#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nei n GLY 2 N 0.00 0.74 3.89 3.03 0.00 -1.26 -5.15 105.19 106.44 1nei n GLY 2 Ca 0.00 -0.70 -0.20 0.00 0.00 0.00 0.00 46.02 45.11 1nei n GLY 2 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nei s LYS 3 N -1.09 2.58 -0.64 1.61 3.01 -1.26 -5.08 119.74 118.88 1nei s LYS 3 Ca 0.00 -1.48 -0.09 0.00 -1.01 0.00 0.00 55.97 53.39 1nei s LYS 3 Cb 0.00 -2.42 0.17 0.00 -1.01 0.00 0.00 37.83 34.56 1nei s LYS 3 CO 0.00 -0.17 0.52 0.00 0.51 0.00 0.00 175.35 176.21 1nei s ALA 4 N -2.44 3.69 0.10 5.17 0.00 -1.26 -5.03 121.76 121.99 1nei s ALA 4 Ca 0.48 -3.02 -0.07 0.00 0.00 0.00 0.00 51.96 49.35 1nei s ALA 4 Cb -0.04 -3.02 -0.01 0.00 0.00 0.00 0.00 23.12 20.05 1nei s ALA 4 CO 0.28 -2.09 0.15 0.95 0.00 0.00 0.00 175.76 175.05 1nei s THR 5 N 0.53 0.14 0.01 0.00 -4.23 -1.26 -4.71 115.64 106.12 1nei s THR 5 Ca 0.13 -1.41 0.01 0.00 -1.18 0.00 0.00 61.69 59.25 1nei s THR 5 Cb -0.19 -1.54 -0.01 0.00 1.34 0.00 0.00 72.50 72.10 1nei s THR 5 CO -0.04 -0.63 -0.04 -0.31 -0.54 0.00 0.00 174.62 173.06 1nei s TYR 6 N -3.91 0.34 -0.32 3.99 2.02 -1.12 -4.95 117.35 113.39 1nei s TYR 6 Ca 0.09 -0.18 -0.02 0.00 -0.37 0.00 0.00 57.07 56.59 1nei s TYR 6 Cb 0.05 -0.22 0.06 0.00 -0.40 0.00 0.00 41.96 41.46 1nei s TYR 6 CO -0.08 -0.04 0.05 0.99 -1.57 0.00 0.00 175.55 174.90 1nei s THR 7 N -0.44 3.13 -0.35 -0.71 2.01 -1.26 -1.56 115.64 116.45 1nei s THR 7 Ca -0.03 -1.47 -0.11 0.00 0.31 0.00 0.00 61.69 60.39 1nei s THR 7 Cb -0.04 -2.86 0.01 0.00 0.01 0.00 0.00 72.50 69.63 1nei s THR 7 CO -0.00 -0.22 0.20 -0.69 -0.69 0.00 0.00 174.62 173.22 1nei s VAL 8 N 1.25 4.70 -0.21 3.82 1.01 -0.86 -4.98 120.40 125.14 1nei s VAL 8 Ca -0.02 -0.63 -0.06 0.00 0.00 0.00 0.00 61.98 61.27 1nei s VAL 8 Cb -0.20 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 1nei s VAL 8 CO -0.01 -0.11 0.03 -0.89 0.00 0.00 0.00 175.10 174.11 1nei s THR 9 N 1.60 4.12 -0.15 3.92 2.01 -1.26 -1.19 115.64 124.69 1nei s THR 9 Ca 0.04 -0.25 0.02 0.00 0.31 0.00 0.00 61.69 61.80 1nei s THR 9 Cb -0.18 -2.88 0.01 0.00 0.01 0.00 0.00 72.50 69.46 1nei s THR 9 CO 0.07 0.40 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.51 1nei s VAL 10 N 1.14 1.98 0.03 3.82 1.01 0.20 -4.97 120.40 123.61 1nei s VAL 10 Ca 0.03 -0.92 0.05 0.00 0.00 0.00 0.00 61.98 61.14 1nei s VAL 10 Cb -0.14 -1.77 -0.02 0.00 0.00 0.00 0.00 36.38 34.44 1nei s VAL 10 CO 0.02 0.53 -0.13 -0.89 0.00 0.00 0.00 175.10 174.63 1nei s THR 11 N 1.03 1.06 -0.26 3.92 2.01 -1.26 -0.11 115.64 122.04 1nei s THR 11 Ca -0.02 -0.93 -0.11 0.00 0.31 0.00 0.00 61.69 60.94 1nei s THR 11 Cb -0.14 -0.96 -0.05 0.00 0.01 0.00 0.00 72.50 71.36 1nei s THR 11 CO -0.06 0.03 0.21 0.20 -0.69 0.00 0.00 174.62 174.30 1nei s ASN 12 N -1.03 6.10 0.31 3.53 -0.87 0.35 -4.93 114.94 118.41 1nei s ASN 12 Ca 0.02 0.10 0.25 0.00 -1.57 0.00 0.00 52.86 51.65 1nei s ASN 12 Cb -0.07 -2.13 0.59 0.00 -0.02 0.00 0.00 41.25 39.61 1nei s ASN 12 CO 0.01 -0.02 1.69 0.78 -2.57 0.00 0.00 177.10 176.99 1nei h ASN 13 N 7.94 0.00 0.46 -1.22 2.35 -1.93 2.71 115.58 125.90 1nei h ASN 13 Ca -0.36 -0.00 -0.30 0.00 -0.55 0.00 0.00 56.30 55.08 1nei h ASN 13 Cb 1.18 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.54 1nei h ASN 13 CO 0.61 0.00 -1.51 0.77 -1.65 0.00 0.00 177.43 175.66 1nei h SER 14 N 0.00 0.40 -0.01 5.81 4.64 -1.97 -3.34 113.55 119.09 1nei h SER 14 Ca 0.00 -0.54 0.00 0.00 -0.47 0.00 0.00 61.79 60.78 1nei h SER 14 Cb 0.86 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1nei h SER 14 CO 0.00 1.45 -0.14 -3.20 -0.87 0.00 0.00 176.83 174.07 1nei n ASN 15 N -3.46 1.45 -1.77 4.97 2.85 -1.20 -4.97 115.26 113.13 1nei n ASN 15 Ca -0.16 -1.23 -0.16 0.00 -0.11 0.00 0.00 54.58 52.93 1nei n ASN 15 Cb 1.04 0.31 -0.05 0.00 1.24 0.00 0.00 39.78 42.33 1nei n ASN 15 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1nei n GLY 16 N 0.81 0.85 3.63 8.20 0.00 0.90 -4.91 105.19 114.67 1nei n GLY 16 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1nei n GLY 16 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nei s VAL 17 N -2.48 5.00 -0.06 1.61 1.01 -0.69 -4.80 120.40 120.00 1nei s VAL 17 Ca 0.00 1.11 -0.02 0.00 0.00 0.00 0.00 61.98 63.07 1nei s VAL 17 Cb 0.00 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 1nei s VAL 17 CO 0.00 0.05 0.03 -0.94 0.00 0.00 0.00 175.10 174.24 1nei s SER 18 N 1.43 5.40 -0.20 3.32 1.04 -1.26 0.13 113.70 123.55 1nei s SER 18 Ca 0.26 0.15 -0.08 0.00 0.48 0.00 0.00 55.95 56.76 1nei s SER 18 Cb -0.16 -1.53 0.08 0.00 0.10 0.00 0.00 66.02 64.51 1nei s SER 18 CO 0.09 0.35 0.44 -0.69 0.98 0.00 0.00 173.24 174.41 1nei s VAL 19 N -0.98 -0.41 0.07 5.02 1.01 0.85 -4.96 120.40 120.99 1nei s VAL 19 Ca 0.16 0.12 0.09 0.00 0.00 0.00 0.00 61.98 62.35 1nei s VAL 19 Cb -0.12 -0.68 -0.03 0.00 0.00 0.00 0.00 36.38 35.55 1nei s VAL 19 CO 0.06 0.05 -0.21 -1.81 0.00 0.00 0.00 175.10 173.18 1nei s ASP 20 N 2.15 3.58 -0.03 3.32 1.01 -1.26 0.62 116.67 126.06 1nei s ASP 20 Ca -0.05 -0.54 -0.01 0.00 0.71 0.00 0.00 52.55 52.67 1nei s ASP 20 Cb -0.10 -0.46 0.03 0.00 1.01 0.00 0.00 42.92 43.40 1nei s ASP 20 CO -0.14 0.23 0.05 -0.31 0.21 0.00 0.00 175.17 175.21 1nei s TYR 21 N -0.95 0.02 -0.39 4.23 1.51 -0.33 -4.99 117.35 116.45 1nei s TYR 21 Ca 0.14 0.19 -0.19 0.00 -1.01 0.00 0.00 57.07 56.20 1nei s TYR 21 Cb -0.10 -0.27 0.01 0.00 -0.11 0.00 0.00 41.96 41.48 1nei s TYR 21 CO 0.05 -0.12 0.54 -2.00 -1.11 0.00 0.00 175.55 172.92 1nei s GLU 22 N 1.30 3.44 -0.03 -0.62 2.12 -1.26 -2.02 118.70 121.63 1nei s GLU 22 Ca -0.06 -0.31 -0.00 0.00 0.36 0.00 0.00 54.97 54.95 1nei s GLU 22 Cb -0.13 -3.87 0.03 0.00 0.26 0.00 0.00 34.13 30.42 1nei s GLU 22 CO -0.03 -0.78 0.02 -0.08 -0.54 0.00 0.00 175.26 173.84 1nei s THR 23 N 2.48 0.08 -0.74 -1.70 -1.32 -0.60 -5.00 115.64 108.83 1nei s THR 23 Ca 0.19 0.19 -0.21 0.00 -1.21 0.00 0.00 61.69 60.64 1nei s THR 23 Cb -0.15 -0.22 0.09 0.00 -1.51 0.00 0.00 72.50 70.71 1nei s THR 23 CO 0.15 0.15 1.00 -0.70 -2.21 0.00 0.00 174.62 173.00 1nei s GLU 24 N 1.33 3.26 -0.17 7.08 2.56 -1.26 -2.81 118.70 128.69 1nei s GLU 24 Ca -0.06 -1.17 -0.02 0.00 0.00 0.00 0.00 54.97 53.72 1nei s GLU 24 Cb -0.13 -4.46 0.05 0.00 2.00 0.00 0.00 34.13 31.59 1nei s GLU 24 CO -0.03 -1.78 0.02 0.95 -0.56 0.00 0.00 175.26 173.86 1nei s THR 25 N 3.52 0.58 0.00 -1.70 -4.23 -1.26 -4.96 115.64 107.59 1nei s THR 25 Ca 0.25 -0.46 0.00 0.00 -1.18 0.00 0.00 61.69 60.29 1nei s THR 25 Cb -0.14 -0.99 0.00 0.00 1.34 0.00 0.00 72.50 72.71 1nei s THR 25 CO 0.03 -0.09 0.04 -0.81 -0.54 0.00 0.00 174.62 173.26 1nei n PRO 26 N 5.04 0.00 0.16 3.99 -0.04 -1.26 -3.96 135.00 138.93 1nei n PRO 26 Ca -0.09 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.39 1nei n PRO 26 Cb 0.48 -0.30 0.22 0.00 -0.04 0.00 0.00 33.50 33.86 1nei n PRO 26 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 1nei h MET 27 N 0.00 0.00 -0.77 0.54 2.86 -2.02 -3.04 114.93 112.50 1nei h MET 27 Ca 0.00 0.00 0.22 0.00 -2.06 0.00 0.00 59.70 57.86 1nei h MET 27 Cb 0.00 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 1nei h MET 27 CO 0.00 0.51 0.55 1.79 1.06 0.00 0.00 176.91 180.82 1nei h THR 28 N 0.00 0.63 -0.76 2.22 1.35 -1.93 0.49 112.91 114.90 1nei h THR 28 Ca -0.01 -0.02 0.06 0.00 -0.55 0.00 0.00 66.41 65.90 1nei h THR 28 Cb 1.08 0.57 -0.05 0.00 -1.73 0.00 0.00 68.15 68.02 1nei h THR 28 CO 0.07 0.01 0.50 -0.07 -0.25 0.00 0.00 175.52 175.77 1nei h LEU 29 N 0.05 0.72 -0.20 3.87 3.38 -1.66 0.86 115.31 122.34 1nei h LEU 29 Ca 0.37 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.18 1nei h LEU 29 Cb 1.41 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.98 1nei h LEU 29 CO -0.02 0.47 -0.77 -0.07 0.09 0.00 0.00 178.44 178.13 1nei h LEU 30 N 0.82 0.00 -9.78 1.67 3.38 -0.25 -3.42 115.31 107.73 1nei h LEU 30 Ca 0.33 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.76 1nei h LEU 30 Cb 0.23 0.00 0.08 0.00 0.09 0.00 0.00 40.66 41.06 1nei h LEU 30 CO -0.11 0.77 0.91 0.52 0.09 0.00 0.00 178.44 180.62 1nei n VAL 31 N -3.41 0.86 -0.01 1.22 0.31 0.30 -4.91 118.33 112.69 1nei n VAL 31 Ca 0.00 -0.21 -0.17 0.00 -0.01 0.00 0.00 64.34 63.95 1nei n VAL 31 Cb 0.80 -1.98 -0.10 0.00 -0.91 0.00 0.00 33.84 31.65 1nei n VAL 31 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1nei h PRO 32 N 5.13 0.44 -0.94 5.55 0.13 -1.87 0.21 132.00 140.65 1nei h PRO 32 Ca -0.46 -0.43 0.03 0.00 -0.87 0.00 0.00 66.00 64.26 1nei h PRO 32 Cb 1.22 0.11 -0.05 0.00 0.13 0.00 0.00 31.00 32.41 1nei h PRO 32 CO 0.82 1.08 0.62 0.93 -0.23 0.00 0.00 178.00 181.22 1nei h GLU 33 N -0.03 1.17 0.03 0.86 5.08 -1.92 1.72 114.58 121.50 1nei h GLU 33 Ca -0.06 -0.07 -0.17 0.00 -1.00 0.00 0.00 59.36 58.06 1nei h GLU 33 Cb 1.25 -0.26 0.01 0.00 0.50 0.00 0.00 28.75 30.25 1nei h GLU 33 CO 0.11 0.78 -0.67 0.28 -1.00 0.00 0.00 179.01 178.51 1nei h VAL 34 N 1.21 1.44 -0.39 3.13 2.07 -1.80 -1.95 116.25 119.96 1nei h VAL 34 Ca 0.37 -2.19 -0.01 0.00 0.82 0.00 0.00 66.70 65.69 1nei h VAL 34 Cb -0.03 2.72 -0.02 0.00 -1.52 0.00 0.00 31.29 32.45 1nei h VAL 34 CO -0.11 0.63 0.21 0.00 0.02 0.00 0.00 177.57 178.32 1nei h ALA 35 N 0.27 0.50 -0.15 1.67 0.00 -0.15 0.34 119.26 121.74 1nei h ALA 35 Ca -0.09 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.74 1nei h ALA 35 Cb 1.40 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1nei h ALA 35 CO 0.13 0.03 0.08 0.00 0.00 0.00 0.00 179.25 179.49 1nei h ALA 36 N 1.06 0.18 -0.42 0.00 0.00 0.25 0.58 119.26 120.91 1nei h ALA 36 Ca 0.14 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1nei h ALA 36 Cb 0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1nei h ALA 36 CO -0.02 -0.35 0.18 1.49 0.00 0.00 0.00 179.25 180.55 1nei h GLU 37 N 0.17 0.59 0.13 0.00 4.22 -1.02 0.75 114.58 119.42 1nei h GLU 37 Ca 0.06 -0.07 -0.01 0.00 0.08 0.00 0.00 59.36 59.42 1nei h GLU 37 Cb 0.00 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.14 1nei h GLU 37 CO -0.03 0.48 -0.06 0.28 -2.18 0.00 0.00 179.01 177.49 1nei h VAL 38 N 0.59 1.05 -0.66 0.32 2.07 0.56 1.69 116.25 121.87 1nei h VAL 38 Ca 0.15 -1.00 -0.00 0.00 0.82 0.00 0.00 66.70 66.67 1nei h VAL 38 Cb 0.10 1.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.48 1nei h VAL 38 CO -0.02 0.23 0.40 0.40 0.02 0.00 0.00 177.57 178.60 1nei h ILE 39 N -0.66 1.19 -0.27 4.57 1.08 0.45 0.23 117.51 124.08 1nei h ILE 39 Ca -0.02 -0.40 -0.16 0.00 -0.39 0.00 0.00 64.86 63.89 1nei h ILE 39 Cb 0.50 0.27 -0.00 0.00 -3.07 0.00 0.00 36.82 34.52 1nei h ILE 39 CO 0.03 0.19 -0.45 0.50 -0.69 0.00 0.00 178.15 177.73 1nei h LYS 40 N 0.89 0.79 -0.55 2.37 3.11 0.51 -1.49 116.57 122.20 1nei h LYS 40 Ca 0.24 -0.48 0.05 0.00 -2.81 0.00 0.00 60.65 57.64 1nei h LYS 40 Cb -0.04 0.05 -0.05 0.00 -1.00 0.00 0.00 32.23 31.19 1nei h LYS 40 CO -0.05 1.11 0.29 0.22 -2.81 0.00 0.00 179.45 178.21 1nei h ASP 41 N 0.55 0.42 0.28 4.20 3.58 0.30 2.14 116.42 127.88 1nei h ASP 41 Ca 0.02 0.03 -0.01 0.00 0.42 0.00 0.00 57.03 57.49 1nei h ASP 41 Cb 1.05 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 42.06 1nei h ASP 41 CO 0.10 0.28 -0.13 -0.07 -2.88 0.00 0.00 179.24 176.54 1nei h LEU 42 N 0.55 -0.31 -0.58 2.28 4.07 -0.48 0.83 115.31 121.66 1nei h LEU 42 Ca 0.24 -0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.13 1nei h LEU 42 Cb 0.14 0.08 -0.03 0.00 1.08 0.00 0.00 40.66 41.94 1nei h LEU 42 CO -0.16 -0.12 0.38 0.58 -1.08 0.00 0.00 178.44 178.04 1nei h VAL 43 N -0.50 1.16 -0.86 1.22 2.07 -0.79 0.13 116.25 118.68 1nei h VAL 43 Ca -0.04 -0.30 0.09 0.00 0.82 0.00 0.00 66.70 67.27 1nei h VAL 43 Cb 0.37 0.31 -0.06 0.00 -1.52 0.00 0.00 31.29 30.40 1nei h VAL 43 CO 0.06 0.15 0.56 0.78 0.02 0.00 0.00 177.57 179.14 1nei h ASN 44 N 0.79 0.78 -0.25 0.57 -0.26 0.37 0.22 115.58 117.80 1nei h ASN 44 Ca 0.21 0.02 -0.17 0.00 -0.56 0.00 0.00 56.30 55.80 1nei h ASN 44 Cb -0.07 -0.15 0.00 0.00 -1.06 0.00 0.00 38.32 37.04 1nei h ASN 44 CO -0.04 0.47 -0.50 0.74 -1.06 0.00 0.00 177.43 177.04 1nei h THR 45 N 0.87 1.29 -0.40 2.81 2.02 0.35 0.27 112.91 120.12 1nei h THR 45 Ca 0.39 -1.69 -0.00 0.00 0.77 0.00 0.00 66.41 65.87 1nei h THR 45 Cb 0.36 1.73 -0.02 0.00 -1.74 0.00 0.00 68.15 68.47 1nei h THR 45 CO -0.16 0.54 0.25 0.58 0.37 0.00 0.00 175.52 177.10 1nei h VAL 46 N 0.53 1.13 0.00 3.16 2.07 0.59 -2.04 116.25 121.68 1nei h VAL 46 Ca 0.01 -0.28 -0.13 0.00 0.82 0.00 0.00 66.70 67.12 1nei h VAL 46 Cb 1.10 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.44 1nei h VAL 46 CO 0.11 0.13 -0.63 0.03 0.02 0.00 0.00 177.57 177.22 1nei h ARG 47 N 0.53 0.00 -0.92 1.57 3.08 -0.61 -3.03 114.38 115.01 1nei h ARG 47 Ca 0.14 0.00 0.14 0.00 0.07 0.00 0.00 59.98 60.34 1nei h ARG 47 Cb -0.01 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 29.96 1nei h ARG 47 CO -0.03 0.63 0.59 0.77 -1.07 0.00 0.00 179.97 180.86 1nei h SER 48 N 0.00 0.71 1.15 7.04 0.02 0.27 0.42 113.55 123.16 1nei h SER 48 Ca -0.01 0.04 -0.05 0.00 -0.84 0.00 0.00 61.79 60.94 1nei h SER 48 Cb 1.14 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.58 1nei h SER 48 CO 0.08 0.36 -0.25 0.22 -1.14 0.00 0.00 176.83 176.10 1nei h TYR 49 N 0.76 0.00 0.65 3.45 5.03 -1.36 -3.28 116.97 122.22 1nei h TYR 49 Ca 0.46 0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.74 1nei h TYR 49 Cb 0.68 0.00 0.01 0.00 1.55 0.00 0.00 36.73 38.97 1nei h TYR 49 CO -0.00 0.25 -0.31 0.22 -1.32 0.00 0.00 178.16 176.99 1nei h ASP 50 N 0.00 -0.74 -4.03 -2.11 3.58 -0.20 -3.45 116.42 109.47 1nei h ASP 50 Ca -0.00 0.03 -0.45 0.00 0.42 0.00 0.00 57.03 57.03 1nei h ASP 50 Cb 0.89 0.19 0.15 0.00 1.72 0.00 0.00 39.33 42.29 1nei h ASP 50 CO 0.03 -0.45 0.30 0.28 -2.88 0.00 0.00 179.24 176.52 1nei s THR 51 N -4.61 1.91 0.00 2.25 -1.32 -0.98 -5.01 115.64 107.88 1nei s THR 51 Ca -0.13 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.35 1nei s THR 51 Cb 0.01 -2.78 0.00 0.00 -1.51 0.00 0.00 72.50 68.23 1nei s THR 51 CO 0.38 0.00 0.27 -0.62 -2.21 0.00 0.00 174.62 172.44 1nei n GLU 52 N -3.97 0.00 -1.99 7.08 -0.58 -1.26 -4.74 120.64 115.18 1nei n GLU 52 Ca 0.11 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.43 1nei n GLU 52 Cb 0.59 -0.75 -0.02 0.00 -0.57 0.00 0.00 31.44 30.69 1nei n GLU 52 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 1nei s ASN 53 N -1.61 6.63 -0.71 1.62 0.01 -1.26 -4.90 114.94 114.72 1nei s ASN 53 Ca 0.00 2.67 -0.03 0.00 -0.71 0.00 0.00 52.86 54.79 1nei s ASN 53 Cb 0.00 -2.62 0.19 0.00 0.41 0.00 0.00 41.25 39.23 1nei s ASN 53 CO 0.00 -0.73 2.41 -1.84 -1.51 0.00 0.00 177.10 175.43 1nei n GLU 54 N 2.61 2.91 0.18 -0.60 0.28 -1.26 -4.22 120.64 120.54 1nei n GLU 54 Ca 0.08 -3.01 0.00 0.00 -0.16 0.00 0.00 57.16 54.07 1nei n GLU 54 Cb 0.40 -2.25 0.00 0.00 1.43 0.00 0.00 31.44 31.02 1nei n GLU 54 CO 0.00 0.00 0.00 1.58 -0.16 0.00 0.00 177.13 178.55 1nei n HIS 55 N 0.37 -3.36 -4.19 -1.84 -0.00 -1.26 -5.03 115.22 99.92 1nei n HIS 55 Ca 0.52 0.87 -0.35 0.00 -0.00 0.00 0.00 57.72 58.75 1nei n HIS 55 Cb 0.39 1.76 -0.08 0.00 -0.00 0.00 0.00 29.99 32.06 1nei n HIS 55 CO 0.00 0.00 0.00 0.16 -0.00 0.00 0.00 176.34 176.50 1nei s ASP 56 N -4.04 5.65 0.42 0.26 1.47 -1.26 -5.10 116.67 114.07 1nei s ASP 56 Ca 0.00 0.25 -0.13 0.00 1.18 0.00 0.00 52.55 53.85 1nei s ASP 56 Cb 0.00 -1.68 -0.07 0.00 -0.34 0.00 0.00 42.92 40.83 1nei s ASP 56 CO 0.00 0.37 0.82 0.54 0.68 0.00 0.00 175.17 177.59 1nei s VAL 57 N -0.97 4.69 0.00 2.11 0.11 -1.26 -4.69 120.40 120.39 1nei s VAL 57 Ca 0.15 0.85 0.00 0.00 -2.93 0.00 0.00 61.98 60.05 1nei s VAL 57 Cb -0.12 -3.71 0.00 0.00 -1.53 0.00 0.00 36.38 31.03 1nei s VAL 57 CO 0.04 -0.51 0.00 0.00 -3.33 0.00 0.00 175.10 171.31 1nei n GLY 59 N 0.00 -1.68 3.70 0.00 0.00 -1.26 -5.11 105.19 100.84 1nei n GLY 59 Ca 0.00 0.97 0.00 0.00 0.00 0.00 0.00 46.02 46.99 1nei n GLY 59 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11