLN 47 Ca -0.01 -0.20 0.22 0.00 -0.00 0.00 0.00 57.00 57.00 1x3p n GLN 47 Cb 0.16 -1.50 0.69 0.00 0.00 0.00 0.00 30.24 29.59 1x3p n GLN 47 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.06 176.50 1x3p h GLN 48 N 0.49 0.02 0.26 3.69 3.07 0.58 1.63 115.11 124.85 1x3p h GLN 48 Ca 0.00 -0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.73 1x3p h GLN 48 Cb 0.52 -0.01 0.00 0.00 0.08 0.00 0.00 27.48 28.07 1x3p h GLN 48 CO 0.00 0.02 -0.13 1.96 0.09 0.00 0.00 178.83 180.77 1x3p h GLN 49 N 0.03 -0.34 -5.19 0.06 1.08 -1.68 -3.41 115.11 105.67 1x3p h GLN 49 Ca 0.29 0.02 -0.64 0.00 -1.45 0.00 0.00 58.65 56.87 1x3p h GLN 49 Cb 1.14 0.08 -0.15 0.00 -0.05 0.00 0.00 27.48 28.49 1x3p h GLN 49 CO -0.01 -0.22 -0.11 -0.65 -0.95 0.00 0.00 178.83 176.89 1x3p s GLN 50 N -6.14 3.70 0.17 1.46 -1.52 0.56 -4.89 119.66 113.00 1x3p s GLN 50 Ca -0.15 -0.14 0.11 0.00 -1.95 0.00 0.00 55.36 53.24 1x3p s GLN 50 Cb 0.05 -3.78 0.62 0.00 -0.22 0.00 0.00 33.01 29.69 1x3p s GLN 50 CO 0.65 -0.55 1.34 -2.30 -0.25 0.00 0.00 175.29 174.18 1x3p n PRO 51 N 5.61 0.07 -1.83 2.91 -0.02 -1.25 -4.77 135.00 135.72 1x3p n PRO 51 Ca -0.06 0.57 -0.02 0.00 -2.02 0.00 0.00 63.50 61.97 1x3p n PRO 51 Cb 0.49 -1.75 -0.00 0.00 -0.02 0.00 0.00 33.50 32.22 1x3p n PRO 51 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 1x3p n MET 52 N -1.90 -0.13 -0.60 -0.52 1.56 -1.26 -4.88 117.12 109.39 1x3p n MET 52 Ca -0.01 0.18 -0.00 0.00 -0.27 0.00 0.00 57.70 57.60 1x3p n MET 52 Cb 0.03 -3.77 -0.01 0.00 2.15 0.00 0.00 33.22 31.63 1x3p n MET 52 CO 0.00 0.00 0.00 0.27 -0.73 0.00 0.00 175.97 175.51 1x3p n ASN 53 N 1.69 -0.05 0.00 6.12 0.23 -1.26 -4.95 115.26 117.05 1x3p n ASN 53 Ca -0.02 -1.43 0.00 0.00 -0.53 0.00 0.00 54.58 52.60 1x3p n ASN 53 Cb 0.42 -0.04 0.00 0.00 -2.08 0.00 0.00 39.78 38.08 1x3p n ASN 53 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71