#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wes s SER 2 N 0.00 6.73 -0.13 1.61 1.04 -1.26 -5.02 113.70 116.67 1wes s SER 2 Ca 0.00 0.66 -0.01 0.00 0.48 0.00 0.00 55.95 57.08 1wes s SER 2 Cb 0.00 -2.51 -0.02 0.00 0.10 0.00 0.00 66.02 63.59 1wes s SER 2 CO 0.00 -1.00 -0.12 -0.55 0.98 0.00 0.00 173.24 172.55 1wes s SER 3 N 2.02 4.13 0.26 7.02 0.15 -1.26 -5.02 113.70 121.01 1wes s SER 3 Ca 0.43 -0.29 -0.06 0.00 0.70 0.00 0.00 55.95 56.72 1wes s SER 3 Cb -0.10 -1.63 0.47 0.00 -1.71 0.00 0.00 66.02 63.05 1wes s SER 3 CO 0.22 0.17 1.61 1.23 1.20 0.00 0.00 173.24 177.67 1wes h GLY 4 N 6.68 0.84 -1.82 9.45 0.00 -2.12 -3.45 103.07 112.65 1wes h GLY 4 Ca -0.27 0.17 0.12 0.00 0.00 0.00 0.00 47.33 47.36 1wes h GLY 4 CO 0.57 -0.34 0.45 -0.45 0.00 0.00 0.00 176.54 176.76 1wes s SER 5 N -5.18 -0.10 0.49 0.19 0.15 -1.26 -5.18 113.70 102.82 1wes s SER 5 Ca -0.14 -0.65 0.08 0.00 0.70 0.00 0.00 55.95 55.95 1wes s SER 5 Cb 0.24 0.59 0.04 0.00 -1.71 0.00 0.00 66.02 65.18 1wes s SER 5 CO 0.76 -1.13 0.61 -0.44 1.20 0.00 0.00 173.24 174.24 1wes s SER 6 N -3.11 5.23 -0.39 5.45 0.01 -1.26 -5.06 113.70 114.57 1wes s SER 6 Ca 0.16 -0.73 0.07 0.00 1.31 0.00 0.00 55.95 56.75 1wes s SER 6 Cb -0.03 -0.15 0.43 0.00 0.21 0.00 0.00 66.02 66.49 1wes s SER 6 CO 0.05 -1.01 1.12 0.61 0.41 0.00 0.00 173.24 174.42 1wes n GLY 7 N -1.95 5.76 3.25 3.44 0.00 -1.26 -4.96 105.19 109.46 1wes n GLY 7 Ca 0.09 -2.63 -0.43 0.00 0.00 0.00 0.00 46.02 43.06 1wes n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wes s GLU 8 N -3.53 3.38 0.08 1.61 0.41 -1.26 -5.01 118.70 114.37 1wes s GLU 8 Ca 0.47 -2.64 -0.16 0.00 -0.41 0.00 0.00 54.97 52.24 1wes s GLU 8 Cb 0.40 -4.22 0.03 0.00 -1.78 0.00 0.00 34.13 28.56 1wes s GLU 8 CO -0.12 -1.25 0.37 0.12 -0.49 0.00 0.00 175.26 173.89 1wes s PHE 9 N -0.19 -0.17 0.05 1.61 5.36 -1.26 -5.18 117.98 118.20 1wes s PHE 9 Ca 0.20 -0.02 -0.27 0.00 -0.96 0.00 0.00 56.93 55.87 1wes s PHE 9 Cb -0.12 0.19 0.07 0.00 -0.34 0.00 0.00 43.02 42.81 1wes s PHE 9 CO -0.08 -0.61 0.65 0.00 -1.46 0.00 0.00 175.22 173.73 1wes s ALA 10 N -3.12 -1.69 -0.40 11.12 0.00 -1.26 -5.10 121.76 121.31 1wes s ALA 10 Ca -0.01 0.92 -0.29 0.00 0.00 0.00 0.00 51.96 52.59 1wes s ALA 10 Cb 0.01 0.42 -0.08 0.00 0.00 0.00 0.00 23.12 23.46 1wes s ALA 10 CO -0.07 -0.56 2.33 -0.89 0.00 0.00 0.00 175.76 176.56 1wes n ILE 11 N 0.27 0.12 -1.97 0.00 5.41 -1.26 -4.91 119.36 117.03 1wes n ILE 11 Ca -0.18 -0.53 -0.37 0.00 1.00 0.00 0.00 62.75 62.68 1wes n ILE 11 Cb 0.61 -2.35 0.03 0.00 -0.71 0.00 0.00 39.64 37.22 1wes n ILE 11 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 1wes s ASP 12 N 9.71 5.30 0.20 4.38 1.01 -1.26 -4.94 116.67 131.07 1wes s ASP 12 Ca 1.04 2.50 -0.03 0.00 0.71 0.00 0.00 52.55 56.76 1wes s ASP 12 Cb -0.43 -2.61 0.16 0.00 1.01 0.00 0.00 42.92 41.04 1wes s ASP 12 CO 0.35 -1.53 1.56 1.55 0.21 0.00 0.00 175.17 177.32 1wes h PRO 13 N 1.18 0.63 -2.43 8.23 0.13 -2.07 -3.31 132.00 134.36 1wes h PRO 13 Ca -0.50 -0.33 -0.70 0.00 -0.87 0.00 0.00 66.00 63.59 1wes h PRO 13 Cb 1.29 0.01 -0.35 0.00 0.13 0.00 0.00 31.00 32.09 1wes h PRO 13 CO 0.56 0.93 0.15 0.27 -0.23 0.00 0.00 178.00 179.68 1wes n ASN 14 N -4.03 5.49 -4.25 1.44 0.23 -1.26 -4.99 115.26 107.90 1wes n ASN 14 Ca -0.02 -3.55 -0.41 0.00 -0.53 0.00 0.00 54.58 50.08 1wes n ASN 14 Cb 0.53 -0.93 -0.09 0.00 -2.08 0.00 0.00 39.78 37.21 1wes n ASN 14 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 1wes s GLU 15 N -3.22 2.57 0.97 -3.83 2.12 -1.25 -5.09 118.70 110.99 1wes s GLU 15 Ca 0.39 -1.55 -0.12 0.00 0.36 0.00 0.00 54.97 54.05 1wes s GLU 15 Cb 0.16 -3.84 0.17 0.00 0.26 0.00 0.00 34.13 30.88 1wes s GLU 15 CO -0.03 -1.03 1.09 -1.25 -0.54 0.00 0.00 175.26 173.50 1wes s PRO 16 N 1.41 0.64 -0.11 4.30 0.04 -1.26 -5.00 135.00 135.03 1wes s PRO 16 Ca 0.04 0.60 -0.09 0.00 0.04 0.00 0.00 61.00 61.59 1wes s PRO 16 Cb -0.24 -1.76 0.03 0.00 0.04 0.00 0.00 34.50 32.58 1wes s PRO 16 CO 0.01 -2.61 0.28 0.95 0.04 0.00 0.00 177.00 175.67 1wes s THR 17 N -2.96 -0.01 0.13 1.26 -4.23 -1.26 -4.15 115.64 104.43 1wes s THR 17 Ca 0.65 0.03 0.00 0.00 -1.18 0.00 0.00 61.69 61.18 1wes s THR 17 Cb -0.18 -0.40 0.00 0.00 1.34 0.00 0.00 72.50 73.26 1wes s THR 17 CO 0.57 0.01 0.00 -1.22 -0.54 0.00 0.00 174.62 173.44 1wes n TYR 18 N 3.17 -0.50 -0.94 3.99 4.02 -1.23 -4.93 117.16 120.74 1wes n TYR 18 Ca -0.15 0.09 -0.37 0.00 -0.01 0.00 0.00 57.90 57.46 1wes n TYR 18 Cb 0.57 0.12 0.06 0.00 -0.02 0.00 0.00 39.34 40.07 1wes n TYR 18 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1wes h LEU 20 N -1.18 0.46 0.00 0.00 3.38 -1.95 -1.99 115.31 114.04 1wes h LEU 20 Ca -0.43 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.39 1wes h LEU 20 Cb 1.35 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1wes h LEU 20 CO 0.25 0.70 0.00 0.00 0.09 0.00 0.00 178.44 179.48 1wes n ASN 22 N -1.07 -3.37 -4.41 0.00 5.03 -0.75 -5.02 115.26 105.68 1wes n ASN 22 Ca 0.12 -0.70 -0.21 0.00 0.87 0.00 0.00 54.58 54.66 1wes n ASN 22 Cb 0.08 -4.86 -0.10 0.00 -1.02 0.00 0.00 39.78 33.87 1wes n ASN 22 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 1wes s GLN 23 N -5.23 1.50 0.24 3.52 -1.52 -1.26 -4.90 119.66 112.01 1wes s GLN 23 Ca 0.16 -1.74 -0.30 0.00 -1.95 0.00 0.00 55.36 51.52 1wes s GLN 23 Cb -0.03 -1.14 -0.10 0.00 -0.22 0.00 0.00 33.01 31.52 1wes s GLN 23 CO 0.76 0.07 1.49 0.14 -0.25 0.00 0.00 175.29 177.49 1wes s VAL 24 N -3.01 2.57 -0.32 1.09 -7.23 -1.26 -3.53 120.40 108.70 1wes s VAL 24 Ca 0.28 0.46 -0.30 0.00 -1.81 0.00 0.00 61.98 60.61 1wes s VAL 24 Cb 0.03 -3.29 -0.08 0.00 0.56 0.00 0.00 36.38 33.59 1wes s VAL 24 CO 0.11 0.07 2.26 -1.20 -0.31 0.00 0.00 175.10 176.02 1wes n SER 25 N 2.63 2.66 -4.06 4.85 7.64 -1.26 -4.92 113.62 121.16 1wes n SER 25 Ca 0.08 0.17 -0.20 0.00 1.01 0.00 0.00 58.87 59.93 1wes n SER 25 Cb 0.39 -1.44 -0.09 0.00 -1.01 0.00 0.00 64.21 62.06 1wes n SER 25 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 1wes s TYR 26 N 8.58 1.64 0.00 1.43 -0.85 -1.26 -5.11 117.35 121.79 1wes s TYR 26 Ca 1.05 -1.32 0.00 0.00 -0.52 0.00 0.00 57.07 56.28 1wes s TYR 26 Cb -0.51 -0.93 0.00 0.00 0.38 0.00 0.00 41.96 40.90 1wes s TYR 26 CO 0.39 -0.44 0.00 0.41 -1.52 0.00 0.00 175.55 174.39 1wes n GLY 27 N -0.62 0.04 3.74 5.49 0.00 -1.26 -4.50 105.19 108.07 1wes n GLY 27 Ca -0.00 -0.39 -0.42 0.00 0.00 0.00 0.00 46.02 45.21 1wes n GLY 27 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wes n GLU 28 N -0.28 2.70 -3.92 1.61 1.02 -1.26 -4.99 120.64 115.51 1wes n GLU 28 Ca 0.00 0.96 -0.10 0.00 -0.02 0.00 0.00 57.16 58.00 1wes n GLU 28 Cb 0.00 -2.75 -0.11 0.00 -0.02 0.00 0.00 31.44 28.56 1wes n GLU 28 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1wes s MET 29 N -0.17 0.37 0.21 3.49 -1.94 -1.26 -2.94 119.30 117.06 1wes s MET 29 Ca 0.66 -0.45 0.11 0.00 -1.71 0.00 0.00 55.69 54.30 1wes s MET 29 Cb -0.50 0.14 -0.05 0.00 2.01 0.00 0.00 34.83 36.44 1wes s MET 29 CO 0.45 -0.08 -0.22 0.96 -0.01 0.00 0.00 175.02 176.13 1wes s ILE 30 N -1.29 2.31 -0.40 2.53 -0.00 -0.85 -4.92 121.20 118.58 1wes s ILE 30 Ca -0.14 -2.12 -0.11 0.00 -0.00 0.00 0.00 60.65 58.28 1wes s ILE 30 Cb -0.08 -2.14 0.05 0.00 -0.00 0.00 0.00 42.46 40.30 1wes s ILE 30 CO 0.00 -0.22 0.25 -0.83 -0.00 0.00 0.00 174.94 174.14 1wes s GLY 31 N -2.89 1.96 -0.50 6.27 0.00 -1.26 -2.43 107.32 108.46 1wes s GLY 31 Ca 0.23 -1.95 -0.43 0.00 0.00 0.00 0.00 44.72 42.57 1wes s GLY 31 CO 0.11 0.92 2.16 0.00 0.00 0.00 0.00 173.10 176.29 1wes n ASP 33 N 7.83 0.12 -4.55 0.00 9.92 -0.40 -4.01 116.55 125.46 1wes n ASP 33 Ca 0.54 1.17 -0.38 0.00 -0.53 0.00 0.00 54.79 55.60 1wes n ASP 33 Cb -0.01 -0.58 -0.03 0.00 -0.64 0.00 0.00 41.12 39.86 1wes n ASP 33 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 1wes s ASN 34 N -4.12 4.94 0.14 -2.24 2.47 -1.26 -4.85 114.94 110.01 1wes s ASN 34 Ca -0.06 0.73 -0.27 0.00 0.42 0.00 0.00 52.86 53.68 1wes s ASN 34 Cb 0.28 -2.52 -0.01 0.00 -1.45 0.00 0.00 41.25 37.55 1wes s ASN 34 CO 0.80 -2.56 1.59 -0.08 -3.72 0.00 0.00 177.10 173.13 1wes h GLU 35 N 16.86 -0.37 -0.84 0.43 4.57 -1.97 -0.52 114.58 132.73 1wes h GLU 35 Ca -0.26 0.03 0.32 0.00 -1.18 0.00 0.00 59.36 58.27 1wes h GLU 35 Cb 1.21 0.09 -0.15 0.00 -0.16 0.00 0.00 28.75 29.73 1wes h GLU 35 CO 1.18 -0.25 0.33 1.04 -1.18 0.00 0.00 179.01 180.13 1wes n GLN 36 N -5.42 -0.06 -1.33 1.92 1.13 -1.26 -4.37 117.38 107.98 1wes n GLN 36 Ca -0.02 1.19 -0.55 0.00 -1.94 0.00 0.00 57.00 55.68 1wes n GLN 36 Cb 0.35 -2.07 -0.11 0.00 0.11 0.00 0.00 30.24 28.52 1wes n GLN 36 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1wes n PRO 38 N 7.82 0.36 -0.08 0.00 -0.04 -1.26 -3.36 135.00 138.44 1wes n PRO 38 Ca 0.51 0.07 -0.17 0.00 -0.04 0.00 0.00 63.50 63.87 1wes n PRO 38 Cb 0.06 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 31.96 1wes n PRO 38 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1wes n ILE 39 N -1.13 1.23 -3.92 0.52 5.41 -1.26 -4.97 119.36 115.23 1wes n ILE 39 Ca 0.10 -0.11 -0.31 0.00 1.00 0.00 0.00 62.75 63.42 1wes n ILE 39 Cb 0.08 -1.91 -0.06 0.00 -0.71 0.00 0.00 39.64 37.05 1wes n ILE 39 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1wes n GLU 40 N -4.01 -1.20 -3.15 0.38 1.02 -1.21 -4.84 120.64 107.63 1wes n GLU 40 Ca -0.30 0.10 0.04 0.00 -0.02 0.00 0.00 57.16 56.99 1wes n GLU 40 Cb 0.64 -4.38 -0.01 0.00 -0.02 0.00 0.00 31.44 27.68 1wes n GLU 40 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1wes s TRP 41 N -2.84 -1.54 0.03 -0.32 0.52 -1.23 -4.09 118.94 109.47 1wes s TRP 41 Ca 0.61 1.48 -0.01 0.00 0.02 0.00 0.00 56.10 58.20 1wes s TRP 41 Cb -0.36 0.48 -0.02 0.00 -1.15 0.00 0.00 33.47 32.42 1wes s TRP 41 CO 0.75 -0.85 -0.00 -0.06 0.02 0.00 0.00 176.95 176.81 1wes s PHE 42 N 2.86 0.31 0.72 -1.98 0.40 -1.02 -2.54 117.98 116.74 1wes s PHE 42 Ca 0.17 -0.66 -0.11 0.00 -0.60 0.00 0.00 56.93 55.73 1wes s PHE 42 Cb -0.13 -0.23 0.02 0.00 0.51 0.00 0.00 43.02 43.18 1wes s PHE 42 CO -0.21 -0.27 1.08 -1.01 0.70 0.00 0.00 175.22 175.51 1wes s HIS 43 N -2.31 3.21 -0.05 0.36 3.76 -1.26 -2.00 115.29 117.00 1wes s HIS 43 Ca -0.08 1.15 -0.01 0.00 -0.15 0.00 0.00 55.06 55.98 1wes s HIS 43 Cb -0.04 -3.01 -0.00 0.00 1.11 0.00 0.00 32.58 30.64 1wes s HIS 43 CO -0.04 -1.28 0.05 0.74 -0.85 0.00 0.00 174.74 173.36 1wes h PHE 44 N -0.73 -0.02 -1.42 1.40 -1.00 -1.84 -3.01 116.94 110.32 1wes h PHE 44 Ca -0.45 -0.00 0.42 0.00 2.81 0.00 0.00 57.97 60.74 1wes h PHE 44 Cb 1.24 0.01 -0.07 0.00 3.61 0.00 0.00 35.95 40.74 1wes h PHE 44 CO 0.53 -0.01 1.00 1.03 -1.61 0.00 0.00 178.31 179.24 1wes h SER 45 N -0.50 0.09 0.12 2.17 0.87 -1.89 0.27 113.55 114.68 1wes h SER 45 Ca -0.00 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.58 1wes h SER 45 Cb 0.02 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 1wes h SER 45 CO 0.00 -0.02 -0.06 0.00 -0.53 0.00 0.00 176.83 176.23 1wes n VAL 47 N -4.94 0.62 -3.58 0.00 0.24 0.69 -4.88 118.33 106.49 1wes n VAL 47 Ca -0.09 -0.33 -0.22 0.00 -2.04 0.00 0.00 64.34 61.66 1wes n VAL 47 Cb 0.26 -0.35 0.05 0.00 -1.47 0.00 0.00 33.84 32.33 1wes n VAL 47 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1wes n SER 48 N 0.14 -3.45 -4.51 -1.34 7.64 0.31 -4.99 113.62 107.42 1wes n SER 48 Ca 0.07 -0.83 -0.32 0.00 1.01 0.00 0.00 58.87 58.80 1wes n SER 48 Cb 0.43 -4.23 -0.12 0.00 -1.01 0.00 0.00 64.21 59.28 1wes n SER 48 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1wes s LEU 49 N -6.32 2.85 -0.08 -3.43 1.43 0.01 -4.98 118.68 108.16 1wes s LEU 49 Ca 0.22 -0.20 0.15 0.00 -1.03 0.00 0.00 54.13 53.27 1wes s LEU 49 Cb -0.05 -1.61 -0.23 0.00 0.03 0.00 0.00 46.19 44.32 1wes s LEU 49 CO 0.80 0.32 0.22 0.41 0.23 0.00 0.00 176.35 178.34 1wes n THR 50 N 2.04 0.47 -3.58 5.49 -1.04 -1.26 -4.02 114.28 112.38 1wes n THR 50 Ca -0.17 -0.50 -0.05 0.00 -2.04 0.00 0.00 64.05 61.29 1wes n THR 50 Cb 0.52 -0.20 -0.02 0.00 -1.82 0.00 0.00 70.33 68.82 1wes n THR 50 CO 0.00 0.00 0.00 -0.72 -0.64 0.00 0.00 175.07 173.71 1wes s TYR 51 N -2.80 -0.18 -0.41 -1.42 -0.85 -1.26 -5.10 117.35 105.33 1wes s TYR 51 Ca -0.07 0.08 -0.37 0.00 -0.52 0.00 0.00 57.07 56.19 1wes s TYR 51 Cb 0.08 0.53 -0.14 0.00 0.38 0.00 0.00 41.96 42.82 1wes s TYR 51 CO 0.66 -0.34 2.20 1.17 -1.52 0.00 0.00 175.55 177.72 1wes n LYS 52 N -0.20 0.77 -2.17 -3.49 3.00 -1.26 -4.85 118.16 109.96 1wes n LYS 52 Ca -0.03 0.20 -0.42 0.00 -0.00 0.00 0.00 58.31 58.05 1wes n LYS 52 Cb 0.60 -2.20 -0.03 0.00 0.00 0.00 0.00 35.03 33.40 1wes n LYS 52 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 1wes s PRO 53 N 6.28 4.24 0.34 1.64 0.04 -1.26 -4.98 135.00 141.30 1wes s PRO 53 Ca 1.13 2.02 -0.29 0.00 0.04 0.00 0.00 61.00 63.90 1wes s PRO 53 Cb -1.02 -3.70 -0.10 0.00 0.04 0.00 0.00 34.50 29.71 1wes s PRO 53 CO 0.53 -0.67 1.33 0.21 0.04 0.00 0.00 177.00 178.44 1wes s LYS 54 N 2.97 4.32 0.22 4.56 2.47 -1.26 -4.46 119.74 128.56 1wes s LYS 54 Ca 0.66 2.27 0.00 0.00 -1.56 0.00 0.00 55.97 57.34 1wes s LYS 54 Cb -0.31 -3.06 0.00 0.00 -1.46 0.00 0.00 37.83 33.00 1wes s LYS 54 CO 0.26 -0.24 0.00 0.41 0.16 0.00 0.00 175.35 175.94 1wes n GLY 55 N 0.78 0.94 3.39 5.54 0.00 -1.26 -4.95 105.19 109.63 1wes n GLY 55 Ca 0.00 -0.90 -0.19 0.00 0.00 0.00 0.00 46.02 44.93 1wes n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wes s LYS 56 N 0.00 1.55 -0.30 1.61 1.02 -1.26 -5.14 119.74 117.21 1wes s LYS 56 Ca 0.00 -1.85 -0.10 0.00 0.02 0.00 0.00 55.97 54.04 1wes s LYS 56 Cb 0.00 -0.57 0.15 0.00 -0.52 0.00 0.00 37.83 36.88 1wes s LYS 56 CO 0.00 -0.25 0.73 -0.46 -0.92 0.00 0.00 175.35 174.45 1wes s TRP 57 N -3.51 -1.21 -0.23 3.18 -0.00 -1.26 -4.95 118.94 110.97 1wes s TRP 57 Ca 0.37 1.97 -0.03 0.00 -0.00 0.00 0.00 56.10 58.41 1wes s TRP 57 Cb 0.08 0.68 0.00 0.00 -0.00 0.00 0.00 33.47 34.23 1wes s TRP 57 CO 0.15 -0.61 -0.05 0.71 -0.00 0.00 0.00 176.95 177.14 1wes s TYR 58 N 2.80 2.97 0.72 5.86 1.51 -1.26 -1.27 117.35 128.67 1wes s TYR 58 Ca -0.02 -1.10 -0.18 0.00 -1.01 0.00 0.00 57.07 54.76 1wes s TYR 58 Cb -0.11 -2.09 -0.15 0.00 -0.11 0.00 0.00 41.96 39.50 1wes s TYR 58 CO -0.19 -0.60 -0.41 0.00 -1.11 0.00 0.00 175.55 173.24 1wes n PRO 60 N 1.90 0.37 -0.01 0.00 -0.04 -1.26 -1.86 135.00 134.09 1wes n PRO 60 Ca 0.04 0.06 -0.03 0.00 -0.04 0.00 0.00 63.50 63.53 1wes n PRO 60 Cb 0.51 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.35 1wes n PRO 60 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1wes n LYS 61 N -1.12 0.64 -0.07 0.54 4.81 -1.26 -3.93 118.16 117.77 1wes n LYS 61 Ca 0.10 0.15 -0.17 0.00 -0.87 0.00 0.00 58.31 57.52 1wes n LYS 61 Cb 0.08 -1.72 -0.13 0.00 0.02 0.00 0.00 35.03 33.28 1wes n LYS 61 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1wes n ARG 63 N -3.21 1.27 -1.64 0.00 1.85 -0.78 -4.82 116.66 109.33 1wes n ARG 63 Ca -0.36 -0.25 -0.43 0.00 -1.00 0.00 0.00 57.85 55.81 1wes n ARG 63 Cb 1.04 -1.41 -0.01 0.00 -1.05 0.00 0.00 32.46 31.03 1wes n ARG 63 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1wes n GLY 64 N 0.21 0.14 0.09 2.89 0.00 -1.25 -4.93 105.19 102.33 1wes n GLY 64 Ca 0.02 0.29 -0.15 0.00 0.00 0.00 0.00 46.02 46.18 1wes n GLY 64 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1wes h ASP 65 N 2.16 0.15 -3.75 1.61 1.82 -1.91 -3.40 116.42 113.10 1wes h ASP 65 Ca -0.43 -0.82 -0.74 0.00 -0.39 0.00 0.00 57.03 54.65 1wes h ASP 65 Cb 1.31 -0.05 -0.30 0.00 0.68 0.00 0.00 39.33 40.98 1wes h ASP 65 CO 0.61 0.95 -0.19 -0.44 -1.61 0.00 0.00 179.24 178.55 1wes s SER 66 N -6.25 5.97 0.00 2.28 0.01 -1.26 -4.71 113.70 109.74 1wes s SER 66 Ca -0.17 -2.50 0.00 0.00 1.31 0.00 0.00 55.95 54.59 1wes s SER 66 Cb -0.00 -2.05 0.00 0.00 0.21 0.00 0.00 66.02 64.18 1wes s SER 66 CO 0.72 -0.55 0.00 0.61 0.41 0.00 0.00 173.24 174.43 1wes n GLY 67 N 4.12 0.77 0.20 3.44 0.00 -1.26 -5.04 105.19 107.41 1wes n GLY 67 Ca 0.05 -0.64 -0.13 0.00 0.00 0.00 0.00 46.02 45.29 1wes n GLY 67 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wes h PRO 68 N 0.00 0.66 -6.05 1.61 0.13 -1.84 -3.44 132.00 123.06 1wes h PRO 68 Ca 0.00 -0.34 -0.69 0.00 -0.87 0.00 0.00 66.00 64.10 1wes h PRO 68 Cb 0.00 0.01 -0.28 0.00 0.13 0.00 0.00 31.00 30.87 1wes h PRO 68 CO 0.00 0.95 -0.82 -1.12 -0.23 0.00 0.00 178.00 176.78 1wes s SER 69 N -6.49 3.58 0.08 1.44 0.01 -1.26 -4.87 113.70 106.20 1wes s SER 69 Ca -0.13 -0.36 -0.04 0.00 1.31 0.00 0.00 55.95 56.73 1wes s SER 69 Cb 0.08 -0.94 -0.03 0.00 0.21 0.00 0.00 66.02 65.35 1wes s SER 69 CO 0.82 0.27 0.07 -0.55 0.41 0.00 0.00 173.24 174.26 1wes s SER 70 N -0.31 0.32 0.00 2.44 0.15 -1.26 -5.23 113.70 109.81 1wes s SER 70 Ca 0.02 -0.93 0.00 0.00 0.70 0.00 0.00 55.95 55.74 1wes s SER 70 Cb -0.13 0.27 0.00 0.00 -1.71 0.00 0.00 66.02 64.46 1wes s SER 70 CO 0.02 -0.68 0.00 0.61 1.20 0.00 0.00 173.24 174.39