#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 0.14 -0.82 0.00 0.11 -1.26 -5.10 120.40 113.47 1x3p s VAL 2 Ca 0.00 -1.21 -0.22 0.00 -2.93 0.00 0.00 61.98 57.62 1x3p s VAL 2 Cb 0.00 -1.37 0.08 0.00 -1.53 0.00 0.00 36.38 33.56 1x3p s VAL 2 CO 0.00 -0.64 1.15 0.00 -3.33 0.00 0.00 175.10 172.28 1x3p s ALA 3 N -3.87 3.06 0.16 1.54 0.00 -1.26 -4.64 121.76 116.76 1x3p s ALA 3 Ca 0.06 -2.14 0.00 0.00 0.00 0.00 0.00 51.96 49.88 1x3p s ALA 3 Cb 0.05 -4.10 0.00 0.00 0.00 0.00 0.00 23.12 19.07 1x3p s ALA 3 CO -0.10 -3.07 0.00 0.39 0.00 0.00 0.00 175.76 172.97 1x3p n GLU 4 N 7.81 0.00 -4.27 0.00 -0.58 -1.26 -5.10 120.64 117.24 1x3p n GLU 4 Ca 0.13 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.52 1x3p n GLU 4 Cb 0.48 -0.05 -0.10 0.00 -0.57 0.00 0.00 31.44 31.21 1x3p n GLU 4 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1x3p s SER 5 N -4.75 5.32 -0.29 1.62 0.15 -1.26 -4.93 113.70 109.55 1x3p s SER 5 Ca 0.00 0.11 0.01 0.00 0.70 0.00 0.00 55.95 56.77 1x3p s SER 5 Cb 0.00 -1.66 0.15 0.00 -1.71 0.00 0.00 66.02 62.80 1x3p s SER 5 CO 0.00 0.30 0.38 0.68 1.20 0.00 0.00 173.24 175.80 1x3p s VAL 6 N -0.43 -0.57 -0.46 4.45 -7.23 -1.14 -3.46 120.40 111.55 1x3p s VAL 6 Ca 0.08 -0.36 0.07 0.00 -1.81 0.00 0.00 61.98 59.96 1x3p s VAL 6 Cb -0.12 -0.98 0.23 0.00 0.56 0.00 0.00 36.38 36.07 1x3p s VAL 6 CO 0.02 -0.34 0.74 2.30 -0.31 0.00 0.00 175.10 177.51 1x3p n ILE 7 N 5.31 -0.26 -3.53 -0.62 -5.35 -1.26 -4.92 119.36 108.74 1x3p n ILE 7 Ca 0.00 -2.17 -0.10 0.00 -0.27 0.00 0.00 62.75 60.20 1x3p n ILE 7 Cb 0.48 0.36 -0.10 0.00 -1.74 0.00 0.00 39.64 38.65 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 -1.08 -0.30 0.16 3.28 0.00 -0.34 -4.77 107.32 104.27 1x3p s GLY 8 Ca 0.33 1.07 -0.06 0.00 0.00 0.00 0.00 44.72 46.05 1x3p s GLY 8 CO -0.18 2.40 0.22 0.54 0.00 0.00 0.00 173.10 176.07 1x3p s LYS 9 N 2.53 1.12 0.00 2.90 1.02 -1.26 0.87 119.74 126.92 1x3p s LYS 9 Ca 0.05 -1.29 0.16 0.00 0.02 0.00 0.00 55.97 54.91 1x3p s LYS 9 Cb -0.14 0.34 0.63 0.00 -0.52 0.00 0.00 37.83 38.14 1x3p s LYS 9 CO -0.13 -0.39 1.45 0.54 -0.92 0.00 0.00 175.35 175.90 1x3p n ARG 10 N -0.20 1.56 0.00 1.68 5.12 0.34 -4.86 116.66 120.30 1x3p n ARG 10 Ca -0.06 -0.85 0.00 0.00 -1.93 0.00 0.00 57.85 55.01 1x3p n ARG 10 Cb 0.63 -1.31 0.00 0.00 -1.16 0.00 0.00 32.46 30.62 1x3p n ARG 10 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1x3p n VAL 11 N 0.11 0.00 -3.21 1.55 0.31 -1.26 -4.66 118.33 111.18 1x3p n VAL 11 Ca 0.13 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.28 1x3p n VAL 11 Cb 0.25 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 33.17 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 2.01 -0.41 2.92 0.00 -1.26 -4.96 107.32 105.62 1x3p s GLY 12 Ca 0.00 -1.76 -0.03 0.00 0.00 0.00 0.00 44.72 42.93 1x3p s GLY 12 CO 0.00 -1.57 2.59 2.09 0.00 0.00 0.00 173.10 176.21 1x3p n ASP 13 N -1.76 6.46 0.00 1.64 5.75 -1.26 -4.34 116.55 123.03 1x3p n ASP 13 Ca 0.07 -3.16 0.00 0.00 -0.01 0.00 0.00 54.79 51.69 1x3p n ASP 13 Cb 0.60 -1.19 0.00 0.00 -1.03 0.00 0.00 41.12 39.50 1x3p n ASP 13 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1x3p n ASP 14 N 0.76 0.00 -1.78 -1.12 9.92 -1.26 -5.03 116.55 118.04 1x3p n ASP 14 Ca 0.44 0.00 -0.02 0.00 -0.53 0.00 0.00 54.79 54.68 1x3p n ASP 14 Cb 0.57 0.00 0.02 0.00 -0.64 0.00 0.00 41.12 41.07 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 4.07 1.17 2.71 0.44 0.00 -1.26 -4.98 105.19 107.34 1x3p n GLY 15 Ca 0.00 -0.44 -0.09 0.00 0.00 0.00 0.00 46.02 45.49 1x3p n GLY 15 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1x3p n LYS 16 N -0.28 0.90 -2.30 1.61 2.85 -1.26 -5.15 118.16 114.52 1x3p n LYS 16 Ca -0.11 -1.90 -0.26 0.00 -1.05 0.00 0.00 58.31 54.99 1x3p n LYS 16 Cb 0.88 -1.26 0.12 0.00 -0.65 0.00 0.00 35.03 34.12 1x3p n LYS 16 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 1x3p s THR 17 N 0.38 2.15 0.08 0.58 -1.32 -1.26 -4.31 115.64 111.94 1x3p s THR 17 Ca 0.28 -0.34 0.00 0.00 -1.21 0.00 0.00 61.69 60.42 1x3p s THR 17 Cb 0.26 -2.81 0.00 0.00 -1.51 0.00 0.00 72.50 68.44 1x3p s THR 17 CO -0.15 0.00 0.00 -0.38 -2.21 0.00 0.00 174.62 171.88 1x3p n ILE 18 N -3.12 0.00 -3.64 5.08 5.41 -1.26 -4.91 119.36 116.92 1x3p n ILE 18 Ca 0.13 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.76 1x3p n ILE 18 Cb 0.60 -0.35 -0.06 0.00 -0.71 0.00 0.00 39.64 39.12 1x3p n ILE 18 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 1x3p s GLU 19 N -2.00 0.99 0.16 0.38 2.12 -1.26 -4.87 118.70 114.22 1x3p s GLU 19 Ca 0.00 -0.46 -0.26 0.00 0.36 0.00 0.00 54.97 54.61 1x3p s GLU 19 Cb 0.00 0.44 -0.08 0.00 0.26 0.00 0.00 34.13 34.75 1x3p s GLU 19 CO 0.00 -0.36 0.79 1.52 -0.54 0.00 0.00 175.26 176.67 1x3p s TYR 20 N -2.93 3.90 -0.21 5.30 -0.85 -1.26 0.13 117.35 121.42 1x3p s TYR 20 Ca -0.02 1.64 -0.06 0.00 -0.52 0.00 0.00 57.07 58.11 1x3p s TYR 20 Cb 0.00 -2.79 0.10 0.00 0.38 0.00 0.00 41.96 39.66 1x3p s TYR 20 CO -0.06 0.49 0.43 -0.51 -1.52 0.00 0.00 175.55 174.38 1x3p s LEU 21 N -1.04 -0.70 -0.15 -3.49 1.43 0.25 -4.53 118.68 110.45 1x3p s LEU 21 Ca 0.36 0.89 -0.07 0.00 -1.03 0.00 0.00 54.13 54.28 1x3p s LEU 21 Cb -0.23 1.39 -0.04 0.00 0.03 0.00 0.00 46.19 47.34 1x3p s LEU 21 CO 0.26 -0.24 0.10 -0.69 0.23 0.00 0.00 176.35 176.01 1x3p s VAL 22 N 2.63 5.18 -0.15 -1.59 1.01 -1.03 -1.20 120.40 125.24 1x3p s VAL 22 Ca 0.01 0.10 -0.01 0.00 0.00 0.00 0.00 61.98 62.08 1x3p s VAL 22 Cb -0.13 -3.30 0.04 0.00 0.00 0.00 0.00 36.38 32.99 1x3p s VAL 22 CO -0.14 0.53 -0.03 -0.54 0.00 0.00 0.00 175.10 174.92 1x3p s LYS 23 N -0.28 1.20 0.88 2.72 3.01 -1.26 -0.93 119.74 125.09 1x3p s LYS 23 Ca 0.10 -0.38 -0.13 0.00 -1.01 0.00 0.00 55.97 54.55 1x3p s LYS 23 Cb -0.12 -1.82 0.15 0.00 -1.01 0.00 0.00 37.83 35.03 1x3p s LYS 23 CO 0.01 -0.43 1.23 -1.58 0.51 0.00 0.00 175.35 175.09 1x3p s TRP 24 N 1.72 2.09 -0.42 3.18 0.23 -1.22 -2.90 118.94 121.62 1x3p s TRP 24 Ca 0.02 0.40 0.00 0.00 -2.03 0.00 0.00 56.10 54.48 1x3p s TRP 24 Cb -0.15 -3.77 0.38 0.00 0.03 0.00 0.00 33.47 29.96 1x3p s TRP 24 CO -0.07 -2.22 1.90 -2.37 0.96 0.00 0.00 176.95 175.15 1x3p n THR 25 N -3.49 2.96 0.00 2.01 5.66 -1.26 -4.22 114.28 115.94 1x3p n THR 25 Ca 0.13 -1.93 0.00 0.00 -3.05 0.00 0.00 64.05 59.20 1x3p n THR 25 Cb 0.60 -1.03 0.00 0.00 -1.55 0.00 0.00 70.33 68.35 1x3p n THR 25 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1x3p n ASP 26 N -0.39 0.00 -3.81 1.09 -0.08 -1.26 -5.02 116.55 107.08 1x3p n ASP 26 Ca 0.44 0.00 -0.28 0.00 -1.51 0.00 0.00 54.79 53.44 1x3p n ASP 26 Cb 0.87 0.41 -0.12 0.00 2.34 0.00 0.00 41.12 44.62 1x3p n ASP 26 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 1x3p s MET 27 N -1.96 2.00 0.74 -0.67 -1.94 -1.26 -5.09 119.30 111.12 1x3p s MET 27 Ca 0.00 -2.88 -0.16 0.00 -1.71 0.00 0.00 55.69 50.94 1x3p s MET 27 Cb 0.00 -2.96 -0.05 0.00 2.01 0.00 0.00 34.83 33.83 1x3p s MET 27 CO 0.00 -1.26 0.39 -1.13 -0.01 0.00 0.00 175.02 173.01 1x3p n SER 28 N 2.47 -1.75 -2.62 3.03 3.41 -1.26 -4.04 113.62 112.86 1x3p n SER 28 Ca 0.18 0.55 -0.02 0.00 -0.26 0.00 0.00 58.87 59.32 1x3p n SER 28 Cb 0.36 -1.16 0.00 0.00 -0.26 0.00 0.00 64.21 63.16 1x3p n SER 28 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1x3p n ASP 29 N 0.06 -6.38 0.00 4.04 2.03 -1.16 -4.85 116.55 110.29 1x3p n ASP 29 Ca 0.09 0.09 0.00 0.00 0.52 0.00 0.00 54.79 55.49 1x3p n ASP 29 Cb 0.50 -4.25 0.00 0.00 -0.72 0.00 0.00 41.12 36.66 1x3p n ASP 29 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1x3p n ALA 30 N -1.20 0.13 -2.52 -1.67 0.00 -0.10 -5.01 120.51 110.13 1x3p n ALA 30 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1x3p n ALA 30 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 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 -0.51 0.00 -3.66 0.00 -1.04 -1.26 -4.92 114.28 102.89 1x3p n THR 31 Ca 0.00 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.87 1x3p n THR 31 Cb 0.00 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.44 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 2.97 -0.31 0.00 -1.42 0.52 -1.26 -2.47 118.94 116.97 1x3p s TRP 32 Ca 0.00 0.38 0.00 0.00 0.02 0.00 0.00 56.10 56.50 1x3p s TRP 32 Cb 0.00 0.22 0.00 0.00 -1.15 0.00 0.00 33.47 32.54 1x3p s TRP 32 CO 0.00 -0.54 0.00 0.39 0.02 0.00 0.00 176.95 176.82 1x3p n GLU 33 N 0.74 0.00 0.00 4.98 -0.58 -1.22 -4.47 120.64 120.09 1x3p n GLU 33 Ca -0.19 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.55 1x3p n GLU 33 Cb 0.59 -0.02 0.00 0.00 -0.57 0.00 0.00 31.44 31.43 1x3p n GLU 33 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 1x3p n PRO 34 N -0.35 0.00 -0.34 3.49 -0.02 -1.23 -1.65 135.00 134.90 1x3p n PRO 34 Ca 0.00 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.40 1x3p n PRO 34 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.45 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 0.86 -3.11 -0.52 7.27 -1.26 -4.18 117.38 116.44 1x3p n GLN 35 Ca 0.00 -0.70 -0.12 0.00 0.07 0.00 0.00 57.00 56.25 1x3p n GLN 35 Cb 0.00 -1.99 -0.04 0.00 2.41 0.00 0.00 30.24 30.62 1x3p n GLN 35 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1x3p s ASP 36 N 3.58 -0.14 -0.26 1.69 1.11 -0.66 -4.91 116.67 117.08 1x3p s ASP 36 Ca 0.20 -1.93 0.00 0.00 0.18 0.00 0.00 52.55 51.00 1x3p s ASP 36 Cb 0.07 1.01 0.24 0.00 1.07 0.00 0.00 42.92 45.31 1x3p s ASP 36 CO -0.01 -0.14 1.76 -3.20 1.18 0.00 0.00 175.17 174.76 1x3p n ASN 37 N 3.39 5.12 -2.33 0.27 4.05 -1.26 -4.53 115.26 119.97 1x3p n ASN 37 Ca 0.19 -2.90 -0.24 0.00 0.45 0.00 0.00 54.58 52.08 1x3p n ASN 37 Cb 0.52 -0.89 -0.04 0.00 1.23 0.00 0.00 39.78 40.59 1x3p n ASN 37 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 177.26 174.73 1x3p n VAL 38 N 0.14 3.18 0.01 3.44 0.31 -1.26 -4.03 118.33 120.12 1x3p n VAL 38 Ca 0.28 -2.61 0.00 0.00 -0.01 0.00 0.00 64.34 62.00 1x3p n VAL 38 Cb 0.76 -1.56 0.00 0.00 -0.91 0.00 0.00 33.84 32.14 1x3p n VAL 38 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1x3p n ASP 39 N 0.83 -0.11 0.00 4.52 2.03 -1.26 -5.03 116.55 117.53 1x3p n ASP 39 Ca 0.44 0.03 0.00 0.00 0.52 0.00 0.00 54.79 55.78 1x3p n ASP 39 Cb 0.58 0.42 0.00 0.00 -0.72 0.00 0.00 41.12 41.40 1x3p n ASP 39 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1x3p n SER 40 N -2.37 0.00 0.02 1.67 7.64 -1.26 -4.73 113.62 114.59 1x3p n SER 40 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1x3p n SER 40 Cb 0.00 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.73 1x3p n SER 40 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 1x3p n THR 41 N -2.00 0.40 0.03 0.44 5.66 -1.26 -4.53 114.28 113.02 1x3p n THR 41 Ca 0.00 0.13 -0.00 0.00 -3.05 0.00 0.00 64.05 61.13 1x3p n THR 41 Cb 0.00 -1.49 -0.09 0.00 -1.55 0.00 0.00 70.33 67.20 1x3p n THR 41 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1x3p n LEU 42 N -3.16 0.84 -0.08 1.09 4.77 -1.26 -4.33 117.00 114.88 1x3p n LEU 42 Ca 0.00 0.37 -0.09 0.00 -0.03 0.00 0.00 56.01 56.26 1x3p n LEU 42 Cb 0.32 0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 1x3p n LEU 42 CO 0.00 0.16 -0.51 0.52 -1.33 0.00 0.00 177.39 176.23 1x3p n VAL 43 N -2.89 1.46 -0.30 4.08 0.31 -1.26 -4.23 118.33 115.50 1x3p n VAL 43 Ca -0.10 0.14 0.24 0.00 -0.01 0.00 0.00 64.34 64.61 1x3p n VAL 43 Cb 0.85 -2.32 0.40 0.00 -0.91 0.00 0.00 33.84 31.86 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 -4.54 0.09 0.28 7.52 7.94 -1.26 0.13 117.00 127.16 1x3p n LEU 44 Ca -0.14 0.74 -0.12 0.00 -1.11 0.00 0.00 56.01 55.38 1x3p n LEU 44 Cb 0.40 -0.36 -0.06 0.00 0.53 0.00 0.00 43.42 43.93 1x3p n LEU 44 CO 0.14 -0.79 0.31 -0.07 -1.11 0.00 0.00 177.39 175.87 1x3p h LEU 45 N 0.00 -0.64 -1.20 -1.96 3.38 -1.76 1.36 115.31 114.49 1x3p h LEU 45 Ca 0.51 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.49 1x3p h LEU 45 Cb 1.72 0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.64 1x3p h LEU 45 CO -0.21 -0.24 0.00 1.88 0.09 0.00 0.00 178.44 179.96 1x3p h TYR 46 N -1.19 0.00 -0.00 1.13 -1.99 0.96 0.46 116.97 116.34 1x3p h TYR 46 Ca -0.08 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.65 1x3p h TYR 46 Cb 0.59 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.32 1x3p h TYR 46 CO 0.00 0.00 -0.55 0.94 -0.00 0.00 0.00 178.16 178.55 1x3p n GLN 47 N -2.31 0.05 -0.22 4.88 7.27 0.35 -3.55 117.38 123.84 1x3p n GLN 47 Ca -0.00 -0.03 0.31 0.00 0.07 0.00 0.00 57.00 57.35 1x3p n GLN 47 Cb 0.12 -1.50 0.73 0.00 2.41 0.00 0.00 30.24 32.01 1x3p n GLN 47 CO 0.00 0.00 0.00 -0.56 0.07 0.00 0.00 177.06 176.57 1x3p h GLN 48 N 0.07 0.00 0.81 3.69 3.07 0.67 1.65 115.11 125.07 1x3p h GLN 48 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 58.65 58.70 1x3p h GLN 48 Cb 0.50 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.07 1x3p h GLN 48 CO 0.00 0.00 -0.39 1.96 0.09 0.00 0.00 178.83 180.49 1x3p h GLN 49 N 0.00 -1.04 -5.30 0.06 1.08 -1.69 -3.43 115.11 104.79 1x3p h GLN 49 Ca 0.47 0.07 -0.62 0.00 -1.45 0.00 0.00 58.65 57.12 1x3p h GLN 49 Cb 1.87 0.24 -0.13 0.00 -0.05 0.00 0.00 27.48 29.41 1x3p h GLN 49 CO -0.00 -0.68 -0.11 -0.65 -0.95 0.00 0.00 178.83 176.43 1x3p s GLN 50 N -5.39 4.07 0.00 1.46 -1.52 0.56 -4.89 119.66 113.96 1x3p s GLN 50 Ca -0.17 0.22 0.04 0.00 -1.95 0.00 0.00 55.36 53.50 1x3p s GLN 50 Cb 0.02 -3.63 0.19 0.00 -0.22 0.00 0.00 33.01 29.37 1x3p s GLN 50 CO 0.53 -0.28 1.11 -0.35 -0.25 0.00 0.00 175.29 176.05 1x3p n PRO 51 N 5.29 0.01 -2.13 2.91 -0.04 -1.25 -4.71 135.00 135.08 1x3p n PRO 51 Ca -0.06 0.40 -0.09 0.00 -0.04 0.00 0.00 63.50 63.70 1x3p n PRO 51 Cb 0.50 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.46 1x3p n PRO 51 CO 0.00 0.00 0.00 -0.12 -0.04 0.00 0.00 175.50 175.34 1x3p n MET 52 N -1.47 -0.74 0.00 0.54 1.56 -1.26 -4.89 117.12 110.86 1x3p n MET 52 Ca 0.01 0.47 0.00 0.00 -0.27 0.00 0.00 57.70 57.92 1x3p n MET 52 Cb 0.05 -4.49 0.00 0.00 2.15 0.00 0.00 33.22 30.93 1x3p n MET 52 CO 0.00 0.00 0.00 -1.71 -0.73 0.00 0.00 175.97 173.53 1x3p n ASN 53 N 0.22 1.15 0.00 6.12 4.05 -1.26 -4.94 115.26 120.60 1x3p n ASN 53 Ca -0.11 -1.34 0.00 0.00 0.45 0.00 0.00 54.58 53.58 1x3p n ASN 53 Cb 0.57 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.58 1x3p n ASN 53 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59