#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 0.21 0.20 1.61 0.01 -1.26 -5.07 113.70 109.40 1whc s SER 2 Ca 0.00 -2.38 0.00 0.00 1.31 0.00 0.00 55.95 54.88 1whc s SER 2 Cb 0.00 0.61 0.00 0.00 0.21 0.00 0.00 66.02 66.84 1whc s SER 2 CO 0.00 -0.13 0.00 -1.20 0.41 0.00 0.00 173.24 172.32 1whc n SER 3 N 3.02 -8.70 -0.26 2.44 7.64 -1.26 -4.97 113.62 111.53 1whc n SER 3 Ca 0.23 1.33 0.00 0.00 1.01 0.00 0.00 58.87 61.45 1whc n SER 3 Cb 0.51 -4.92 0.00 0.00 -1.01 0.00 0.00 64.21 58.79 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 1.84 0.68 3.15 0.23 0.00 -1.26 -4.95 105.19 104.88 1whc n GLY 4 Ca 0.00 -0.66 0.06 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.03 -0.07 0.29 1.61 0.15 -1.26 -4.71 113.70 107.68 1whc s SER 5 Ca 0.00 0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.67 1whc s SER 5 Cb 0.00 1.05 0.00 0.00 -1.71 0.00 0.00 66.02 65.36 1whc s SER 5 CO 0.00 -0.01 0.00 -0.24 1.20 0.00 0.00 173.24 174.19 1whc n SER 6 N 5.18 -1.99 0.00 5.45 2.88 -1.26 -5.06 113.62 118.81 1whc n SER 6 Ca 0.04 0.54 0.00 0.00 -1.33 0.00 0.00 58.87 58.12 1whc n SER 6 Cb 0.57 2.00 0.00 0.00 -0.75 0.00 0.00 64.21 66.04 1whc n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1whc n GLY 7 N -0.42 2.06 3.64 0.46 0.00 -1.26 -5.18 105.19 104.49 1whc n GLY 7 Ca 0.00 -0.86 0.01 0.00 0.00 0.00 0.00 46.02 45.17 1whc n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1whc s ALA 8 N 0.00 -2.15 -0.25 4.61 0.00 -1.26 -5.15 121.76 117.56 1whc s ALA 8 Ca 0.00 0.60 -0.02 0.00 0.00 0.00 0.00 51.96 52.54 1whc s ALA 8 Cb 0.00 0.41 0.14 0.00 0.00 0.00 0.00 23.12 23.66 1whc s ALA 8 CO 0.00 -1.05 0.39 -1.21 0.00 0.00 0.00 175.76 173.88 1whc s GLU 9 N -2.56 0.36 -0.07 0.00 2.02 -1.26 -4.89 118.70 112.30 1whc s GLU 9 Ca 0.14 0.48 -0.06 0.00 0.02 0.00 0.00 54.97 55.55 1whc s GLU 9 Cb 0.04 -0.44 -0.02 0.00 0.10 0.00 0.00 34.13 33.81 1whc s GLU 9 CO -0.03 -0.70 -0.12 1.28 0.02 0.00 0.00 175.26 175.71 1whc n LEU 10 N 5.36 0.85 0.00 1.80 4.77 -1.26 -5.02 117.00 123.51 1whc n LEU 10 Ca -0.03 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 1whc n LEU 10 Cb 0.50 -0.64 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 1whc n LEU 10 CO 0.05 -0.45 0.00 0.35 -1.33 0.00 0.00 177.39 176.01 1whc n THR 11 N -3.36 0.00 -0.01 -5.08 -2.24 -1.26 -4.96 114.28 97.36 1whc n THR 11 Ca -0.05 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.64 1whc n THR 11 Cb 0.17 0.00 -0.14 0.00 -2.10 0.00 0.00 70.33 68.27 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 1.30 0.72 0.09 6.98 0.00 -1.98 -2.98 119.26 123.39 1whc h ALA 12 Ca 0.00 -1.41 -0.00 0.00 0.00 0.00 0.00 54.91 53.50 1whc h ALA 12 Cb 0.00 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1whc h ALA 12 CO 0.00 1.54 -0.04 1.25 0.00 0.00 0.00 179.25 182.00 1whc h LEU 13 N 0.00 -0.10 -0.36 0.00 7.12 -1.96 -3.27 115.31 116.73 1whc h LEU 13 Ca -0.27 0.00 0.08 0.00 0.13 0.00 0.00 57.88 57.82 1whc h LEU 13 Cb 1.99 0.03 -0.08 0.00 -0.53 0.00 0.00 40.66 42.07 1whc h LEU 13 CO 0.09 0.20 -0.14 -0.33 -0.13 0.00 0.00 178.44 178.13 1whc h GLU 14 N -0.66 -0.06 -0.88 1.25 4.39 -1.96 -0.42 114.58 116.23 1whc h GLU 14 Ca -0.01 0.00 0.18 0.00 0.34 0.00 0.00 59.36 59.87 1whc h GLU 14 Cb 0.09 0.01 -0.17 0.00 -0.10 0.00 0.00 28.75 28.59 1whc h GLU 14 CO 0.02 -0.04 -0.22 0.43 -1.16 0.00 0.00 179.01 178.04 1whc n SER 15 N -5.33 -0.31 0.07 1.42 7.64 -1.12 0.19 113.62 116.17 1whc n SER 15 Ca 0.02 1.51 -0.12 0.00 1.01 0.00 0.00 58.87 61.28 1whc n SER 15 Cb 0.24 -0.46 -0.08 0.00 -1.01 0.00 0.00 64.21 62.90 1whc n SER 15 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1whc h LEU 16 N 0.00 -0.19 -1.67 -3.43 3.38 -1.27 -2.93 115.31 109.20 1whc h LEU 16 Ca 0.42 -0.32 0.31 0.00 0.09 0.00 0.00 57.88 58.38 1whc h LEU 16 Cb 0.64 0.05 -0.07 0.00 0.09 0.00 0.00 40.66 41.37 1whc h LEU 16 CO -0.90 0.27 0.76 0.40 0.09 0.00 0.00 178.44 179.06 1whc h ILE 17 N -0.72 0.45 -0.30 1.22 2.04 0.15 1.44 117.51 121.79 1whc h ILE 17 Ca -0.02 -0.06 -0.05 0.00 1.00 0.00 0.00 64.86 65.72 1whc h ILE 17 Cb 0.50 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 1whc h ILE 17 CO 0.04 0.03 -0.04 -0.33 0.00 0.00 0.00 178.15 177.85 1whc h GLU 18 N 0.19 0.47 0.00 2.37 4.39 0.22 -1.48 114.58 120.75 1whc h GLU 18 Ca 0.59 -0.11 -0.01 0.00 0.34 0.00 0.00 59.36 60.17 1whc h GLU 18 Cb 1.91 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 30.50 1whc h GLU 18 CO -0.16 0.54 -0.07 0.52 -1.16 0.00 0.00 179.01 178.67 1whc h MET 19 N 0.45 0.00 0.00 2.33 2.86 0.21 -3.39 114.93 117.39 1whc h MET 19 Ca 0.09 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 1whc h MET 19 Cb 0.36 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.02 1whc h MET 19 CO 0.02 0.07 0.00 0.41 1.06 0.00 0.00 176.91 178.46 1whc n GLY 20 N -0.52 1.89 3.93 8.32 0.00 -0.56 -4.95 105.19 113.30 1whc n GLY 20 Ca -0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 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 0.30 1.61 0.08 -1.21 -5.03 117.98 115.21 1whc s PHE 21 Ca 0.00 0.16 -0.29 0.00 0.12 0.00 0.00 56.93 56.92 1whc s PHE 21 Cb 0.00 -1.69 -0.09 0.00 -0.57 0.00 0.00 43.02 40.66 1whc s PHE 21 CO 0.00 0.54 1.07 -1.25 -0.10 0.00 0.00 175.22 175.49 1whc s PRO 22 N -2.94 4.59 0.11 0.24 0.04 -1.26 -4.30 135.00 131.47 1whc s PRO 22 Ca 0.34 1.73 -0.32 0.00 0.04 0.00 0.00 61.00 62.79 1whc s PRO 22 Cb -0.12 -3.09 -0.12 0.00 0.04 0.00 0.00 34.50 31.21 1whc s PRO 22 CO 0.28 0.19 1.58 -0.09 0.04 0.00 0.00 177.00 178.99 1whc h ARG 23 N 3.63 -0.68 -0.89 4.56 2.43 -1.96 -0.25 114.38 121.22 1whc h ARG 23 Ca -0.47 0.05 0.15 0.00 -0.81 0.00 0.00 59.98 58.90 1whc h ARG 23 Cb 1.21 0.15 -0.15 0.00 -0.42 0.00 0.00 29.97 30.77 1whc h ARG 23 CO 0.66 -0.45 -0.32 0.41 -1.51 0.00 0.00 179.97 178.76 1whc n GLY 24 N -1.48 -1.76 0.21 2.80 0.00 -1.26 0.85 105.19 104.56 1whc n GLY 24 Ca -0.08 0.99 -0.08 0.00 0.00 0.00 0.00 46.02 46.85 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 -0.51 -1.00 1.61 3.08 -1.79 0.23 114.38 116.00 1whc h ARG 25 Ca 0.34 0.03 0.12 0.00 0.07 0.00 0.00 59.98 60.54 1whc h ARG 25 Cb 0.56 0.12 -0.14 0.00 0.08 0.00 0.00 29.97 30.59 1whc h ARG 25 CO -0.89 -0.34 -0.51 0.00 -1.07 0.00 0.00 179.97 177.16 1whc n ALA 26 N -2.30 -0.43 0.10 0.04 0.00 -0.16 0.18 120.51 117.94 1whc n ALA 26 Ca -0.07 0.91 -0.07 0.00 0.00 0.00 0.00 53.44 54.21 1whc n ALA 26 Cb 0.21 -0.26 -0.04 0.00 0.00 0.00 0.00 19.45 19.35 1whc n ALA 26 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1whc h GLU 27 N 0.00 -0.37 -0.78 0.00 5.08 0.47 1.48 114.58 120.46 1whc h GLU 27 Ca 0.24 0.03 0.15 0.00 -1.00 0.00 0.00 59.36 58.77 1whc h GLU 27 Cb 0.49 0.08 -0.15 0.00 0.50 0.00 0.00 28.75 29.67 1whc h GLU 27 CO -0.96 -0.25 -0.25 -0.22 -1.00 0.00 0.00 179.01 176.34 1whc h LYS 28 N -0.38 -0.03 0.19 2.33 3.64 0.82 0.78 116.57 123.92 1whc h LYS 28 Ca -0.02 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1whc h LYS 28 Cb 0.35 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 1whc h LYS 28 CO -0.06 -0.02 -0.10 0.00 -2.27 0.00 0.00 179.45 177.00 1whc h ALA 29 N 1.60 -1.04 -1.36 5.00 0.00 0.23 0.54 119.26 124.23 1whc h ALA 29 Ca 0.35 -0.06 0.48 0.00 0.00 0.00 0.00 54.91 55.68 1whc h ALA 29 Cb 0.58 0.15 -0.14 0.00 0.00 0.00 0.00 17.79 18.38 1whc h ALA 29 CO -0.81 -1.02 0.86 -0.07 0.00 0.00 0.00 179.25 178.21 1whc h LEU 30 N -0.27 0.21 0.34 0.00 -0.00 0.29 0.40 115.31 116.29 1whc h LEU 30 Ca -0.03 0.17 -0.02 0.00 -0.00 0.00 0.00 57.88 58.00 1whc h LEU 30 Cb 0.21 0.17 0.00 0.00 -0.00 0.00 0.00 40.66 41.05 1whc h LEU 30 CO 0.04 -0.28 -0.17 0.00 -0.00 0.00 0.00 178.44 178.03 1whc h ALA 31 N 1.64 -0.62 -0.92 1.53 0.00 0.11 0.78 119.26 121.78 1whc h ALA 31 Ca 0.88 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 55.80 1whc h ALA 31 Cb 2.81 0.18 -0.13 0.00 0.00 0.00 0.00 17.79 20.65 1whc h ALA 31 CO -0.49 -0.59 -0.52 -0.07 0.00 0.00 0.00 179.25 177.57 1whc h LEU 32 N -0.80 -1.89 -0.41 0.00 3.38 0.41 0.43 115.31 116.42 1whc h LEU 32 Ca -0.05 0.31 0.08 0.00 0.09 0.00 0.00 57.88 58.32 1whc h LEU 32 Cb 0.35 0.87 -0.08 0.00 0.09 0.00 0.00 40.66 41.89 1whc h LEU 32 CO 0.08 -0.27 -0.10 0.71 0.09 0.00 0.00 178.44 178.95 1whc h THR 33 N -0.05 0.59 0.00 0.22 1.35 -0.85 -3.46 112.91 110.71 1whc h THR 33 Ca 0.21 -0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.06 1whc h THR 33 Cb 0.49 0.58 0.00 0.00 -1.73 0.00 0.00 68.15 67.49 1whc h THR 33 CO -0.91 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 174.98 1whc n GLY 34 N -1.31 1.07 4.17 5.82 0.00 0.15 -4.67 105.19 110.41 1whc n GLY 34 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 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 0.00 0.06 0.03 1.61 3.02 0.26 -4.84 115.26 115.40 1whc n ASN 35 Ca 0.00 -1.19 -0.22 0.00 -0.03 0.00 0.00 54.58 53.14 1whc n ASN 35 Cb 0.00 -2.12 -0.14 0.00 -0.61 0.00 0.00 39.78 36.91 1whc n ASN 35 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 1whc h GLN 36 N -1.86 0.30 0.00 3.52 1.08 -1.83 -3.51 115.11 112.81 1whc h GLN 36 Ca -0.65 -0.52 0.00 0.00 -1.45 0.00 0.00 58.65 56.03 1whc h GLN 36 Cb 1.39 0.19 0.00 0.00 -0.05 0.00 0.00 27.48 29.01 1whc h GLN 36 CO 0.66 1.25 0.00 0.41 -0.95 0.00 0.00 178.83 180.20 1whc n GLY 37 N 1.86 -1.67 0.21 3.46 0.00 -1.26 -4.97 105.19 102.82 1whc n GLY 37 Ca -0.28 -1.09 -0.07 0.00 0.00 0.00 0.00 46.02 44.59 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 -0.73 -0.61 1.08 -1.96 -2.31 117.51 112.98 1whc h ILE 38 Ca 0.00 -0.62 0.16 0.00 -0.39 0.00 0.00 64.86 64.01 1whc h ILE 38 Cb 0.00 0.00 -0.13 0.00 -3.07 0.00 0.00 36.82 33.62 1whc h ILE 38 CO 0.00 0.00 -0.06 -0.08 -0.69 0.00 0.00 178.15 177.32 1whc h GLU 39 N -1.08 0.06 -0.69 2.37 4.22 -1.97 1.43 114.58 118.91 1whc h GLU 39 Ca -0.05 -0.00 0.06 0.00 0.08 0.00 0.00 59.36 59.45 1whc h GLU 39 Cb 0.36 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.53 1whc h GLU 39 CO 0.08 0.04 0.38 0.00 -2.18 0.00 0.00 179.01 177.33 1whc h ALA 40 N 1.70 0.93 0.59 2.92 0.00 -1.94 0.12 119.26 123.58 1whc h ALA 40 Ca 0.38 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.28 1whc h ALA 40 Cb 0.65 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.32 1whc h ALA 40 CO -0.68 0.06 -0.28 0.00 0.00 0.00 0.00 179.25 178.35 1whc h ALA 41 N 1.36 -0.79 -0.96 0.00 0.00 0.61 -3.14 119.26 116.34 1whc h ALA 41 Ca 0.31 -0.17 0.29 0.00 0.00 0.00 0.00 54.91 55.34 1whc h ALA 41 Cb 0.21 0.31 -0.17 0.00 0.00 0.00 0.00 17.79 18.14 1whc h ALA 41 CO -0.19 -0.73 0.23 0.52 0.00 0.00 0.00 179.25 179.08 1whc h MET 42 N -1.21 0.09 -0.90 0.00 2.07 0.18 1.44 114.93 116.60 1whc h MET 42 Ca -0.08 -0.01 0.16 0.00 -2.07 0.00 0.00 59.70 57.70 1whc h MET 42 Cb 0.61 -0.02 -0.10 0.00 -1.87 0.00 0.00 31.60 30.22 1whc h MET 42 CO 0.13 0.06 0.49 0.22 1.07 0.00 0.00 176.91 178.88 1whc h ASP 43 N 0.09 0.62 0.47 1.22 3.58 -0.75 0.53 116.42 122.18 1whc h ASP 43 Ca 0.64 0.09 -0.02 0.00 0.42 0.00 0.00 57.03 58.16 1whc h ASP 43 Cb 1.44 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 42.48 1whc h ASP 43 CO -0.79 0.25 -0.23 -0.25 -2.88 0.00 0.00 179.24 175.35 1whc h TRP 44 N 0.68 -0.59 -0.64 0.28 7.01 0.20 -1.65 115.95 121.25 1whc h TRP 44 Ca 0.50 -0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.56 1whc h TRP 44 Cb 0.70 0.20 -0.10 0.00 -2.10 0.00 0.00 29.16 27.86 1whc h TRP 44 CO -0.06 -0.37 -0.51 -0.07 -2.79 0.00 0.00 178.44 174.64 1whc h LEU 45 N -0.67 -1.78 -0.97 0.65 3.38 -0.82 0.64 115.31 115.74 1whc h LEU 45 Ca -0.07 0.27 0.33 0.00 0.09 0.00 0.00 57.88 58.50 1whc h LEU 45 Cb 0.49 0.78 -0.16 0.00 0.09 0.00 0.00 40.66 41.86 1whc h LEU 45 CO 0.11 -0.33 0.41 0.24 0.09 0.00 0.00 178.44 178.95 1whc h MET 46 N -0.22 0.15 -0.28 1.13 2.86 0.08 1.68 114.93 120.33 1whc h MET 46 Ca 0.15 -0.01 -0.17 0.00 -2.06 0.00 0.00 59.70 57.61 1whc h MET 46 Cb 0.54 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.16 1whc h MET 46 CO -0.73 0.10 -0.50 1.49 1.06 0.00 0.00 176.91 178.33 1whc h GLU 47 N 0.16 0.77 -0.65 1.72 4.81 0.11 -2.65 114.58 118.84 1whc h GLU 47 Ca 0.71 -0.46 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 1whc h GLU 47 Cb 1.66 0.04 0.00 0.00 0.63 0.00 0.00 28.75 31.09 1whc h GLU 47 CO -0.71 1.08 0.00 0.72 -0.73 0.00 0.00 179.01 179.37 1whc n HIS 48 N -4.01 1.09 0.11 0.92 8.25 0.40 -4.28 115.22 117.71 1whc n HIS 48 Ca -0.03 -0.41 0.19 0.00 -0.26 0.00 0.00 57.72 57.21 1whc n HIS 48 Cb 0.59 -0.24 0.76 0.00 1.12 0.00 0.00 29.99 32.22 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 2.58 0.00 -0.01 -0.41 4.11 0.23 0.43 114.58 121.51 1whc h GLU 49 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.43 1whc h GLU 49 Cb 1.17 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.42 1whc h GLU 49 CO 0.21 0.00 -0.29 -0.25 0.07 0.00 0.00 179.01 178.75 1whc n ASP 50 N -3.80 1.99 -4.31 3.06 8.00 -1.26 -5.07 116.55 115.16 1whc n ASP 50 Ca 0.06 -3.58 -0.42 0.00 0.71 0.00 0.00 54.79 51.56 1whc n ASP 50 Cb 0.53 -0.49 -0.00 0.00 -0.02 0.00 0.00 41.12 41.14 1whc n ASP 50 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1whc n ASP 51 N -1.24 -2.71 0.10 -2.24 2.03 0.15 -4.85 116.55 107.79 1whc n ASP 51 Ca 0.18 0.82 -0.05 0.00 0.52 0.00 0.00 54.79 56.26 1whc n ASP 51 Cb 0.68 -0.90 0.06 0.00 -0.72 0.00 0.00 41.12 40.23 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 0.36 0.07 -0.13 -0.67 0.13 -1.98 -3.41 132.00 126.38 1whc h PRO 52 Ca -0.37 -0.07 -0.11 0.00 -0.87 0.00 0.00 66.00 64.57 1whc h PRO 52 Cb 1.44 0.02 -0.14 0.00 0.13 0.00 0.00 31.00 32.45 1whc h PRO 52 CO 0.47 0.80 -0.24 -0.25 -0.23 0.00 0.00 178.00 178.55 1whc n ASP 53 N -3.67 -2.06 -0.33 1.44 8.00 -1.26 -5.01 116.55 113.65 1whc n ASP 53 Ca -0.02 -2.27 -0.04 0.00 0.71 0.00 0.00 54.79 53.17 1whc n ASP 53 Cb 0.74 1.19 0.09 0.00 -0.02 0.00 0.00 41.12 43.11 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 2.41 1.25 -1.82 2.53 3.04 -1.94 -3.32 116.25 118.39 1whc h VAL 54 Ca -0.14 -0.58 -0.53 0.00 -1.01 0.00 0.00 66.70 64.44 1whc h VAL 54 Cb 1.13 0.02 -0.37 0.00 -2.01 0.00 0.00 31.29 30.06 1whc h VAL 54 CO 0.01 0.27 -1.06 -0.90 -1.01 0.00 0.00 177.57 174.88 1whc n ASP 55 N -4.37 -0.10 -4.46 3.17 5.68 -1.26 -5.00 116.55 110.21 1whc n ASP 55 Ca 0.10 -2.75 -0.37 0.00 -0.50 0.00 0.00 54.79 51.27 1whc n ASP 55 Cb 0.07 -0.42 0.05 0.00 -1.14 0.00 0.00 41.12 39.68 1whc n ASP 55 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 1whc n GLU 56 N 1.43 0.40 -2.48 0.11 0.28 -1.25 -4.89 120.64 114.23 1whc n GLU 56 Ca 0.20 0.17 -0.41 0.00 -0.16 0.00 0.00 57.16 56.96 1whc n GLU 56 Cb 0.54 -1.75 -0.04 0.00 1.43 0.00 0.00 31.44 31.63 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 -2.39 4.54 -0.81 3.44 0.04 -1.26 -4.98 135.00 133.58 1whc s PRO 57 Ca 0.67 1.74 0.02 0.00 0.04 0.00 0.00 61.00 63.47 1whc s PRO 57 Cb -0.40 -3.29 0.28 0.00 0.04 0.00 0.00 34.50 31.13 1whc s PRO 57 CO 0.57 -0.02 1.05 1.28 0.04 0.00 0.00 177.00 179.91 1whc n LEU 58 N 2.76 4.86 -3.49 -3.56 4.32 -1.26 -4.99 117.00 115.63 1whc n LEU 58 Ca 0.04 -5.37 -0.10 0.00 -0.02 0.00 0.00 56.01 50.57 1whc n LEU 58 Cb 0.46 -0.90 -0.03 0.00 -1.62 0.00 0.00 43.42 41.33 1whc n LEU 58 CO 0.54 1.93 0.62 -0.44 -1.22 0.00 0.00 177.39 178.82 1whc s SER 59 N -2.24 -0.43 0.85 -1.43 0.01 -1.26 -5.16 113.70 104.04 1whc s SER 59 Ca 0.37 0.09 -0.13 0.00 1.31 0.00 0.00 55.95 57.58 1whc s SER 59 Cb 0.11 0.43 0.05 0.00 0.21 0.00 0.00 66.02 66.83 1whc s SER 59 CO 0.03 -0.66 0.81 0.61 0.41 0.00 0.00 173.24 174.44 1whc n GLY 60 N -0.09 -1.00 3.78 3.44 0.00 -1.26 -4.95 105.19 105.12 1whc n GLY 60 Ca -0.11 -0.58 -0.36 0.00 0.00 0.00 0.00 46.02 44.97 1whc n GLY 60 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1whc s PRO 61 N -3.76 4.08 0.03 1.61 0.04 -1.26 -4.94 135.00 130.79 1whc s PRO 61 Ca 0.66 1.49 0.00 0.00 0.04 0.00 0.00 61.00 63.19 1whc s PRO 61 Cb -0.27 -2.45 0.00 0.00 0.04 0.00 0.00 34.50 31.82 1whc s PRO 61 CO 0.58 -0.21 0.00 -1.13 0.04 0.00 0.00 177.00 176.28 1whc n SER 62 N -0.26 0.01 -3.47 6.66 3.41 -1.26 -5.10 113.62 113.61 1whc n SER 62 Ca 0.06 0.05 0.01 0.00 -0.26 0.00 0.00 58.87 58.72 1whc n SER 62 Cb 0.50 0.03 -0.04 0.00 -0.26 0.00 0.00 64.21 64.44 1whc n SER 62 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1whc s SER 63 N -5.02 -0.91 0.00 4.04 0.01 -1.26 -5.35 113.70 105.20 1whc s SER 63 Ca 0.00 1.13 0.00 0.00 1.31 0.00 0.00 55.95 58.39 1whc s SER 63 Cb 0.00 1.99 0.00 0.00 0.21 0.00 0.00 66.02 68.22 1whc s SER 63 CO 0.00 -0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.09