#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 -1.61 0.41 3.03 0.00 -1.26 -5.17 107.32 102.73 1nei s GLY 2 Ca 0.00 0.49 0.08 0.00 0.00 0.00 0.00 44.72 45.29 1nei s GLY 2 CO 0.00 4.09 0.31 0.54 0.00 0.00 0.00 173.10 178.04 1nei s LYS 3 N 1.30 2.44 -0.63 2.90 3.01 -1.26 -5.08 119.74 122.42 1nei s LYS 3 Ca 0.22 -1.62 -0.08 0.00 -1.01 0.00 0.00 55.97 53.48 1nei s LYS 3 Cb 0.06 -2.26 0.16 0.00 -1.01 0.00 0.00 37.83 34.78 1nei s LYS 3 CO -0.10 -0.15 0.51 0.00 0.51 0.00 0.00 175.35 176.12 1nei s ALA 4 N -2.50 3.67 0.07 5.17 0.00 -1.26 -5.03 121.76 121.88 1nei s ALA 4 Ca 0.45 -3.04 -0.05 0.00 0.00 0.00 0.00 51.96 49.33 1nei s ALA 4 Cb -0.01 -2.98 -0.02 0.00 0.00 0.00 0.00 23.12 20.11 1nei s ALA 4 CO 0.26 -2.09 0.08 0.95 0.00 0.00 0.00 175.76 174.96 1nei s THR 5 N 0.49 0.18 0.01 0.00 -4.23 -1.26 -4.74 115.64 106.08 1nei s THR 5 Ca 0.13 -1.53 0.03 0.00 -1.18 0.00 0.00 61.69 59.15 1nei s THR 5 Cb -0.19 -1.47 -0.01 0.00 1.34 0.00 0.00 72.50 72.16 1nei s THR 5 CO -0.04 -0.81 -0.10 -0.31 -0.54 0.00 0.00 174.62 172.82 1nei s TYR 6 N -3.90 0.92 -0.32 3.99 1.51 -1.14 -4.98 117.35 113.43 1nei s TYR 6 Ca 0.07 -0.25 -0.04 0.00 -1.01 0.00 0.00 57.07 55.84 1nei s TYR 6 Cb 0.06 -0.57 0.05 0.00 -0.11 0.00 0.00 41.96 41.39 1nei s TYR 6 CO -0.10 -0.01 0.05 0.99 -1.11 0.00 0.00 175.55 175.37 1nei s THR 7 N -0.53 3.33 -0.31 -0.71 2.01 -1.26 -2.02 115.64 116.14 1nei s THR 7 Ca 0.01 -1.29 -0.09 0.00 0.31 0.00 0.00 61.69 60.64 1nei s THR 7 Cb -0.06 -2.91 -0.00 0.00 0.01 0.00 0.00 72.50 69.54 1nei s THR 7 CO 0.00 -0.15 0.14 -0.69 -0.69 0.00 0.00 174.62 173.23 1nei s VAL 8 N 1.32 4.45 -0.14 3.82 1.01 -0.67 -4.98 120.40 125.21 1nei s VAL 8 Ca -0.04 -0.51 -0.01 0.00 0.00 0.00 0.00 61.98 61.42 1nei s VAL 8 Cb -0.20 -3.29 -0.02 0.00 0.00 0.00 0.00 36.38 32.88 1nei s VAL 8 CO 0.01 0.05 -0.11 -0.89 0.00 0.00 0.00 175.10 174.15 1nei s THR 9 N 1.58 3.16 -0.13 3.92 2.01 -1.26 -0.67 115.64 124.24 1nei s THR 9 Ca 0.04 -0.62 0.01 0.00 0.31 0.00 0.00 61.69 61.43 1nei s THR 9 Cb -0.17 -2.34 0.02 0.00 0.01 0.00 0.00 72.50 70.02 1nei s THR 9 CO 0.05 0.51 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.67 1nei s VAL 10 N 0.46 1.49 0.04 3.82 1.01 0.35 -4.97 120.40 122.59 1nei s VAL 10 Ca -0.08 -0.59 0.06 0.00 0.00 0.00 0.00 61.98 61.36 1nei s VAL 10 Cb -0.16 -1.39 -0.02 0.00 0.00 0.00 0.00 36.38 34.81 1nei s VAL 10 CO 0.04 0.44 -0.17 -0.89 0.00 0.00 0.00 175.10 174.53 1nei s THR 11 N 1.39 1.36 -0.26 3.92 2.01 -1.26 -0.27 115.64 122.53 1nei s THR 11 Ca 0.02 -1.06 -0.12 0.00 0.31 0.00 0.00 61.69 60.85 1nei s THR 11 Cb -0.13 -1.20 -0.05 0.00 0.01 0.00 0.00 72.50 71.13 1nei s THR 11 CO -0.08 0.12 0.21 0.20 -0.69 0.00 0.00 174.62 174.38 1nei s ASN 12 N -1.09 6.11 0.22 3.53 -0.87 0.34 -4.93 114.94 118.24 1nei s ASN 12 Ca 0.04 0.10 0.25 0.00 -1.57 0.00 0.00 52.86 51.69 1nei s ASN 12 Cb -0.08 -2.13 0.69 0.00 -0.02 0.00 0.00 41.25 39.71 1nei s ASN 12 CO 0.01 -0.03 1.69 0.78 -2.57 0.00 0.00 177.10 176.98 1nei h ASN 13 N 8.00 0.00 0.44 -1.22 2.35 -1.93 2.56 115.58 125.78 1nei h ASN 13 Ca -0.36 -0.03 -0.31 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 0.61 0.02 -1.50 0.77 -1.65 0.00 0.00 177.43 175.67 1nei h SER 14 N 0.00 0.46 -0.00 5.81 4.64 -1.97 -3.35 113.55 119.14 1nei h SER 14 Ca 0.00 -0.60 0.00 0.00 -0.47 0.00 0.00 61.79 60.72 1nei h SER 14 Cb 0.77 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1nei h SER 14 CO 0.00 1.49 -0.32 -3.20 -0.87 0.00 0.00 176.83 173.93 1nei n ASN 15 N -3.50 0.85 -1.82 4.97 5.15 -1.21 -4.97 115.26 114.73 1nei n ASN 15 Ca -0.16 -0.93 -0.20 0.00 -0.60 0.00 0.00 54.58 52.69 1nei n ASN 15 Cb 1.05 0.72 -0.06 0.00 -0.53 0.00 0.00 39.78 40.95 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 1.04 1.10 3.63 8.20 0.00 0.85 -4.94 105.19 115.08 1nei n GLY 16 Ca 0.03 -0.04 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.84 5.01 -0.01 1.61 1.01 -0.68 -4.80 120.40 119.70 1nei s VAL 17 Ca 0.00 1.07 -0.02 0.00 0.00 0.00 0.00 61.98 63.03 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 0.05 0.12 -0.94 0.00 0.00 0.00 175.10 174.33 1nei s SER 18 N 1.47 5.98 -0.20 3.32 1.04 -1.26 0.13 113.70 124.18 1nei s SER 18 Ca 0.25 0.24 -0.09 0.00 0.48 0.00 0.00 55.95 56.83 1nei s SER 18 Cb -0.16 -1.79 0.08 0.00 0.10 0.00 0.00 66.02 64.25 1nei s SER 18 CO 0.09 0.27 0.45 -0.69 0.98 0.00 0.00 173.24 174.34 1nei s VAL 19 N -1.24 -0.38 0.04 5.02 1.01 0.63 -4.95 120.40 120.54 1nei s VAL 19 Ca 0.24 0.12 0.09 0.00 0.00 0.00 0.00 61.98 62.43 1nei s VAL 19 Cb -0.12 -0.68 -0.03 0.00 0.00 0.00 0.00 36.38 35.54 1nei s VAL 19 CO 0.15 0.05 -0.24 -1.81 0.00 0.00 0.00 175.10 173.25 1nei s ASP 20 N 2.08 3.33 -0.04 3.32 1.01 -1.26 0.13 116.67 125.24 1nei s ASP 20 Ca -0.06 -0.55 -0.01 0.00 0.71 0.00 0.00 52.55 52.64 1nei s ASP 20 Cb -0.10 -0.37 0.03 0.00 1.01 0.00 0.00 42.92 43.49 1nei s ASP 20 CO -0.14 0.26 0.07 -0.31 0.21 0.00 0.00 175.17 175.26 1nei s TYR 21 N -0.84 -0.03 -0.37 4.23 2.02 0.15 -4.99 117.35 117.53 1nei s TYR 21 Ca 0.12 0.26 -0.15 0.00 -0.37 0.00 0.00 57.07 56.94 1nei s TYR 21 Cb -0.10 -0.23 -0.00 0.00 -0.40 0.00 0.00 41.96 41.23 1nei s TYR 21 CO 0.03 -0.13 0.35 -2.00 -1.57 0.00 0.00 175.55 172.22 1nei s GLU 22 N 1.29 3.37 -0.03 -0.62 2.12 -1.26 -1.67 118.70 121.91 1nei s GLU 22 Ca -0.07 -0.61 0.01 0.00 0.36 0.00 0.00 54.97 54.66 1nei s GLU 22 Cb -0.12 -3.86 0.03 0.00 0.26 0.00 0.00 34.13 30.43 1nei s GLU 22 CO -0.04 -0.61 -0.01 -0.08 -0.54 0.00 0.00 175.26 173.98 1nei s THR 23 N 1.94 0.25 -0.76 -1.70 -1.32 -0.86 -5.02 115.64 108.17 1nei s THR 23 Ca 0.10 0.04 -0.21 0.00 -1.21 0.00 0.00 61.69 60.41 1nei s THR 23 Cb -0.17 -0.33 0.10 0.00 -1.51 0.00 0.00 72.50 70.58 1nei s THR 23 CO 0.12 0.16 1.01 -0.70 -2.21 0.00 0.00 174.62 173.00 1nei s GLU 24 N 0.99 3.30 -0.17 7.08 -6.30 -1.26 -2.86 118.70 119.48 1nei s GLU 24 Ca -0.10 -1.25 -0.02 0.00 -2.50 0.00 0.00 54.97 51.09 1nei s GLU 24 Cb -0.14 -4.52 0.05 0.00 0.00 0.00 0.00 34.13 29.53 1nei s GLU 24 CO -0.01 -1.78 0.02 0.95 0.02 0.00 0.00 175.26 174.45 1nei s THR 25 N 3.39 0.60 0.00 -1.70 -4.23 -1.26 -4.98 115.64 107.47 1nei s THR 25 Ca 0.25 -0.47 0.00 0.00 -1.18 0.00 0.00 61.69 60.30 1nei s THR 25 Cb -0.13 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.71 1nei s THR 25 CO 0.02 -0.08 0.05 -0.81 -0.54 0.00 0.00 174.62 173.25 1nei n PRO 26 N 5.03 0.00 0.15 3.99 -0.04 -1.26 -3.94 135.00 138.93 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 0.48 -0.31 0.20 0.00 -0.04 0.00 0.00 33.50 33.82 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 -0.94 0.54 2.86 -2.02 -3.08 114.93 112.30 1nei h MET 27 Ca 0.00 0.00 0.23 0.00 -2.06 0.00 0.00 59.70 57.87 1nei h MET 27 Cb 0.00 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.59 1nei h MET 27 CO 0.00 0.55 0.62 1.79 1.06 0.00 0.00 176.91 180.94 1nei h THR 28 N 0.00 0.62 -0.84 2.22 1.35 -1.93 0.57 112.91 114.91 1nei h THR 28 Ca -0.01 -0.12 0.14 0.00 -0.55 0.00 0.00 66.41 65.88 1nei h THR 28 Cb 1.10 0.26 -0.06 0.00 -1.73 0.00 0.00 68.15 67.72 1nei h THR 28 CO 0.07 0.06 0.55 -0.07 -0.25 0.00 0.00 175.52 175.88 1nei h LEU 29 N 0.34 0.58 0.00 3.87 3.38 -1.66 0.45 115.31 122.27 1nei h LEU 29 Ca 0.49 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 58.36 1nei h LEU 29 Cb 1.34 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 1nei h LEU 29 CO -0.17 0.30 -0.64 -0.07 0.09 0.00 0.00 178.44 177.95 1nei h LEU 30 N 0.62 0.00 -9.84 1.67 3.38 -0.08 -3.43 115.31 107.63 1nei h LEU 30 Ca 0.41 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.85 1nei h LEU 30 Cb 0.71 0.00 0.08 0.00 0.09 0.00 0.00 40.66 41.54 1nei h LEU 30 CO -0.17 0.61 0.78 -0.69 0.09 0.00 0.00 178.44 179.06 1nei s VAL 31 N -2.90 2.35 0.03 1.22 1.01 0.16 -4.92 120.40 117.34 1nei s VAL 31 Ca 0.03 0.32 -0.18 0.00 0.00 0.00 0.00 61.98 62.15 1nei s VAL 31 Cb 0.08 -3.20 -0.21 0.00 0.00 0.00 0.00 36.38 33.05 1nei s VAL 31 CO 0.76 0.06 1.16 1.55 0.00 0.00 0.00 175.10 178.64 1nei h PRO 32 N 4.10 0.51 -0.56 2.72 0.13 -1.88 0.71 132.00 137.73 1nei h PRO 32 Ca -0.48 -0.49 0.02 0.00 -0.87 0.00 0.00 66.00 64.18 1nei h PRO 32 Cb 1.23 0.13 -0.04 0.00 0.13 0.00 0.00 31.00 32.45 1nei h PRO 32 CO 0.72 1.13 0.34 0.93 -0.23 0.00 0.00 178.00 180.89 1nei h GLU 33 N 0.07 0.65 -0.12 0.86 5.08 -1.91 2.18 114.58 121.39 1nei h GLU 33 Ca -0.07 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.14 1nei h GLU 33 Cb 1.33 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1nei h GLU 33 CO 0.13 0.43 -0.33 0.28 -1.00 0.00 0.00 179.01 178.52 1nei h VAL 34 N 0.67 1.37 -0.14 3.13 2.07 -1.79 -0.22 116.25 121.34 1nei h VAL 34 Ca 0.22 -1.63 -0.01 0.00 0.82 0.00 0.00 66.70 66.10 1nei h VAL 34 Cb 0.02 2.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 1nei h VAL 34 CO -0.10 0.49 0.07 0.00 0.02 0.00 0.00 177.57 178.05 1nei h ALA 35 N 0.52 0.19 -0.19 1.67 0.00 -0.48 0.44 119.26 121.41 1nei h ALA 35 Ca -0.01 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1nei h ALA 35 Cb 0.95 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 1nei h ALA 35 CO 0.07 -0.25 0.06 0.00 0.00 0.00 0.00 179.25 179.13 1nei h ALA 36 N 0.93 0.20 -0.46 0.00 0.00 0.36 0.54 119.26 120.84 1nei h ALA 36 Ca 0.05 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1nei h ALA 36 Cb 0.13 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1nei h ALA 36 CO -0.01 -0.37 0.20 0.93 0.00 0.00 0.00 179.25 180.01 1nei h GLU 37 N 0.15 0.64 0.14 0.00 5.08 -0.79 0.57 114.58 120.38 1nei h GLU 37 Ca 0.08 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1nei h GLU 37 Cb 0.05 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1nei h GLU 37 CO -0.08 0.52 -0.07 0.28 -1.00 0.00 0.00 179.01 178.66 1nei h VAL 38 N 0.65 1.03 0.11 3.13 2.07 0.92 1.01 116.25 125.17 1nei h VAL 38 Ca 0.16 -0.88 -0.00 0.00 0.82 0.00 0.00 66.70 66.79 1nei h VAL 38 Cb 0.10 1.56 -0.00 0.00 -1.52 0.00 0.00 31.29 31.43 1nei h VAL 38 CO -0.02 0.20 -0.06 0.40 0.02 0.00 0.00 177.57 178.11 1nei h ILE 39 N -0.62 0.88 -0.67 4.57 1.08 0.36 0.44 117.51 123.56 1nei h ILE 39 Ca -0.02 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.43 1nei h ILE 39 Cb 0.47 0.88 -0.03 0.00 -3.07 0.00 0.00 36.82 35.07 1nei h ILE 39 CO 0.03 0.00 0.34 0.50 -0.69 0.00 0.00 178.15 178.33 1nei h LYS 40 N -0.16 0.96 -0.58 2.37 3.11 0.12 -0.30 116.57 122.09 1nei h LYS 40 Ca -0.01 -0.13 0.02 0.00 -2.81 0.00 0.00 60.65 57.72 1nei h LYS 40 Cb 0.13 -0.18 -0.04 0.00 -1.00 0.00 0.00 32.23 31.14 1nei h LYS 40 CO 0.02 0.75 0.36 0.22 -2.81 0.00 0.00 179.45 177.98 1nei h ASP 41 N 0.93 0.58 0.23 4.20 3.58 0.15 1.95 116.42 128.04 1nei h ASP 41 Ca 0.23 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.67 1nei h ASP 41 Cb 0.09 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 41.02 1nei h ASP 41 CO -0.03 0.41 -0.11 -0.07 -2.88 0.00 0.00 179.24 176.56 1nei h LEU 42 N 0.71 -0.27 -0.46 2.28 3.38 0.46 0.30 115.31 121.72 1nei h LEU 42 Ca 0.23 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.18 1nei h LEU 42 Cb 0.01 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1nei h LEU 42 CO -0.09 -0.19 0.16 0.58 0.09 0.00 0.00 178.44 178.99 1nei h VAL 43 N -0.31 1.21 -0.83 1.22 2.07 -0.60 0.18 116.25 119.19 1nei h VAL 43 Ca -0.03 -0.69 0.10 0.00 0.82 0.00 0.00 66.70 66.90 1nei h VAL 43 Cb 0.24 0.81 -0.06 0.00 -1.52 0.00 0.00 31.29 30.76 1nei h VAL 43 CO 0.05 0.25 0.54 0.78 0.02 0.00 0.00 177.57 179.21 1nei h ASN 44 N 0.60 0.71 -0.07 0.57 2.35 0.34 0.26 115.58 120.34 1nei h ASN 44 Ca 0.15 0.02 -0.24 0.00 -0.55 0.00 0.00 56.30 55.68 1nei h ASN 44 Cb 0.23 -0.13 0.01 0.00 0.05 0.00 0.00 38.32 38.49 1nei h ASN 44 CO -0.01 0.42 -0.90 0.74 -1.65 0.00 0.00 177.43 176.03 1nei h THR 45 N 0.79 1.28 -0.66 2.81 2.02 0.30 -0.45 112.91 118.99 1nei h THR 45 Ca 0.38 -2.10 -0.00 0.00 0.77 0.00 0.00 66.41 65.46 1nei h THR 45 Cb 0.44 2.16 -0.03 0.00 -1.74 0.00 0.00 68.15 68.98 1nei h THR 45 CO -0.15 0.66 0.40 0.58 0.37 0.00 0.00 175.52 177.38 1nei h VAL 46 N 0.47 1.19 -0.03 3.16 2.07 0.79 -1.90 116.25 122.00 1nei h VAL 46 Ca -0.09 -0.40 -0.15 0.00 0.82 0.00 0.00 66.70 66.88 1nei h VAL 46 Cb 1.54 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 1nei h VAL 46 CO 0.18 0.19 -0.66 0.03 0.02 0.00 0.00 177.57 177.34 1nei h ARG 47 N 0.89 0.12 -0.90 1.57 3.08 -0.55 -3.02 114.38 115.58 1nei h ARG 47 Ca 0.24 -0.09 0.15 0.00 0.07 0.00 0.00 59.98 60.35 1nei h ARG 47 Cb -0.04 0.02 -0.07 0.00 0.08 0.00 0.00 29.97 29.95 1nei h ARG 47 CO -0.05 0.73 0.58 0.77 -1.07 0.00 0.00 179.97 180.93 1nei h SER 48 N 0.08 0.63 0.78 7.04 0.02 -0.26 0.39 113.55 122.23 1nei h SER 48 Ca -0.01 0.04 -0.13 0.00 -0.84 0.00 0.00 61.79 60.86 1nei h SER 48 Cb 1.17 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.61 1nei h SER 48 CO 0.09 0.31 -0.60 0.22 -1.14 0.00 0.00 176.83 175.71 1nei h TYR 49 N 0.66 0.00 -0.03 3.45 5.03 -1.36 -3.03 116.97 121.70 1nei h TYR 49 Ca 0.46 0.00 -0.20 0.00 2.58 0.00 0.00 58.73 61.57 1nei h TYR 49 Cb 0.78 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 39.06 1nei h TYR 49 CO -0.00 0.60 -0.83 0.22 -1.32 0.00 0.00 178.16 176.83 1nei h ASP 50 N 0.00 0.39 -3.23 -2.11 3.58 -0.40 -3.44 116.42 111.22 1nei h ASP 50 Ca -0.01 -0.29 -0.57 0.00 0.42 0.00 0.00 57.03 56.58 1nei h ASP 50 Cb 1.15 -0.12 -0.04 0.00 1.72 0.00 0.00 39.33 42.04 1nei h ASP 50 CO 0.08 1.06 -0.05 0.42 -2.88 0.00 0.00 179.24 177.87 1nei s THR 51 N -3.39 4.78 0.05 2.25 -4.23 0.63 -4.88 115.64 110.85 1nei s THR 51 Ca -0.05 1.14 -0.18 0.00 -1.18 0.00 0.00 61.69 61.43 1nei s THR 51 Cb 0.10 -3.86 -0.07 0.00 1.34 0.00 0.00 72.50 70.00 1nei s THR 51 CO 0.84 0.52 1.28 -0.33 -0.54 0.00 0.00 174.62 176.39 1nei h GLU 52 N 4.43 -0.36 -6.03 3.99 5.08 -1.85 -3.40 114.58 116.44 1nei h GLU 52 Ca -0.50 0.02 -0.57 0.00 -1.00 0.00 0.00 59.36 57.32 1nei h GLU 52 Cb 1.21 0.08 -0.06 0.00 0.50 0.00 0.00 28.75 30.49 1nei h GLU 52 CO 0.63 -0.24 -0.03 -0.80 -1.00 0.00 0.00 179.01 177.57 1nei s ASN 53 N -3.58 6.93 -0.33 1.42 -0.87 -1.26 -5.01 114.94 112.23 1nei s ASN 53 Ca -0.08 1.10 -0.10 0.00 -1.57 0.00 0.00 52.86 52.21 1nei s ASN 53 Cb 0.03 -2.35 0.00 0.00 -0.02 0.00 0.00 41.25 38.91 1nei s ASN 53 CO 0.31 0.08 0.17 -1.83 -2.57 0.00 0.00 177.10 173.26 1nei s GLU 54 N -0.03 3.16 0.05 -0.60 -1.05 -1.26 -4.70 118.70 114.26 1nei s GLU 54 Ca 0.30 -0.84 0.00 0.00 -0.15 0.00 0.00 54.97 54.28 1nei s GLU 54 Cb -0.18 -3.62 0.00 0.00 -0.44 0.00 0.00 34.13 29.89 1nei s GLU 54 CO 0.16 -0.51 0.00 0.72 0.95 0.00 0.00 175.26 176.58 1nei n HIS 55 N 4.99 -1.72 -4.94 4.83 8.25 -1.26 -5.13 115.22 120.23 1nei n HIS 55 Ca -0.13 0.16 -0.31 0.00 -0.26 0.00 0.00 57.72 57.18 1nei n HIS 55 Cb 0.48 0.65 -0.14 0.00 1.12 0.00 0.00 29.99 32.10 1nei n HIS 55 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 1nei s ASP 56 N -1.51 3.39 0.01 0.41 1.47 -1.26 -5.08 116.67 114.10 1nei s ASP 56 Ca 0.00 -0.48 -0.30 0.00 1.18 0.00 0.00 52.55 52.95 1nei s ASP 56 Cb 0.00 -0.44 -0.07 0.00 -0.34 0.00 0.00 42.92 42.07 1nei s ASP 56 CO 0.00 0.28 1.76 0.68 0.68 0.00 0.00 175.17 178.57 1nei s VAL 57 N -0.78 3.22 -0.30 2.11 -7.23 -1.26 -4.93 120.40 111.23 1nei s VAL 57 Ca 0.12 0.41 -0.15 0.00 -1.81 0.00 0.00 61.98 60.55 1nei s VAL 57 Cb -0.10 -3.26 0.17 0.00 0.56 0.00 0.00 36.38 33.75 1nei s VAL 57 CO 0.02 -0.03 1.05 0.00 -0.31 0.00 0.00 175.10 175.83 1nei n GLY 59 N 5.09 0.65 3.07 0.00 0.00 -1.26 -4.87 105.19 107.87 1nei n GLY 59 Ca -0.08 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.03 1nei n GLY 59 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11