#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 2.37 0.43 3.03 0.00 -1.26 -4.98 107.32 106.91 1nei s GLY 2 Ca 0.00 -3.33 0.08 0.00 0.00 0.00 0.00 44.72 41.47 1nei s GLY 2 CO 0.00 2.08 0.52 0.54 0.00 0.00 0.00 173.10 176.24 1nei s LYS 3 N 1.70 2.72 -0.64 2.90 -0.14 -1.26 -5.07 119.74 119.95 1nei s LYS 3 Ca 0.43 -1.35 -0.09 0.00 -1.36 0.00 0.00 55.97 53.60 1nei s LYS 3 Cb -0.03 -2.64 0.17 0.00 -1.68 0.00 0.00 37.83 33.65 1nei s LYS 3 CO 0.00 -0.27 0.52 0.00 -0.76 0.00 0.00 175.35 174.85 1nei s ALA 4 N -2.40 3.70 0.13 5.17 0.00 -1.26 -5.04 121.76 122.07 1nei s ALA 4 Ca 0.53 -3.04 0.02 0.00 0.00 0.00 0.00 51.96 49.47 1nei s ALA 4 Cb -0.08 -3.02 -0.04 0.00 0.00 0.00 0.00 23.12 19.97 1nei s ALA 4 CO 0.32 -2.10 -0.03 0.95 0.00 0.00 0.00 175.76 174.90 1nei s THR 5 N 0.51 0.66 0.01 0.00 -4.23 -1.26 -4.59 115.64 106.74 1nei s THR 5 Ca 0.13 -1.96 0.01 0.00 -1.18 0.00 0.00 61.69 58.70 1nei s THR 5 Cb -0.19 -1.90 -0.01 0.00 1.34 0.00 0.00 72.50 71.74 1nei s THR 5 CO -0.04 -0.67 -0.04 -0.31 -0.54 0.00 0.00 174.62 173.02 1nei s TYR 6 N -3.66 0.36 -0.30 3.99 1.51 -0.72 -4.92 117.35 113.62 1nei s TYR 6 Ca 0.18 -0.18 -0.00 0.00 -1.01 0.00 0.00 57.07 56.06 1nei s TYR 6 Cb 0.06 -0.23 0.06 0.00 -0.11 0.00 0.00 41.96 41.74 1nei s TYR 6 CO -0.00 -0.04 -0.01 0.99 -1.11 0.00 0.00 175.55 175.37 1nei s THR 7 N -0.44 2.72 -0.26 -0.71 2.01 -1.26 -0.03 115.64 117.68 1nei s THR 7 Ca -0.02 -1.57 -0.09 0.00 0.31 0.00 0.00 61.69 60.32 1nei s THR 7 Cb -0.04 -2.63 -0.04 0.00 0.01 0.00 0.00 72.50 69.81 1nei s THR 7 CO -0.00 -0.16 0.13 -0.69 -0.69 0.00 0.00 174.62 173.21 1nei s VAL 8 N 1.18 4.83 -0.10 3.82 1.01 0.21 -4.91 120.40 126.44 1nei s VAL 8 Ca -0.04 0.00 0.02 0.00 0.00 0.00 0.00 61.98 61.96 1nei s VAL 8 Cb -0.20 -3.28 -0.01 0.00 0.00 0.00 0.00 36.38 32.89 1nei s VAL 8 CO -0.03 0.31 -0.18 -0.89 0.00 0.00 0.00 175.10 174.31 1nei s THR 9 N 1.59 2.64 -0.12 3.92 2.01 -1.26 0.11 115.64 124.53 1nei s THR 9 Ca 0.07 -0.82 0.00 0.00 0.31 0.00 0.00 61.69 61.25 1nei s THR 9 Cb -0.15 -2.06 0.02 0.00 0.01 0.00 0.00 72.50 70.32 1nei s THR 9 CO 0.07 0.55 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.74 1nei s VAL 10 N 0.14 1.33 -0.01 3.82 1.01 0.91 -4.97 120.40 122.63 1nei s VAL 10 Ca -0.09 -0.50 0.06 0.00 0.00 0.00 0.00 61.98 61.44 1nei s VAL 10 Cb -0.16 -1.27 -0.01 0.00 0.00 0.00 0.00 36.38 34.94 1nei s VAL 10 CO 0.06 0.42 -0.19 -0.89 0.00 0.00 0.00 175.10 174.50 1nei s THR 11 N 1.41 1.48 -0.39 3.92 2.01 -1.26 -1.45 115.64 121.37 1nei s THR 11 Ca 0.01 -0.82 -0.14 0.00 0.31 0.00 0.00 61.69 61.06 1nei s THR 11 Cb -0.13 -1.23 0.01 0.00 0.01 0.00 0.00 72.50 71.15 1nei s THR 11 CO -0.07 0.40 0.28 0.20 -0.69 0.00 0.00 174.62 174.74 1nei s ASN 12 N -0.48 6.06 0.22 3.53 0.01 0.35 -4.91 114.94 119.72 1nei s ASN 12 Ca 0.07 -0.78 0.24 0.00 -0.71 0.00 0.00 52.86 51.68 1nei s ASN 12 Cb -0.07 -2.14 0.93 0.00 0.41 0.00 0.00 41.25 40.37 1nei s ASN 12 CO -0.01 -0.39 1.71 0.59 -1.51 0.00 0.00 177.10 177.50 1nei n ASN 13 N 5.13 0.63 0.08 -1.22 3.02 -1.26 0.37 115.26 122.01 1nei n ASN 13 Ca -0.12 0.63 -0.16 0.00 -0.03 0.00 0.00 54.58 54.91 1nei n ASN 13 Cb 0.48 -0.78 -0.14 0.00 -0.61 0.00 0.00 39.78 38.73 1nei n ASN 13 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1nei h SER 14 N 0.00 0.38 -0.01 6.41 4.64 -1.96 -3.33 113.55 119.69 1nei h SER 14 Ca 0.00 -0.46 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1nei h SER 14 Cb 0.43 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1nei h SER 14 CO 0.00 1.38 -0.28 -3.20 -0.87 0.00 0.00 176.83 173.86 1nei n ASN 15 N -3.47 1.10 -1.40 4.97 5.15 -0.98 -4.97 115.26 115.66 1nei n ASN 15 Ca -0.12 -1.05 -0.18 0.00 -0.60 0.00 0.00 54.58 52.63 1nei n ASN 15 Cb 1.03 0.58 -0.08 0.00 -0.53 0.00 0.00 39.78 40.78 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 0.99 1.77 3.66 8.20 0.00 1.17 -4.94 105.19 116.05 1nei n GLY 16 Ca 0.04 -0.09 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.63 5.08 0.02 1.61 1.01 -0.66 -4.85 120.40 119.98 1nei s VAL 17 Ca 0.00 1.02 0.05 0.00 0.00 0.00 0.00 61.98 63.06 1nei s VAL 17 Cb 0.00 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 1nei s VAL 17 CO 0.00 0.16 -0.14 -0.94 0.00 0.00 0.00 175.10 174.18 1nei s SER 18 N 1.15 4.09 -0.01 3.32 1.04 -1.26 0.13 113.70 122.16 1nei s SER 18 Ca 0.26 -0.31 -0.17 0.00 0.48 0.00 0.00 55.95 56.21 1nei s SER 18 Cb -0.16 -0.79 0.03 0.00 0.10 0.00 0.00 66.02 65.20 1nei s SER 18 CO 0.10 0.28 0.35 -0.69 0.98 0.00 0.00 173.24 174.26 1nei s VAL 19 N -0.92 0.05 0.06 5.02 1.01 -0.53 -4.97 120.40 120.13 1nei s VAL 19 Ca 0.15 -0.45 0.05 0.00 0.00 0.00 0.00 61.98 61.74 1nei s VAL 19 Cb -0.11 -0.71 -0.03 0.00 0.00 0.00 0.00 36.38 35.54 1nei s VAL 19 CO 0.05 -0.25 -0.15 -1.81 0.00 0.00 0.00 175.10 172.95 1nei s ASP 20 N -1.43 1.74 -0.04 3.32 1.11 -1.26 -0.06 116.67 120.05 1nei s ASP 20 Ca -0.12 -0.57 -0.01 0.00 0.18 0.00 0.00 52.55 52.03 1nei s ASP 20 Cb -0.04 -0.07 0.03 0.00 1.07 0.00 0.00 42.92 43.90 1nei s ASP 20 CO 0.04 -0.03 0.02 -0.31 1.18 0.00 0.00 175.17 176.07 1nei s TYR 21 N -1.13 0.25 -0.39 4.23 1.51 0.30 -4.95 117.35 117.17 1nei s TYR 21 Ca -0.00 0.07 -0.13 0.00 -1.01 0.00 0.00 57.07 55.99 1nei s TYR 21 Cb -0.09 -0.46 0.02 0.00 -0.11 0.00 0.00 41.96 41.32 1nei s TYR 21 CO 0.02 -0.17 0.26 -2.00 -1.11 0.00 0.00 175.55 172.55 1nei s GLU 22 N 1.47 2.99 -0.03 -0.62 2.12 -1.26 0.64 118.70 124.01 1nei s GLU 22 Ca -0.04 -0.99 0.00 0.00 0.36 0.00 0.00 54.97 54.30 1nei s GLU 22 Cb -0.13 -3.87 0.03 0.00 0.26 0.00 0.00 34.13 30.41 1nei s GLU 22 CO -0.03 -0.70 0.02 -0.08 -0.54 0.00 0.00 175.26 173.93 1nei s THR 23 N 1.64 0.07 -0.75 -1.70 -1.32 0.96 -4.97 115.64 109.57 1nei s THR 23 Ca 0.04 0.16 -0.20 0.00 -1.21 0.00 0.00 61.69 60.48 1nei s THR 23 Cb -0.19 -0.20 0.10 0.00 -1.51 0.00 0.00 72.50 70.71 1nei s THR 23 CO 0.09 0.13 0.98 -1.83 -2.21 0.00 0.00 174.62 171.78 1nei s GLU 24 N 1.14 3.29 -0.12 7.08 -1.05 -1.26 -1.75 118.70 126.03 1nei s GLU 24 Ca -0.08 -1.28 -0.02 0.00 -0.15 0.00 0.00 54.97 53.44 1nei s GLU 24 Cb -0.13 -4.50 0.04 0.00 -0.44 0.00 0.00 34.13 29.10 1nei s GLU 24 CO -0.02 -1.75 -0.00 0.95 0.95 0.00 0.00 175.26 175.38 1nei s THR 25 N 3.28 0.56 0.00 1.83 -4.23 -1.26 -4.93 115.64 110.89 1nei s THR 25 Ca 0.24 -0.18 0.00 0.00 -1.18 0.00 0.00 61.69 60.57 1nei s THR 25 Cb -0.13 -0.80 0.00 0.00 1.34 0.00 0.00 72.50 72.91 1nei s THR 25 CO 0.02 0.14 0.03 -0.81 -0.54 0.00 0.00 174.62 173.45 1nei n PRO 26 N 5.07 0.00 0.13 3.99 -0.04 -1.26 -4.08 135.00 138.81 1nei n PRO 26 Ca -0.09 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.37 1nei n PRO 26 Cb 0.49 -0.24 0.13 0.00 -0.04 0.00 0.00 33.50 33.85 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 -0.48 0.54 2.86 -2.01 -3.05 114.93 112.78 1nei h MET 27 Ca 0.00 0.00 0.14 0.00 -2.06 0.00 0.00 59.70 57.78 1nei h MET 27 Cb 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 1nei h MET 27 CO 0.00 0.64 0.56 1.79 1.06 0.00 0.00 176.91 180.96 1nei h THR 28 N 0.00 0.29 -0.59 2.22 1.35 -1.93 0.77 112.91 115.01 1nei h THR 28 Ca -0.01 0.00 -0.07 0.00 -0.55 0.00 0.00 66.41 65.79 1nei h THR 28 Cb 1.21 0.55 -0.03 0.00 -1.73 0.00 0.00 68.15 68.16 1nei h THR 28 CO 0.08 0.00 0.10 -0.07 -0.25 0.00 0.00 175.52 175.39 1nei h LEU 29 N 0.00 0.90 -0.09 3.87 3.38 -1.68 -1.82 115.31 119.87 1nei h LEU 29 Ca 0.23 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1nei h LEU 29 Cb 1.34 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1nei h LEU 29 CO -0.00 0.90 -0.25 -0.07 0.09 0.00 0.00 178.44 179.11 1nei h LEU 30 N 0.90 0.00 -9.80 1.67 3.38 0.31 -3.42 115.31 108.36 1nei h LEU 30 Ca 0.19 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.63 1nei h LEU 30 Cb 0.39 0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.21 1nei h LEU 30 CO 0.01 0.25 0.79 -0.69 0.09 0.00 0.00 178.44 178.89 1nei s VAL 31 N -3.12 2.40 0.02 1.22 1.01 -0.63 -4.92 120.40 116.38 1nei s VAL 31 Ca 0.05 0.35 -0.19 0.00 0.00 0.00 0.00 61.98 62.19 1nei s VAL 31 Cb 0.07 -3.23 -0.22 0.00 0.00 0.00 0.00 36.38 33.00 1nei s VAL 31 CO 0.70 0.06 1.14 1.55 0.00 0.00 0.00 175.10 178.56 1nei h PRO 32 N 4.60 0.44 -0.54 2.72 0.13 -1.87 0.21 132.00 137.68 1nei h PRO 32 Ca -0.47 -0.43 0.01 0.00 -0.87 0.00 0.00 66.00 64.24 1nei h PRO 32 Cb 1.22 0.11 -0.03 0.00 0.13 0.00 0.00 31.00 32.43 1nei h PRO 32 CO 0.76 1.08 0.36 0.93 -0.23 0.00 0.00 178.00 180.89 1nei h GLU 33 N -0.04 0.69 0.12 0.86 5.08 -1.92 2.08 114.58 121.46 1nei h GLU 33 Ca -0.06 -0.04 -0.17 0.00 -1.00 0.00 0.00 59.36 58.09 1nei h GLU 33 Cb 1.24 -0.16 0.02 0.00 0.50 0.00 0.00 28.75 30.35 1nei h GLU 33 CO 0.11 0.46 -0.78 0.28 -1.00 0.00 0.00 179.01 178.08 1nei h VAL 34 N 0.71 1.49 -0.31 3.13 2.07 -1.78 -2.25 116.25 119.31 1nei h VAL 34 Ca 0.20 -2.50 -0.03 0.00 0.82 0.00 0.00 66.70 65.19 1nei h VAL 34 Cb -0.05 3.17 -0.01 0.00 -1.52 0.00 0.00 31.29 32.87 1nei h VAL 34 CO -0.05 0.70 0.09 0.00 0.02 0.00 0.00 177.57 178.33 1nei h ALA 35 N 0.05 0.41 -0.14 1.67 0.00 -0.15 0.45 119.26 121.56 1nei h ALA 35 Ca -0.14 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.61 1nei h ALA 35 Cb 1.58 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 1nei h ALA 35 CO 0.12 0.06 0.07 0.00 0.00 0.00 0.00 179.25 179.50 1nei h ALA 36 N 0.93 0.17 -0.39 0.00 0.00 0.33 0.82 119.26 121.11 1nei h ALA 36 Ca 0.10 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1nei h ALA 36 Cb 0.26 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1nei h ALA 36 CO -0.00 -0.37 0.04 0.93 0.00 0.00 0.00 179.25 179.85 1nei h GLU 37 N 0.15 0.60 0.21 0.00 5.08 -1.20 0.34 114.58 119.75 1nei h GLU 37 Ca 0.06 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1nei h GLU 37 Cb 0.01 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.17 1nei h GLU 37 CO -0.04 0.59 -0.10 0.28 -1.00 0.00 0.00 179.01 178.74 1nei h VAL 38 N 0.58 0.85 -0.41 3.13 2.07 0.72 1.46 116.25 124.64 1nei h VAL 38 Ca 0.13 -0.85 0.04 0.00 0.82 0.00 0.00 66.70 66.84 1nei h VAL 38 Cb 0.30 1.31 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 1nei h VAL 38 CO 0.01 0.18 0.19 0.40 0.02 0.00 0.00 177.57 178.36 1nei h ILE 39 N -0.74 0.94 -0.36 4.57 1.08 0.81 0.79 117.51 124.60 1nei h ILE 39 Ca -0.03 -0.13 -0.10 0.00 -0.39 0.00 0.00 64.86 64.21 1nei h ILE 39 Cb 0.50 0.52 -0.01 0.00 -3.07 0.00 0.00 36.82 34.77 1nei h ILE 39 CO 0.05 0.07 -0.16 0.50 -0.69 0.00 0.00 178.15 177.91 1nei h LYS 40 N 0.38 0.74 -0.54 2.37 3.11 -0.33 -1.33 116.57 120.97 1nei h LYS 40 Ca 0.18 -0.32 0.03 0.00 -2.81 0.00 0.00 60.65 57.73 1nei h LYS 40 Cb 0.12 -0.02 -0.04 0.00 -1.00 0.00 0.00 32.23 31.29 1nei h LYS 40 CO -0.15 0.93 0.32 0.22 -2.81 0.00 0.00 179.45 177.96 1nei h ASP 41 N 0.53 0.50 0.24 4.20 3.58 0.28 2.20 116.42 127.96 1nei h ASP 41 Ca 0.08 0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.53 1nei h ASP 41 Cb 0.70 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.66 1nei h ASP 41 CO 0.05 0.35 -0.13 -0.07 -2.88 0.00 0.00 179.24 176.56 1nei h LEU 42 N 0.62 -0.31 -0.18 2.28 4.07 0.74 0.80 115.31 123.34 1nei h LEU 42 Ca 0.22 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.19 1nei h LEU 42 Cb 0.05 0.08 -0.01 0.00 1.08 0.00 0.00 40.66 41.87 1nei h LEU 42 CO -0.11 -0.21 0.06 0.58 -1.08 0.00 0.00 178.44 177.68 1nei h VAL 43 N -0.34 1.17 -0.96 1.22 2.07 -0.77 1.11 116.25 119.74 1nei h VAL 43 Ca -0.03 -0.52 0.09 0.00 0.82 0.00 0.00 66.70 67.06 1nei h VAL 43 Cb 0.27 1.19 -0.07 0.00 -1.52 0.00 0.00 31.29 31.16 1nei h VAL 43 CO 0.05 0.16 0.62 0.78 0.02 0.00 0.00 177.57 179.20 1nei h ASN 44 N 0.12 0.93 -0.02 0.57 2.35 0.39 0.63 115.58 120.54 1nei h ASN 44 Ca 0.06 0.02 -0.19 0.00 -0.55 0.00 0.00 56.30 55.65 1nei h ASN 44 Cb 0.19 -0.17 0.01 0.00 0.05 0.00 0.00 38.32 38.41 1nei h ASN 44 CO -0.00 0.55 -0.71 0.74 -1.65 0.00 0.00 177.43 176.36 1nei h THR 45 N 1.03 1.37 -0.97 2.81 2.02 0.11 -0.88 112.91 118.40 1nei h THR 45 Ca 0.44 -2.08 0.01 0.00 0.77 0.00 0.00 66.41 65.55 1nei h THR 45 Cb 0.33 2.46 -0.05 0.00 -1.74 0.00 0.00 68.15 69.15 1nei h THR 45 CO -0.20 0.62 0.65 0.58 0.37 0.00 0.00 175.52 177.54 1nei h VAL 46 N 0.08 1.25 -0.05 3.16 2.07 0.22 -1.03 116.25 121.95 1nei h VAL 46 Ca -0.08 -0.45 -0.17 0.00 0.82 0.00 0.00 66.70 66.81 1nei h VAL 46 Cb 1.39 -0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1nei h VAL 46 CO 0.14 0.24 -0.72 0.03 0.02 0.00 0.00 177.57 177.28 1nei h ARG 47 N 1.32 0.26 -0.12 1.57 3.08 0.23 -2.97 114.38 117.75 1nei h ARG 47 Ca 0.36 -0.22 -0.04 0.00 0.07 0.00 0.00 59.98 60.15 1nei h ARG 47 Cb -0.15 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 1nei h ARG 47 CO -0.08 0.88 -0.09 1.03 -1.07 0.00 0.00 179.97 180.64 1nei h SER 48 N 0.18 0.16 0.24 7.04 0.87 -0.10 0.28 113.55 122.22 1nei h SER 48 Ca -0.02 -0.03 -0.08 0.00 -1.23 0.00 0.00 61.79 60.43 1nei h SER 48 Cb 1.29 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 63.19 1nei h SER 48 CO 0.11 0.28 -0.32 0.22 -0.53 0.00 0.00 176.83 176.59 1nei h TYR 49 N 0.17 0.16 0.00 2.24 5.03 -1.07 -3.25 116.97 120.25 1nei h TYR 49 Ca 0.04 -0.03 -0.06 0.00 2.58 0.00 0.00 58.73 61.25 1nei h TYR 49 Cb 0.28 -0.04 -0.01 0.00 1.55 0.00 0.00 36.73 38.51 1nei h TYR 49 CO 0.00 0.45 -0.48 0.22 -1.32 0.00 0.00 178.16 177.03 1nei h ASP 50 N 0.12 0.00 -1.96 -2.11 3.58 -1.30 -3.46 116.42 111.29 1nei h ASP 50 Ca 0.02 -0.37 -0.60 0.00 0.42 0.00 0.00 57.03 56.50 1nei h ASP 50 Cb 0.64 0.00 -0.13 0.00 1.72 0.00 0.00 39.33 41.56 1nei h ASP 50 CO 0.05 0.96 -0.59 0.28 -2.88 0.00 0.00 179.24 177.05 1nei s THR 51 N -2.11 1.70 -0.76 2.25 -1.32 0.90 -2.80 115.64 113.50 1nei s THR 51 Ca -0.16 -2.00 -0.07 0.00 -1.21 0.00 0.00 61.69 58.25 1nei s THR 51 Cb 0.01 -2.86 0.01 0.00 -1.51 0.00 0.00 72.50 68.16 1nei s THR 51 CO 0.38 0.00 0.62 1.21 -2.21 0.00 0.00 174.62 174.62 1nei n GLU 52 N -0.93 -1.61 -3.93 7.08 2.13 -1.26 -3.76 120.64 118.37 1nei n GLU 52 Ca -0.06 0.93 -0.30 0.00 0.66 0.00 0.00 57.16 58.40 1nei n GLU 52 Cb 0.67 -2.52 -0.04 0.00 0.27 0.00 0.00 31.44 29.82 1nei n GLU 52 CO 0.00 0.00 0.00 -0.80 -0.41 0.00 0.00 177.13 175.92 1nei s ASN 53 N -2.74 6.35 -0.36 4.31 0.01 -1.24 -4.66 114.94 116.61 1nei s ASN 53 Ca 0.07 0.25 0.06 0.00 -0.71 0.00 0.00 52.86 52.53 1nei s ASN 53 Cb -0.01 -1.95 0.50 0.00 0.41 0.00 0.00 41.25 40.20 1nei s ASN 53 CO 0.88 0.14 1.51 -1.84 -1.51 0.00 0.00 177.10 176.29 1nei n GLU 54 N 0.11 2.40 0.00 -0.60 0.28 -1.26 -4.77 120.64 116.80 1nei n GLU 54 Ca -0.05 -3.43 0.00 0.00 -0.16 0.00 0.00 57.16 53.51 1nei n GLU 54 Cb 0.52 -2.02 0.00 0.00 1.43 0.00 0.00 31.44 31.37 1nei n GLU 54 CO 0.00 0.00 0.00 -2.39 -0.16 0.00 0.00 177.13 174.58 1nei n HIS 55 N -1.00 -0.75 -4.33 -1.84 1.44 -1.26 -5.14 115.22 102.34 1nei n HIS 55 Ca 0.42 0.00 -0.26 0.00 -2.01 0.00 0.00 57.72 55.87 1nei n HIS 55 Cb 0.99 0.22 -0.09 0.00 0.12 0.00 0.00 29.99 31.23 1nei n HIS 55 CO 0.00 0.00 0.00 0.16 -2.81 0.00 0.00 176.34 173.69 1nei s ASP 56 N 0.08 4.11 -0.14 4.39 -4.77 -1.26 -5.12 116.67 113.96 1nei s ASP 56 Ca 0.00 -0.67 -0.14 0.00 -3.30 0.00 0.00 52.55 48.44 1nei s ASP 56 Cb 0.00 -0.63 -0.05 0.00 -1.09 0.00 0.00 42.92 41.16 1nei s ASP 56 CO 0.00 0.09 0.32 0.54 0.70 0.00 0.00 175.17 176.82 1nei s VAL 57 N -1.85 5.27 0.02 2.11 0.11 -1.26 -4.58 120.40 120.22 1nei s VAL 57 Ca 0.25 0.62 -0.02 0.00 -2.93 0.00 0.00 61.98 59.91 1nei s VAL 57 Cb -0.08 -3.66 -0.01 0.00 -1.53 0.00 0.00 36.38 31.11 1nei s VAL 57 CO 0.15 0.41 -0.04 0.00 -3.33 0.00 0.00 175.10 172.29 1nei n GLY 59 N 3.04 -2.48 3.32 0.00 0.00 -1.12 -5.08 105.19 102.88 1nei n GLY 59 Ca -0.04 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 44.97 1nei n GLY 59 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11