#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 2.95 0.40 -5.12 0.00 -1.26 -5.08 107.32 99.22 1nei s GLY 2 Ca 0.00 -3.85 0.08 0.00 0.00 0.00 0.00 44.72 40.94 1nei s GLY 2 CO 0.00 1.08 0.44 0.54 0.00 0.00 0.00 173.10 175.16 1nei s LYS 3 N -1.47 2.69 -0.62 2.90 3.01 -1.26 -5.08 119.74 119.91 1nei s LYS 3 Ca 0.25 -1.38 -0.08 0.00 -1.01 0.00 0.00 55.97 53.75 1nei s LYS 3 Cb -0.04 -2.54 0.16 0.00 -1.01 0.00 0.00 37.83 34.39 1nei s LYS 3 CO -0.17 -0.18 0.49 0.00 0.51 0.00 0.00 175.35 176.01 1nei s ALA 4 N -2.40 3.64 0.05 5.17 0.00 -1.26 -5.03 121.76 121.93 1nei s ALA 4 Ca 0.50 -3.01 -0.03 0.00 0.00 0.00 0.00 51.96 49.41 1nei s ALA 4 Cb -0.06 -2.94 -0.02 0.00 0.00 0.00 0.00 23.12 20.09 1nei s ALA 4 CO 0.30 -2.08 0.04 0.95 0.00 0.00 0.00 175.76 174.97 1nei s THR 5 N 0.51 0.18 -0.02 0.00 -4.23 -1.26 -4.76 115.64 106.06 1nei s THR 5 Ca 0.13 -1.45 0.03 0.00 -1.18 0.00 0.00 61.69 59.22 1nei s THR 5 Cb -0.20 -1.22 -0.00 0.00 1.34 0.00 0.00 72.50 72.42 1nei s THR 5 CO -0.04 -0.80 -0.10 -0.31 -0.54 0.00 0.00 174.62 172.83 1nei s TYR 6 N -3.37 0.93 -0.26 3.99 1.51 -1.00 -4.91 117.35 114.24 1nei s TYR 6 Ca 0.02 -0.20 -0.04 0.00 -1.01 0.00 0.00 57.07 55.84 1nei s TYR 6 Cb 0.04 -0.62 0.01 0.00 -0.11 0.00 0.00 41.96 41.27 1nei s TYR 6 CO -0.08 -0.05 0.00 0.99 -1.11 0.00 0.00 175.55 175.30 1nei s THR 7 N -0.06 3.42 -0.13 -0.71 2.01 -1.26 0.17 115.64 119.08 1nei s THR 7 Ca 0.01 -0.78 -0.03 0.00 0.31 0.00 0.00 61.69 61.20 1nei s THR 7 Cb -0.06 -2.71 -0.03 0.00 0.01 0.00 0.00 72.50 69.71 1nei s THR 7 CO -0.00 0.19 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.40 1nei s VAL 8 N 1.43 3.95 -0.05 3.82 1.01 -0.38 -4.96 120.40 125.21 1nei s VAL 8 Ca 0.02 -0.35 0.03 0.00 0.00 0.00 0.00 61.98 61.68 1nei s VAL 8 Cb -0.16 -2.70 0.00 0.00 0.00 0.00 0.00 36.38 33.52 1nei s VAL 8 CO -0.01 0.53 -0.15 -0.89 0.00 0.00 0.00 175.10 174.57 1nei s THR 9 N -0.01 1.30 -0.12 3.92 2.01 -1.26 0.32 115.64 121.80 1nei s THR 9 Ca 0.01 -0.61 0.01 0.00 0.31 0.00 0.00 61.69 61.41 1nei s THR 9 Cb -0.13 -1.15 0.02 0.00 0.01 0.00 0.00 72.50 71.25 1nei s THR 9 CO 0.03 0.38 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.51 1nei s VAL 10 N 0.33 1.43 -0.01 3.82 1.01 0.52 -4.95 120.40 122.55 1nei s VAL 10 Ca -0.09 -0.59 0.06 0.00 0.00 0.00 0.00 61.98 61.36 1nei s VAL 10 Cb -0.13 -1.33 -0.01 0.00 0.00 0.00 0.00 36.38 34.90 1nei s VAL 10 CO 0.03 0.43 -0.18 -0.89 0.00 0.00 0.00 175.10 174.49 1nei s THR 11 N 1.17 1.42 -0.54 3.92 2.01 -1.26 0.04 115.64 122.40 1nei s THR 11 Ca -0.03 -0.79 -0.14 0.00 0.31 0.00 0.00 61.69 61.04 1nei s THR 11 Cb -0.14 -1.18 0.13 0.00 0.01 0.00 0.00 72.50 71.32 1nei s THR 11 CO -0.04 0.38 0.47 0.54 -0.69 0.00 0.00 174.62 175.28 1nei s ASN 12 N -0.46 6.08 0.37 3.53 2.20 0.17 -4.89 114.94 121.94 1nei s ASN 12 Ca 0.07 -1.87 0.23 0.00 -0.94 0.00 0.00 52.86 50.35 1nei s ASN 12 Cb -0.07 -2.16 1.26 0.00 -2.00 0.00 0.00 41.25 38.29 1nei s ASN 12 CO -0.01 -0.80 1.70 0.78 -2.94 0.00 0.00 177.10 175.83 1nei h ASN 13 N 8.71 0.00 0.06 3.54 2.35 -1.92 2.42 115.58 130.74 1nei h ASN 13 Ca -0.26 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.33 1nei h ASN 13 Cb 1.09 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.45 1nei h ASN 13 CO 0.98 0.00 -0.56 -1.28 -1.65 0.00 0.00 177.43 174.92 1nei h SER 14 N 0.00 0.59 0.00 5.81 0.87 -1.94 -3.25 113.55 115.63 1nei h SER 14 Ca 0.00 -0.32 0.00 0.00 -1.23 0.00 0.00 61.79 60.24 1nei h SER 14 Cb 0.10 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 61.89 1nei h SER 14 CO 0.00 1.03 -0.44 -3.20 -0.53 0.00 0.00 176.83 173.69 1nei n ASN 15 N -3.95 0.54 -0.08 6.23 5.15 0.61 -4.98 115.26 118.79 1nei n ASN 15 Ca -0.03 -0.65 -0.01 0.00 -0.60 0.00 0.00 54.58 53.29 1nei n ASN 15 Cb 0.61 1.02 -0.00 0.00 -0.53 0.00 0.00 39.78 40.88 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 1.24 0.39 3.83 8.20 0.00 0.78 -4.99 105.19 114.65 1nei n GLY 16 Ca 0.01 -0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.69 4.74 0.27 1.61 1.01 -1.07 -4.87 120.40 120.40 1nei s VAL 17 Ca 0.00 0.99 0.11 0.00 0.00 0.00 0.00 61.98 63.09 1nei s VAL 17 Cb 0.00 -3.77 -0.05 0.00 0.00 0.00 0.00 36.38 32.56 1nei s VAL 17 CO 0.00 0.19 -0.19 -0.55 0.00 0.00 0.00 175.10 174.55 1nei s SER 18 N -1.75 3.47 -0.21 3.32 0.15 -1.26 0.44 113.70 117.85 1nei s SER 18 Ca 0.41 -1.03 -0.09 0.00 0.70 0.00 0.00 55.95 55.94 1nei s SER 18 Cb -0.15 -0.28 0.08 0.00 -1.71 0.00 0.00 66.02 63.96 1nei s SER 18 CO 0.20 0.01 0.48 -0.69 1.20 0.00 0.00 173.24 174.44 1nei s VAL 19 N -2.57 -0.41 -0.02 4.45 1.01 0.11 -4.92 120.40 118.05 1nei s VAL 19 Ca 0.29 0.10 0.08 0.00 0.00 0.00 0.00 61.98 62.45 1nei s VAL 19 Cb -0.04 -0.73 -0.02 0.00 0.00 0.00 0.00 36.38 35.58 1nei s VAL 19 CO 0.14 0.04 -0.25 -1.81 0.00 0.00 0.00 175.10 173.23 1nei s ASP 20 N 2.13 3.17 -0.04 3.32 1.01 -1.26 0.20 116.67 125.20 1nei s ASP 20 Ca -0.06 -0.45 -0.01 0.00 0.71 0.00 0.00 52.55 52.74 1nei s ASP 20 Cb -0.10 -0.39 0.03 0.00 1.01 0.00 0.00 42.92 43.47 1nei s ASP 20 CO -0.14 0.32 0.07 -0.31 0.21 0.00 0.00 175.17 175.31 1nei s TYR 21 N -0.64 -0.02 -0.39 4.23 1.51 0.15 -4.98 117.35 117.20 1nei s TYR 21 Ca 0.10 0.25 -0.24 0.00 -1.01 0.00 0.00 57.07 56.18 1nei s TYR 21 Cb -0.10 -0.23 0.02 0.00 -0.11 0.00 0.00 41.96 41.54 1nei s TYR 21 CO -0.01 -0.13 0.81 -2.00 -1.11 0.00 0.00 175.55 173.12 1nei s GLU 22 N 1.28 3.66 -0.09 -0.62 2.12 -1.26 -1.24 118.70 122.54 1nei s GLU 22 Ca -0.07 0.22 -0.02 0.00 0.36 0.00 0.00 54.97 55.46 1nei s GLU 22 Cb -0.12 -3.85 0.04 0.00 0.26 0.00 0.00 34.13 30.45 1nei s GLU 22 CO -0.04 -0.96 0.04 -0.08 -0.54 0.00 0.00 175.26 173.68 1nei s THR 23 N 3.24 0.15 -0.74 -1.70 -1.32 0.13 -5.00 115.64 110.40 1nei s THR 23 Ca 0.32 0.11 -0.21 0.00 -1.21 0.00 0.00 61.69 60.70 1nei s THR 23 Cb -0.12 -0.46 0.10 0.00 -1.51 0.00 0.00 72.50 70.50 1nei s THR 23 CO 0.19 0.10 0.99 -1.83 -2.21 0.00 0.00 174.62 171.86 1nei s GLU 24 N 2.05 3.27 -0.14 7.08 -1.05 -1.26 -2.36 118.70 126.30 1nei s GLU 24 Ca 0.04 -1.21 -0.01 0.00 -0.15 0.00 0.00 54.97 53.64 1nei s GLU 24 Cb -0.13 -4.47 0.04 0.00 -0.44 0.00 0.00 34.13 29.12 1nei s GLU 24 CO -0.05 -1.77 -0.03 0.95 0.95 0.00 0.00 175.26 175.31 1nei s THR 25 N 3.43 0.81 0.00 1.83 -4.23 -1.26 -4.88 115.64 111.34 1nei s THR 25 Ca 0.24 -0.37 0.00 0.00 -1.18 0.00 0.00 61.69 60.38 1nei s THR 25 Cb -0.14 -1.01 0.00 0.00 1.34 0.00 0.00 72.50 72.69 1nei s THR 25 CO 0.03 0.14 0.02 -0.81 -0.54 0.00 0.00 174.62 173.46 1nei n PRO 26 N 4.99 0.00 0.13 3.99 -0.04 -1.26 -4.04 135.00 138.77 1nei n PRO 26 Ca -0.10 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.35 1nei n PRO 26 Cb 0.49 -0.21 0.14 0.00 -0.04 0.00 0.00 33.50 33.88 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 -3.05 114.93 112.49 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 0.63 0.61 1.79 1.06 0.00 0.00 176.91 181.01 1nei h THR 28 N 0.00 0.48 -0.66 2.22 1.35 -1.93 0.68 112.91 115.05 1nei h THR 28 Ca -0.01 0.00 0.06 0.00 -0.55 0.00 0.00 66.41 65.91 1nei h THR 28 Cb 1.19 0.55 -0.04 0.00 -1.73 0.00 0.00 68.15 68.13 1nei h THR 28 CO 0.08 0.00 0.43 -0.07 -0.25 0.00 0.00 175.52 175.72 1nei h LEU 29 N 0.00 0.59 0.00 3.87 3.38 -1.67 0.13 115.31 121.62 1nei h LEU 29 Ca 0.36 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.26 1nei h LEU 29 Cb 1.59 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 42.20 1nei h LEU 29 CO -0.00 0.39 -0.60 -0.07 0.09 0.00 0.00 178.44 178.25 1nei h LEU 30 N 0.68 0.00 -9.75 1.67 3.38 0.14 -3.43 115.31 108.00 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 0.24 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.05 1nei h LEU 30 CO -0.09 0.34 0.79 -0.69 0.09 0.00 0.00 178.44 178.88 1nei s VAL 31 N -3.06 2.54 0.03 1.22 1.01 0.47 -4.92 120.40 117.69 1nei s VAL 31 Ca 0.03 0.45 -0.18 0.00 0.00 0.00 0.00 61.98 62.28 1nei s VAL 31 Cb 0.07 -3.29 -0.21 0.00 0.00 0.00 0.00 36.38 32.95 1nei s VAL 31 CO 0.74 0.07 1.16 1.55 0.00 0.00 0.00 175.10 178.63 1nei h PRO 32 N 5.08 0.49 -0.76 2.72 0.13 -1.88 0.29 132.00 138.07 1nei h PRO 32 Ca -0.46 -0.47 0.04 0.00 -0.87 0.00 0.00 66.00 64.23 1nei h PRO 32 Cb 1.22 0.12 -0.04 0.00 0.13 0.00 0.00 31.00 32.42 1nei h PRO 32 CO 0.79 1.11 0.50 0.93 -0.23 0.00 0.00 178.00 181.10 1nei h GLU 33 N 0.05 0.89 0.12 0.86 5.08 -1.91 2.03 114.58 121.70 1nei h GLU 33 Ca -0.06 -0.05 -0.19 0.00 -1.00 0.00 0.00 59.36 58.05 1nei h GLU 33 Cb 1.29 -0.20 0.01 0.00 0.50 0.00 0.00 28.75 30.36 1nei h GLU 33 CO 0.12 0.59 -0.86 0.28 -1.00 0.00 0.00 179.01 178.14 1nei h VAL 34 N 0.92 1.44 -0.30 3.13 2.07 -1.79 -2.37 116.25 119.35 1nei h VAL 34 Ca 0.30 -2.50 -0.01 0.00 0.82 0.00 0.00 66.70 65.32 1nei h VAL 34 Cb 0.06 3.12 -0.01 0.00 -1.52 0.00 0.00 31.29 32.94 1nei h VAL 34 CO -0.09 0.70 0.14 0.00 0.02 0.00 0.00 177.57 178.35 1nei h ALA 35 N 0.04 0.39 -0.17 1.67 0.00 -0.00 0.44 119.26 121.62 1nei h ALA 35 Ca -0.16 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.66 1nei h ALA 35 Cb 1.61 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 1nei h ALA 35 CO 0.12 -0.05 0.10 0.00 0.00 0.00 0.00 179.25 179.41 1nei h ALA 36 N 1.00 0.21 -0.37 0.00 0.00 0.31 0.60 119.26 121.02 1nei h ALA 36 Ca 0.10 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1nei h ALA 36 Cb 0.12 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1nei h ALA 36 CO -0.01 -0.32 0.11 0.93 0.00 0.00 0.00 179.25 179.95 1nei h GLU 37 N 0.21 0.53 0.11 0.00 5.08 -1.14 0.55 114.58 119.91 1nei h GLU 37 Ca 0.07 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1nei h GLU 37 Cb -0.01 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.15 1nei h GLU 37 CO -0.03 0.47 -0.05 0.28 -1.00 0.00 0.00 179.01 178.68 1nei h VAL 38 N 0.52 1.10 -0.63 3.13 2.07 0.78 1.61 116.25 124.83 1nei h VAL 38 Ca 0.13 -1.04 0.01 0.00 0.82 0.00 0.00 66.70 66.61 1nei h VAL 38 Cb 0.17 1.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.64 1nei h VAL 38 CO -0.01 0.24 0.42 0.40 0.02 0.00 0.00 177.57 178.64 1nei h ILE 39 N -0.65 1.16 -0.23 4.57 1.08 0.45 0.49 117.51 124.38 1nei h ILE 39 Ca -0.02 -0.29 -0.13 0.00 -0.39 0.00 0.00 64.86 64.04 1nei h ILE 39 Cb 0.51 0.23 -0.00 0.00 -3.07 0.00 0.00 36.82 34.49 1nei h ILE 39 CO 0.02 0.16 -0.35 0.50 -0.69 0.00 0.00 178.15 177.79 1nei h LYS 40 N 0.85 0.63 -0.59 2.37 3.11 0.09 -1.06 116.57 121.97 1nei h LYS 40 Ca 0.23 -0.38 0.04 0.00 -2.81 0.00 0.00 60.65 57.73 1nei h LYS 40 Cb -0.09 0.04 -0.04 0.00 -1.00 0.00 0.00 32.23 31.13 1nei h LYS 40 CO -0.05 0.99 0.34 0.22 -2.81 0.00 0.00 179.45 178.14 1nei h ASP 41 N 0.33 0.52 0.09 4.20 3.58 0.29 2.07 116.42 127.50 1nei h ASP 41 Ca 0.02 0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.48 1nei h ASP 41 Cb 0.94 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.90 1nei h ASP 41 CO 0.08 0.35 -0.04 -0.07 -2.88 0.00 0.00 179.24 176.68 1nei h LEU 42 N 0.65 -0.10 -0.31 2.28 3.38 0.05 0.15 115.31 121.41 1nei h LEU 42 Ca 0.25 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1nei h LEU 42 Cb 0.10 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1nei h LEU 42 CO -0.14 0.06 0.16 0.58 0.09 0.00 0.00 178.44 179.19 1nei h VAL 43 N -0.26 1.14 -0.73 1.22 2.07 -0.64 0.21 116.25 119.26 1nei h VAL 43 Ca -0.01 -0.40 0.10 0.00 0.82 0.00 0.00 66.70 67.21 1nei h VAL 43 Cb 0.22 0.84 -0.05 0.00 -1.52 0.00 0.00 31.29 30.78 1nei h VAL 43 CO 0.02 0.15 0.48 0.78 0.02 0.00 0.00 177.57 179.02 1nei h ASN 44 N 0.37 0.56 -0.12 0.57 2.35 0.35 0.28 115.58 119.95 1nei h ASN 44 Ca 0.11 0.01 -0.15 0.00 -0.55 0.00 0.00 56.30 55.72 1nei h ASN 44 Cb 0.09 -0.10 0.01 0.00 0.05 0.00 0.00 38.32 38.37 1nei h ASN 44 CO -0.02 0.33 -0.51 0.74 -1.65 0.00 0.00 177.43 176.33 1nei h THR 45 N 0.62 1.36 -0.78 2.81 2.02 0.19 0.19 112.91 119.31 1nei h THR 45 Ca 0.34 -1.81 0.00 0.00 0.77 0.00 0.00 66.41 65.71 1nei h THR 45 Cb 0.49 2.15 -0.04 0.00 -1.74 0.00 0.00 68.15 69.01 1nei h THR 45 CO -0.12 0.55 0.51 0.58 0.37 0.00 0.00 175.52 177.40 1nei h VAL 46 N 0.16 1.21 -0.00 3.16 2.07 0.73 -1.52 116.25 122.06 1nei h VAL 46 Ca -0.03 -0.40 -0.13 0.00 0.82 0.00 0.00 66.70 66.96 1nei h VAL 46 Cb 1.15 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 1nei h VAL 46 CO 0.11 0.20 -0.64 0.03 0.02 0.00 0.00 177.57 177.29 1nei h ARG 47 N 1.06 0.01 -0.75 1.57 3.08 -0.49 -2.97 114.38 115.90 1nei h ARG 47 Ca 0.28 -0.01 0.14 0.00 0.07 0.00 0.00 59.98 60.47 1nei h ARG 47 Cb -0.10 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 29.90 1nei h ARG 47 CO -0.06 0.64 0.50 1.03 -1.07 0.00 0.00 179.97 181.02 1nei h SER 48 N 0.01 0.41 -0.01 7.04 0.87 0.11 0.34 113.55 122.33 1nei h SER 48 Ca -0.01 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1nei h SER 48 Cb 1.13 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 63.03 1nei h SER 48 CO 0.08 0.22 0.01 0.22 -0.53 0.00 0.00 176.83 176.83 1nei h TYR 49 N 0.44 0.00 -1.59 2.24 3.20 -1.34 -3.34 116.97 116.59 1nei h TYR 49 Ca 0.37 0.00 -0.30 0.00 3.14 0.00 0.00 58.73 61.94 1nei h TYR 49 Cb 0.81 0.00 -0.26 0.00 1.54 0.00 0.00 36.73 38.82 1nei h TYR 49 CO -0.00 0.00 -0.65 -0.51 -1.64 0.00 0.00 178.16 175.36 1nei s ASP 50 N -6.83 -0.01 0.43 -2.11 1.01 0.11 -5.14 116.67 104.13 1nei s ASP 50 Ca -0.05 -1.80 0.06 0.00 0.71 0.00 0.00 52.55 51.47 1nei s ASP 50 Cb 0.17 0.99 -0.06 0.00 1.01 0.00 0.00 42.92 45.03 1nei s ASP 50 CO 0.64 -0.16 0.06 0.28 0.21 0.00 0.00 175.17 176.20 1nei s THR 51 N 1.05 1.93 0.05 -1.27 -1.32 -0.75 -4.84 115.64 110.49 1nei s THR 51 Ca 0.24 -1.92 -0.20 0.00 -1.21 0.00 0.00 61.69 58.60 1nei s THR 51 Cb -0.05 -2.85 -0.10 0.00 -1.51 0.00 0.00 72.50 67.99 1nei s THR 51 CO -0.07 0.00 1.31 -0.33 -2.21 0.00 0.00 174.62 173.32 1nei h GLU 52 N 1.60 -0.57 -6.37 7.08 5.08 -1.89 -3.43 114.58 116.07 1nei h GLU 52 Ca -0.44 0.04 -0.61 0.00 -1.00 0.00 0.00 59.36 57.35 1nei h GLU 52 Cb 1.26 0.13 -0.12 0.00 0.50 0.00 0.00 28.75 30.51 1nei h GLU 52 CO 0.77 -0.38 -0.68 0.54 -1.00 0.00 0.00 179.01 178.26 1nei s ASN 53 N -3.38 4.62 -0.82 1.42 4.22 -1.26 -5.07 114.94 114.67 1nei s ASN 53 Ca -0.10 -0.44 0.02 0.00 -2.14 0.00 0.00 52.86 50.20 1nei s ASN 53 Cb 0.02 -0.93 0.26 0.00 1.28 0.00 0.00 41.25 41.88 1nei s ASN 53 CO 0.33 0.10 0.96 -0.62 -2.04 0.00 0.00 177.10 175.84 1nei n GLU 54 N -0.02 3.11 0.00 3.55 4.71 -1.26 -4.69 120.64 126.03 1nei n GLU 54 Ca -0.10 -4.60 0.00 0.00 -0.01 0.00 0.00 57.16 52.45 1nei n GLU 54 Cb 0.55 -2.36 0.00 0.00 -1.01 0.00 0.00 31.44 28.62 1nei n GLU 54 CO 0.00 0.00 0.00 1.58 0.09 0.00 0.00 177.13 178.80 1nei n HIS 55 N 1.26 -2.15 -4.97 -0.32 -0.00 -1.26 -5.13 115.22 102.65 1nei n HIS 55 Ca 0.27 0.00 -0.32 0.00 0.46 0.00 0.00 57.72 58.13 1nei n HIS 55 Cb 0.38 0.43 -0.14 0.00 -0.12 0.00 0.00 29.99 30.54 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 -0.78 3.69 0.09 0.26 -4.77 -1.26 -5.08 116.67 108.82 1nei s ASP 56 Ca 0.00 -0.32 -0.31 0.00 -3.30 0.00 0.00 52.55 48.62 1nei s ASP 56 Cb 0.00 -0.65 -0.09 0.00 -1.09 0.00 0.00 42.92 41.09 1nei s ASP 56 CO 0.00 0.32 1.67 0.68 0.70 0.00 0.00 175.17 178.54 1nei s VAL 57 N -0.74 2.88 -0.23 2.11 -7.23 -1.26 -4.83 120.40 111.10 1nei s VAL 57 Ca 0.12 0.40 -0.19 0.00 -1.81 0.00 0.00 61.98 60.50 1nei s VAL 57 Cb -0.10 -3.26 0.06 0.00 0.56 0.00 0.00 36.38 33.64 1nei s VAL 57 CO 0.01 0.00 0.59 0.00 -0.31 0.00 0.00 175.10 175.40 1nei n GLY 59 N 3.22 -4.84 0.00 0.00 0.00 -1.26 -4.74 105.19 97.57 1nei n GLY 59 Ca -0.16 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1nei n GLY 59 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11