#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 0.47 -0.33 0.00 -7.23 -1.26 -5.13 120.40 106.92 1x3p s VAL 2 Ca 0.00 -1.13 0.04 0.00 -1.81 0.00 0.00 61.98 59.08 1x3p s VAL 2 Cb 0.00 -0.64 0.10 0.00 0.56 0.00 0.00 36.38 36.39 1x3p s VAL 2 CO 0.00 -0.45 0.04 0.00 -0.31 0.00 0.00 175.10 174.38 1x3p s ALA 3 N -1.61 2.88 0.00 1.32 0.00 -1.26 -4.93 121.76 118.15 1x3p s ALA 3 Ca -0.09 -2.47 0.00 0.00 0.00 0.00 0.00 51.96 49.40 1x3p s ALA 3 Cb -0.09 -1.95 0.00 0.00 0.00 0.00 0.00 23.12 21.09 1x3p s ALA 3 CO -0.00 -1.65 0.00 0.39 0.00 0.00 0.00 175.76 174.50 1x3p n GLU 4 N 4.27 0.00 -4.20 0.00 -0.58 -1.26 -5.09 120.64 113.78 1x3p n GLU 4 Ca 0.02 0.00 -0.34 0.00 -0.42 0.00 0.00 57.16 56.42 1x3p n GLU 4 Cb 0.42 0.00 -0.10 0.00 -0.57 0.00 0.00 31.44 31.19 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 -1.10 5.29 -0.32 1.62 0.15 -1.26 -4.89 113.70 113.18 1x3p s SER 5 Ca 0.00 0.03 0.02 0.00 0.70 0.00 0.00 55.95 56.70 1x3p s SER 5 Cb 0.00 -1.82 0.16 0.00 -1.71 0.00 0.00 66.02 62.64 1x3p s SER 5 CO 0.00 0.21 0.40 0.68 1.20 0.00 0.00 173.24 175.73 1x3p s VAL 6 N 0.12 -0.53 -0.46 4.45 -7.23 -1.21 -3.04 120.40 112.50 1x3p s VAL 6 Ca 0.02 -0.51 0.07 0.00 -1.81 0.00 0.00 61.98 59.75 1x3p s VAL 6 Cb -0.13 -0.82 0.24 0.00 0.56 0.00 0.00 36.38 36.23 1x3p s VAL 6 CO 0.02 -0.38 0.74 2.30 -0.31 0.00 0.00 175.10 177.46 1x3p n ILE 7 N 4.95 -0.27 -3.46 -0.62 -5.35 -1.26 -4.95 119.36 108.41 1x3p n ILE 7 Ca 0.04 -2.34 -0.14 0.00 -0.27 0.00 0.00 62.75 60.04 1x3p n ILE 7 Cb 0.48 0.25 -0.11 0.00 -1.74 0.00 0.00 39.64 38.52 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 -1.32 -0.18 0.20 3.28 0.00 -0.47 -4.87 107.32 103.95 1x3p s GLY 8 Ca 0.33 0.61 -0.01 0.00 0.00 0.00 0.00 44.72 45.65 1x3p s GLY 8 CO -0.19 2.34 0.13 0.54 0.00 0.00 0.00 173.10 175.93 1x3p s LYS 9 N 2.43 1.19 0.00 2.90 1.02 -1.26 0.16 119.74 126.18 1x3p s LYS 9 Ca 0.08 -1.60 0.18 0.00 0.02 0.00 0.00 55.97 54.65 1x3p s LYS 9 Cb -0.15 0.27 0.74 0.00 -0.52 0.00 0.00 37.83 38.18 1x3p s LYS 9 CO -0.13 -0.39 1.52 0.54 -0.92 0.00 0.00 175.35 175.97 1x3p n ARG 10 N -0.26 1.50 0.00 1.68 1.74 0.26 -4.86 116.66 116.73 1x3p n ARG 10 Ca 0.01 -0.76 0.00 0.00 -0.77 0.00 0.00 57.85 56.34 1x3p n ARG 10 Cb 0.66 -1.33 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 1x3p n ARG 10 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1x3p n VAL 11 N 0.00 0.00 -3.32 1.55 0.31 -1.26 -4.67 118.33 110.93 1x3p n VAL 11 Ca 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.47 1x3p n VAL 11 Cb 0.23 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.16 1x3p n VAL 11 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1x3p n GLY 12 N 0.00 4.02 2.20 2.92 0.00 -1.26 -4.97 105.19 108.09 1x3p n GLY 12 Ca 0.00 -2.14 -0.30 0.00 0.00 0.00 0.00 46.02 43.59 1x3p n GLY 12 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1x3p n ASP 13 N -1.23 6.30 0.00 1.61 -0.08 -1.26 -4.55 116.55 117.33 1x3p n ASP 13 Ca 0.00 -3.75 0.00 0.00 -1.51 0.00 0.00 54.79 49.53 1x3p n ASP 13 Cb 0.00 -0.85 0.00 0.00 2.34 0.00 0.00 41.12 42.61 1x3p n ASP 13 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1x3p n ASP 14 N -0.95 0.00 -2.69 1.67 2.03 -1.26 -5.03 116.55 110.33 1x3p n ASP 14 Ca 0.58 0.00 -0.07 0.00 0.52 0.00 0.00 54.79 55.82 1x3p n ASP 14 Cb 0.91 0.00 0.09 0.00 -0.72 0.00 0.00 41.12 41.39 1x3p n ASP 14 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1x3p n GLY 15 N 3.36 1.44 2.65 0.27 0.00 -1.26 -5.01 105.19 106.63 1x3p n GLY 15 Ca 0.00 -0.57 -0.04 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.45 0.01 -2.28 1.61 2.85 -1.26 -5.15 118.16 113.49 1x3p n LYS 16 Ca 0.01 -0.51 -0.26 0.00 -1.05 0.00 0.00 58.31 56.49 1x3p n LYS 16 Cb 0.84 0.16 0.13 0.00 -0.65 0.00 0.00 35.03 35.52 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 0.37 2.10 0.16 0.58 -1.32 -1.26 -4.40 115.64 111.86 1x3p s THR 17 Ca 0.24 -0.32 0.00 0.00 -1.21 0.00 0.00 61.69 60.40 1x3p s THR 17 Cb 0.18 -2.78 0.00 0.00 -1.51 0.00 0.00 72.50 68.40 1x3p s THR 17 CO -0.08 0.00 0.00 -0.38 -2.21 0.00 0.00 174.62 171.95 1x3p n ILE 18 N -3.21 0.00 -3.64 5.08 2.08 -1.26 -4.90 119.36 113.51 1x3p n ILE 18 Ca 0.14 0.00 -0.11 0.00 0.56 0.00 0.00 62.75 63.34 1x3p n ILE 18 Cb 0.60 -0.36 -0.05 0.00 -0.75 0.00 0.00 39.64 39.08 1x3p n ILE 18 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 1x3p s GLU 19 N -2.00 1.04 0.13 0.38 2.56 -1.26 -4.87 118.70 114.68 1x3p s GLU 19 Ca 0.00 -0.63 -0.24 0.00 0.00 0.00 0.00 54.97 54.10 1x3p s GLU 19 Cb 0.00 0.46 -0.07 0.00 2.00 0.00 0.00 34.13 36.52 1x3p s GLU 19 CO 0.00 -0.40 0.74 1.52 -0.56 0.00 0.00 175.26 176.56 1x3p s TYR 20 N -3.51 3.86 -0.24 5.30 -0.85 -1.26 0.92 117.35 121.57 1x3p s TYR 20 Ca 0.01 1.55 -0.04 0.00 -0.52 0.00 0.00 57.07 58.07 1x3p s TYR 20 Cb 0.01 -2.73 0.13 0.00 0.38 0.00 0.00 41.96 39.75 1x3p s TYR 20 CO -0.10 0.49 0.41 -0.51 -1.52 0.00 0.00 175.55 174.33 1x3p s LEU 21 N -0.96 -0.72 -0.08 -3.49 1.02 0.43 -4.51 118.68 110.37 1x3p s LEU 21 Ca 0.35 0.52 -0.07 0.00 0.02 0.00 0.00 54.13 54.96 1x3p s LEU 21 Cb -0.22 1.30 -0.04 0.00 0.02 0.00 0.00 46.19 47.25 1x3p s LEU 21 CO 0.24 -0.28 0.18 -0.69 0.02 0.00 0.00 176.35 175.83 1x3p s VAL 22 N 2.60 5.44 -0.22 -1.59 1.01 -1.01 -1.37 120.40 125.26 1x3p s VAL 22 Ca 0.09 0.18 -0.04 0.00 0.00 0.00 0.00 61.98 62.22 1x3p s VAL 22 Cb -0.14 -3.47 0.09 0.00 0.00 0.00 0.00 36.38 32.85 1x3p s VAL 22 CO -0.15 0.53 0.16 -0.54 0.00 0.00 0.00 175.10 175.10 1x3p s LYS 23 N -1.29 0.16 1.16 2.72 3.01 -1.26 -2.13 119.74 122.12 1x3p s LYS 23 Ca 0.19 -0.11 -0.17 0.00 -1.01 0.00 0.00 55.97 54.87 1x3p s LYS 23 Cb -0.13 -1.35 0.27 0.00 -1.01 0.00 0.00 37.83 35.61 1x3p s LYS 23 CO 0.09 -0.79 1.08 -1.58 0.51 0.00 0.00 175.35 174.66 1x3p s TRP 24 N 2.21 0.93 -0.41 3.18 0.23 -1.17 -3.35 118.94 120.57 1x3p s TRP 24 Ca 0.06 0.69 -0.01 0.00 -2.03 0.00 0.00 56.10 54.81 1x3p s TRP 24 Cb -0.16 -3.32 0.25 0.00 0.03 0.00 0.00 33.47 30.27 1x3p s TRP 24 CO -0.19 -3.71 2.09 -2.37 0.96 0.00 0.00 176.95 173.73 1x3p n THR 25 N -4.69 3.01 0.00 2.01 5.66 -1.26 -4.17 114.28 114.84 1x3p n THR 25 Ca 0.10 -2.07 0.00 0.00 -3.05 0.00 0.00 64.05 59.03 1x3p n THR 25 Cb 0.59 -1.33 0.00 0.00 -1.55 0.00 0.00 70.33 68.04 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 0.13 0.00 -4.59 1.09 -0.08 -1.26 -4.99 116.55 106.86 1x3p n ASP 26 Ca 0.39 0.00 -0.30 0.00 -1.51 0.00 0.00 54.79 53.37 1x3p n ASP 26 Cb 0.59 0.15 -0.10 0.00 2.34 0.00 0.00 41.12 44.10 1x3p n ASP 26 CO 0.00 0.00 0.00 -0.32 0.12 0.00 0.00 177.20 177.00 1x3p s MET 27 N -1.46 2.16 -0.10 -0.67 1.75 -1.26 -5.12 119.30 114.60 1x3p s MET 27 Ca 0.00 -1.02 -0.11 0.00 -1.25 0.00 0.00 55.69 53.31 1x3p s MET 27 Cb 0.00 -2.32 -0.05 0.00 2.84 0.00 0.00 34.83 35.30 1x3p s MET 27 CO 0.00 0.51 0.24 -1.12 -0.65 0.00 0.00 175.02 173.99 1x3p s SER 28 N -2.27 6.50 -0.36 1.11 0.01 -1.26 -3.02 113.70 114.41 1x3p s SER 28 Ca 0.22 0.59 -0.13 0.00 1.31 0.00 0.00 55.95 57.94 1x3p s SER 28 Cb -0.11 -2.14 0.02 0.00 0.21 0.00 0.00 66.02 64.00 1x3p s SER 28 CO 0.14 0.31 0.37 -0.67 0.41 0.00 0.00 173.24 173.81 1x3p n ASP 29 N 2.34 -7.58 -0.10 2.44 2.03 -1.24 -5.00 116.55 109.44 1x3p n ASP 29 Ca -0.17 0.73 -0.13 0.00 0.52 0.00 0.00 54.79 55.74 1x3p n ASP 29 Cb 0.53 -4.63 -0.05 0.00 -0.72 0.00 0.00 41.12 36.26 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 0.15 0.82 -2.31 -1.67 0.00 -0.90 -5.03 120.51 111.58 1x3p n ALA 30 Ca 0.05 -0.74 0.00 0.00 0.00 0.00 0.00 53.44 52.75 1x3p n ALA 30 Cb 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.79 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 -4.46 0.00 -3.71 0.00 -1.04 -1.25 -5.01 114.28 98.80 1x3p n THR 31 Ca -0.22 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.65 1x3p n THR 31 Cb 0.54 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.97 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 2.98 -0.32 0.00 -1.42 0.52 -1.26 -2.39 118.94 117.05 1x3p s TRP 32 Ca 0.00 0.60 0.00 0.00 0.02 0.00 0.00 56.10 56.72 1x3p s TRP 32 Cb 0.00 0.16 0.00 0.00 -1.15 0.00 0.00 33.47 32.48 1x3p s TRP 32 CO 0.00 -0.39 0.00 0.39 0.02 0.00 0.00 176.95 176.97 1x3p n GLU 33 N 1.57 0.00 0.00 4.98 1.02 -1.24 -4.48 120.64 122.49 1x3p n GLU 33 Ca -0.19 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.95 1x3p n GLU 33 Cb 0.56 -0.05 0.00 0.00 -0.02 0.00 0.00 31.44 31.93 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 -0.54 0.00 -0.34 3.49 -0.02 -1.25 -1.21 135.00 135.14 1x3p n PRO 34 Ca 0.00 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.44 1x3p n PRO 34 Cb 0.00 -0.02 -0.06 0.00 -0.02 0.00 0.00 33.50 33.40 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 0.67 -3.27 -0.52 7.27 -1.26 -4.24 117.38 116.03 1x3p n GLN 35 Ca 0.00 -0.34 -0.07 0.00 0.07 0.00 0.00 57.00 56.67 1x3p n GLN 35 Cb 0.00 -1.67 -0.04 0.00 2.41 0.00 0.00 30.24 30.94 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 2.66 -0.13 -0.26 1.69 1.11 -0.35 -4.64 116.67 116.75 1x3p s ASP 36 Ca 0.23 -0.60 0.00 0.00 0.18 0.00 0.00 52.55 52.36 1x3p s ASP 36 Cb 0.11 1.30 0.25 0.00 1.07 0.00 0.00 42.92 45.65 1x3p s ASP 36 CO 0.00 -0.29 1.76 -3.20 1.18 0.00 0.00 175.17 174.61 1x3p n ASN 37 N 4.98 5.09 -4.70 0.27 5.15 -1.26 -4.49 115.26 120.29 1x3p n ASN 37 Ca 0.05 -2.90 -0.42 0.00 -0.60 0.00 0.00 54.58 50.71 1x3p n ASN 37 Cb 0.51 -0.89 -0.03 0.00 -0.53 0.00 0.00 39.78 38.84 1x3p n ASN 37 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1x3p s VAL 38 N -1.89 4.33 0.00 3.44 0.11 -1.26 -3.17 120.40 121.96 1x3p s VAL 38 Ca 0.28 1.66 0.00 0.00 -2.93 0.00 0.00 61.98 60.99 1x3p s VAL 38 Cb 0.23 -4.07 0.00 0.00 -1.53 0.00 0.00 36.38 31.01 1x3p s VAL 38 CO 0.02 0.07 0.00 -0.67 -3.33 0.00 0.00 175.10 171.19 1x3p n ASP 39 N 4.52 0.00 -0.32 3.54 -0.08 -1.26 -4.41 116.55 118.54 1x3p n ASP 39 Ca 0.09 0.00 -0.04 0.00 -1.51 0.00 0.00 54.79 53.33 1x3p n ASP 39 Cb 0.47 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 43.91 1x3p n ASP 39 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1x3p n SER 40 N 0.75 -5.77 0.02 1.67 7.64 -1.19 -4.73 113.62 112.00 1x3p n SER 40 Ca 0.00 0.10 0.00 0.00 1.01 0.00 0.00 58.87 59.98 1x3p n SER 40 Cb 0.00 -3.64 0.00 0.00 -1.01 0.00 0.00 64.21 59.56 1x3p n SER 40 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1x3p n THR 41 N -2.12 0.36 0.12 0.44 -1.04 -1.26 -4.52 114.28 106.25 1x3p n THR 41 Ca -0.04 0.12 -0.02 0.00 -2.04 0.00 0.00 64.05 62.07 1x3p n THR 41 Cb 0.52 -1.13 0.07 0.00 -1.82 0.00 0.00 70.33 67.96 1x3p n THR 41 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1x3p h LEU 42 N 0.00 0.00 0.00 -4.42 -0.00 -1.87 -3.34 115.31 105.68 1x3p h LEU 42 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 57.85 1x3p h LEU 42 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.66 1x3p h LEU 42 CO 0.00 0.71 -0.66 0.52 -0.00 0.00 0.00 178.44 179.01 1x3p n VAL 43 N -3.52 1.44 -0.28 1.22 0.31 -1.26 -4.18 118.33 112.06 1x3p n VAL 43 Ca -0.00 0.18 0.22 0.00 -0.01 0.00 0.00 64.34 64.73 1x3p n VAL 43 Cb 0.74 -2.35 0.36 0.00 -0.91 0.00 0.00 33.84 31.67 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 -4.58 0.07 0.12 7.52 7.94 -1.26 0.19 117.00 127.00 1x3p n LEU 44 Ca -0.11 0.62 -0.11 0.00 -1.11 0.00 0.00 56.01 55.31 1x3p n LEU 44 Cb 0.34 -0.31 -0.07 0.00 0.53 0.00 0.00 43.42 43.91 1x3p n LEU 44 CO 0.12 -0.66 0.38 -0.07 -1.11 0.00 0.00 177.39 176.05 1x3p h LEU 45 N 0.00 -0.31 -1.60 -1.96 3.38 -1.75 1.51 115.31 114.57 1x3p h LEU 45 Ca 0.45 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1x3p h LEU 45 Cb 1.57 0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.40 1x3p h LEU 45 CO -0.15 0.16 0.00 1.88 0.09 0.00 0.00 178.44 180.42 1x3p h TYR 46 N -0.93 0.00 -0.00 1.13 -1.99 0.19 -0.01 116.97 115.36 1x3p h TYR 46 Ca -0.04 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.69 1x3p h TYR 46 Cb 0.50 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.23 1x3p h TYR 46 CO 0.05 0.00 -0.59 0.94 -0.00 0.00 0.00 178.16 178.55 1x3p n GLN 47 N -2.88 0.08 -0.17 4.88 0.00 0.49 -3.67 117.38 116.11 1x3p n GLN 47 Ca 0.00 -0.05 0.23 0.00 -0.00 0.00 0.00 57.00 57.18 1x3p n GLN 47 Cb 0.23 -1.50 0.64 0.00 0.00 0.00 0.00 30.24 29.61 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 0.12 0.15 0.48 3.69 3.07 0.42 1.61 115.11 124.66 1x3p h GLN 48 Ca 0.00 -0.01 -0.02 0.00 0.09 0.00 0.00 58.65 58.71 1x3p h GLN 48 Cb 0.51 -0.03 -0.01 0.00 0.08 0.00 0.00 27.48 28.02 1x3p h GLN 48 CO 0.00 0.10 -0.32 1.96 0.09 0.00 0.00 178.83 180.66 1x3p h GLN 49 N 0.16 -0.74 -5.25 0.06 1.08 -1.69 -3.40 115.11 105.33 1x3p h GLN 49 Ca 0.41 0.05 -0.65 0.00 -1.45 0.00 0.00 58.65 57.01 1x3p h GLN 49 Cb 1.37 0.17 -0.15 0.00 -0.05 0.00 0.00 27.48 28.81 1x3p h GLN 49 CO -0.07 -0.49 -0.03 -0.65 -0.95 0.00 0.00 178.83 176.63 1x3p s GLN 50 N -6.04 3.58 0.47 1.46 -1.52 0.55 -4.92 119.66 113.24 1x3p s GLN 50 Ca -0.17 -0.18 0.18 0.00 -1.95 0.00 0.00 55.36 53.24 1x3p s GLN 50 Cb 0.05 -3.82 1.00 0.00 -0.22 0.00 0.00 33.01 30.01 1x3p s GLN 50 CO 0.63 -0.68 1.50 -1.35 -0.25 0.00 0.00 175.29 175.14 1x3p h PRO 51 N 8.50 0.00 -0.08 2.91 0.11 -1.79 -3.44 132.00 138.21 1x3p h PRO 51 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1x3p h PRO 51 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1x3p h PRO 51 CO 0.79 0.00 0.00 -0.12 -0.21 0.00 0.00 178.00 178.46 1x3p n MET 52 N -2.38 0.00 0.33 1.05 1.56 -1.26 -4.94 117.12 111.48 1x3p n MET 52 Ca -0.01 0.00 0.21 0.00 -0.27 0.00 0.00 57.70 57.63 1x3p n MET 52 Cb 0.39 -2.79 1.14 0.00 2.15 0.00 0.00 33.22 34.11 1x3p n MET 52 CO 0.00 0.00 0.00 -0.91 -0.73 0.00 0.00 175.97 174.33 1x3p h ASN 53 N 0.00 0.00 0.00 6.12 4.21 -1.91 -3.47 115.58 120.53 1x3p h ASN 53 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1x3p h ASN 53 Cb 0.82 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.02 1x3p h ASN 53 CO 0.00 0.00 0.00 -1.84 -1.29 0.00 0.00 177.43 174.30