#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 0.37 0.42 3.03 0.00 -1.26 -5.13 107.32 104.75 1nei s GLY 2 Ca 0.00 -1.76 0.08 0.00 0.00 0.00 0.00 44.72 43.04 1nei s GLY 2 CO 0.00 2.63 0.41 0.54 0.00 0.00 0.00 173.10 176.69 1nei s LYS 3 N 0.36 2.59 -0.64 2.90 -0.14 -1.26 -5.08 119.74 118.48 1nei s LYS 3 Ca 0.31 -1.48 -0.09 0.00 -1.36 0.00 0.00 55.97 53.36 1nei s LYS 3 Cb 0.02 -2.45 0.17 0.00 -1.68 0.00 0.00 37.83 33.88 1nei s LYS 3 CO -0.15 -0.21 0.52 0.00 -0.76 0.00 0.00 175.35 174.76 1nei s ALA 4 N -2.45 3.69 0.19 5.17 0.00 -1.26 -5.03 121.76 122.08 1nei s ALA 4 Ca 0.49 -3.02 0.01 0.00 0.00 0.00 0.00 51.96 49.44 1nei s ALA 4 Cb -0.05 -3.03 -0.05 0.00 0.00 0.00 0.00 23.12 20.00 1nei s ALA 4 CO 0.29 -2.10 0.05 0.95 0.00 0.00 0.00 175.76 174.96 1nei s THR 5 N 0.53 0.47 0.00 0.00 -4.23 -1.26 -4.65 115.64 106.50 1nei s THR 5 Ca 0.13 -1.98 0.01 0.00 -1.18 0.00 0.00 61.69 58.67 1nei s THR 5 Cb -0.19 -2.30 -0.00 0.00 1.34 0.00 0.00 72.50 71.34 1nei s THR 5 CO -0.04 -0.28 -0.03 -0.31 -0.54 0.00 0.00 174.62 173.42 1nei s TYR 6 N -3.81 0.25 -0.33 3.99 1.51 -0.99 -4.90 117.35 113.07 1nei s TYR 6 Ca 0.30 -0.10 -0.03 0.00 -1.01 0.00 0.00 57.07 56.22 1nei s TYR 6 Cb 0.07 -0.16 0.06 0.00 -0.11 0.00 0.00 41.96 41.82 1nei s TYR 6 CO 0.07 -0.02 0.06 0.99 -1.11 0.00 0.00 175.55 175.54 1nei s THR 7 N -0.23 3.26 -0.27 -0.71 2.01 -1.26 -1.24 115.64 117.19 1nei s THR 7 Ca -0.01 -1.40 -0.08 0.00 0.31 0.00 0.00 61.69 60.51 1nei s THR 7 Cb -0.02 -2.92 -0.02 0.00 0.01 0.00 0.00 72.50 69.55 1nei s THR 7 CO -0.00 -0.21 0.10 -0.69 -0.69 0.00 0.00 174.62 173.14 1nei s VAL 8 N 1.28 4.47 -0.17 3.82 1.01 -0.91 -4.99 120.40 124.91 1nei s VAL 8 Ca -0.02 -0.23 -0.00 0.00 0.00 0.00 0.00 61.98 61.72 1nei s VAL 8 Cb -0.20 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.02 1nei s VAL 8 CO -0.00 0.24 -0.14 -0.89 0.00 0.00 0.00 175.10 174.31 1nei s THR 9 N 1.62 2.66 -0.18 3.92 2.01 -1.26 -0.52 115.64 123.90 1nei s THR 9 Ca 0.06 -0.76 0.01 0.00 0.31 0.00 0.00 61.69 61.31 1nei s THR 9 Cb -0.16 -2.14 0.02 0.00 0.01 0.00 0.00 72.50 70.23 1nei s THR 9 CO 0.05 0.50 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.59 1nei s VAL 10 N 1.07 2.06 0.02 3.82 1.01 0.37 -4.96 120.40 123.79 1nei s VAL 10 Ca -0.00 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 61.09 1nei s VAL 10 Cb -0.15 -1.86 -0.02 0.00 0.00 0.00 0.00 36.38 34.36 1nei s VAL 10 CO -0.04 0.54 -0.16 -0.89 0.00 0.00 0.00 175.10 174.55 1nei s THR 11 N 1.25 1.30 -0.25 3.92 2.01 -1.26 0.06 115.64 122.67 1nei s THR 11 Ca 0.04 -0.93 -0.12 0.00 0.31 0.00 0.00 61.69 60.99 1nei s THR 11 Cb -0.13 -1.13 -0.05 0.00 0.01 0.00 0.00 72.50 71.20 1nei s THR 11 CO -0.12 0.18 0.23 0.20 -0.69 0.00 0.00 174.62 174.42 1nei s ASN 12 N -0.88 6.14 0.22 3.53 0.01 0.38 -4.93 114.94 119.41 1nei s ASN 12 Ca 0.05 0.14 0.25 0.00 -0.71 0.00 0.00 52.86 52.59 1nei s ASN 12 Cb -0.07 -2.14 0.66 0.00 0.41 0.00 0.00 41.25 40.10 1nei s ASN 12 CO 0.01 -0.03 1.67 0.78 -1.51 0.00 0.00 177.10 178.01 1nei h ASN 13 N 7.91 0.00 0.50 -1.22 2.35 -1.93 2.59 115.58 125.78 1nei h ASN 13 Ca -0.36 -0.04 -0.30 0.00 -0.55 0.00 0.00 56.30 55.06 1nei h ASN 13 Cb 1.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.55 1nei h ASN 13 CO 0.62 0.02 -1.42 -1.28 -1.65 0.00 0.00 177.43 173.72 1nei h SER 14 N 0.00 0.45 -0.00 5.81 0.87 -1.97 -3.34 113.55 115.37 1nei h SER 14 Ca 0.00 -0.55 0.00 0.00 -1.23 0.00 0.00 61.79 60.01 1nei h SER 14 Cb 0.78 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.59 1nei h SER 14 CO 0.00 1.44 -0.41 -3.20 -0.53 0.00 0.00 176.83 174.13 1nei n ASN 15 N -3.51 0.50 -1.44 6.23 5.15 -1.21 -4.98 115.26 116.00 1nei n ASN 15 Ca -0.14 -0.75 -0.17 0.00 -0.60 0.00 0.00 54.58 52.92 1nei n ASN 15 Cb 1.04 0.95 -0.06 0.00 -0.53 0.00 0.00 39.78 41.19 1nei n ASN 15 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1nei n GLY 16 N 1.19 1.28 3.65 8.20 0.00 0.86 -4.95 105.19 115.42 1nei n GLY 16 Ca 0.02 -0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.68 5.04 0.01 1.61 1.01 -0.70 -4.80 120.40 119.89 1nei s VAL 17 Ca 0.00 1.09 0.00 0.00 0.00 0.00 0.00 61.98 63.08 1nei s VAL 17 Cb 0.00 -3.91 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 1nei s VAL 17 CO 0.00 0.12 0.07 -0.94 0.00 0.00 0.00 175.10 174.34 1nei s SER 18 N 1.24 5.56 -0.20 3.32 1.04 -1.26 0.14 113.70 123.54 1nei s SER 18 Ca 0.27 0.10 -0.08 0.00 0.48 0.00 0.00 55.95 56.71 1nei s SER 18 Cb -0.16 -1.56 0.08 0.00 0.10 0.00 0.00 66.02 64.49 1nei s SER 18 CO 0.10 0.26 0.45 -0.69 0.98 0.00 0.00 173.24 174.33 1nei s VAL 19 N -1.20 -0.42 0.04 5.02 1.01 0.11 -4.95 120.40 120.01 1nei s VAL 19 Ca 0.23 0.12 0.09 0.00 0.00 0.00 0.00 61.98 62.42 1nei s VAL 19 Cb -0.12 -0.69 -0.03 0.00 0.00 0.00 0.00 36.38 35.54 1nei s VAL 19 CO 0.14 0.05 -0.25 -1.81 0.00 0.00 0.00 175.10 173.23 1nei s ASP 20 N 2.17 3.03 -0.03 3.32 1.11 -1.26 0.14 116.67 125.15 1nei s ASP 20 Ca -0.05 -0.58 -0.01 0.00 0.18 0.00 0.00 52.55 52.09 1nei s ASP 20 Cb -0.10 -0.27 0.03 0.00 1.07 0.00 0.00 42.92 43.65 1nei s ASP 20 CO -0.14 0.24 0.06 -0.31 1.18 0.00 0.00 175.17 176.21 1nei s TYR 21 N -0.80 -0.01 -0.38 4.23 2.02 0.32 -4.99 117.35 117.75 1nei s TYR 21 Ca 0.11 0.24 -0.22 0.00 -0.37 0.00 0.00 57.07 56.83 1nei s TYR 21 Cb -0.10 -0.26 0.01 0.00 -0.40 0.00 0.00 41.96 41.22 1nei s TYR 21 CO 0.02 -0.13 0.72 -2.00 -1.57 0.00 0.00 175.55 172.59 1nei s GLU 22 N 1.35 3.65 -0.05 -0.62 2.12 -1.26 -2.14 118.70 121.75 1nei s GLU 22 Ca -0.06 0.12 -0.01 0.00 0.36 0.00 0.00 54.97 55.38 1nei s GLU 22 Cb -0.13 -3.84 0.03 0.00 0.26 0.00 0.00 34.13 30.46 1nei s GLU 22 CO -0.04 -0.86 0.02 -0.08 -0.54 0.00 0.00 175.26 173.76 1nei s THR 23 N 2.98 0.21 -0.77 -1.70 -1.32 -0.37 -5.00 115.64 109.66 1nei s THR 23 Ca 0.28 0.20 -0.21 0.00 -1.21 0.00 0.00 61.69 60.75 1nei s THR 23 Cb -0.14 -0.38 0.10 0.00 -1.51 0.00 0.00 72.50 70.57 1nei s THR 23 CO 0.17 0.22 1.02 -1.83 -2.21 0.00 0.00 174.62 171.99 1nei s GLU 24 N 1.85 3.30 -0.13 7.08 -1.05 -1.26 -2.34 118.70 126.15 1nei s GLU 24 Ca 0.02 -1.23 -0.02 0.00 -0.15 0.00 0.00 54.97 53.59 1nei s GLU 24 Cb -0.12 -4.53 0.04 0.00 -0.44 0.00 0.00 34.13 29.08 1nei s GLU 24 CO -0.04 -1.79 0.01 0.95 0.95 0.00 0.00 175.26 175.34 1nei s THR 25 N 3.46 0.54 0.00 1.83 -4.23 -1.26 -4.92 115.64 111.06 1nei s THR 25 Ca 0.26 -0.25 0.00 0.00 -1.18 0.00 0.00 61.69 60.52 1nei s THR 25 Cb -0.12 -0.84 0.00 0.00 1.34 0.00 0.00 72.50 72.88 1nei s THR 25 CO 0.02 0.06 0.00 -0.81 -0.54 0.00 0.00 174.62 173.35 1nei n PRO 26 N 5.07 0.00 0.14 3.99 -0.04 -1.26 -4.15 135.00 138.75 1nei n PRO 26 Ca -0.09 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.38 1nei n PRO 26 Cb 0.49 -0.13 0.16 0.00 -0.04 0.00 0.00 33.50 33.97 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 -0.11 0.54 2.86 -2.02 -3.05 114.93 113.14 1nei h MET 27 Ca 0.00 0.00 0.03 0.00 -2.06 0.00 0.00 59.70 57.67 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 0.57 0.41 1.15 1.06 0.00 0.00 176.91 180.11 1nei h THR 28 N 0.00 0.09 -0.82 2.22 2.02 -1.94 0.46 112.91 114.94 1nei h THR 28 Ca -0.01 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 1nei h THR 28 Cb 1.19 0.61 -0.04 0.00 -1.74 0.00 0.00 68.15 68.18 1nei h THR 28 CO 0.07 0.00 0.36 -0.07 0.37 0.00 0.00 175.52 176.25 1nei h LEU 29 N 0.00 1.10 -0.66 2.58 3.38 -1.69 -1.47 115.31 118.55 1nei h LEU 29 Ca 0.05 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.78 1nei h LEU 29 Cb 0.88 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1nei h LEU 29 CO -0.00 0.95 -0.41 -0.07 0.09 0.00 0.00 178.44 179.01 1nei h LEU 30 N 1.18 0.00 -9.77 1.67 3.38 -0.31 -3.41 115.31 108.06 1nei h LEU 30 Ca 0.28 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.72 1nei h LEU 30 Cb 0.17 0.00 0.07 0.00 0.09 0.00 0.00 40.66 40.99 1nei h LEU 30 CO -0.03 0.41 0.88 -0.69 0.09 0.00 0.00 178.44 179.10 1nei s VAL 31 N -3.40 2.19 0.04 1.22 1.01 -0.55 -4.91 120.40 116.01 1nei s VAL 31 Ca 0.01 0.16 -0.17 0.00 0.00 0.00 0.00 61.98 61.98 1nei s VAL 31 Cb 0.10 -3.10 -0.21 0.00 0.00 0.00 0.00 36.38 33.16 1nei s VAL 31 CO 0.70 0.02 1.18 1.55 0.00 0.00 0.00 175.10 178.55 1nei h PRO 32 N 5.21 0.56 -0.79 2.72 0.13 -1.86 0.26 132.00 138.22 1nei h PRO 32 Ca -0.46 -0.55 0.03 0.00 -0.87 0.00 0.00 66.00 64.16 1nei h PRO 32 Cb 1.22 0.14 -0.04 0.00 0.13 0.00 0.00 31.00 32.44 1nei h PRO 32 CO 0.82 1.17 0.52 0.93 -0.23 0.00 0.00 178.00 181.21 1nei h GLU 33 N 0.15 0.94 0.10 0.86 5.08 -1.92 2.17 114.58 121.98 1nei h GLU 33 Ca -0.08 -0.06 -0.16 0.00 -1.00 0.00 0.00 59.36 58.07 1nei h GLU 33 Cb 1.39 -0.21 0.01 0.00 0.50 0.00 0.00 28.75 30.44 1nei h GLU 33 CO 0.14 0.62 -0.73 0.28 -1.00 0.00 0.00 179.01 178.33 1nei h VAL 34 N 0.97 1.49 -0.15 3.13 2.07 -1.79 -2.39 116.25 119.59 1nei h VAL 34 Ca 0.32 -2.47 -0.00 0.00 0.82 0.00 0.00 66.70 65.36 1nei h VAL 34 Cb 0.05 3.15 -0.01 0.00 -1.52 0.00 0.00 31.29 32.96 1nei h VAL 34 CO -0.09 0.68 0.08 0.00 0.02 0.00 0.00 177.57 178.26 1nei h ALA 35 N 0.03 0.19 -0.21 1.67 0.00 -0.10 0.49 119.26 121.33 1nei h ALA 35 Ca -0.14 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.73 1nei h ALA 35 Cb 1.51 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.21 1nei h ALA 35 CO 0.09 -0.26 0.05 0.00 0.00 0.00 0.00 179.25 179.13 1nei h ALA 36 N 0.97 0.22 -0.46 0.00 0.00 0.35 0.76 119.26 121.08 1nei h ALA 36 Ca 0.05 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1nei h ALA 36 Cb 0.09 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1nei h ALA 36 CO -0.01 -0.38 0.18 1.49 0.00 0.00 0.00 179.25 180.54 1nei h GLU 37 N 0.14 0.66 0.20 0.00 4.22 -1.14 0.45 114.58 119.12 1nei h GLU 37 Ca 0.09 -0.09 -0.01 0.00 0.08 0.00 0.00 59.36 59.43 1nei h GLU 37 Cb 0.08 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1nei h GLU 37 CO -0.12 0.55 -0.10 0.28 -2.18 0.00 0.00 179.01 177.45 1nei h VAL 38 N 0.66 0.87 -0.07 0.32 2.07 0.11 0.92 116.25 121.13 1nei h VAL 38 Ca 0.16 -0.85 0.02 0.00 0.82 0.00 0.00 66.70 66.85 1nei h VAL 38 Cb 0.14 1.33 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 1nei h VAL 38 CO -0.02 0.18 -0.06 0.40 0.02 0.00 0.00 177.57 178.09 1nei h ILE 39 N -0.73 0.82 -0.66 4.57 1.08 0.73 0.63 117.51 123.95 1nei h ILE 39 Ca -0.03 0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 64.39 1nei h ILE 39 Cb 0.50 0.82 -0.03 0.00 -3.07 0.00 0.00 36.82 35.04 1nei h ILE 39 CO 0.05 0.00 0.19 0.50 -0.69 0.00 0.00 178.15 178.20 1nei h LYS 40 N -0.08 1.01 -0.50 2.37 3.11 -0.13 0.54 116.57 122.90 1nei h LYS 40 Ca 0.05 -0.21 -0.01 0.00 -2.81 0.00 0.00 60.65 57.67 1nei h LYS 40 Cb 0.15 -0.15 -0.02 0.00 -1.00 0.00 0.00 32.23 31.20 1nei h LYS 40 CO -0.12 0.87 0.27 0.22 -2.81 0.00 0.00 179.45 177.89 1nei h ASP 41 N 0.97 0.63 0.02 4.20 3.58 0.18 1.75 116.42 127.75 1nei h ASP 41 Ca 0.21 -0.09 -0.00 0.00 0.42 0.00 0.00 57.03 57.57 1nei h ASP 41 Cb 0.30 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.19 1nei h ASP 41 CO -0.01 0.54 -0.01 -0.07 -2.88 0.00 0.00 179.24 176.81 1nei h LEU 42 N 0.67 -0.03 -0.41 2.28 3.38 0.72 0.74 115.31 122.67 1nei h LEU 42 Ca 0.18 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1nei h LEU 42 Cb 0.05 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1nei h LEU 42 CO -0.03 0.14 0.17 0.58 0.09 0.00 0.00 178.44 179.38 1nei h VAL 43 N -0.19 1.20 -0.97 1.22 2.07 -0.63 0.33 116.25 119.26 1nei h VAL 43 Ca -0.00 -0.60 0.11 0.00 0.82 0.00 0.00 66.70 67.03 1nei h VAL 43 Cb 0.18 0.83 -0.08 0.00 -1.52 0.00 0.00 31.29 30.70 1nei h VAL 43 CO 0.01 0.22 0.62 0.78 0.02 0.00 0.00 177.57 179.21 1nei h ASN 44 N 0.51 0.90 0.19 0.57 -0.26 0.28 0.32 115.58 118.10 1nei h ASN 44 Ca 0.14 0.04 -0.22 0.00 -0.56 0.00 0.00 56.30 55.70 1nei h ASN 44 Cb 0.18 -0.15 0.00 0.00 -1.06 0.00 0.00 38.32 37.30 1nei h ASN 44 CO -0.01 0.50 -0.86 0.74 -1.06 0.00 0.00 177.43 176.73 1nei h THR 45 N 0.98 1.36 -0.50 2.81 2.02 -0.22 -0.53 112.91 118.82 1nei h THR 45 Ca 0.47 -2.25 -0.01 0.00 0.77 0.00 0.00 66.41 65.38 1nei h THR 45 Cb 0.45 2.25 -0.02 0.00 -1.74 0.00 0.00 68.15 69.09 1nei h THR 45 CO -0.23 0.68 0.26 0.58 0.37 0.00 0.00 175.52 177.18 1nei h VAL 46 N 0.32 1.18 -0.00 3.16 2.07 0.14 -2.20 116.25 120.91 1nei h VAL 46 Ca -0.07 -0.50 -0.14 0.00 0.82 0.00 0.00 66.70 66.82 1nei h VAL 46 Cb 1.48 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.82 1nei h VAL 46 CO 0.16 0.20 -0.67 0.03 0.02 0.00 0.00 177.57 177.30 1nei h ARG 47 N 0.67 0.02 -0.92 1.57 3.08 -0.45 -3.05 114.38 115.30 1nei h ARG 47 Ca 0.18 -0.02 0.13 0.00 0.07 0.00 0.00 59.98 60.34 1nei h ARG 47 Cb 0.08 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.06 1nei h ARG 47 CO -0.03 0.69 0.59 0.77 -1.07 0.00 0.00 179.97 180.92 1nei h SER 48 N 0.01 0.73 0.79 7.04 0.02 -0.47 0.37 113.55 122.05 1nei h SER 48 Ca -0.01 0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 60.92 1nei h SER 48 Cb 1.19 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.62 1nei h SER 48 CO 0.09 0.38 -0.31 0.22 -1.14 0.00 0.00 176.83 176.07 1nei h TYR 49 N 0.78 0.00 -0.06 3.45 3.20 -1.38 -2.69 116.97 120.27 1nei h TYR 49 Ca 0.46 0.00 -0.15 0.00 3.14 0.00 0.00 58.73 62.18 1nei h TYR 49 Cb 0.64 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.90 1nei h TYR 49 CO -0.00 0.31 -0.64 0.22 -1.64 0.00 0.00 178.16 176.40 1nei h ASP 50 N 0.00 0.26 -3.26 -2.11 3.58 -0.34 -3.44 116.42 111.12 1nei h ASP 50 Ca -0.00 -0.16 -0.57 0.00 0.42 0.00 0.00 57.03 56.72 1nei h ASP 50 Cb 0.79 -0.08 -0.04 0.00 1.72 0.00 0.00 39.33 41.72 1nei h ASP 50 CO 0.04 0.84 -0.20 0.42 -2.88 0.00 0.00 179.24 177.45 1nei s THR 51 N -3.67 5.04 0.52 2.25 -4.23 -0.66 -4.86 115.64 110.02 1nei s THR 51 Ca -0.04 0.37 0.18 0.00 -1.18 0.00 0.00 61.69 61.02 1nei s THR 51 Cb 0.12 -3.64 0.27 0.00 1.34 0.00 0.00 72.50 70.59 1nei s THR 51 CO 0.80 0.09 2.14 1.05 -0.54 0.00 0.00 174.62 178.16 1nei h GLU 52 N 3.04 0.00 -5.75 3.99 4.11 -1.81 -3.40 114.58 114.76 1nei h GLU 52 Ca -0.47 0.00 -0.67 0.00 0.07 0.00 0.00 59.36 58.28 1nei h GLU 52 Cb 1.18 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 30.16 1nei h GLU 52 CO 0.69 0.03 -0.79 -0.80 0.07 0.00 0.00 179.01 178.22 1nei s ASN 53 N -6.93 3.86 0.21 3.06 -0.87 -1.26 -5.09 114.94 107.92 1nei s ASN 53 Ca -0.05 -0.31 0.05 0.00 -1.57 0.00 0.00 52.86 50.97 1nei s ASN 53 Cb 0.16 -1.24 -0.03 0.00 -0.02 0.00 0.00 41.25 40.12 1nei s ASN 53 CO 0.66 0.24 0.30 -1.83 -2.57 0.00 0.00 177.10 173.90 1nei s GLU 54 N -0.09 3.34 0.00 -0.60 -1.05 -1.26 -4.65 118.70 114.39 1nei s GLU 54 Ca -0.03 -0.76 0.00 0.00 -0.15 0.00 0.00 54.97 54.03 1nei s GLU 54 Cb -0.14 -2.85 0.00 0.00 -0.44 0.00 0.00 34.13 30.70 1nei s GLU 54 CO 0.04 0.46 0.00 1.58 0.95 0.00 0.00 175.26 178.28 1nei n HIS 55 N -1.07 0.00 -2.80 4.83 -0.00 -1.26 -4.90 115.22 110.02 1nei n HIS 55 Ca -0.08 0.00 -0.32 0.00 0.46 0.00 0.00 57.72 57.78 1nei n HIS 55 Cb 0.56 0.00 -0.05 0.00 -0.12 0.00 0.00 29.99 30.38 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 -0.93 6.69 -0.26 0.26 -4.77 -1.26 -5.04 116.67 111.36 1nei s ASP 56 Ca 0.00 1.39 -0.16 0.00 -3.30 0.00 0.00 52.55 50.48 1nei s ASP 56 Cb 0.00 -2.43 -0.03 0.00 -1.09 0.00 0.00 42.92 39.37 1nei s ASP 56 CO 0.00 -0.39 0.44 0.54 0.70 0.00 0.00 175.17 176.46 1nei s VAL 57 N -2.30 5.13 0.00 2.11 0.11 -1.26 -4.85 120.40 119.33 1nei s VAL 57 Ca 0.56 0.72 0.00 0.00 -2.93 0.00 0.00 61.98 60.33 1nei s VAL 57 Cb -0.10 -3.76 0.00 0.00 -1.53 0.00 0.00 36.38 30.99 1nei s VAL 57 CO 0.24 0.13 0.00 0.00 -3.33 0.00 0.00 175.10 172.15 1nei n GLY 59 N -0.02 1.05 3.88 0.00 0.00 -1.26 -4.47 105.19 104.37 1nei n GLY 59 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1nei n GLY 59 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11