#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nei s GLY 2 N 0.00 -1.49 0.42 3.03 0.00 -1.26 -5.17 107.32 102.85 1nei s GLY 2 Ca 0.00 0.81 0.08 0.00 0.00 0.00 0.00 44.72 45.61 1nei s GLY 2 CO 0.00 4.09 0.45 0.54 0.00 0.00 0.00 173.10 178.18 1nei s LYS 3 N 1.77 2.64 -0.63 2.90 3.01 -1.26 -5.08 119.74 123.10 1nei s LYS 3 Ca 0.17 -1.43 -0.08 0.00 -1.01 0.00 0.00 55.97 53.61 1nei s LYS 3 Cb 0.02 -2.51 0.16 0.00 -1.01 0.00 0.00 37.83 34.49 1nei s LYS 3 CO -0.12 -0.23 0.49 0.00 0.51 0.00 0.00 175.35 176.01 1nei s ALA 4 N -2.43 3.65 0.15 5.17 0.00 -1.26 -5.03 121.76 122.00 1nei s ALA 4 Ca 0.51 -3.04 -0.06 0.00 0.00 0.00 0.00 51.96 49.37 1nei s ALA 4 Cb -0.06 -2.93 -0.02 0.00 0.00 0.00 0.00 23.12 20.11 1nei s ALA 4 CO 0.30 -2.08 0.19 0.95 0.00 0.00 0.00 175.76 175.12 1nei s THR 5 N 0.46 0.09 0.01 0.00 -4.23 -1.26 -4.77 115.64 105.93 1nei s THR 5 Ca 0.14 -1.57 0.01 0.00 -1.18 0.00 0.00 61.69 59.09 1nei s THR 5 Cb -0.19 -1.88 -0.01 0.00 1.34 0.00 0.00 72.50 71.76 1nei s THR 5 CO -0.04 -0.39 -0.04 -0.31 -0.54 0.00 0.00 174.62 173.30 1nei s TYR 6 N -3.99 0.38 -0.26 3.99 1.51 -1.12 -4.96 117.35 112.90 1nei s TYR 6 Ca 0.19 -0.16 -0.01 0.00 -1.01 0.00 0.00 57.07 56.07 1nei s TYR 6 Cb 0.05 -0.24 0.03 0.00 -0.11 0.00 0.00 41.96 41.70 1nei s TYR 6 CO -0.00 -0.03 -0.06 0.99 -1.11 0.00 0.00 175.55 175.34 1nei s THR 7 N -0.38 2.79 -0.20 -0.71 2.01 -1.26 -1.66 115.64 116.22 1nei s THR 7 Ca -0.02 -1.17 -0.06 0.00 0.31 0.00 0.00 61.69 60.75 1nei s THR 7 Cb -0.03 -2.47 -0.03 0.00 0.01 0.00 0.00 72.50 69.97 1nei s THR 7 CO -0.00 0.12 0.04 -0.69 -0.69 0.00 0.00 174.62 173.40 1nei s VAL 8 N 1.28 4.39 -0.15 3.82 1.01 -0.92 -4.98 120.40 124.86 1nei s VAL 8 Ca -0.02 -0.16 0.02 0.00 0.00 0.00 0.00 61.98 61.82 1nei s VAL 8 Cb -0.18 -3.00 0.01 0.00 0.00 0.00 0.00 36.38 33.22 1nei s VAL 8 CO -0.04 0.42 -0.21 -0.89 0.00 0.00 0.00 175.10 174.37 1nei s THR 9 N 0.85 2.08 -0.13 3.92 2.01 -1.26 -0.36 115.64 122.76 1nei s THR 9 Ca 0.03 -0.97 0.02 0.00 0.31 0.00 0.00 61.69 61.08 1nei s THR 9 Cb -0.14 -1.84 0.01 0.00 0.01 0.00 0.00 72.50 70.55 1nei s THR 9 CO 0.02 0.55 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.64 1nei s VAL 10 N 0.88 1.71 0.00 3.82 1.01 0.38 -4.97 120.40 123.24 1nei s VAL 10 Ca -0.05 -0.76 0.05 0.00 0.00 0.00 0.00 61.98 61.21 1nei s VAL 10 Cb -0.15 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.67 1nei s VAL 10 CO -0.03 0.48 -0.14 -0.89 0.00 0.00 0.00 175.10 174.51 1nei s THR 11 N 1.01 1.14 -0.56 3.92 2.01 -1.26 0.12 115.64 122.03 1nei s THR 11 Ca -0.05 -0.72 -0.16 0.00 0.31 0.00 0.00 61.69 61.07 1nei s THR 11 Cb -0.15 -0.98 0.14 0.00 0.01 0.00 0.00 72.50 71.53 1nei s THR 11 CO -0.03 0.24 0.52 0.54 -0.69 0.00 0.00 174.62 175.20 1nei s ASN 12 N -0.56 6.23 0.45 3.53 2.20 0.13 -4.88 114.94 122.03 1nei s ASN 12 Ca 0.05 -1.88 0.26 0.00 -0.94 0.00 0.00 52.86 50.35 1nei s ASN 12 Cb -0.06 -2.20 1.42 0.00 -2.00 0.00 0.00 41.25 38.41 1nei s ASN 12 CO -0.00 -0.83 1.78 0.78 -2.94 0.00 0.00 177.10 175.89 1nei h ASN 13 N 8.77 0.00 0.40 3.54 2.35 -1.93 3.13 115.58 131.84 1nei h ASN 13 Ca -0.26 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.28 1nei h ASN 13 Cb 1.09 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.46 1nei h ASN 13 CO 1.01 0.00 -0.91 -1.28 -1.65 0.00 0.00 177.43 174.60 1nei h SER 14 N 0.00 0.45 -0.01 5.81 0.87 -1.94 -3.26 113.55 115.47 1nei h SER 14 Ca 0.00 -0.36 0.00 0.00 -1.23 0.00 0.00 61.79 60.20 1nei h SER 14 Cb 0.22 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 1nei h SER 14 CO 0.00 1.15 -0.23 -3.20 -0.53 0.00 0.00 176.83 174.02 1nei n ASN 15 N -3.73 1.19 -0.45 6.23 2.85 0.13 -4.96 115.26 116.52 1nei n ASN 15 Ca -0.06 -1.10 -0.06 0.00 -0.11 0.00 0.00 54.58 53.26 1nei n ASN 15 Cb 0.82 0.50 -0.03 0.00 1.24 0.00 0.00 39.78 42.31 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 0.93 0.60 3.82 8.20 0.00 1.00 -4.94 105.19 114.80 1nei n GLY 16 Ca 0.04 -0.03 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.59 4.82 0.14 1.61 1.01 -1.09 -4.88 120.40 120.43 1nei s VAL 17 Ca 0.00 1.07 0.09 0.00 0.00 0.00 0.00 61.98 63.14 1nei s VAL 17 Cb 0.00 -3.83 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 1nei s VAL 17 CO 0.00 0.51 -0.18 -0.94 0.00 0.00 0.00 175.10 174.49 1nei s SER 18 N -1.21 3.86 -0.19 3.32 1.04 -1.26 0.19 113.70 119.45 1nei s SER 18 Ca 0.29 -0.62 -0.08 0.00 0.48 0.00 0.00 55.95 56.02 1nei s SER 18 Cb -0.18 -0.52 0.08 0.00 0.10 0.00 0.00 66.02 65.50 1nei s SER 18 CO 0.18 0.15 0.43 -0.69 0.98 0.00 0.00 173.24 174.29 1nei s VAL 19 N -1.35 -0.39 0.05 5.02 1.01 0.12 -4.95 120.40 119.91 1nei s VAL 19 Ca 0.20 0.13 0.08 0.00 0.00 0.00 0.00 61.98 62.39 1nei s VAL 19 Cb -0.10 -0.66 -0.03 0.00 0.00 0.00 0.00 36.38 35.59 1nei s VAL 19 CO 0.11 0.05 -0.23 -1.81 0.00 0.00 0.00 175.10 173.22 1nei s ASP 20 N 2.12 2.78 -0.03 3.32 1.01 -1.26 0.14 116.67 124.76 1nei s ASP 20 Ca -0.05 -0.56 -0.01 0.00 0.71 0.00 0.00 52.55 52.64 1nei s ASP 20 Cb -0.10 -0.24 0.03 0.00 1.01 0.00 0.00 42.92 43.62 1nei s ASP 20 CO -0.13 0.20 0.04 -0.31 0.21 0.00 0.00 175.17 175.18 1nei s TYR 21 N -0.82 0.03 -0.37 4.23 1.51 0.51 -4.99 117.35 117.45 1nei s TYR 21 Ca 0.09 0.17 -0.21 0.00 -1.01 0.00 0.00 57.07 56.11 1nei s TYR 21 Cb -0.09 -0.29 0.01 0.00 -0.11 0.00 0.00 41.96 41.47 1nei s TYR 21 CO 0.02 -0.11 0.67 -2.00 -1.11 0.00 0.00 175.55 173.01 1nei s GLU 22 N 1.33 3.63 -0.04 -0.62 2.12 -1.26 -2.17 118.70 121.69 1nei s GLU 22 Ca -0.06 0.04 -0.00 0.00 0.36 0.00 0.00 54.97 55.31 1nei s GLU 22 Cb -0.13 -3.83 0.03 0.00 0.26 0.00 0.00 34.13 30.46 1nei s GLU 22 CO -0.03 -0.80 -0.01 -0.08 -0.54 0.00 0.00 175.26 173.80 1nei s THR 23 N 2.81 0.29 -0.76 -1.70 -1.32 -0.67 -5.01 115.64 109.28 1nei s THR 23 Ca 0.25 0.07 -0.21 0.00 -1.21 0.00 0.00 61.69 60.59 1nei s THR 23 Cb -0.14 -0.40 0.10 0.00 -1.51 0.00 0.00 72.50 70.55 1nei s THR 23 CO 0.16 0.19 1.01 -0.70 -2.21 0.00 0.00 174.62 173.08 1nei s GLU 24 N 1.30 3.30 -0.15 7.08 -6.30 -1.26 -2.79 118.70 119.88 1nei s GLU 24 Ca -0.06 -1.24 -0.02 0.00 -2.50 0.00 0.00 54.97 51.16 1nei s GLU 24 Cb -0.13 -4.52 0.05 0.00 0.00 0.00 0.00 34.13 29.53 1nei s GLU 24 CO -0.02 -1.79 0.01 0.95 0.02 0.00 0.00 175.26 174.43 1nei s THR 25 N 3.44 0.55 0.00 -1.70 -4.23 -1.26 -4.97 115.64 107.47 1nei s THR 25 Ca 0.26 -0.33 0.00 0.00 -1.18 0.00 0.00 61.69 60.44 1nei s THR 25 Cb -0.13 -0.89 0.00 0.00 1.34 0.00 0.00 72.50 72.82 1nei s THR 25 CO 0.02 0.00 0.01 -0.81 -0.54 0.00 0.00 174.62 173.29 1nei n PRO 26 N 5.06 0.00 0.16 3.99 -0.04 -1.26 -4.14 135.00 138.77 1nei n PRO 26 Ca -0.09 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.40 1nei n PRO 26 Cb 0.48 -0.14 0.22 0.00 -0.04 0.00 0.00 33.50 34.02 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 -0.07 0.54 2.86 -2.02 -2.99 114.93 113.25 1nei h MET 27 Ca 0.00 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.66 1nei h MET 27 Cb 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.66 1nei h MET 27 CO 0.00 0.51 0.41 1.79 1.06 0.00 0.00 176.91 180.67 1nei h THR 28 N 0.00 0.05 -0.51 2.22 1.35 -1.94 0.58 112.91 114.67 1nei h THR 28 Ca -0.01 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.82 1nei h THR 28 Cb 1.06 0.61 -0.02 0.00 -1.73 0.00 0.00 68.15 68.07 1nei h THR 28 CO 0.07 0.00 0.15 -0.07 -0.25 0.00 0.00 175.52 175.42 1nei h LEU 29 N 0.00 0.69 0.00 3.87 3.38 -1.68 -1.27 115.31 120.31 1nei h LEU 29 Ca 0.03 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 1nei h LEU 29 Cb 0.84 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1nei h LEU 29 CO -0.00 0.66 -0.42 -0.07 0.09 0.00 0.00 178.44 178.70 1nei h LEU 30 N 0.74 0.00 -9.78 1.67 3.38 -0.06 -3.43 115.31 107.83 1nei h LEU 30 Ca 0.17 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.61 1nei h LEU 30 Cb 0.22 0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.05 1nei h LEU 30 CO -0.01 0.38 0.86 -0.69 0.09 0.00 0.00 178.44 179.07 1nei s VAL 31 N -3.02 2.23 0.03 1.22 1.01 -0.48 -4.92 120.40 116.48 1nei s VAL 31 Ca 0.04 0.19 -0.18 0.00 0.00 0.00 0.00 61.98 62.04 1nei s VAL 31 Cb 0.07 -3.12 -0.21 0.00 0.00 0.00 0.00 36.38 33.11 1nei s VAL 31 CO 0.73 0.03 1.16 1.55 0.00 0.00 0.00 175.10 178.57 1nei h PRO 32 N 5.04 0.52 -0.79 2.72 0.13 -1.88 0.10 132.00 137.84 1nei h PRO 32 Ca -0.46 -0.50 0.02 0.00 -0.87 0.00 0.00 66.00 64.18 1nei h PRO 32 Cb 1.22 0.13 -0.04 0.00 0.13 0.00 0.00 31.00 32.43 1nei h PRO 32 CO 0.80 1.14 0.51 0.93 -0.23 0.00 0.00 178.00 181.15 1nei h GLU 33 N 0.09 0.98 -0.05 0.86 5.08 -1.92 2.06 114.58 121.68 1nei h GLU 33 Ca -0.07 -0.06 -0.13 0.00 -1.00 0.00 0.00 59.36 58.10 1nei h GLU 33 Cb 1.34 -0.22 0.01 0.00 0.50 0.00 0.00 28.75 30.37 1nei h GLU 33 CO 0.13 0.65 -0.48 0.28 -1.00 0.00 0.00 179.01 178.60 1nei h VAL 34 N 1.01 1.41 -0.20 3.13 2.07 -1.80 -1.04 116.25 120.83 1nei h VAL 34 Ca 0.30 -1.89 -0.01 0.00 0.82 0.00 0.00 66.70 65.92 1nei h VAL 34 Cb -0.04 2.40 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 1nei h VAL 34 CO -0.09 0.55 0.09 0.00 0.02 0.00 0.00 177.57 178.14 1nei h ALA 35 N 0.40 0.26 -0.18 1.67 0.00 -0.40 0.30 119.26 121.29 1nei h ALA 35 Ca -0.04 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.79 1nei h ALA 35 Cb 1.15 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1nei h ALA 35 CO 0.10 -0.16 0.06 0.00 0.00 0.00 0.00 179.25 179.24 1nei h ALA 36 N 0.94 0.20 -0.38 0.00 0.00 0.33 0.58 119.26 120.93 1nei h ALA 36 Ca 0.07 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1nei h ALA 36 Cb 0.15 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1nei h ALA 36 CO -0.01 -0.37 0.18 0.93 0.00 0.00 0.00 179.25 179.98 1nei h GLU 37 N 0.15 0.53 0.14 0.00 5.08 -0.95 0.62 114.58 120.14 1nei h GLU 37 Ca 0.08 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1nei h GLU 37 Cb 0.05 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1nei h GLU 37 CO -0.08 0.42 -0.07 0.28 -1.00 0.00 0.00 179.01 178.56 1nei h VAL 38 N 0.53 1.02 -0.69 3.13 2.07 0.69 1.47 116.25 124.48 1nei h VAL 38 Ca 0.13 -1.02 0.01 0.00 0.82 0.00 0.00 66.70 66.65 1nei h VAL 38 Cb 0.07 1.61 -0.04 0.00 -1.52 0.00 0.00 31.29 31.41 1nei h VAL 38 CO -0.02 0.23 0.45 0.40 0.02 0.00 0.00 177.57 178.65 1nei h ILE 39 N -0.70 1.15 -0.27 4.57 1.08 0.46 0.58 117.51 124.37 1nei h ILE 39 Ca -0.02 -0.31 -0.17 0.00 -0.39 0.00 0.00 64.86 63.97 1nei h ILE 39 Cb 0.51 0.17 0.00 0.00 -3.07 0.00 0.00 36.82 34.43 1nei h ILE 39 CO 0.03 0.16 -0.49 0.50 -0.69 0.00 0.00 178.15 177.67 1nei h LYS 40 N 0.90 0.81 -0.48 2.37 3.11 0.23 -1.20 116.57 122.33 1nei h LYS 40 Ca 0.26 -0.51 0.01 0.00 -2.81 0.00 0.00 60.65 57.60 1nei h LYS 40 Cb -0.07 0.06 -0.02 0.00 -1.00 0.00 0.00 32.23 31.20 1nei h LYS 40 CO -0.07 1.14 0.31 0.22 -2.81 0.00 0.00 179.45 178.24 1nei h ASP 41 N 0.58 0.53 -0.07 4.20 3.58 0.27 1.97 116.42 127.48 1nei h ASP 41 Ca 0.02 -0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.45 1nei h ASP 41 Cb 1.10 -0.13 -0.00 0.00 1.72 0.00 0.00 39.33 42.01 1nei h ASP 41 CO 0.11 0.38 0.04 -0.07 -2.88 0.00 0.00 179.24 176.82 1nei h LEU 42 N 0.63 0.09 -0.28 2.28 3.38 0.20 0.21 115.31 121.83 1nei h LEU 42 Ca 0.18 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1nei h LEU 42 Cb -0.06 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1nei h LEU 42 CO -0.05 0.17 0.09 0.58 0.09 0.00 0.00 178.44 179.32 1nei h VAL 43 N 0.00 1.20 -0.77 1.22 2.07 -0.79 0.91 116.25 120.09 1nei h VAL 43 Ca 0.02 -0.64 0.10 0.00 0.82 0.00 0.00 66.70 67.00 1nei h VAL 43 Cb 0.10 1.10 -0.05 0.00 -1.52 0.00 0.00 31.29 30.92 1nei h VAL 43 CO -0.00 0.21 0.50 0.78 0.02 0.00 0.00 177.57 179.08 1nei h ASN 44 N 0.29 0.61 -0.18 0.57 2.35 0.33 0.26 115.58 119.81 1nei h ASN 44 Ca 0.09 0.02 -0.16 0.00 -0.55 0.00 0.00 56.30 55.70 1nei h ASN 44 Cb 0.24 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.51 1nei h ASN 44 CO -0.00 0.36 -0.50 0.74 -1.65 0.00 0.00 177.43 176.38 1nei h THR 45 N 0.67 1.32 -0.40 2.81 2.02 0.02 0.34 112.91 119.70 1nei h THR 45 Ca 0.35 -1.74 -0.00 0.00 0.77 0.00 0.00 66.41 65.79 1nei h THR 45 Cb 0.48 1.93 -0.02 0.00 -1.74 0.00 0.00 68.15 68.80 1nei h THR 45 CO -0.13 0.54 0.24 0.58 0.37 0.00 0.00 175.52 177.12 1nei h VAL 46 N 0.34 1.13 0.00 3.16 2.07 0.64 -2.10 116.25 121.49 1nei h VAL 46 Ca -0.01 -0.28 -0.14 0.00 0.82 0.00 0.00 66.70 67.09 1nei h VAL 46 Cb 1.12 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 1nei h VAL 46 CO 0.11 0.13 -0.66 0.03 0.02 0.00 0.00 177.57 177.19 1nei h ARG 47 N 0.53 0.00 -0.67 1.57 3.08 -0.56 -2.99 114.38 115.34 1nei h ARG 47 Ca 0.14 0.00 0.15 0.00 0.07 0.00 0.00 59.98 60.34 1nei h ARG 47 Cb -0.01 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.00 1nei h ARG 47 CO -0.03 0.66 0.46 0.77 -1.07 0.00 0.00 179.97 180.76 1nei h SER 48 N 0.00 0.26 0.24 7.04 0.02 0.38 0.36 113.55 121.86 1nei h SER 48 Ca -0.01 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 1nei h SER 48 Cb 1.18 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.67 1nei h SER 48 CO 0.09 0.14 -0.21 0.22 -1.14 0.00 0.00 176.83 175.93 1nei h TYR 49 N 0.28 0.00 -2.02 3.45 3.20 -1.33 -3.39 116.97 117.16 1nei h TYR 49 Ca 0.32 0.00 -0.21 0.00 3.14 0.00 0.00 58.73 61.98 1nei h TYR 49 Cb 0.87 0.00 -0.31 0.00 1.54 0.00 0.00 36.73 38.83 1nei h TYR 49 CO -0.00 0.21 -0.54 -0.51 -1.64 0.00 0.00 178.16 175.68 1nei s ASP 50 N -6.90 0.69 0.49 -2.11 1.01 0.13 -5.10 116.67 104.88 1nei s ASP 50 Ca -0.04 -0.10 0.06 0.00 0.71 0.00 0.00 52.55 53.19 1nei s ASP 50 Cb 0.15 0.89 0.01 0.00 1.01 0.00 0.00 42.92 44.98 1nei s ASP 50 CO 0.69 -0.33 0.37 0.42 0.21 0.00 0.00 175.17 176.53 1nei s THR 51 N 2.48 2.01 0.32 -1.27 -4.23 -1.14 -4.71 115.64 109.09 1nei s THR 51 Ca 0.11 -1.48 0.09 0.00 -1.18 0.00 0.00 61.69 59.22 1nei s THR 51 Cb -0.15 -2.49 0.31 0.00 1.34 0.00 0.00 72.50 71.51 1nei s THR 51 CO -0.20 0.00 1.71 -0.08 -0.54 0.00 0.00 174.62 175.51 1nei h GLU 52 N 0.92 0.49 -7.50 3.99 4.81 -1.87 -3.34 114.58 112.09 1nei h GLU 52 Ca -0.39 -0.03 -0.46 0.00 -0.13 0.00 0.00 59.36 58.36 1nei h GLU 52 Cb 1.29 -0.11 0.11 0.00 0.63 0.00 0.00 28.75 30.67 1nei h GLU 52 CO 0.59 0.33 0.30 -0.80 -0.73 0.00 0.00 179.01 178.70 1nei s ASN 53 N -5.16 4.13 -1.02 1.04 0.01 -1.26 -4.00 114.94 108.67 1nei s ASN 53 Ca -0.11 0.32 -0.13 0.00 -0.71 0.00 0.00 52.86 52.23 1nei s ASN 53 Cb 0.27 -0.70 0.13 0.00 0.41 0.00 0.00 41.25 41.36 1nei s ASN 53 CO 0.79 -2.07 0.33 -1.84 -1.51 0.00 0.00 177.10 172.80 1nei n GLU 54 N -3.25 -1.09 -1.56 -0.60 0.28 -1.26 -4.65 120.64 108.52 1nei n GLU 54 Ca 0.11 0.08 0.00 0.00 -0.16 0.00 0.00 57.16 57.19 1nei n GLU 54 Cb 0.60 -3.11 0.00 0.00 1.43 0.00 0.00 31.44 30.36 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 -2.64 -0.22 -4.27 -1.84 -0.00 -1.25 -4.79 115.22 100.20 1nei n HIS 55 Ca 0.07 0.00 -0.26 0.00 0.46 0.00 0.00 57.72 57.99 1nei n HIS 55 Cb 0.31 0.00 -0.08 0.00 -0.12 0.00 0.00 29.99 30.09 1nei n HIS 55 CO 0.00 0.00 0.00 0.16 0.46 0.00 0.00 176.34 176.96 1nei s ASP 56 N -0.67 4.46 0.13 0.26 -4.77 -1.26 -4.91 116.67 109.92 1nei s ASP 56 Ca 0.00 -0.54 -0.31 0.00 -3.30 0.00 0.00 52.55 48.40 1nei s ASP 56 Cb 0.00 -0.83 -0.09 0.00 -1.09 0.00 0.00 42.92 40.91 1nei s ASP 56 CO 0.00 0.08 1.53 0.68 0.70 0.00 0.00 175.17 178.16 1nei s VAL 57 N -1.83 2.90 0.07 2.11 -7.23 -1.26 -4.74 120.40 110.42 1nei s VAL 57 Ca 0.27 0.60 0.00 0.00 -1.81 0.00 0.00 61.98 61.04 1nei s VAL 57 Cb -0.08 -3.39 0.00 0.00 0.56 0.00 0.00 36.38 33.47 1nei s VAL 57 CO 0.17 0.04 0.00 0.00 -0.31 0.00 0.00 175.10 175.00 1nei s GLY 59 N -4.84 -0.30 0.00 0.00 0.00 -1.26 -5.22 107.32 95.70 1nei s GLY 59 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 44.72 45.12 1nei s GLY 59 CO 0.00 0.08 0.00 0.79 0.00 0.00 0.00 173.10 173.97