#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1whc s SER 2 N 0.00 -0.00 -0.45 1.61 0.15 -1.26 -5.10 113.70 108.65 1whc s SER 2 Ca 0.00 0.00 -0.37 0.00 0.70 0.00 0.00 55.95 56.28 1whc s SER 2 Cb 0.00 0.00 -0.14 0.00 -1.71 0.00 0.00 66.02 64.17 1whc s SER 2 CO 0.00 -0.01 2.23 -1.20 1.20 0.00 0.00 173.24 175.46 1whc n SER 3 N 0.29 1.60 0.00 5.45 7.64 -1.26 -3.30 113.62 124.05 1whc n SER 3 Ca 0.03 0.42 0.00 0.00 1.01 0.00 0.00 58.87 60.33 1whc n SER 3 Cb 0.58 -1.15 0.00 0.00 -1.01 0.00 0.00 64.21 62.63 1whc n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1whc n GLY 4 N 6.79 0.71 3.88 0.23 0.00 -1.26 -5.05 105.19 110.49 1whc n GLY 4 Ca 0.47 -0.77 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 1whc n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1whc s SER 5 N -1.17 6.52 -0.53 1.61 0.15 -1.21 -4.36 113.70 114.72 1whc s SER 5 Ca 0.00 0.60 -0.21 0.00 0.70 0.00 0.00 55.95 57.04 1whc s SER 5 Cb 0.00 -2.11 0.03 0.00 -1.71 0.00 0.00 66.02 62.23 1whc s SER 5 CO 0.00 0.26 0.64 -1.20 1.20 0.00 0.00 173.24 174.14 1whc n SER 6 N 1.17 -6.58 -3.38 5.45 7.64 -1.26 -3.59 113.62 113.07 1whc n SER 6 Ca -0.11 -0.01 -0.32 0.00 1.01 0.00 0.00 58.87 59.43 1whc n SER 6 Cb 0.53 -3.46 0.03 0.00 -1.01 0.00 0.00 64.21 60.30 1whc n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1whc n GLY 7 N -0.64 -0.21 1.01 0.23 0.00 -1.26 -4.52 105.19 99.81 1whc n GLY 7 Ca -0.04 0.91 0.12 0.00 0.00 0.00 0.00 46.02 47.01 1whc n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1whc n ALA 8 N -0.81 -3.16 -3.33 4.61 0.00 -1.24 -4.86 120.51 111.72 1whc n ALA 8 Ca -0.14 0.36 -0.13 0.00 0.00 0.00 0.00 53.44 53.53 1whc n ALA 8 Cb 0.62 -1.06 -0.07 0.00 0.00 0.00 0.00 19.45 18.94 1whc n ALA 8 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1whc s GLU 9 N -2.37 0.51 -0.04 0.00 2.02 -1.26 -4.51 118.70 113.06 1whc s GLU 9 Ca 0.00 -0.31 -0.02 0.00 0.02 0.00 0.00 54.97 54.66 1whc s GLU 9 Cb 0.00 -0.49 -0.01 0.00 0.10 0.00 0.00 34.13 33.73 1whc s GLU 9 CO 0.00 -1.10 0.16 -0.07 0.02 0.00 0.00 175.26 174.26 1whc h LEU 10 N 7.70 -0.07 0.00 1.80 4.07 -1.95 -3.50 115.31 123.35 1whc h LEU 10 Ca -0.04 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 57.80 1whc h LEU 10 Cb 1.09 0.02 -0.02 0.00 1.08 0.00 0.00 40.66 42.83 1whc h LEU 10 CO 0.24 0.17 0.06 0.35 -1.08 0.00 0.00 178.44 178.18 1whc n THR 11 N -3.44 0.00 0.14 0.22 -2.24 -1.26 -5.01 114.28 102.69 1whc n THR 11 Ca -0.01 -1.14 0.00 0.00 -2.27 0.00 0.00 64.05 60.63 1whc n THR 11 Cb 0.03 0.87 0.27 0.00 -2.10 0.00 0.00 70.33 69.41 1whc n THR 11 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1whc h ALA 12 N 1.97 1.21 0.13 6.98 0.00 -1.97 -0.50 119.26 127.09 1whc h ALA 12 Ca -0.25 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.25 1whc h ALA 12 Cb 1.01 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1whc h ALA 12 CO 0.33 0.56 -0.06 1.25 0.00 0.00 0.00 179.25 181.33 1whc h LEU 13 N 0.09 -0.15 -0.64 0.00 7.12 -1.95 -3.10 115.31 116.67 1whc h LEU 13 Ca 0.01 0.01 0.13 0.00 0.13 0.00 0.00 57.88 58.15 1whc h LEU 13 Cb 0.79 0.04 -0.12 0.00 -0.53 0.00 0.00 40.66 40.83 1whc h LEU 13 CO 0.06 0.10 -0.20 -0.33 -0.13 0.00 0.00 178.44 177.93 1whc h GLU 14 N -0.59 -0.04 -0.64 1.25 4.39 -1.95 -0.56 114.58 116.44 1whc h GLU 14 Ca -0.02 0.00 0.07 0.00 0.34 0.00 0.00 59.36 59.76 1whc h GLU 14 Cb 0.13 0.01 -0.10 0.00 -0.10 0.00 0.00 28.75 28.69 1whc h GLU 14 CO 0.03 -0.03 -0.54 0.77 -1.16 0.00 0.00 179.01 178.09 1whc h SER 15 N -0.04 -1.87 -0.28 1.42 0.02 -1.21 0.52 113.55 112.11 1whc h SER 15 Ca 0.30 0.27 0.06 0.00 -0.84 0.00 0.00 61.79 61.59 1whc h SER 15 Cb 0.50 0.81 -0.08 0.00 0.14 0.00 0.00 62.40 63.77 1whc h SER 15 CO -0.68 -0.33 -0.32 -0.07 -1.14 0.00 0.00 176.83 174.28 1whc h LEU 16 N -0.23 -1.04 -0.97 5.07 3.38 -1.05 0.26 115.31 120.73 1whc h LEU 16 Ca 0.13 0.17 0.21 0.00 0.09 0.00 0.00 57.88 58.48 1whc h LEU 16 Cb 0.53 0.47 -0.11 0.00 0.09 0.00 0.00 40.66 41.64 1whc h LEU 16 CO -0.73 -0.33 0.55 0.40 0.09 0.00 0.00 178.44 178.42 1whc h ILE 17 N -0.31 0.62 -0.81 1.22 2.04 0.05 0.27 117.51 120.59 1whc h ILE 17 Ca 0.14 -0.22 0.18 0.00 1.00 0.00 0.00 64.86 65.96 1whc h ILE 17 Cb 0.54 -0.07 -0.12 0.00 -0.74 0.00 0.00 36.82 36.43 1whc h ILE 17 CO -0.46 0.12 0.27 -0.08 0.00 0.00 0.00 178.15 178.00 1whc h GLU 18 N 0.63 0.33 -0.02 2.37 4.22 0.36 1.04 114.58 123.50 1whc h GLU 18 Ca 0.59 -0.02 0.01 0.00 0.08 0.00 0.00 59.36 60.01 1whc h GLU 18 Cb 1.01 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.18 1whc h GLU 18 CO -0.43 0.22 0.03 0.52 -2.18 0.00 0.00 179.01 177.17 1whc h MET 19 N 0.34 0.00 0.00 1.92 2.86 -0.15 -3.44 114.93 116.45 1whc h MET 19 Ca 0.47 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.11 1whc h MET 19 Cb 0.84 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.50 1whc h MET 19 CO -0.51 0.00 0.00 0.41 1.06 0.00 0.00 176.91 177.87 1whc n GLY 20 N -1.26 1.91 3.91 8.32 0.00 0.36 -5.13 105.19 113.29 1whc n GLY 20 Ca -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 1whc n GLY 20 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1whc s PHE 21 N -2.00 3.48 0.21 1.61 0.08 -1.05 -5.02 117.98 115.29 1whc s PHE 21 Ca 0.00 0.46 -0.30 0.00 0.12 0.00 0.00 56.93 57.21 1whc s PHE 21 Cb 0.00 -1.93 -0.08 0.00 -0.57 0.00 0.00 43.02 40.43 1whc s PHE 21 CO 0.00 0.42 1.11 -1.25 -0.10 0.00 0.00 175.22 175.40 1whc s PRO 22 N -2.90 4.60 0.10 0.24 0.04 -1.26 -4.26 135.00 131.56 1whc s PRO 22 Ca 0.40 1.75 -0.29 0.00 0.04 0.00 0.00 61.00 62.90 1whc s PRO 22 Cb -0.12 -3.25 -0.11 0.00 0.04 0.00 0.00 34.50 31.06 1whc s PRO 22 CO 0.27 0.10 1.46 -0.09 0.04 0.00 0.00 177.00 178.78 1whc h ARG 23 N 4.78 -0.49 -0.89 4.56 2.43 -1.97 -0.43 114.38 122.37 1whc h ARG 23 Ca -0.45 0.03 0.12 0.00 -0.81 0.00 0.00 59.98 58.87 1whc h ARG 23 Cb 1.21 0.11 -0.13 0.00 -0.42 0.00 0.00 29.97 30.74 1whc h ARG 23 CO 0.71 -0.32 -0.42 0.41 -1.51 0.00 0.00 179.97 178.84 1whc n GLY 24 N -1.37 -2.03 0.10 2.80 0.00 -1.26 0.53 105.19 103.96 1whc n GLY 24 Ca -0.05 1.03 -0.04 0.00 0.00 0.00 0.00 46.02 46.96 1whc n GLY 24 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1whc h ARG 25 N 0.00 -0.20 -0.83 1.61 3.08 -1.73 0.48 114.38 116.79 1whc h ARG 25 Ca 0.25 0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.38 1whc h ARG 25 Cb 0.47 0.04 -0.10 0.00 0.08 0.00 0.00 29.97 30.46 1whc h ARG 25 CO -0.87 -0.13 -0.49 0.00 -1.07 0.00 0.00 179.97 177.41 1whc h ALA 26 N -1.61 -0.46 -0.51 0.04 0.00 0.08 1.32 119.26 118.12 1whc h ALA 26 Ca -0.01 0.10 0.10 0.00 0.00 0.00 0.00 54.91 55.10 1whc h ALA 26 Cb 0.17 1.31 -0.10 0.00 0.00 0.00 0.00 17.79 19.17 1whc h ALA 26 CO -0.01 -0.81 -0.20 0.93 0.00 0.00 0.00 179.25 179.16 1whc h GLU 27 N -0.01 -0.08 0.39 0.00 4.39 0.18 1.48 114.58 120.93 1whc h GLU 27 Ca 0.13 0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.83 1whc h GLU 27 Cb 0.34 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.99 1whc h GLU 27 CO -0.78 -0.05 -0.36 -0.22 -1.16 0.00 0.00 179.01 176.44 1whc h LYS 28 N -0.08 -0.74 0.36 2.33 3.64 0.43 0.10 116.57 122.61 1whc h LYS 28 Ca 0.24 0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.66 1whc h LYS 28 Cb 0.46 0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.43 1whc h LYS 28 CO -0.57 -0.49 -0.41 0.00 -2.27 0.00 0.00 179.45 175.70 1whc h ALA 29 N -0.33 -1.05 -0.97 5.00 0.00 0.26 0.51 119.26 122.67 1whc h ALA 29 Ca -0.03 -0.14 0.14 0.00 0.00 0.00 0.00 54.91 54.87 1whc h ALA 29 Cb 0.68 0.67 -0.15 0.00 0.00 0.00 0.00 17.79 18.99 1whc h ALA 29 CO -0.04 -1.09 -0.41 1.28 0.00 0.00 0.00 179.25 178.99 1whc n LEU 30 N -4.89 -0.69 0.19 0.00 7.99 0.50 0.71 117.00 120.80 1whc n LEU 30 Ca -0.09 1.70 -0.14 0.00 -0.01 0.00 0.00 56.01 57.46 1whc n LEU 30 Cb 0.37 -0.36 -0.07 0.00 -0.11 0.00 0.00 43.42 43.24 1whc n LEU 30 CO 0.20 -1.50 0.69 0.00 -1.51 0.00 0.00 177.39 175.26 1whc h ALA 31 N 1.22 -0.56 -0.93 -1.18 0.00 -0.29 1.46 119.26 118.98 1whc h ALA 31 Ca 0.31 -0.09 0.25 0.00 0.00 0.00 0.00 54.91 55.38 1whc h ALA 31 Cb 0.55 0.38 -0.13 0.00 0.00 0.00 0.00 17.79 18.59 1whc h ALA 31 CO -0.96 -0.85 0.43 -0.07 0.00 0.00 0.00 179.25 177.81 1whc h LEU 32 N -0.57 0.35 -3.19 0.00 3.38 0.47 1.45 115.31 117.19 1whc h LEU 32 Ca -0.01 0.17 -0.30 0.00 0.09 0.00 0.00 57.88 57.83 1whc h LEU 32 Cb 0.52 0.15 -0.16 0.00 0.09 0.00 0.00 40.66 41.26 1whc h LEU 32 CO -0.05 -0.05 0.38 0.35 0.09 0.00 0.00 178.44 179.16 1whc n THR 33 N -5.07 2.37 -4.08 0.22 -2.24 0.22 -4.85 114.28 100.86 1whc n THR 33 Ca 0.25 -1.24 -0.33 0.00 -2.27 0.00 0.00 64.05 60.45 1whc n THR 33 Cb 0.75 -0.91 -0.07 0.00 -2.10 0.00 0.00 70.33 68.00 1whc n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1whc n GLY 34 N -0.18 -0.26 3.95 3.38 0.00 0.50 -0.09 105.19 112.48 1whc n GLY 34 Ca 0.32 0.09 -0.37 0.00 0.00 0.00 0.00 46.02 46.06 1whc n GLY 34 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1whc n ASN 35 N -2.11 -4.47 0.04 1.61 4.13 0.49 -4.87 115.26 110.09 1whc n ASN 35 Ca -0.02 -1.16 -0.22 0.00 1.68 0.00 0.00 54.58 54.86 1whc n ASN 35 Cb 0.45 -1.70 -0.14 0.00 -1.54 0.00 0.00 39.78 36.85 1whc n ASN 35 CO 0.00 0.00 0.00 1.56 0.28 0.00 0.00 177.26 179.10 1whc h GLN 36 N -1.64 0.32 0.00 3.52 4.20 -0.69 -3.51 115.11 117.32 1whc h GLN 36 Ca -0.68 -0.55 0.00 0.00 0.06 0.00 0.00 58.65 57.48 1whc h GLN 36 Cb 1.40 0.21 0.00 0.00 0.30 0.00 0.00 27.48 29.39 1whc h GLN 36 CO 0.45 1.26 0.00 0.41 -0.67 0.00 0.00 178.83 180.29 1whc n GLY 37 N 1.77 -1.25 0.25 3.46 0.00 -1.26 -4.93 105.19 103.23 1whc n GLY 37 Ca -0.23 -1.04 -0.09 0.00 0.00 0.00 0.00 46.02 44.65 1whc n GLY 37 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1whc h ILE 38 N 0.00 0.00 -0.16 -0.61 1.08 -1.98 -2.38 117.51 113.46 1whc h ILE 38 Ca 0.00 -0.19 0.05 0.00 -0.39 0.00 0.00 64.86 64.33 1whc h ILE 38 Cb 0.00 0.00 -0.07 0.00 -3.07 0.00 0.00 36.82 33.68 1whc h ILE 38 CO 0.00 0.00 -0.37 -0.33 -0.69 0.00 0.00 178.15 176.76 1whc h GLU 39 N -0.81 -0.41 -0.97 2.37 5.08 -1.98 0.35 114.58 118.21 1whc h GLU 39 Ca -0.06 0.03 0.16 0.00 -1.00 0.00 0.00 59.36 58.48 1whc h GLU 39 Cb 0.47 0.09 -0.16 0.00 0.50 0.00 0.00 28.75 29.66 1whc h GLU 39 CO 0.10 -0.28 -0.36 0.00 -1.00 0.00 0.00 179.01 177.48 1whc h ALA 40 N 0.30 0.23 0.77 3.43 0.00 -1.92 0.86 119.26 122.94 1whc h ALA 40 Ca 0.09 0.29 -0.04 0.00 0.00 0.00 0.00 54.91 55.25 1whc h ALA 40 Cb 0.59 0.95 0.01 0.00 0.00 0.00 0.00 17.79 19.34 1whc h ALA 40 CO -0.39 -0.58 -0.37 0.00 0.00 0.00 0.00 179.25 177.90 1whc h ALA 41 N 1.46 -1.16 -0.98 0.00 0.00 -0.68 -3.11 119.26 114.79 1whc h ALA 41 Ca 0.36 -0.23 0.16 0.00 0.00 0.00 0.00 54.91 55.21 1whc h ALA 41 Cb 0.62 0.40 -0.16 0.00 0.00 0.00 0.00 17.79 18.64 1whc h ALA 41 CO -0.98 -1.09 -0.36 0.52 0.00 0.00 0.00 179.25 177.35 1whc h MET 42 N -1.14 -0.01 -0.98 0.00 2.07 0.16 1.08 114.93 116.11 1whc h MET 42 Ca -0.11 0.00 0.32 0.00 -2.07 0.00 0.00 59.70 57.85 1whc h MET 42 Cb 0.80 0.00 -0.18 0.00 -1.87 0.00 0.00 31.60 30.35 1whc h MET 42 CO 0.17 -0.00 0.25 -0.44 1.07 0.00 0.00 176.91 177.96 1whc h ASP 43 N -0.01 -0.12 0.64 1.22 5.19 0.72 1.43 116.42 125.49 1whc h ASP 43 Ca 0.37 0.26 -0.03 0.00 -0.62 0.00 0.00 57.03 57.01 1whc h ASP 43 Cb 0.62 0.38 0.01 0.00 0.18 0.00 0.00 39.33 40.51 1whc h ASP 43 CO -0.99 -0.36 -0.31 -0.25 -3.12 0.00 0.00 179.24 174.22 1whc h TRP 44 N 0.04 -0.80 -0.66 4.55 7.01 0.12 -2.00 115.95 124.21 1whc h TRP 44 Ca 0.69 -0.02 0.12 0.00 2.11 0.00 0.00 58.89 61.79 1whc h TRP 44 Cb 1.60 0.27 -0.12 0.00 -2.10 0.00 0.00 29.16 28.80 1whc h TRP 44 CO -0.29 -0.50 -0.29 -0.07 -2.79 0.00 0.00 178.44 174.51 1whc h LEU 45 N -1.13 -1.02 -1.49 0.65 3.38 0.48 0.98 115.31 117.16 1whc h LEU 45 Ca -0.09 0.23 0.23 0.00 0.09 0.00 0.00 57.88 58.34 1whc h LEU 45 Cb 0.66 0.55 -0.07 0.00 0.09 0.00 0.00 40.66 41.89 1whc h LEU 45 CO 0.15 -0.28 0.63 0.24 0.09 0.00 0.00 178.44 179.26 1whc h MET 46 N -0.10 0.38 0.00 1.13 2.86 0.17 1.43 114.93 120.80 1whc h MET 46 Ca 0.28 -0.02 -0.10 0.00 -2.06 0.00 0.00 59.70 57.79 1whc h MET 46 Cb 0.55 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.11 1whc h MET 46 CO -0.72 0.25 -0.49 1.49 1.06 0.00 0.00 176.91 178.50 1whc h GLU 47 N 0.39 0.00 -0.51 1.72 4.22 0.17 -2.93 114.58 117.63 1whc h GLU 47 Ca 0.51 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.95 1whc h GLU 47 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 1whc h GLU 47 CO -0.20 0.49 0.00 0.72 -2.18 0.00 0.00 179.01 177.83 1whc n HIS 48 N -3.39 1.03 0.31 0.92 8.25 0.28 -4.50 115.22 118.12 1whc n HIS 48 Ca 0.01 -0.61 0.15 0.00 -0.26 0.00 0.00 57.72 57.01 1whc n HIS 48 Cb 0.64 -0.16 0.77 0.00 1.12 0.00 0.00 29.99 32.36 1whc n HIS 48 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 1whc h GLU 49 N 3.14 0.00 -0.09 -0.41 -0.00 0.17 1.30 114.58 118.69 1whc h GLU 49 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 59.36 59.33 1whc h GLU 49 Cb 1.18 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.91 1whc h GLU 49 CO 0.13 0.00 -0.19 -3.47 -0.00 0.00 0.00 179.01 175.48 1whc n ASP 50 N -2.95 2.33 -4.32 3.06 -0.08 -1.26 -5.07 116.55 108.25 1whc n ASP 50 Ca -0.01 -3.49 -0.41 0.00 -1.51 0.00 0.00 54.79 49.37 1whc n ASP 50 Cb 0.44 -0.51 0.00 0.00 2.34 0.00 0.00 41.12 43.39 1whc n ASP 50 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1whc n ASP 51 N -1.16 -2.58 0.06 1.67 2.03 0.45 -4.87 116.55 112.15 1whc n ASP 51 Ca 0.21 0.81 -0.13 0.00 0.52 0.00 0.00 54.79 56.20 1whc n ASP 51 Cb 0.76 -0.93 -0.02 0.00 -0.72 0.00 0.00 41.12 40.20 1whc n ASP 51 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1whc h PRO 52 N 0.35 0.43 -0.25 -0.67 0.13 -1.97 -3.42 132.00 126.60 1whc h PRO 52 Ca -0.38 -0.42 -0.11 0.00 -0.87 0.00 0.00 66.00 64.22 1whc h PRO 52 Cb 1.44 0.11 -0.14 0.00 0.13 0.00 0.00 31.00 32.53 1whc h PRO 52 CO 0.47 1.08 -0.28 -0.25 -0.23 0.00 0.00 178.00 178.78 1whc n ASP 53 N -3.79 -2.24 0.31 1.44 8.00 -1.26 -4.98 116.55 114.02 1whc n ASP 53 Ca -0.06 -2.27 0.19 0.00 0.71 0.00 0.00 54.79 53.36 1whc n ASP 53 Cb 0.79 1.26 0.99 0.00 -0.02 0.00 0.00 41.12 44.14 1whc n ASP 53 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 1whc h VAL 54 N 2.84 0.21 -1.16 2.53 3.04 -1.95 -3.25 116.25 118.52 1whc h VAL 54 Ca -0.10 -0.18 -0.40 0.00 -1.01 0.00 0.00 66.70 65.02 1whc h VAL 54 Cb 1.13 1.14 -0.27 0.00 -2.01 0.00 0.00 31.29 31.28 1whc h VAL 54 CO 0.02 0.02 -0.81 -0.67 -1.01 0.00 0.00 177.57 175.12 1whc n ASP 55 N -3.34 -1.38 -4.47 3.17 -0.08 -1.26 -4.95 116.55 104.24 1whc n ASP 55 Ca -0.02 -2.93 -0.37 0.00 -1.51 0.00 0.00 54.79 49.96 1whc n ASP 55 Cb 0.14 0.54 0.05 0.00 2.34 0.00 0.00 41.12 44.18 1whc n ASP 55 CO 0.00 0.00 0.00 -1.84 0.12 0.00 0.00 177.20 175.48 1whc n GLU 56 N 1.74 0.44 -2.48 -0.67 0.28 -1.23 -4.90 120.64 113.82 1whc n GLU 56 Ca 0.17 0.18 -0.41 0.00 -0.16 0.00 0.00 57.16 56.94 1whc n GLU 56 Cb 0.57 -1.76 -0.04 0.00 1.43 0.00 0.00 31.44 31.64 1whc n GLU 56 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 1whc s PRO 57 N -2.36 4.57 -0.96 3.44 0.04 -1.26 -4.97 135.00 133.50 1whc s PRO 57 Ca 0.68 1.75 -0.01 0.00 0.04 0.00 0.00 61.00 63.46 1whc s PRO 57 Cb -0.41 -3.27 0.30 0.00 0.04 0.00 0.00 34.50 31.16 1whc s PRO 57 CO 0.56 0.03 1.32 1.28 0.04 0.00 0.00 177.00 180.23 1whc n LEU 58 N 2.42 5.80 -2.75 -3.56 4.77 -1.26 -4.87 117.00 117.56 1whc n LEU 58 Ca 0.03 -5.30 -0.03 0.00 -0.03 0.00 0.00 56.01 50.69 1whc n LEU 58 Cb 0.46 -1.10 -0.02 0.00 -2.33 0.00 0.00 43.42 40.43 1whc n LEU 58 CO 0.54 1.83 -0.53 -1.20 -1.33 0.00 0.00 177.39 176.70 1whc n SER 59 N 1.06 -4.30 0.00 -1.43 7.64 -1.26 -5.06 113.62 110.27 1whc n SER 59 Ca 0.28 1.26 0.00 0.00 1.01 0.00 0.00 58.87 61.43 1whc n SER 59 Cb 0.35 -4.58 0.00 0.00 -1.01 0.00 0.00 64.21 58.97 1whc n SER 59 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1whc n GLY 60 N 1.43 2.54 0.15 0.23 0.00 -1.26 -5.05 105.19 103.23 1whc n GLY 60 Ca -0.20 0.14 -0.17 0.00 0.00 0.00 0.00 46.02 45.79 1whc n GLY 60 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1whc h PRO 61 N 0.00 0.46 -3.65 1.61 0.13 -2.02 -3.49 132.00 125.04 1whc h PRO 61 Ca 0.00 -0.45 0.07 0.00 -0.87 0.00 0.00 66.00 64.75 1whc h PRO 61 Cb 0.00 0.11 -0.04 0.00 0.13 0.00 0.00 31.00 31.21 1whc h PRO 61 CO 0.00 1.09 -1.02 0.43 -0.23 0.00 0.00 178.00 178.27 1whc n SER 62 N -4.21 -8.25 -4.57 1.44 7.64 -1.26 -4.52 113.62 99.89 1whc n SER 62 Ca -0.10 1.78 -0.39 0.00 1.01 0.00 0.00 58.87 61.17 1whc n SER 62 Cb 0.65 -5.00 -0.03 0.00 -1.01 0.00 0.00 64.21 58.83 1whc n SER 62 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1whc s SER 63 N -5.74 4.88 0.00 6.43 0.01 -1.26 -5.32 113.70 112.70 1whc s SER 63 Ca 0.00 1.38 0.00 0.00 1.31 0.00 0.00 55.95 58.64 1whc s SER 63 Cb 0.00 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.72 1whc s SER 63 CO 0.00 -2.49 0.00 0.61 0.41 0.00 0.00 173.24 171.77