#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wep n SER 2 N 0.00 -2.39 -4.66 1.61 3.41 -1.26 -4.91 113.62 105.43 1wep n SER 2 Ca 0.00 -1.07 -0.29 0.00 -0.26 0.00 0.00 58.87 57.25 1wep n SER 2 Cb 0.00 -2.52 0.18 0.00 -0.26 0.00 0.00 64.21 61.61 1wep n SER 2 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1wep s SER 3 N -3.50 2.53 0.00 4.04 0.15 -1.26 -5.08 113.70 110.59 1wep s SER 3 Ca 0.61 1.23 0.00 0.00 0.70 0.00 0.00 55.95 58.49 1wep s SER 3 Cb -0.34 -1.91 0.00 0.00 -1.71 0.00 0.00 66.02 62.06 1wep s SER 3 CO 0.95 -3.20 0.00 0.61 1.20 0.00 0.00 173.24 172.80 1wep n GLY 4 N -0.94 1.03 3.56 9.45 0.00 -1.26 -5.16 105.19 111.88 1wep n GLY 4 Ca 0.05 -0.67 -0.09 0.00 0.00 0.00 0.00 46.02 45.32 1wep n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wep s SER 5 N -1.00 -0.39 0.07 1.61 0.15 -1.26 -5.17 113.70 107.71 1wep s SER 5 Ca 0.00 -0.15 -0.05 0.00 0.70 0.00 0.00 55.95 56.45 1wep s SER 5 Cb 0.00 0.52 -0.05 0.00 -1.71 0.00 0.00 66.02 64.78 1wep s SER 5 CO 0.00 -0.89 0.31 -0.94 1.20 0.00 0.00 173.24 172.92 1wep s SER 6 N -2.71 6.49 0.22 5.45 1.04 -1.26 -5.11 113.70 117.82 1wep s SER 6 Ca 0.06 0.56 0.07 0.00 0.48 0.00 0.00 55.95 57.11 1wep s SER 6 Cb -0.02 -2.08 -0.05 0.00 0.10 0.00 0.00 66.02 63.97 1wep s SER 6 CO -0.06 0.17 -0.12 -0.83 0.98 0.00 0.00 173.24 173.38 1wep s GLY 7 N -2.04 1.48 0.00 7.32 0.00 -1.26 -5.16 107.32 107.67 1wep s GLY 7 Ca 0.33 -1.70 0.02 0.00 0.00 0.00 0.00 44.72 43.37 1wep s GLY 7 CO 0.21 -1.76 -0.06 -0.29 0.00 0.00 0.00 173.10 171.20 1wep s MET 8 N -3.68 0.46 -0.06 2.90 -2.45 -1.26 -5.10 119.30 110.12 1wep s MET 8 Ca 0.24 -0.28 -0.32 0.00 -1.25 0.00 0.00 55.69 54.07 1wep s MET 8 Cb 0.01 -0.41 -0.16 0.00 1.25 0.00 0.00 34.83 35.52 1wep s MET 8 CO 0.07 0.11 0.89 0.00 1.05 0.00 0.00 175.02 177.14 1wep n ALA 9 N 2.72 -2.68 -2.82 4.11 0.00 -1.26 -4.94 120.51 115.65 1wep n ALA 9 Ca -0.14 0.45 -0.28 0.00 0.00 0.00 0.00 53.44 53.47 1wep n ALA 9 Cb 0.58 -1.38 -0.16 0.00 0.00 0.00 0.00 19.45 18.48 1wep n ALA 9 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1wep s LEU 10 N 0.34 1.98 0.20 0.00 2.34 -1.26 -5.12 118.68 117.16 1wep s LEU 10 Ca 0.72 -0.41 -0.30 0.00 0.06 0.00 0.00 54.13 54.20 1wep s LEU 10 Cb -1.01 -1.12 -0.08 0.00 -0.56 0.00 0.00 46.19 43.41 1wep s LEU 10 CO 0.47 0.19 1.09 0.54 -1.06 0.00 0.00 176.35 177.58 1wep s VAL 11 N -0.06 3.81 0.72 1.48 0.11 -1.26 -5.03 120.40 120.17 1wep s VAL 11 Ca -0.03 1.63 -0.12 0.00 -2.93 0.00 0.00 61.98 60.52 1wep s VAL 11 Cb -0.12 -4.04 0.03 0.00 -1.53 0.00 0.00 36.38 30.72 1wep s VAL 11 CO 0.03 0.31 1.10 -2.16 -3.33 0.00 0.00 175.10 171.05 1wep s PRO 12 N -0.66 2.49 0.44 1.54 0.04 -1.26 -4.69 135.00 132.90 1wep s PRO 12 Ca 0.48 1.26 -0.08 0.00 0.04 0.00 0.00 61.00 62.70 1wep s PRO 12 Cb -0.30 -1.92 -0.05 0.00 0.04 0.00 0.00 34.50 32.27 1wep s PRO 12 CO 0.36 -1.47 0.79 0.14 0.04 0.00 0.00 177.00 176.85 1wep s VAL 13 N -2.66 4.84 0.00 -0.36 -7.23 -1.26 -4.37 120.40 109.36 1wep s VAL 13 Ca 0.64 0.45 0.00 0.00 -1.81 0.00 0.00 61.98 61.26 1wep s VAL 13 Cb -0.19 -3.79 0.00 0.00 0.56 0.00 0.00 36.38 32.96 1wep s VAL 13 CO 0.50 -0.68 0.00 -1.22 -0.31 0.00 0.00 175.10 173.39 1wep n TYR 14 N -1.75 0.00 -1.08 2.82 4.01 -1.01 -4.93 117.16 115.21 1wep n TYR 14 Ca 0.02 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.49 1wep n TYR 14 Cb 0.54 0.00 0.22 0.00 -0.31 0.00 0.00 39.34 39.79 1wep n TYR 14 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1wep n LEU 16 N 0.00 0.68 -0.43 0.00 4.77 -1.26 -3.62 117.00 117.15 1wep n LEU 16 Ca 0.14 0.22 0.05 0.00 -0.03 0.00 0.00 56.01 56.39 1wep n LEU 16 Cb 0.52 -0.19 0.17 0.00 -2.33 0.00 0.00 43.42 41.59 1wep n LEU 16 CO 0.36 -0.04 0.63 0.00 -1.33 0.00 0.00 177.39 177.01 1wep n ARG 18 N 0.15 -6.92 -4.90 0.00 3.00 -1.24 -5.01 116.66 101.73 1wep n ARG 18 Ca 0.09 0.78 -0.30 0.00 -0.01 0.00 0.00 57.85 58.41 1wep n ARG 18 Cb 0.21 -5.63 -0.15 0.00 0.00 0.00 0.00 32.46 26.89 1wep n ARG 18 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 1wep s GLN 19 N -5.85 1.81 -0.02 5.56 -1.52 -1.26 -4.88 119.66 113.50 1wep s GLN 19 Ca 0.34 -1.11 -0.22 0.00 -1.95 0.00 0.00 55.36 52.42 1wep s GLN 19 Cb -0.15 -1.99 -0.14 0.00 -0.22 0.00 0.00 33.01 30.51 1wep s GLN 19 CO 0.68 0.51 0.97 -1.00 -0.25 0.00 0.00 175.29 176.20 1wep h PRO 20 N 4.78 -0.43 -0.12 2.91 0.13 -1.84 -2.68 132.00 134.75 1wep h PRO 20 Ca -0.47 0.03 0.27 0.00 -0.87 0.00 0.00 66.00 64.96 1wep h PRO 20 Cb 1.14 0.10 -0.25 0.00 0.13 0.00 0.00 31.00 32.12 1wep h PRO 20 CO 0.44 -0.10 0.45 -0.47 -0.23 0.00 0.00 178.00 178.08 1wep s TYR 21 N -3.98 -0.11 -0.94 1.56 6.14 -1.26 -4.46 117.35 114.30 1wep s TYR 21 Ca -0.12 0.16 -0.01 0.00 0.64 0.00 0.00 57.07 57.73 1wep s TYR 21 Cb 0.01 0.05 0.29 0.00 0.42 0.00 0.00 41.96 42.74 1wep s TYR 21 CO 0.44 -0.05 1.24 0.09 0.64 0.00 0.00 175.55 177.91 1wep n ASN 22 N 4.88 5.57 -0.22 4.32 4.13 -1.26 -4.85 115.26 127.83 1wep n ASN 22 Ca -0.07 -3.41 0.24 0.00 1.68 0.00 0.00 54.58 53.01 1wep n ASN 22 Cb 0.55 -1.09 0.61 0.00 -1.54 0.00 0.00 39.78 38.32 1wep n ASN 22 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 1wep h VAL 23 N 3.37 0.60 -0.23 2.41 2.07 -1.98 0.99 116.25 123.47 1wep h VAL 23 Ca 0.20 -0.07 0.07 0.00 0.82 0.00 0.00 66.70 67.71 1wep h VAL 23 Cb 0.63 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1wep h VAL 23 CO 1.17 0.04 0.65 0.78 0.02 0.00 0.00 177.57 180.23 1wep h ASN 24 N 0.21 0.00 0.00 0.57 -0.26 -2.06 -3.30 115.58 110.74 1wep h ASN 24 Ca 0.46 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.20 1wep h ASN 24 Cb 1.47 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.73 1wep h ASN 24 CO -0.11 0.00 0.00 1.41 -1.06 0.00 0.00 177.43 177.67 1wep n HIS 25 N -3.01 0.00 0.00 1.19 8.25 0.33 -5.16 115.22 116.82 1wep n HIS 25 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 1wep n HIS 25 Cb 0.75 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.86 1wep n HIS 25 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1wep n PHE 26 N -0.94 0.00 -3.50 4.41 -0.00 -1.14 -4.99 117.46 111.30 1wep n PHE 26 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 57.45 57.35 1wep n PHE 26 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 39.48 39.45 1wep n PHE 26 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.76 175.12 1wep s MET 27 N -2.00 0.89 0.16 -4.13 -1.94 -1.26 -3.89 119.30 107.13 1wep s MET 27 Ca 0.00 -0.24 0.02 0.00 -1.71 0.00 0.00 55.69 53.76 1wep s MET 27 Cb 0.00 0.41 -0.01 0.00 2.01 0.00 0.00 34.83 37.24 1wep s MET 27 CO 0.00 -0.37 0.09 0.44 -0.01 0.00 0.00 175.02 175.17 1wep n ILE 28 N -0.08 0.00 -4.08 2.53 -6.64 -0.78 -4.96 119.36 105.35 1wep n ILE 28 Ca -0.11 -1.02 -0.18 0.00 -1.77 0.00 0.00 62.75 59.67 1wep n ILE 28 Cb 0.62 0.43 -0.16 0.00 -1.44 0.00 0.00 39.64 39.09 1wep n ILE 28 CO 0.00 0.00 0.00 -0.70 -1.77 0.00 0.00 176.55 174.08 1wep s GLU 29 N -2.62 0.53 -0.10 6.28 2.12 -1.26 -2.94 118.70 120.71 1wep s GLU 29 Ca 0.12 -0.06 -0.29 0.00 0.36 0.00 0.00 54.97 55.10 1wep s GLU 29 Cb 0.01 -0.59 -0.02 0.00 0.26 0.00 0.00 34.13 33.79 1wep s GLU 29 CO 0.09 -0.05 0.97 0.00 -0.54 0.00 0.00 175.26 175.73 1wep n GLY 31 N 3.10 2.21 1.24 0.00 0.00 -0.30 -0.98 105.19 110.46 1wep n GLY 31 Ca 0.07 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1wep n GLY 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wep n LEU 32 N 0.24 0.22 -0.16 0.99 4.77 -1.26 -4.86 117.00 116.93 1wep n LEU 32 Ca 0.07 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.08 1wep n LEU 32 Cb 0.60 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 1wep n LEU 32 CO 0.07 -0.15 0.21 0.00 -1.33 0.00 0.00 177.39 176.20 1wep n GLN 34 N -0.23 -6.22 -4.18 0.00 6.02 -0.15 -5.01 117.38 107.61 1wep n GLN 34 Ca 0.03 0.75 -0.27 0.00 -0.01 0.00 0.00 57.00 57.49 1wep n GLN 34 Cb 0.14 -5.48 -0.07 0.00 1.02 0.00 0.00 30.24 25.84 1wep n GLN 34 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1wep s ASP 35 N -3.93 4.91 -0.04 1.08 1.11 -1.25 -4.81 116.67 113.74 1wep s ASP 35 Ca 0.15 -0.33 0.01 0.00 0.18 0.00 0.00 52.55 52.56 1wep s ASP 35 Cb -0.07 -1.10 -0.03 0.00 1.07 0.00 0.00 42.92 42.79 1wep s ASP 35 CO 0.65 0.10 -0.05 0.26 1.18 0.00 0.00 175.17 177.31 1wep s TRP 36 N -1.68 2.98 0.27 4.23 0.52 -1.26 -0.33 118.94 123.68 1wep s TRP 36 Ca 0.28 0.05 0.00 0.00 0.02 0.00 0.00 56.10 56.45 1wep s TRP 36 Cb -0.10 -1.69 -0.03 0.00 -1.15 0.00 0.00 33.47 30.51 1wep s TRP 36 CO 0.19 0.39 0.28 -0.06 0.02 0.00 0.00 176.95 177.77 1wep s PHE 37 N -0.91 1.27 0.20 -1.98 0.40 -1.15 -1.89 117.98 113.92 1wep s PHE 37 Ca 0.15 -1.40 0.04 0.00 -0.60 0.00 0.00 56.93 55.13 1wep s PHE 37 Cb -0.11 -0.45 -0.03 0.00 0.51 0.00 0.00 43.02 42.93 1wep s PHE 37 CO 0.04 -0.84 0.29 -1.01 0.70 0.00 0.00 175.22 174.40 1wep s HIS 38 N -3.70 3.39 0.26 0.36 3.76 -1.26 -1.87 115.29 116.22 1wep s HIS 38 Ca 0.36 0.01 0.12 0.00 -0.15 0.00 0.00 55.06 55.41 1wep s HIS 38 Cb 0.03 -1.57 0.45 0.00 1.11 0.00 0.00 32.58 32.60 1wep s HIS 38 CO 0.19 0.48 1.65 0.78 -0.85 0.00 0.00 174.74 176.99 1wep h GLY 39 N 1.65 0.00 1.59 -2.22 0.00 -1.68 -1.73 103.07 100.68 1wep h GLY 39 Ca -0.50 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 46.62 1wep h GLY 39 CO 0.64 0.00 -1.18 0.23 0.00 0.00 0.00 176.54 176.22 1wep h SER 40 N 0.00 0.00 0.86 0.19 0.87 -1.91 0.84 113.55 114.40 1wep h SER 40 Ca -0.01 0.00 -0.21 0.00 -1.23 0.00 0.00 61.79 60.34 1wep h SER 40 Cb 1.03 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.96 1wep h SER 40 CO 0.07 0.88 -0.98 0.00 -0.53 0.00 0.00 176.83 176.27 1wep n VAL 42 N -3.46 1.05 0.00 0.00 0.24 -0.66 -4.98 118.33 110.53 1wep n VAL 42 Ca -0.02 -0.33 0.00 0.00 -2.04 0.00 0.00 64.34 61.95 1wep n VAL 42 Cb 0.91 -1.47 0.00 0.00 -1.47 0.00 0.00 33.84 31.81 1wep n VAL 42 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wep n GLY 43 N 2.19 0.98 2.93 7.63 0.00 0.26 -5.06 105.19 114.11 1wep n GLY 43 Ca -0.35 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.39 1wep n GLY 43 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wep s ILE 44 N -1.56 1.13 0.35 -0.61 1.01 0.51 -5.00 121.20 117.03 1wep s ILE 44 Ca 0.00 -0.36 -0.14 0.00 0.00 0.00 0.00 60.65 60.16 1wep s ILE 44 Cb 0.00 -1.13 -0.08 0.00 0.01 0.00 0.00 42.46 41.26 1wep s ILE 44 CO 0.00 0.39 0.75 -1.61 0.00 0.00 0.00 174.94 174.46 1wep s GLU 45 N 1.65 3.94 0.22 2.79 2.02 -1.26 -3.90 118.70 124.16 1wep s GLU 45 Ca 0.05 0.62 -0.09 0.00 0.02 0.00 0.00 54.97 55.57 1wep s GLU 45 Cb -0.13 -2.42 0.22 0.00 0.10 0.00 0.00 34.13 31.91 1wep s GLU 45 CO -0.09 0.10 1.87 1.49 0.02 0.00 0.00 175.26 178.65 1wep h GLU 46 N 1.97 0.96 -0.04 1.61 4.81 -1.98 0.25 114.58 122.16 1wep h GLU 46 Ca -0.48 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 58.71 1wep h GLU 46 Cb 1.18 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 30.34 1wep h GLU 46 CO 0.65 0.63 0.03 1.05 -0.73 0.00 0.00 179.01 180.64 1wep h GLU 47 N 0.99 0.00 0.00 1.92 4.11 -2.02 -1.59 114.58 117.99 1wep h GLU 47 Ca 0.31 0.00 -0.21 0.00 0.07 0.00 0.00 59.36 59.53 1wep h GLU 47 Cb -0.01 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.20 1wep h GLU 47 CO -0.10 0.00 -1.61 0.09 0.07 0.00 0.00 179.01 177.45 1wep n ASN 48 N -4.26 0.74 -0.34 3.06 3.02 -0.44 -4.15 115.26 112.88 1wep n ASN 48 Ca -0.02 0.33 0.07 0.00 -0.03 0.00 0.00 54.58 54.93 1wep n ASN 48 Cb 0.13 0.27 0.23 0.00 -0.61 0.00 0.00 39.78 39.80 1wep n ASN 48 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wep h ALA 49 N 1.30 1.43 0.00 5.41 0.00 0.48 0.35 119.26 128.24 1wep h ALA 49 Ca -0.23 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1wep h ALA 49 Cb 1.73 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.37 1wep h ALA 49 CO 0.05 0.13 0.00 1.55 0.00 0.00 0.00 179.25 180.98 1wep n VAL 50 N -4.69 1.44 0.51 0.00 3.14 -1.18 -0.49 118.33 117.07 1wep n VAL 50 Ca 0.18 0.36 0.06 0.00 -2.96 0.00 0.00 64.34 61.98 1wep n VAL 50 Cb 0.37 -1.29 0.02 0.00 -1.06 0.00 0.00 33.84 31.88 1wep n VAL 50 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1wep n ASP 51 N -1.42 1.64 -4.38 6.55 -0.08 0.12 -4.86 116.55 114.12 1wep n ASP 51 Ca 0.01 -1.32 -0.45 0.00 -1.51 0.00 0.00 54.79 51.52 1wep n ASP 51 Cb 0.04 0.26 -0.03 0.00 2.34 0.00 0.00 41.12 43.73 1wep n ASP 51 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1wep s ILE 52 N -1.28 5.13 0.28 5.18 1.01 0.36 -0.00 121.20 131.88 1wep s ILE 52 Ca 0.12 -1.78 -0.02 0.00 0.00 0.00 0.00 60.65 58.96 1wep s ILE 52 Cb 0.10 -4.56 0.27 0.00 0.01 0.00 0.00 42.46 38.27 1wep s ILE 52 CO 0.23 -1.19 1.93 -0.78 0.00 0.00 0.00 174.94 175.13 1wep h ASP 53 N 8.51 1.01 -2.42 3.58 1.82 -1.76 -3.40 116.42 123.77 1wep h ASP 53 Ca -0.00 -0.01 -0.34 0.00 -0.39 0.00 0.00 57.03 56.28 1wep h ASP 53 Cb 1.05 -0.24 -0.35 0.00 0.68 0.00 0.00 39.33 40.47 1wep h ASP 53 CO 0.96 0.70 -0.65 -0.63 -1.61 0.00 0.00 179.24 178.02 1wep s ILE 54 N -5.99 -0.32 0.31 2.25 1.01 -1.21 -4.93 121.20 112.31 1wep s ILE 54 Ca -0.12 -0.32 -0.28 0.00 0.00 0.00 0.00 60.65 59.93 1wep s ILE 54 Cb 0.19 -0.82 -0.09 0.00 0.01 0.00 0.00 42.46 41.74 1wep s ILE 54 CO 0.81 -0.36 1.02 -0.47 0.00 0.00 0.00 174.94 175.94 1wep s TYR 55 N 2.31 3.62 -0.27 3.97 5.04 -1.25 -0.41 117.35 130.37 1wep s TYR 55 Ca 0.08 1.75 0.03 0.00 -2.44 0.00 0.00 57.07 56.49 1wep s TYR 55 Cb -0.15 -3.12 0.07 0.00 0.35 0.00 0.00 41.96 39.11 1wep s TYR 55 CO -0.22 -0.20 -0.07 -1.01 -1.34 0.00 0.00 175.55 172.70 1wep s HIS 56 N -1.36 3.15 0.83 4.97 3.76 -1.26 -1.15 115.29 124.23 1wep s HIS 56 Ca 0.48 -2.31 -0.15 0.00 -0.15 0.00 0.00 55.06 52.93 1wep s HIS 56 Cb -0.26 -2.01 -0.01 0.00 1.11 0.00 0.00 32.58 31.41 1wep s HIS 56 CO 0.33 -0.87 0.46 0.00 -0.85 0.00 0.00 174.74 173.81 1wep n PRO 58 N -1.10 0.49 -0.03 0.00 -0.04 -1.26 -1.89 135.00 131.17 1wep n PRO 58 Ca 0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1wep n PRO 58 Cb 0.52 -1.11 -0.09 0.00 -0.04 0.00 0.00 33.50 32.77 1wep n PRO 58 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1wep n ASP 59 N -0.61 2.16 -0.09 3.54 2.03 -1.26 -4.61 116.55 117.71 1wep n ASP 59 Ca 0.03 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.23 1wep n ASP 59 Cb 0.01 1.17 -0.15 0.00 -0.72 0.00 0.00 41.12 41.43 1wep n ASP 59 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1wep h GLU 61 N 0.00 0.00 0.00 0.00 4.81 -1.52 0.49 114.58 118.36 1wep h GLU 61 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1wep h GLU 61 Cb 2.18 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.56 1wep h GLU 61 CO 0.03 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.31 1wep n ALA 62 N -2.42 1.74 0.01 2.92 0.00 -1.26 -1.80 120.51 119.70 1wep n ALA 62 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1wep n ALA 62 Cb 0.51 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.76 1wep n ALA 62 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1wep n VAL 63 N -1.29 0.06 -0.03 0.00 0.31 0.13 -4.90 118.33 112.61 1wep n VAL 63 Ca 0.06 0.02 -0.15 0.00 -0.01 0.00 0.00 64.34 64.26 1wep n VAL 63 Cb 0.10 -0.95 -0.11 0.00 -0.91 0.00 0.00 33.84 31.97 1wep n VAL 63 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1wep h PHE 64 N 0.00 0.17 0.00 3.52 -1.00 -0.52 -3.51 116.94 115.60 1wep h PHE 64 Ca 0.00 -0.09 0.00 0.00 2.81 0.00 0.00 57.97 60.69 1wep h PHE 64 Cb 0.40 -0.02 0.00 0.00 3.61 0.00 0.00 35.95 39.93 1wep h PHE 64 CO 0.00 0.87 0.00 0.41 -1.61 0.00 0.00 178.31 177.98 1wep n GLY 65 N 1.00 0.54 3.63 -1.45 0.00 -0.74 -5.00 105.19 103.17 1wep n GLY 65 Ca -0.09 -1.95 -0.29 0.00 0.00 0.00 0.00 46.02 43.68 1wep n GLY 65 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wep s PRO 66 N -0.82 -0.53 0.20 1.61 0.04 -1.26 -4.04 135.00 130.19 1wep s PRO 66 Ca 0.00 0.19 -0.16 0.00 0.04 0.00 0.00 61.00 61.06 1wep s PRO 66 Cb 0.00 -1.65 -0.08 0.00 0.04 0.00 0.00 34.50 32.81 1wep s PRO 66 CO 0.00 -3.30 0.63 -1.12 0.04 0.00 0.00 177.00 173.25 1wep s SER 67 N -3.69 6.90 0.67 6.66 0.01 -1.26 -4.79 113.70 118.21 1wep s SER 67 Ca 0.68 1.22 -0.11 0.00 1.31 0.00 0.00 55.95 59.05 1wep s SER 67 Cb -0.14 -2.34 -0.01 0.00 0.21 0.00 0.00 66.02 63.74 1wep s SER 67 CO 0.57 0.04 1.06 -0.63 0.41 0.00 0.00 173.24 174.68 1wep s ILE 68 N -1.56 4.12 -0.02 1.44 -1.09 0.45 -4.94 121.20 119.61 1wep s ILE 68 Ca 0.42 0.69 0.02 0.00 -2.23 0.00 0.00 60.65 59.55 1wep s ILE 68 Cb -0.15 -3.60 -0.00 0.00 -1.58 0.00 0.00 42.46 37.13 1wep s ILE 68 CO 0.20 -0.90 -0.08 -0.04 -1.23 0.00 0.00 174.94 172.88 1wep s MET 69 N -5.19 0.80 1.30 2.79 -1.94 -1.26 -2.88 119.30 112.92 1wep s MET 69 Ca 0.57 -0.29 -0.19 0.00 -1.71 0.00 0.00 55.69 54.07 1wep s MET 69 Cb -0.12 -0.77 0.30 0.00 2.01 0.00 0.00 34.83 36.25 1wep s MET 69 CO 0.54 0.14 0.72 1.63 -0.01 0.00 0.00 175.02 178.03 1wep n LYS 70 N 3.12 -3.61 -3.17 2.03 5.02 1.00 -4.51 118.16 118.03 1wep n LYS 70 Ca -0.16 -1.06 -0.22 0.00 -2.02 0.00 0.00 58.31 54.84 1wep n LYS 70 Cb 0.55 -1.87 -0.05 0.00 -0.02 0.00 0.00 35.03 33.65 1wep n LYS 70 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1wep n ASN 71 N -4.40 1.66 -0.23 4.39 4.13 -1.26 -4.83 115.26 114.72 1wep n ASN 71 Ca 0.08 -3.10 -0.06 0.00 1.68 0.00 0.00 54.58 53.18 1wep n ASN 71 Cb 0.54 -0.62 0.04 0.00 -1.54 0.00 0.00 39.78 38.20 1wep n ASN 71 CO 0.00 0.00 0.00 -0.50 0.28 0.00 0.00 177.26 177.04 1wep h TRP 72 N 3.41 0.89 0.00 3.10 4.06 -1.94 -3.37 115.95 122.10 1wep h TRP 72 Ca 0.11 -0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.03 1wep h TRP 72 Cb 0.82 -0.28 0.00 0.00 -1.00 0.00 0.00 29.16 28.70 1wep h TRP 72 CO 0.53 0.65 -0.27 -2.39 -3.56 0.00 0.00 178.44 173.41 1wep n HIS 73 N -4.52 -0.58 -0.35 0.49 1.44 -1.26 -4.86 115.22 105.57 1wep n HIS 73 Ca 0.05 0.10 0.01 0.00 -2.01 0.00 0.00 57.72 55.86 1wep n HIS 73 Cb 0.10 0.30 0.07 0.00 0.12 0.00 0.00 29.99 30.58 1wep n HIS 73 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 1wep h SER 74 N 0.00 -1.22 0.00 4.39 4.64 -1.92 -3.47 113.55 115.96 1wep h SER 74 Ca 0.00 0.29 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 1wep h SER 74 Cb 0.27 0.68 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 1wep h SER 74 CO 0.00 -0.30 0.00 0.61 -0.87 0.00 0.00 176.83 176.27 1wep n GLY 75 N -1.51 0.27 3.57 -0.77 0.00 -1.26 -4.77 105.19 100.73 1wep n GLY 75 Ca 0.11 -1.60 -0.27 0.00 0.00 0.00 0.00 46.02 44.25 1wep n GLY 75 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wep s PRO 76 N 0.00 2.52 0.11 1.61 0.04 -1.26 -4.67 135.00 133.35 1wep s PRO 76 Ca 0.00 -0.77 -0.11 0.00 0.04 0.00 0.00 61.00 60.16 1wep s PRO 76 Cb 0.00 -5.16 0.01 0.00 0.04 0.00 0.00 34.50 29.38 1wep s PRO 76 CO 0.00 -3.71 0.27 -1.54 0.04 0.00 0.00 177.00 172.06 1wep s SER 77 N 7.19 0.01 -0.36 6.66 1.04 -1.26 -5.14 113.70 121.84 1wep s SER 77 Ca 0.69 -0.61 -0.12 0.00 0.48 0.00 0.00 55.95 56.39 1wep s SER 77 Cb -0.03 0.40 0.01 0.00 0.10 0.00 0.00 66.02 66.49 1wep s SER 77 CO 0.07 -0.80 0.23 -0.44 0.98 0.00 0.00 173.24 173.28 1wep s SER 78 N -2.87 5.90 0.00 7.02 0.01 -1.26 -4.94 113.70 117.55 1wep s SER 78 Ca 0.07 -0.71 0.11 0.00 1.31 0.00 0.00 55.95 56.72 1wep s SER 78 Cb 0.04 -2.09 0.09 0.00 0.21 0.00 0.00 66.02 64.26 1wep s SER 78 CO -0.09 -0.32 0.85 0.61 0.41 0.00 0.00 173.24 174.69