#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bdg s ILE 17 N 0.00 5.27 -1.64 1.39 -1.09 0.54 -4.18 121.20 121.49 2bdg s ILE 17 Ca 0.00 0.61 0.00 0.00 -2.23 0.00 0.00 60.65 59.03 2bdg s ILE 17 Cb 0.00 -3.67 0.00 0.00 -1.58 0.00 0.00 42.46 37.21 2bdg s ILE 17 CO 0.00 0.34 0.00 0.59 -1.23 0.00 0.00 174.94 174.64 2bdg n ASN 18 N 3.87 -5.37 0.00 3.58 5.03 -1.26 -3.16 115.26 117.95 2bdg n ASN 18 Ca -0.11 0.04 0.00 0.00 0.87 0.00 0.00 54.58 55.38 2bdg n ASN 18 Cb 0.52 -4.44 0.00 0.00 -1.02 0.00 0.00 39.78 34.84 2bdg n ASN 18 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2bdg n GLY 19 N -0.98 2.29 3.72 7.41 0.00 -1.26 -4.89 105.19 111.47 2bdg n GLY 19 Ca -0.22 -1.94 -0.09 0.00 0.00 0.00 0.00 46.02 43.77 2bdg n GLY 19 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2bdg s GLU 20 N 3.47 1.80 0.18 1.61 -1.05 -0.45 -4.95 118.70 119.33 2bdg s GLU 20 Ca 0.00 -1.24 -0.32 0.00 -0.15 0.00 0.00 54.97 53.26 2bdg s GLU 20 Cb 0.00 0.55 -0.11 0.00 -0.44 0.00 0.00 34.13 34.12 2bdg s GLU 20 CO 0.00 -0.80 1.77 -0.51 0.95 0.00 0.00 175.26 176.67 2bdg s ASP 21 N -3.01 6.39 0.67 0.83 1.11 -1.26 -0.35 116.67 121.04 2bdg s ASP 21 Ca 0.18 2.84 -0.14 0.00 0.18 0.00 0.00 52.55 55.61 2bdg s ASP 21 Cb -0.03 -2.59 0.00 0.00 1.07 0.00 0.00 42.92 41.37 2bdg s ASP 21 CO 0.10 -0.99 1.10 0.00 1.18 0.00 0.00 175.17 176.56 2bdg s SER 23 N -2.80 6.74 0.10 0.00 0.15 -1.26 -4.87 113.70 111.76 2bdg s SER 23 Ca 0.65 2.58 -0.36 0.00 0.70 0.00 0.00 55.95 59.52 2bdg s SER 23 Cb -0.19 -2.62 -0.16 0.00 -1.71 0.00 0.00 66.02 61.35 2bdg s SER 23 CO 0.44 -0.63 1.45 -2.65 1.20 0.00 0.00 173.24 173.04 2bdg n PRO 24 N 2.36 1.52 -1.63 5.44 -0.02 -1.26 -1.89 135.00 139.52 2bdg n PRO 24 Ca 0.06 0.55 -0.16 0.00 -2.02 0.00 0.00 63.50 61.93 2bdg n PRO 24 Cb 0.41 -2.24 -0.06 0.00 -0.02 0.00 0.00 33.50 31.59 2bdg n PRO 24 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2bdg n HIS 25 N 2.99 -0.15 0.80 6.00 8.25 -1.26 -4.87 115.22 126.99 2bdg n HIS 25 Ca 0.18 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.77 2bdg n HIS 25 Cb 0.23 -2.94 0.44 0.00 1.12 0.00 0.00 29.99 28.84 2bdg n HIS 25 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2bdg n SER 26 N -0.74 0.46 -3.20 0.41 3.41 -0.79 -3.85 113.62 109.32 2bdg n SER 26 Ca -0.17 0.41 -0.25 0.00 -0.26 0.00 0.00 58.87 58.60 2bdg n SER 26 Cb 0.56 -0.46 -0.06 0.00 -0.26 0.00 0.00 64.21 63.99 2bdg n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bdg n GLN 27 N -1.87 2.01 0.11 4.33 1.13 -1.26 -4.96 117.38 116.87 2bdg n GLN 27 Ca 0.06 -4.15 0.07 0.00 -1.94 0.00 0.00 57.00 51.03 2bdg n GLN 27 Cb 0.39 -1.91 0.35 0.00 0.11 0.00 0.00 30.24 29.18 2bdg n GLN 27 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 2bdg n PRO 28 N 0.58 0.08 0.00 -1.09 -0.04 -1.25 -1.05 135.00 132.24 2bdg n PRO 28 Ca 0.27 0.55 0.13 0.00 -0.04 0.00 0.00 63.50 64.42 2bdg n PRO 28 Cb 0.48 -1.88 0.38 0.00 -0.04 0.00 0.00 33.50 32.43 2bdg n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2bdg n TRP 29 N -1.95 0.00 -1.98 0.54 2.14 -1.09 -1.93 117.44 113.18 2bdg n TRP 29 Ca -0.01 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.14 2bdg n TRP 29 Cb 0.12 -0.19 -0.03 0.00 -0.81 0.00 0.00 31.31 30.40 2bdg n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 2bdg s GLN 30 N -2.70 4.24 -0.03 -2.67 2.00 -0.21 0.01 119.66 120.29 2bdg s GLN 30 Ca 0.20 2.31 0.07 0.00 -2.00 0.00 0.00 55.36 55.94 2bdg s GLN 30 Cb 0.19 -3.15 -0.02 0.00 0.80 0.00 0.00 33.01 30.82 2bdg s GLN 30 CO 0.58 -0.54 -0.24 0.00 -0.50 0.00 0.00 175.29 174.59 2bdg s ALA 31 N 0.84 2.26 -0.13 1.58 0.00 0.14 -4.38 121.76 122.06 2bdg s ALA 31 Ca 0.67 -1.08 -0.06 0.00 0.00 0.00 0.00 51.96 51.49 2bdg s ALA 31 Cb -0.42 -0.66 -0.04 0.00 0.00 0.00 0.00 23.12 22.00 2bdg s ALA 31 CO 0.34 0.51 0.08 0.00 0.00 0.00 0.00 175.76 176.69 2bdg s ALA 32 N -0.54 3.56 -0.31 0.00 0.00 -0.49 -0.11 121.76 123.86 2bdg s ALA 32 Ca 0.08 -0.72 -0.06 0.00 0.00 0.00 0.00 51.96 51.25 2bdg s ALA 32 Cb -0.11 -1.82 0.03 0.00 0.00 0.00 0.00 23.12 21.22 2bdg s ALA 32 CO 0.00 0.47 0.08 -0.51 0.00 0.00 0.00 175.76 175.81 2bdg s LEU 33 N -0.55 4.03 -0.12 0.00 1.02 -0.18 -1.04 118.68 121.83 2bdg s LEU 33 Ca 0.11 -0.94 0.02 0.00 0.02 0.00 0.00 54.13 53.34 2bdg s LEU 33 Cb -0.12 -1.86 -0.00 0.00 0.02 0.00 0.00 46.19 44.23 2bdg s LEU 33 CO 0.02 -0.25 -0.19 0.68 0.02 0.00 0.00 176.35 176.62 2bdg s VAL 34 N 1.44 2.41 -0.57 -1.59 -7.23 -1.04 -2.01 120.40 111.81 2bdg s VAL 34 Ca 0.00 -0.88 -0.11 0.00 -1.81 0.00 0.00 61.98 59.19 2bdg s VAL 34 Cb -0.18 -1.97 0.14 0.00 0.56 0.00 0.00 36.38 34.93 2bdg s VAL 34 CO 0.02 0.54 0.46 -0.32 -0.31 0.00 0.00 175.10 175.49 2bdg s MET 35 N 0.50 2.79 -0.47 4.82 1.75 0.35 -3.74 119.30 125.30 2bdg s MET 35 Ca -0.13 -1.97 -0.34 0.00 -1.25 0.00 0.00 55.69 52.00 2bdg s MET 35 Cb -0.17 -4.07 0.05 0.00 2.84 0.00 0.00 34.83 33.49 2bdg s MET 35 CO 0.05 -1.24 0.66 0.39 -0.65 0.00 0.00 175.02 174.23 2bdg n GLU 36 N 4.64 -1.97 -0.98 4.11 -0.58 -1.26 -2.86 120.64 121.74 2bdg n GLU 36 Ca -0.03 1.49 0.00 0.00 -0.42 0.00 0.00 57.16 58.19 2bdg n GLU 36 Cb 0.41 -2.55 0.00 0.00 -0.57 0.00 0.00 31.44 28.73 2bdg n GLU 36 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2bdg n ASN 37 N -0.34 -4.70 -3.98 1.62 5.03 -1.26 -4.99 115.26 106.65 2bdg n ASN 37 Ca -0.07 0.00 -0.22 0.00 0.87 0.00 0.00 54.58 55.15 2bdg n ASN 37 Cb 0.66 -2.46 -0.16 0.00 -1.02 0.00 0.00 39.78 36.79 2bdg n ASN 37 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 2bdg s GLU 38 N -1.30 1.30 -0.10 3.52 2.12 -1.14 -5.12 118.70 117.98 2bdg s GLU 38 Ca 0.00 -0.29 -0.24 0.00 0.36 0.00 0.00 54.97 54.79 2bdg s GLU 38 Cb 0.00 -1.14 -0.03 0.00 0.26 0.00 0.00 34.13 33.22 2bdg s GLU 38 CO 0.00 0.00 0.75 -1.17 -0.54 0.00 0.00 175.26 174.31 2bdg s LEU 40 N 0.68 4.27 0.00 2.70 1.98 -1.26 -0.49 118.68 126.55 2bdg s LEU 40 Ca -0.12 1.19 0.00 0.00 -2.89 0.00 0.00 54.13 52.31 2bdg s LEU 40 Cb -0.14 -3.14 0.00 0.00 0.66 0.00 0.00 46.19 43.56 2bdg s LEU 40 CO 0.02 -0.22 0.00 2.22 -1.89 0.00 0.00 176.35 176.48 2bdg n PHE 41 N 4.30 0.00 -3.80 5.38 -1.74 -0.85 -4.98 117.46 115.77 2bdg n PHE 41 Ca 0.01 0.00 -0.05 0.00 -0.56 0.00 0.00 57.45 56.85 2bdg n PHE 41 Cb 0.50 0.00 -0.01 0.00 1.52 0.00 0.00 39.48 41.50 2bdg n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2bdg s SER 43 N -3.01 3.32 0.37 0.00 0.01 -0.10 -1.01 113.70 113.28 2bdg s SER 43 Ca 0.13 -1.56 -0.06 0.00 1.31 0.00 0.00 55.95 55.77 2bdg s SER 43 Cb -0.03 0.25 0.02 0.00 0.21 0.00 0.00 66.02 66.47 2bdg s SER 43 CO 0.05 -0.76 0.59 -0.83 0.41 0.00 0.00 173.24 172.69 2bdg s GLY 44 N -3.69 1.21 -0.06 3.44 0.00 0.84 -3.93 107.32 105.13 2bdg s GLY 44 Ca 0.22 -1.32 0.00 0.00 0.00 0.00 0.00 44.72 43.62 2bdg s GLY 44 CO 0.11 -0.79 -0.04 0.14 0.00 0.00 0.00 173.10 172.52 2bdg s VAL 45 N -2.65 0.56 -0.14 1.40 1.01 0.18 -0.69 120.40 120.07 2bdg s VAL 45 Ca 0.26 -0.08 -0.29 0.00 0.00 0.00 0.00 61.98 61.87 2bdg s VAL 45 Cb -0.02 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.71 2bdg s VAL 45 CO 0.19 0.25 1.39 -0.22 0.00 0.00 0.00 175.10 176.71 2bdg s LEU 46 N 1.30 4.20 -0.01 3.92 2.96 0.10 -0.14 118.68 131.02 2bdg s LEU 46 Ca -0.05 1.83 0.06 0.00 -0.22 0.00 0.00 54.13 55.76 2bdg s LEU 46 Cb -0.14 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 42.93 2bdg s LEU 46 CO -0.02 -0.84 0.20 1.33 -1.32 0.00 0.00 176.35 175.70 2bdg n VAL 47 N 5.47 0.00 -3.68 1.68 0.24 -0.67 -1.87 118.33 119.49 2bdg n VAL 47 Ca 0.15 -0.24 -0.12 0.00 -2.04 0.00 0.00 64.34 62.10 2bdg n VAL 47 Cb 0.44 0.63 -0.06 0.00 -1.47 0.00 0.00 33.84 33.38 2bdg n VAL 47 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 2bdg s HIS 48 N -2.09 -0.20 0.64 6.34 3.76 -1.15 -4.54 115.29 118.06 2bdg s HIS 48 Ca -0.00 0.04 0.29 0.00 -0.15 0.00 0.00 55.06 55.24 2bdg s HIS 48 Cb 0.04 0.19 1.58 0.00 1.11 0.00 0.00 32.58 35.50 2bdg s HIS 48 CO 0.27 -0.60 1.91 -1.35 -0.85 0.00 0.00 174.74 174.13 2bdg h PRO 49 N 2.84 0.00 -0.02 8.40 0.11 -1.96 -1.75 132.00 139.62 2bdg h PRO 49 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2bdg h PRO 49 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2bdg h PRO 49 CO 0.46 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.25 2bdg n GLN 50 N -3.16 0.39 -4.62 1.05 0.00 -1.26 -1.65 117.38 108.13 2bdg n GLN 50 Ca 0.01 -0.91 -0.23 0.00 0.00 0.00 0.00 57.00 55.86 2bdg n GLN 50 Cb 0.46 -1.04 -0.16 0.00 0.00 0.00 0.00 30.24 29.50 2bdg n GLN 50 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.06 175.48 2bdg s TRP 51 N -0.42 1.36 -0.10 2.61 0.52 -0.66 -0.07 118.94 122.19 2bdg s TRP 51 Ca 0.03 -0.38 0.04 0.00 0.02 0.00 0.00 56.10 55.81 2bdg s TRP 51 Cb 0.02 -0.94 -0.00 0.00 -1.15 0.00 0.00 33.47 31.39 2bdg s TRP 51 CO 0.03 -0.14 -0.23 0.08 0.02 0.00 0.00 176.95 176.71 2bdg s VAL 52 N 0.15 2.21 -0.04 4.03 1.01 0.51 -1.67 120.40 126.60 2bdg s VAL 52 Ca -0.04 -0.97 -0.13 0.00 0.00 0.00 0.00 61.98 60.84 2bdg s VAL 52 Cb -0.10 -1.85 -0.05 0.00 0.00 0.00 0.00 36.38 34.37 2bdg s VAL 52 CO 0.01 0.56 0.33 -0.22 0.00 0.00 0.00 175.10 175.79 2bdg s LEU 53 N 0.27 4.44 0.36 3.92 2.96 0.81 0.20 118.68 131.63 2bdg s LEU 53 Ca -0.16 0.81 -0.08 0.00 -0.22 0.00 0.00 54.13 54.49 2bdg s LEU 53 Cb -0.17 -2.44 0.02 0.00 0.50 0.00 0.00 46.19 44.10 2bdg s LEU 53 CO 0.08 0.33 0.60 -0.55 -1.32 0.00 0.00 176.35 175.49 2bdg s SER 54 N -0.97 0.54 0.31 3.68 0.15 -0.58 0.50 113.70 117.33 2bdg s SER 54 Ca 0.21 -1.34 -0.27 0.00 0.70 0.00 0.00 55.95 55.25 2bdg s SER 54 Cb -0.15 0.74 -0.10 0.00 -1.71 0.00 0.00 66.02 64.80 2bdg s SER 54 CO 0.10 -1.45 0.97 0.00 1.20 0.00 0.00 173.24 174.06 2bdg s ALA 55 N -2.78 3.24 0.50 5.45 0.00 -1.26 -1.08 121.76 125.84 2bdg s ALA 55 Ca 0.24 0.60 0.17 0.00 0.00 0.00 0.00 51.96 52.98 2bdg s ALA 55 Cb -0.02 -3.21 1.24 0.00 0.00 0.00 0.00 23.12 21.12 2bdg s ALA 55 CO 0.17 0.10 2.11 0.00 0.00 0.00 0.00 175.76 178.13 2bdg h ALA 56 N 3.35 1.86 0.00 0.00 0.00 -1.69 -0.04 119.26 122.73 2bdg h ALA 56 Ca -0.47 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2bdg h ALA 56 Cb 1.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2bdg h ALA 56 CO 0.65 0.07 0.00 -2.39 0.00 0.00 0.00 179.25 177.59 2bdg n HIS 57 N -4.40 0.00 0.83 0.00 1.44 -1.26 -1.59 115.22 110.24 2bdg n HIS 57 Ca -0.03 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.78 2bdg n HIS 57 Cb 0.14 -0.26 0.28 0.00 0.12 0.00 0.00 29.99 30.27 2bdg n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2bdg n PHE 59 N 0.72 1.93 -4.02 0.00 7.35 -0.62 -5.01 117.46 117.81 2bdg n PHE 59 Ca 0.16 0.45 -0.08 0.00 -0.76 0.00 0.00 57.45 57.22 2bdg n PHE 59 Cb 0.40 -2.44 -0.11 0.00 0.35 0.00 0.00 39.48 37.68 2bdg n PHE 59 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 2bdg s GLN 60 N 0.42 0.43 0.38 -4.13 -1.52 -1.26 -5.04 119.66 108.94 2bdg s GLN 60 Ca 0.78 -0.83 0.06 0.00 -1.95 0.00 0.00 55.36 53.42 2bdg s GLN 60 Cb -0.77 0.15 0.75 0.00 -0.22 0.00 0.00 33.01 32.92 2bdg s GLN 60 CO 0.44 -0.08 1.98 -0.97 -0.25 0.00 0.00 175.29 176.41 2bdg h ASN 61 N 4.07 0.47 -5.10 5.90 -1.24 -1.95 -3.44 115.58 114.29 2bdg h ASN 61 Ca -0.33 -0.05 -0.08 0.00 0.71 0.00 0.00 56.30 56.56 2bdg h ASN 61 Cb 1.18 -0.12 -0.15 0.00 0.73 0.00 0.00 38.32 39.97 2bdg h ASN 61 CO 0.50 0.43 -0.26 -0.55 -1.29 0.00 0.00 177.43 176.27 2bdg s SER 62 N -6.71 -0.05 0.07 1.15 0.15 -1.26 -4.77 113.70 102.28 2bdg s SER 62 Ca -0.08 -0.42 -0.03 0.00 0.70 0.00 0.00 55.95 56.12 2bdg s SER 62 Cb 0.17 0.38 -0.03 0.00 -1.71 0.00 0.00 66.02 64.82 2bdg s SER 62 CO 0.74 -0.72 0.03 -0.31 1.20 0.00 0.00 173.24 174.19 2bdg s TYR 63 N -3.42 0.49 -0.19 3.44 1.51 0.82 -5.01 117.35 114.99 2bdg s TYR 63 Ca 0.01 -0.99 0.01 0.00 -1.01 0.00 0.00 57.07 55.10 2bdg s TYR 63 Cb 0.02 -0.33 0.03 0.00 -0.11 0.00 0.00 41.96 41.57 2bdg s TYR 63 CO -0.09 -0.44 -0.18 0.99 -1.11 0.00 0.00 175.55 174.72 2bdg s THR 64 N -3.93 2.02 -0.20 -0.71 2.01 -1.25 -1.11 115.64 112.48 2bdg s THR 64 Ca 0.09 -1.01 -0.07 0.00 0.31 0.00 0.00 61.69 61.01 2bdg s THR 64 Cb 0.07 -1.88 -0.04 0.00 0.01 0.00 0.00 72.50 70.67 2bdg s THR 64 CO -0.08 0.45 0.07 -0.63 -0.69 0.00 0.00 174.62 173.73 2bdg s ILE 65 N 1.29 4.71 -0.25 1.82 -1.09 0.40 -2.50 121.20 125.58 2bdg s ILE 65 Ca 0.03 -0.06 -0.07 0.00 -2.23 0.00 0.00 60.65 58.32 2bdg s ILE 65 Cb -0.14 -3.14 -0.03 0.00 -1.58 0.00 0.00 42.46 37.58 2bdg s ILE 65 CO -0.12 0.43 0.06 -0.83 -1.23 0.00 0.00 174.94 173.26 2bdg s GLY 66 N 0.61 1.75 0.02 6.18 0.00 -0.21 -0.26 107.32 115.41 2bdg s GLY 66 Ca 0.03 -1.13 0.08 0.00 0.00 0.00 0.00 44.72 43.70 2bdg s GLY 66 CO 0.01 0.53 -0.23 1.08 0.00 0.00 0.00 173.10 174.49 2bdg s LEU 67 N 1.60 2.29 0.00 0.66 1.43 0.15 -1.40 118.68 123.41 2bdg s LEU 67 Ca 0.06 -0.49 0.00 0.00 -1.03 0.00 0.00 54.13 52.67 2bdg s LEU 67 Cb -0.15 -1.37 0.00 0.00 0.03 0.00 0.00 46.19 44.70 2bdg s LEU 67 CO 0.03 0.28 0.00 0.61 0.23 0.00 0.00 176.35 177.50 2bdg n GLY 69 N 1.94 0.44 3.96 -3.19 0.00 -1.26 -0.40 105.19 106.68 2bdg n GLY 69 Ca -0.17 -0.90 -0.23 0.00 0.00 0.00 0.00 46.02 44.73 2bdg n GLY 69 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bdg s LEU 70 N 0.00 3.56 0.11 0.99 1.43 -1.26 -4.53 118.68 118.98 2bdg s LEU 70 Ca 0.00 0.24 0.00 0.00 -1.03 0.00 0.00 54.13 53.34 2bdg s LEU 70 Cb 0.00 -3.12 0.00 0.00 0.03 0.00 0.00 46.19 43.10 2bdg s LEU 70 CO 0.00 -0.80 0.00 1.57 0.23 0.00 0.00 176.35 177.35 2bdg n HIS 71 N -2.14 -0.85 -2.24 0.29 -0.00 -1.26 -4.67 115.22 104.34 2bdg n HIS 71 Ca 0.03 0.15 -0.27 0.00 -0.00 0.00 0.00 57.72 57.63 2bdg n HIS 71 Cb 0.58 0.41 0.14 0.00 -0.00 0.00 0.00 29.99 31.13 2bdg n HIS 71 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 2bdg s SER 72 N -4.67 3.76 0.00 0.26 1.04 -1.26 -1.80 113.70 111.04 2bdg s SER 72 Ca 0.00 -0.01 0.18 0.00 0.48 0.00 0.00 55.95 56.60 2bdg s SER 72 Cb 0.00 -0.21 0.51 0.00 0.10 0.00 0.00 66.02 66.42 2bdg s SER 72 CO 0.00 -2.28 1.43 0.18 0.98 0.00 0.00 173.24 173.55 2bdg n LEU 73 N -3.30 3.06 -4.55 2.42 4.77 -1.26 -4.83 117.00 113.31 2bdg n LEU 73 Ca 0.15 -1.52 -0.40 0.00 -0.03 0.00 0.00 56.01 54.21 2bdg n LEU 73 Cb 0.60 -0.37 -0.10 0.00 -2.33 0.00 0.00 43.42 41.22 2bdg n LEU 73 CO 0.45 0.76 -0.07 -1.61 -1.33 0.00 0.00 177.39 175.59 2bdg s GLU 74 N -1.26 3.65 0.14 3.23 0.41 -1.26 -5.00 118.70 118.61 2bdg s GLU 74 Ca 0.38 -0.45 -0.19 0.00 -0.41 0.00 0.00 54.97 54.30 2bdg s GLU 74 Cb 0.20 -3.77 0.00 0.00 -1.78 0.00 0.00 34.13 28.79 2bdg s GLU 74 CO 0.26 -0.41 1.71 0.00 -0.49 0.00 0.00 175.26 176.34 2bdg h ALA 74 N 8.43 0.20 0.00 5.21 0.00 -1.95 -2.58 119.26 128.57 2bdg h ALA 74 Ca -0.32 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2bdg h ALA 74 Cb 1.16 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2bdg h ALA 74 CO 0.64 -0.44 0.08 0.38 0.00 0.00 0.00 179.25 179.91 2bdg h ASP 75 N 0.05 0.00 1.17 0.00 2.03 -1.98 -0.90 116.42 116.80 2bdg h ASP 75 Ca 0.12 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.42 2bdg h ASP 75 Cb 0.16 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.66 2bdg h ASP 75 CO -0.22 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 177.99 2bdg n GLN 76 N -2.82 0.17 -3.98 4.15 6.02 -0.97 -4.69 117.38 115.27 2bdg n GLN 76 Ca -0.02 0.20 -0.34 0.00 -0.01 0.00 0.00 57.00 56.82 2bdg n GLN 76 Cb 0.13 -1.72 -0.14 0.00 1.02 0.00 0.00 30.24 29.53 2bdg n GLN 76 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 2bdg s GLU 77 N -3.10 2.68 0.33 -1.09 0.41 -0.34 -5.08 118.70 112.51 2bdg s GLU 77 Ca 0.10 -1.08 -0.28 0.00 -0.41 0.00 0.00 54.97 53.30 2bdg s GLU 77 Cb 0.13 -2.98 -0.10 0.00 -1.78 0.00 0.00 34.13 29.40 2bdg s GLU 77 CO 0.53 -0.45 1.27 -2.14 -0.49 0.00 0.00 175.26 173.97 2bdg s PRO 78 N 1.28 4.34 0.00 0.39 0.02 -1.26 -2.34 135.00 137.43 2bdg s PRO 78 Ca -0.02 2.14 0.00 0.00 0.02 0.00 0.00 61.00 63.14 2bdg s PRO 78 Cb -0.17 -3.04 0.00 0.00 0.02 0.00 0.00 34.50 31.31 2bdg s PRO 78 CO -0.04 -0.17 0.00 0.41 -0.33 0.00 0.00 177.00 176.87 2bdg n GLY 79 N 0.83 1.29 3.83 0.52 0.00 -1.26 -5.03 105.19 105.37 2bdg n GLY 79 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 2bdg n GLY 79 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bdg s SER 80 N -3.14 5.33 -0.08 1.61 1.04 -0.99 -4.78 113.70 112.70 2bdg s SER 80 Ca 0.00 1.51 -0.03 0.00 0.48 0.00 0.00 55.95 57.91 2bdg s SER 80 Cb 0.00 -2.38 0.04 0.00 0.10 0.00 0.00 66.02 63.78 2bdg s SER 80 CO 0.00 -1.46 0.16 -1.10 0.98 0.00 0.00 173.24 171.81 2bdg s GLN 81 N -5.10 0.07 -0.35 4.02 -1.52 0.47 -4.99 119.66 112.26 2bdg s GLN 81 Ca 0.58 0.46 -0.12 0.00 -1.95 0.00 0.00 55.36 54.33 2bdg s GLN 81 Cb -0.14 -0.21 0.00 0.00 -0.22 0.00 0.00 33.01 32.44 2bdg s GLN 81 CO 0.55 -0.23 0.22 -1.64 -0.25 0.00 0.00 175.29 173.94 2bdg s MET 82 N 1.65 3.20 -0.11 2.91 -1.94 -1.26 -0.68 119.30 123.09 2bdg s MET 82 Ca -0.04 -0.83 0.03 0.00 -1.71 0.00 0.00 55.69 53.14 2bdg s MET 82 Cb -0.12 -3.76 -0.01 0.00 2.01 0.00 0.00 34.83 32.96 2bdg s MET 82 CO -0.06 -0.55 -0.20 0.08 -0.01 0.00 0.00 175.02 174.27 2bdg s VAL 83 N 1.65 2.39 0.41 -6.03 1.01 0.63 -4.92 120.40 115.55 2bdg s VAL 83 Ca 0.05 -0.91 -0.24 0.00 0.00 0.00 0.00 61.98 60.88 2bdg s VAL 83 Cb -0.18 -1.94 -0.08 0.00 0.00 0.00 0.00 36.38 34.18 2bdg s VAL 83 CO 0.08 0.55 1.14 -1.61 0.00 0.00 0.00 175.10 175.26 2bdg s GLU 84 N 0.29 4.01 -0.04 2.72 0.41 -1.26 -0.45 118.70 124.36 2bdg s GLU 84 Ca -0.15 1.74 -0.02 0.00 -0.41 0.00 0.00 54.97 56.14 2bdg s GLU 84 Cb -0.17 -2.58 0.03 0.00 -1.78 0.00 0.00 34.13 29.63 2bdg s GLU 84 CO 0.07 -0.33 0.05 0.00 -0.49 0.00 0.00 175.26 174.56 2bdg s ALA 85 N -1.50 0.31 -0.21 5.21 0.00 -0.26 -0.80 121.76 124.50 2bdg s ALA 85 Ca 0.59 0.14 0.08 0.00 0.00 0.00 0.00 51.96 52.76 2bdg s ALA 85 Cb -0.28 -0.63 -0.21 0.00 0.00 0.00 0.00 23.12 22.00 2bdg s ALA 85 CO 0.35 -0.47 -0.01 0.43 0.00 0.00 0.00 175.76 176.06 2bdg n SER 86 N 5.23 1.18 -4.73 0.00 7.64 -1.26 -0.13 113.62 121.55 2bdg n SER 86 Ca -0.05 -0.02 -0.38 0.00 1.01 0.00 0.00 58.87 59.44 2bdg n SER 86 Cb 0.50 0.10 -0.06 0.00 -1.01 0.00 0.00 64.21 63.74 2bdg n SER 86 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2bdg s LEU 87 N -6.15 4.29 -0.01 -3.43 0.20 -1.26 -4.62 118.68 107.70 2bdg s LEU 87 Ca -0.23 0.79 0.01 0.00 0.69 0.00 0.00 54.13 55.39 2bdg s LEU 87 Cb 0.08 -2.64 0.01 0.00 -0.43 0.00 0.00 46.19 43.20 2bdg s LEU 87 CO 0.72 0.04 -0.03 -0.94 -0.29 0.00 0.00 176.35 175.85 2bdg s SER 88 N 0.44 0.46 -0.30 3.68 1.04 -1.26 -0.95 113.70 116.82 2bdg s SER 88 Ca 0.24 -0.06 0.01 0.00 0.48 0.00 0.00 55.95 56.62 2bdg s SER 88 Cb -0.15 -0.11 0.07 0.00 0.10 0.00 0.00 66.02 65.92 2bdg s SER 88 CO 0.10 0.01 -0.01 -0.69 0.98 0.00 0.00 173.24 173.62 2bdg s VAL 89 N 0.23 2.64 0.28 5.02 1.01 0.13 -4.94 120.40 124.78 2bdg s VAL 89 Ca -0.02 -1.66 -0.18 0.00 0.00 0.00 0.00 61.98 60.12 2bdg s VAL 89 Cb -0.05 -2.61 -0.09 0.00 0.00 0.00 0.00 36.38 33.63 2bdg s VAL 89 CO -0.00 -0.20 0.76 -0.60 0.00 0.00 0.00 175.10 175.06 2bdg s ARG 90 N 1.15 4.18 0.28 2.72 3.52 -1.26 -0.26 118.95 129.27 2bdg s ARG 90 Ca -0.03 0.84 -0.30 0.00 -0.13 0.00 0.00 55.73 56.10 2bdg s ARG 90 Cb -0.20 -2.65 -0.11 0.00 -1.56 0.00 0.00 34.95 30.42 2bdg s ARG 90 CO -0.04 0.27 1.61 -1.58 -0.81 0.00 0.00 175.30 174.75 2bdg s HIS 91 N -1.75 2.77 0.56 5.12 5.65 -0.79 -4.86 115.29 121.98 2bdg s HIS 91 Ca 0.49 0.72 0.26 0.00 0.25 0.00 0.00 55.06 56.78 2bdg s HIS 91 Cb -0.14 -4.08 1.48 0.00 -1.18 0.00 0.00 32.58 28.66 2bdg s HIS 91 CO 0.19 -3.70 2.04 -1.00 -0.65 0.00 0.00 174.74 171.63 2bdg h PRO 92 N 5.10 0.00 -0.66 2.88 0.13 -1.93 -1.74 132.00 135.78 2bdg h PRO 92 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2bdg h PRO 92 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2bdg h PRO 92 CO 0.81 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.97 2bdg n GLU 93 N -4.13 3.82 -1.62 0.86 -0.58 -1.26 -5.00 120.64 112.73 2bdg n GLU 93 Ca 0.05 -2.93 -0.46 0.00 -0.42 0.00 0.00 57.16 53.41 2bdg n GLU 93 Cb 0.45 -1.92 -0.03 0.00 -0.57 0.00 0.00 31.44 29.38 2bdg n GLU 93 CO 0.00 0.00 0.00 0.98 -0.48 0.00 0.00 177.13 177.63 2bdg n TYR 94 N 1.13 1.66 -1.02 -0.32 9.36 -0.66 -1.34 117.16 125.98 2bdg n TYR 94 Ca 0.26 0.59 -0.01 0.00 3.32 0.00 0.00 57.90 62.07 2bdg n TYR 94 Cb 0.92 -2.34 -0.00 0.00 -0.63 0.00 0.00 39.34 37.28 2bdg n TYR 94 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 2bdg n ASN 95 N 1.73 -5.19 -3.91 2.98 4.05 0.04 -4.95 115.26 110.02 2bdg n ASN 95 Ca 0.11 0.01 -0.30 0.00 0.45 0.00 0.00 54.58 54.85 2bdg n ASN 95 Cb 0.30 -2.74 -0.15 0.00 1.23 0.00 0.00 39.78 38.42 2bdg n ASN 95 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 2bdg s ARG 96 N -1.54 1.42 1.01 1.20 0.52 -0.45 -2.85 118.95 118.26 2bdg s ARG 96 Ca 0.00 -1.91 -0.16 0.00 -0.52 0.00 0.00 55.73 53.13 2bdg s ARG 96 Cb 0.00 -2.88 0.21 0.00 0.52 0.00 0.00 34.95 32.80 2bdg s ARG 96 CO 0.00 -1.02 1.25 -1.25 0.02 0.00 0.00 175.30 174.30 2bdg s PRO 97 N 0.69 0.26 -0.25 3.54 0.04 -1.26 -4.87 135.00 133.15 2bdg s PRO 97 Ca 0.13 -0.26 -0.43 0.00 0.04 0.00 0.00 61.00 60.49 2bdg s PRO 97 Cb -0.21 -1.79 -0.19 0.00 0.04 0.00 0.00 34.50 32.35 2bdg s PRO 97 CO -0.08 -2.69 1.42 -0.11 0.04 0.00 0.00 177.00 175.57 2bdg n LEU 98 N -4.00 1.01 0.00 -3.56 7.94 -1.13 -1.31 117.00 115.95 2bdg n LEU 98 Ca 0.14 1.16 0.00 0.00 -1.11 0.00 0.00 56.01 56.20 2bdg n LEU 98 Cb 0.59 -0.96 0.00 0.00 0.53 0.00 0.00 43.42 43.59 2bdg n LEU 98 CO 0.47 -1.16 0.00 0.18 -1.11 0.00 0.00 177.39 175.77 2bdg n LEU 99 N 3.22 0.00 -4.80 -1.96 4.77 -1.26 -4.95 117.00 112.02 2bdg n LEU 99 Ca 0.26 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.94 2bdg n LEU 99 Cb 0.04 -0.14 0.10 0.00 -2.33 0.00 0.00 43.42 41.08 2bdg n LEU 99 CO 0.77 0.00 0.71 0.00 -1.33 0.00 0.00 177.39 177.53 2bdg s ALA 100 N -2.36 2.17 -1.39 -1.18 0.00 -0.42 -4.24 121.76 114.33 2bdg s ALA 100 Ca 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 51.96 51.72 2bdg s ALA 100 Cb 0.00 -3.11 0.01 0.00 0.00 0.00 0.00 23.12 20.02 2bdg s ALA 100 CO 0.00 -1.82 0.52 0.09 0.00 0.00 0.00 175.76 174.56 2bdg n ASN 101 N -3.49 -0.77 -3.84 0.00 5.03 -1.26 -0.78 115.26 110.16 2bdg n ASN 101 Ca 0.07 -0.95 -0.42 0.00 0.87 0.00 0.00 54.58 54.15 2bdg n ASN 101 Cb 0.56 -3.35 0.00 0.00 -1.02 0.00 0.00 39.78 35.97 2bdg n ASN 101 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 2bdg n ASP 102 N -2.99 4.45 -3.81 6.41 2.03 -1.26 -4.04 116.55 117.33 2bdg n ASP 102 Ca -0.29 -2.96 -0.10 0.00 0.52 0.00 0.00 54.79 51.97 2bdg n ASP 102 Cb 0.67 -1.59 -0.07 0.00 -0.72 0.00 0.00 41.12 39.41 2bdg n ASP 102 CO 0.00 0.00 0.00 -1.48 -1.92 0.00 0.00 177.20 173.80 2bdg s LEU 103 N 1.30 1.18 -0.04 -2.67 2.34 -1.26 -3.57 118.68 115.96 2bdg s LEU 103 Ca 0.44 -0.43 -0.29 0.00 0.06 0.00 0.00 54.13 53.91 2bdg s LEU 103 Cb 0.11 1.17 0.06 0.00 -0.56 0.00 0.00 46.19 46.97 2bdg s LEU 103 CO -0.04 -0.67 0.62 0.00 -1.06 0.00 0.00 176.35 175.20 2bdg s MET 104 N -3.19 1.01 -0.21 1.48 0.23 -0.24 -1.89 119.30 116.49 2bdg s MET 104 Ca -0.00 0.18 -0.06 0.00 -1.03 0.00 0.00 55.69 54.78 2bdg s MET 104 Cb 0.02 0.47 -0.03 0.00 -1.53 0.00 0.00 34.83 33.76 2bdg s MET 104 CO -0.07 -0.31 0.03 -0.51 -2.03 0.00 0.00 175.02 172.13 2bdg s LEU 105 N -1.23 3.43 -0.21 0.18 1.43 0.64 -1.53 118.68 121.39 2bdg s LEU 105 Ca -0.11 -0.14 -0.09 0.00 -1.03 0.00 0.00 54.13 52.77 2bdg s LEU 105 Cb -0.01 -1.88 -0.04 0.00 0.03 0.00 0.00 46.19 44.29 2bdg s LEU 105 CO 0.09 0.07 0.10 -0.63 0.23 0.00 0.00 176.35 176.21 2bdg s ILE 106 N 1.00 4.97 -0.24 -0.59 -1.09 0.13 0.21 121.20 125.59 2bdg s ILE 106 Ca 0.03 0.04 -0.12 0.00 -2.23 0.00 0.00 60.65 58.36 2bdg s ILE 106 Cb -0.14 -3.28 -0.05 0.00 -1.58 0.00 0.00 42.46 37.41 2bdg s ILE 106 CO 0.02 0.40 0.25 -0.75 -1.23 0.00 0.00 174.94 173.63 2bdg s LYS 107 N 0.80 4.07 0.52 2.79 2.20 -0.12 -0.36 119.74 129.63 2bdg s LYS 107 Ca 0.05 -0.13 -0.21 0.00 -0.36 0.00 0.00 55.97 55.32 2bdg s LYS 107 Cb -0.13 -3.58 -0.06 0.00 -1.51 0.00 0.00 37.83 32.55 2bdg s LYS 107 CO 0.02 -0.05 1.18 -0.51 -0.36 0.00 0.00 175.35 175.63 2bdg s LEU 108 N 1.37 3.84 0.48 5.43 1.43 0.90 -4.12 118.68 128.02 2bdg s LEU 108 Ca 0.11 2.31 0.26 0.00 -1.03 0.00 0.00 54.13 55.78 2bdg s LEU 108 Cb -0.14 -4.43 1.16 0.00 0.03 0.00 0.00 46.19 42.80 2bdg s LEU 108 CO 0.07 -1.20 1.93 0.44 0.23 0.00 0.00 176.35 177.82 2bdg h ASP 109 N 1.49 0.00 -3.70 2.29 3.45 -1.30 -3.42 116.42 115.22 2bdg h ASP 109 Ca -0.50 0.00 -0.25 0.00 0.43 0.00 0.00 57.03 56.71 2bdg h ASP 109 Cb 1.27 0.00 -0.29 0.00 -0.56 0.00 0.00 39.33 39.74 2bdg h ASP 109 CO 0.58 0.18 -0.72 -1.61 -1.57 0.00 0.00 179.24 176.09 2bdg s GLU 110 N -3.85 0.03 0.60 3.56 8.01 -1.26 -5.10 118.70 120.69 2bdg s GLU 110 Ca -0.01 0.02 -0.17 0.00 0.01 0.00 0.00 54.97 54.82 2bdg s GLU 110 Cb 0.11 -0.08 -0.03 0.00 -4.31 0.00 0.00 34.13 29.82 2bdg s GLU 110 CO 0.61 -0.03 1.13 -1.12 0.01 0.00 0.00 175.26 175.86 2bdg s SER 111 N 0.21 5.34 0.12 -0.19 0.01 -1.26 -4.89 113.70 113.05 2bdg s SER 111 Ca -0.02 2.13 0.04 0.00 1.31 0.00 0.00 55.95 59.41 2bdg s SER 111 Cb -0.03 -2.57 -0.04 0.00 0.21 0.00 0.00 66.02 63.59 2bdg s SER 111 CO -0.01 -1.47 0.13 0.54 0.41 0.00 0.00 173.24 172.84 2bdg s VAL 112 N -2.00 4.61 -0.11 3.43 0.11 -0.66 -5.00 120.40 120.78 2bdg s VAL 112 Ca 0.71 -0.89 -0.22 0.00 -2.93 0.00 0.00 61.98 58.65 2bdg s VAL 112 Cb -0.23 -3.29 -0.03 0.00 -1.53 0.00 0.00 36.38 31.29 2bdg s VAL 112 CO 0.34 0.00 0.66 -0.55 -3.33 0.00 0.00 175.10 172.23 2bdg s SER 113 N -2.78 6.87 0.48 3.54 0.15 -1.26 -4.81 113.70 115.90 2bdg s SER 113 Ca 0.31 1.05 -0.22 0.00 0.70 0.00 0.00 55.95 57.80 2bdg s SER 113 Cb -0.11 -2.38 -0.07 0.00 -1.71 0.00 0.00 66.02 61.74 2bdg s SER 113 CO 0.23 -0.15 1.11 -1.61 1.20 0.00 0.00 173.24 174.03 2bdg s GLU 114 N 1.08 3.72 0.00 5.44 2.02 -1.26 -4.88 118.70 124.82 2bdg s GLU 114 Ca 0.34 1.60 0.00 0.00 0.02 0.00 0.00 54.97 56.93 2bdg s GLU 114 Cb -0.17 -2.25 0.00 0.00 0.10 0.00 0.00 34.13 31.82 2bdg s GLU 114 CO 0.15 -0.54 0.00 -1.13 0.02 0.00 0.00 175.26 173.75 2bdg n SER 115 N -0.75 0.00 0.20 -0.19 3.41 0.25 -4.96 113.62 111.58 2bdg n SER 115 Ca 0.09 -0.66 0.06 0.00 -0.26 0.00 0.00 58.87 58.10 2bdg n SER 115 Cb 0.50 0.00 0.41 0.00 -0.26 0.00 0.00 64.21 64.86 2bdg n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2bdg h ASP 116 N 0.00 0.00 -0.00 4.04 3.45 -1.99 -3.26 116.42 118.66 2bdg h ASP 116 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2bdg h ASP 116 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 2bdg h ASP 116 CO 0.00 0.33 -0.61 0.35 -1.57 0.00 0.00 179.24 177.74 2bdg n THR 117 N -3.66 0.00 -3.73 0.35 -2.24 -1.26 -4.84 114.28 98.91 2bdg n THR 117 Ca -0.01 -0.20 -0.29 0.00 -2.27 0.00 0.00 64.05 61.29 2bdg n THR 117 Cb 0.44 1.06 -0.16 0.00 -2.10 0.00 0.00 70.33 69.58 2bdg n THR 117 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2bdg s ILE 118 N -2.29 0.64 -0.03 2.28 1.09 -1.23 -3.99 121.20 117.67 2bdg s ILE 118 Ca 0.08 -0.90 -0.03 0.00 -1.10 0.00 0.00 60.65 58.70 2bdg s ILE 118 Cb 0.12 -1.29 0.01 0.00 -1.06 0.00 0.00 42.46 40.24 2bdg s ILE 118 CO 0.56 -0.42 0.10 -0.13 -0.10 0.00 0.00 174.94 174.96 2bdg s ARG 119 N 1.77 0.13 0.71 2.79 0.52 -0.81 -0.58 118.95 123.48 2bdg s ARG 119 Ca 0.03 0.11 -0.11 0.00 -0.52 0.00 0.00 55.73 55.24 2bdg s ARG 119 Cb -0.17 0.06 0.02 0.00 0.52 0.00 0.00 34.95 35.38 2bdg s ARG 119 CO -0.17 -0.02 1.07 -1.12 0.02 0.00 0.00 175.30 175.09 2bdg s SER 120 N -0.01 5.14 0.04 0.23 0.01 -1.26 -2.65 113.70 115.20 2bdg s SER 120 Ca -0.01 1.70 0.06 0.00 1.31 0.00 0.00 55.95 59.02 2bdg s SER 120 Cb -0.01 -2.51 -0.02 0.00 0.21 0.00 0.00 66.02 63.69 2bdg s SER 120 CO 0.00 -1.61 -0.16 -0.51 0.41 0.00 0.00 173.24 171.37 2bdg s ILE 121 N -2.94 1.32 0.36 1.44 1.10 -0.78 -4.90 121.20 116.79 2bdg s ILE 121 Ca 0.60 -1.09 -0.24 0.00 -0.51 0.00 0.00 60.65 59.40 2bdg s ILE 121 Cb -0.15 -1.17 -0.10 0.00 0.15 0.00 0.00 42.46 41.18 2bdg s ILE 121 CO 0.54 0.06 0.94 -0.94 -2.11 0.00 0.00 174.94 173.43 2bdg s SER 122 N -1.20 7.20 0.14 4.50 1.04 -1.26 -4.60 113.70 119.52 2bdg s SER 122 Ca 0.04 1.78 -0.23 0.00 0.48 0.00 0.00 55.95 58.02 2bdg s SER 122 Cb -0.08 -2.56 -0.08 0.00 0.10 0.00 0.00 66.02 63.40 2bdg s SER 122 CO 0.02 -0.16 0.70 -0.63 0.98 0.00 0.00 173.24 174.14 2bdg s ILE 123 N -1.80 4.51 0.30 -1.02 -1.09 -1.26 -1.17 121.20 119.66 2bdg s ILE 123 Ca 0.54 1.51 -0.28 0.00 -2.23 0.00 0.00 60.65 60.19 2bdg s ILE 123 Cb -0.15 -4.04 -0.14 0.00 -1.58 0.00 0.00 42.46 36.55 2bdg s ILE 123 CO 0.20 0.52 1.08 0.00 -1.23 0.00 0.00 174.94 175.51 2bdg n ALA 124 N 1.59 0.14 -0.68 9.38 0.00 0.11 -4.79 120.51 126.27 2bdg n ALA 124 Ca -0.07 0.38 0.08 0.00 0.00 0.00 0.00 53.44 53.83 2bdg n ALA 124 Cb 0.49 -2.08 0.27 0.00 0.00 0.00 0.00 19.45 18.14 2bdg n ALA 124 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2bdg n SER 125 N 1.12 4.03 -3.83 0.00 3.41 -1.26 -4.54 113.62 112.55 2bdg n SER 125 Ca 0.08 -2.59 -0.12 0.00 -0.26 0.00 0.00 58.87 55.98 2bdg n SER 125 Cb 0.33 -0.48 -0.10 0.00 -0.26 0.00 0.00 64.21 63.70 2bdg n SER 125 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bdg s GLN 127 N -2.08 0.53 0.81 4.33 -2.07 -1.26 -5.10 119.66 114.81 2bdg s GLN 127 Ca 0.41 -0.30 -0.11 0.00 -1.82 0.00 0.00 55.36 53.53 2bdg s GLN 127 Cb 0.29 0.23 0.08 0.00 -1.09 0.00 0.00 33.01 32.51 2bdg s GLN 127 CO 0.16 -0.13 1.09 0.00 -1.32 0.00 0.00 175.29 175.09 2bdg n PRO 129 N -3.51 1.99 -3.62 0.00 -0.02 -1.26 -5.00 135.00 123.57 2bdg n PRO 129 Ca 0.07 0.70 -0.38 0.00 -2.02 0.00 0.00 63.50 61.88 2bdg n PRO 129 Cb 0.55 -2.31 -0.11 0.00 -0.02 0.00 0.00 33.50 31.61 2bdg n PRO 129 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2bdg s THR 130 N -0.42 5.06 0.19 3.45 2.01 -1.26 -5.01 115.64 119.66 2bdg s THR 130 Ca 0.64 0.04 -0.33 0.00 0.31 0.00 0.00 61.69 62.35 2bdg s THR 130 Cb -0.64 -3.43 -0.15 0.00 0.01 0.00 0.00 72.50 68.30 2bdg s THR 130 CO 0.54 0.24 1.33 0.00 -0.69 0.00 0.00 174.62 176.04 2bdg n ALA 132 N 5.03 0.20 0.00 7.40 0.00 -1.26 -1.55 120.51 130.32 2bdg n ALA 132 Ca -0.14 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.74 2bdg n ALA 132 Cb 0.52 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.80 2bdg n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bdg n GLY 133 N 2.32 2.26 3.70 0.00 0.00 0.31 -4.95 105.19 108.83 2bdg n GLY 133 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2bdg n GLY 133 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2bdg s ASN 134 N -2.33 6.61 -0.34 1.61 2.47 -0.60 -4.65 114.94 117.72 2bdg s ASN 134 Ca 0.00 2.50 -0.26 0.00 0.42 0.00 0.00 52.86 55.51 2bdg s ASN 134 Cb 0.00 -2.57 0.01 0.00 -1.45 0.00 0.00 41.25 37.24 2bdg s ASN 134 CO 0.00 -0.86 0.95 -0.55 -3.72 0.00 0.00 177.10 172.92 2bdg s SER 135 N 2.10 6.76 0.50 -4.21 0.15 -1.26 -1.10 113.70 116.64 2bdg s SER 135 Ca 0.73 0.76 0.04 0.00 0.70 0.00 0.00 55.95 58.17 2bdg s SER 135 Cb -0.40 -2.48 -0.01 0.00 -1.71 0.00 0.00 66.02 61.42 2bdg s SER 135 CO 0.32 -0.82 0.15 0.00 1.20 0.00 0.00 173.24 174.09 2bdg s LEU 137 N -3.99 1.99 -0.04 0.00 2.96 0.08 -1.21 118.68 118.47 2bdg s LEU 137 Ca 0.21 -0.41 0.06 0.00 -0.22 0.00 0.00 54.13 53.77 2bdg s LEU 137 Cb 0.01 -1.12 -0.01 0.00 0.50 0.00 0.00 46.19 45.57 2bdg s LEU 137 CO 0.12 0.20 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.44 2bdg s VAL 138 N -0.12 1.81 0.08 1.68 1.01 -0.42 0.22 120.40 124.66 2bdg s VAL 138 Ca -0.02 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 61.05 2bdg s VAL 138 Cb -0.12 -1.53 -0.03 0.00 0.00 0.00 0.00 36.38 34.71 2bdg s VAL 138 CO 0.02 0.51 -0.10 -0.94 0.00 0.00 0.00 175.10 174.59 2bdg s SER 139 N -0.27 1.37 0.00 3.32 1.04 -1.14 -1.45 113.70 116.57 2bdg s SER 139 Ca 0.01 -0.72 0.00 0.00 0.48 0.00 0.00 55.95 55.72 2bdg s SER 139 Cb -0.11 0.00 0.00 0.00 0.10 0.00 0.00 66.02 66.01 2bdg s SER 139 CO 0.01 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.63 2bdg n GLY 140 N 0.87 0.34 0.94 7.32 0.00 -0.56 -4.24 105.19 109.86 2bdg n GLY 140 Ca -0.18 -0.97 0.08 0.00 0.00 0.00 0.00 46.02 44.95 2bdg n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2bdg n TRP 141 N -0.31 0.86 -0.94 1.61 8.01 -1.26 -1.21 117.44 124.20 2bdg n TRP 141 Ca 0.00 -0.66 -0.14 0.00 -1.31 0.00 0.00 57.50 55.39 2bdg n TRP 141 Cb 0.00 -0.18 0.11 0.00 -2.01 0.00 0.00 31.31 29.23 2bdg n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2bdg n GLY 142 N 0.28 -2.24 3.57 6.99 0.00 -1.25 -4.26 105.19 108.27 2bdg n GLY 142 Ca 0.18 -1.53 -0.44 0.00 0.00 0.00 0.00 46.02 44.23 2bdg n GLY 142 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bdg n LEU 143 N 0.00 1.57 -4.98 0.99 4.32 0.00 -3.20 117.00 115.70 2bdg n LEU 143 Ca 0.07 1.14 -0.20 0.00 -0.02 0.00 0.00 56.01 57.00 2bdg n LEU 143 Cb 0.27 -1.26 0.01 0.00 -1.62 0.00 0.00 43.42 40.82 2bdg n LEU 143 CO 0.19 -1.62 0.20 -0.76 -1.22 0.00 0.00 177.39 174.18 2bdg s LEU 144 N 0.59 3.67 0.35 2.23 1.43 0.28 -0.24 118.68 126.99 2bdg s LEU 144 Ca 0.60 -0.10 0.09 0.00 -1.03 0.00 0.00 54.13 53.69 2bdg s LEU 144 Cb -0.69 -2.85 0.82 0.00 0.03 0.00 0.00 46.19 43.51 2bdg s LEU 144 CO 0.59 -0.72 1.85 0.00 0.23 0.00 0.00 176.35 178.30 2bdg h ALA 145 N 0.54 1.84 0.00 4.21 0.00 -1.88 0.32 119.26 124.29 2bdg h ALA 145 Ca -0.44 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2bdg h ALA 145 Cb 1.27 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2bdg h ALA 145 CO 0.52 -0.10 0.00 0.27 0.00 0.00 0.00 179.25 179.93 2bdg n ASN 146 N -4.58 0.00 0.00 0.00 0.23 -1.26 -4.88 115.26 104.77 2bdg n ASN 146 Ca 0.18 -0.48 0.00 0.00 -0.53 0.00 0.00 54.58 53.75 2bdg n ASN 146 Cb 0.50 -0.12 0.00 0.00 -2.08 0.00 0.00 39.78 38.08 2bdg n ASN 146 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2bdg n GLY 147 N 0.66 0.77 3.98 4.83 0.00 0.10 -5.06 105.19 110.47 2bdg n GLY 147 Ca 0.16 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.99 2bdg n GLY 147 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bdg s ARG 150 N -0.51 2.66 -0.04 1.61 0.52 -1.26 -4.78 118.95 117.16 2bdg s ARG 150 Ca 0.00 -1.40 -0.03 0.00 -0.52 0.00 0.00 55.73 53.78 2bdg s ARG 150 Cb 0.00 -2.63 -0.04 0.00 0.52 0.00 0.00 34.95 32.80 2bdg s ARG 150 CO 0.00 -0.35 0.15 -1.64 0.02 0.00 0.00 175.30 173.49 2bdg s MET 151 N -4.34 3.38 0.67 3.54 -1.94 -1.26 -0.56 119.30 118.78 2bdg s MET 151 Ca 0.54 -0.30 -0.10 0.00 -1.71 0.00 0.00 55.69 54.11 2bdg s MET 151 Cb -0.07 -3.08 0.00 0.00 2.01 0.00 0.00 34.83 33.69 2bdg s MET 151 CO 0.32 0.70 1.04 -1.25 -0.01 0.00 0.00 175.02 175.82 2bdg s PRO 152 N -1.67 3.02 0.00 2.03 0.04 -1.26 -4.96 135.00 132.19 2bdg s PRO 152 Ca 0.23 0.43 0.23 0.00 0.04 0.00 0.00 61.00 61.93 2bdg s PRO 152 Cb -0.12 -2.08 0.06 0.00 0.04 0.00 0.00 34.50 32.39 2bdg s PRO 152 CO 0.14 -0.87 1.11 0.25 0.04 0.00 0.00 177.00 177.67 2bdg n THR 153 N -2.87 0.00 -4.01 1.26 -2.24 -1.26 -4.95 114.28 100.20 2bdg n THR 153 Ca 0.06 -0.07 -0.08 0.00 -2.27 0.00 0.00 64.05 61.70 2bdg n THR 153 Cb 0.57 0.85 -0.09 0.00 -2.10 0.00 0.00 70.33 69.55 2bdg n THR 153 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2bdg s VAL 154 N -2.84 0.19 0.12 2.28 1.01 -1.26 -4.15 120.40 115.74 2bdg s VAL 154 Ca 0.12 -1.55 -0.34 0.00 0.00 0.00 0.00 61.98 60.21 2bdg s VAL 154 Cb 0.17 -1.36 -0.14 0.00 0.00 0.00 0.00 36.38 35.05 2bdg s VAL 154 CO 0.74 -0.86 1.56 -0.11 0.00 0.00 0.00 175.10 176.44 2bdg n LEU 155 N 0.20 2.87 -4.84 3.92 0.00 -0.74 -4.85 117.00 113.56 2bdg n LEU 155 Ca -0.15 1.08 -0.31 0.00 0.00 0.00 0.00 56.01 56.63 2bdg n LEU 155 Cb 0.61 -1.38 -0.05 0.00 0.00 0.00 0.00 43.42 42.59 2bdg n LEU 155 CO 0.26 -0.40 -0.21 -1.10 0.00 0.00 0.00 177.39 175.93 2bdg s GLN 156 N 1.13 3.14 0.01 1.96 -1.52 -0.35 -1.01 119.66 123.02 2bdg s GLN 156 Ca 0.81 -0.56 0.04 0.00 -1.95 0.00 0.00 55.36 53.71 2bdg s GLN 156 Cb -0.73 -2.88 -0.01 0.00 -0.22 0.00 0.00 33.01 29.17 2bdg s GLN 156 CO 0.41 0.60 -0.14 0.00 -0.25 0.00 0.00 175.29 175.91 2bdg s VAL 158 N -0.50 0.05 -0.12 0.00 0.11 -0.53 -1.34 120.40 118.08 2bdg s VAL 158 Ca 0.04 -0.42 -0.07 0.00 -2.93 0.00 0.00 61.98 58.61 2bdg s VAL 158 Cb -0.06 -0.72 -0.04 0.00 -1.53 0.00 0.00 36.38 34.03 2bdg s VAL 158 CO 0.00 -0.23 0.14 0.20 -3.33 0.00 0.00 175.10 171.88 2bdg s ASN 159 N -1.41 6.36 0.01 3.54 -0.87 -1.26 -1.30 114.94 120.01 2bdg s ASN 159 Ca -0.12 0.45 -0.03 0.00 -1.57 0.00 0.00 52.86 51.59 2bdg s ASN 159 Cb -0.04 -2.06 -0.01 0.00 -0.02 0.00 0.00 41.25 39.12 2bdg s ASN 159 CO 0.04 0.40 0.05 0.68 -2.57 0.00 0.00 177.10 175.70 2bdg s VAL 160 N -0.96 0.09 -0.03 1.60 -7.23 -0.35 -4.91 120.40 108.61 2bdg s VAL 160 Ca 0.15 -0.77 -0.01 0.00 -1.81 0.00 0.00 61.98 59.54 2bdg s VAL 160 Cb -0.12 -0.32 -0.04 0.00 0.56 0.00 0.00 36.38 36.46 2bdg s VAL 160 CO 0.04 -0.42 0.05 -0.44 -0.31 0.00 0.00 175.10 174.02 2bdg s SER 161 N -1.34 5.50 0.38 4.85 0.01 -1.26 0.12 113.70 121.95 2bdg s SER 161 Ca -0.15 0.13 -0.28 0.00 1.31 0.00 0.00 55.95 56.97 2bdg s SER 161 Cb -0.08 -1.56 -0.10 0.00 0.21 0.00 0.00 66.02 64.49 2bdg s SER 161 CO 0.00 0.31 1.41 -0.69 0.41 0.00 0.00 173.24 174.67 2bdg s VAL 162 N -1.09 2.31 -0.08 3.43 1.01 -0.26 -1.08 120.40 124.65 2bdg s VAL 162 Ca 0.19 0.30 -0.02 0.00 0.00 0.00 0.00 61.98 62.46 2bdg s VAL 162 Cb -0.12 -3.19 -0.03 0.00 0.00 0.00 0.00 36.38 33.04 2bdg s VAL 162 CO 0.10 0.07 0.03 -0.69 0.00 0.00 0.00 175.10 174.61 2bdg s VAL 163 N -1.15 4.53 0.64 2.92 1.01 -0.20 -0.53 120.40 127.62 2bdg s VAL 163 Ca 0.53 -0.22 -0.18 0.00 0.00 0.00 0.00 61.98 62.12 2bdg s VAL 163 Cb -0.43 -2.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.97 2bdg s VAL 163 CO 0.58 0.56 0.96 -1.54 0.00 0.00 0.00 175.10 175.66 2bdg n SER 164 N 1.96 0.66 -0.26 3.32 3.41 -1.26 -4.44 113.62 117.01 2bdg n SER 164 Ca -0.18 0.76 -0.05 0.00 -0.26 0.00 0.00 58.87 59.15 2bdg n SER 164 Cb 0.54 -1.39 0.10 0.00 -0.26 0.00 0.00 64.21 63.20 2bdg n SER 164 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2bdg h GLU 165 N 0.27 1.12 -0.33 4.33 4.81 -1.96 -1.34 114.58 121.47 2bdg h GLU 165 Ca -0.48 -0.20 0.04 0.00 -0.13 0.00 0.00 59.36 58.59 2bdg h GLU 165 Cb 1.36 -0.18 -0.04 0.00 0.63 0.00 0.00 28.75 30.52 2bdg h GLU 165 CO 0.50 0.91 0.11 1.49 -0.73 0.00 0.00 179.01 181.28 2bdg h GLU 166 N 1.09 0.24 -0.23 1.92 4.81 -2.00 0.02 114.58 120.43 2bdg h GLU 166 Ca 0.25 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.42 2bdg h GLU 166 Cb 0.21 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 2bdg h GLU 166 CO -0.02 0.16 -0.06 0.28 -0.73 0.00 0.00 179.01 178.64 2bdg h VAL 167 N 0.24 1.28 -0.31 0.32 2.07 -1.88 -2.69 116.25 115.29 2bdg h VAL 167 Ca 0.15 -1.06 0.04 0.00 0.82 0.00 0.00 66.70 66.65 2bdg h VAL 167 Cb 0.13 1.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 2bdg h VAL 167 CO -0.16 0.33 0.08 0.00 0.02 0.00 0.00 177.57 177.83 2bdg h SER 169 N 0.20 0.56 -0.13 0.00 4.64 -0.97 -1.76 113.55 116.09 2bdg h SER 169 Ca 0.14 -0.08 -0.22 0.00 -0.47 0.00 0.00 61.79 61.16 2bdg h SER 169 Cb 0.13 -0.14 0.01 0.00 -0.31 0.00 0.00 62.40 62.09 2bdg h SER 169 CO -0.17 0.56 -0.76 0.11 -0.87 0.00 0.00 176.83 175.71 2bdg h LYS 170 N 0.59 0.74 -0.74 4.77 1.79 -1.12 -1.07 116.57 121.54 2bdg h LYS 170 Ca 0.14 -0.63 -0.04 0.00 -2.18 0.00 0.00 60.65 57.94 2bdg h LYS 170 Cb 0.23 0.14 -0.03 0.00 -1.58 0.00 0.00 32.23 30.98 2bdg h LYS 170 CO -0.00 1.23 0.31 -0.07 -1.08 0.00 0.00 179.45 179.84 2bdg h LEU 171 N 0.45 1.00 -1.80 2.94 3.38 -0.54 -3.26 115.31 117.48 2bdg h LEU 171 Ca -0.06 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2bdg h LEU 171 Cb 1.40 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2bdg h LEU 171 CO 0.16 0.89 0.00 -1.22 0.09 0.00 0.00 178.44 178.35 2bdg n TYR 172 N -4.36 0.02 -1.59 1.13 4.01 -0.69 -4.98 117.16 110.70 2bdg n TYR 172 Ca 0.06 -0.01 -0.49 0.00 -0.16 0.00 0.00 57.90 57.30 2bdg n TYR 172 Cb 0.17 -0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.15 2bdg n TYR 172 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2bdg n ASP 173 N 1.13 1.51 -0.65 7.72 -0.08 -0.41 0.87 116.55 126.64 2bdg n ASP 173 Ca 0.12 1.14 0.06 0.00 -1.51 0.00 0.00 54.79 54.59 2bdg n ASP 173 Cb 0.50 -1.23 0.16 0.00 2.34 0.00 0.00 41.12 42.89 2bdg n ASP 173 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2bdg n PRO 174 N 1.90 1.82 0.11 -0.67 -0.04 -1.26 -4.87 135.00 131.99 2bdg n PRO 174 Ca 0.15 -1.27 -0.02 0.00 -0.04 0.00 0.00 63.50 62.33 2bdg n PRO 174 Cb 0.24 -1.28 -0.03 0.00 -0.04 0.00 0.00 33.50 32.40 2bdg n PRO 174 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2bdg h LEU 175 N 2.07 0.00 -9.69 1.53 3.38 0.11 -3.46 115.31 109.25 2bdg h LEU 175 Ca 0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 2bdg h LEU 175 Cb 0.47 0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.30 2bdg h LEU 175 CO 0.00 0.71 0.88 0.00 0.09 0.00 0.00 178.44 180.12 2bdg n TYR 176 N -3.29 2.67 -3.97 1.13 4.19 -1.09 -4.86 117.16 111.94 2bdg n TYR 176 Ca 0.01 0.21 -0.10 0.00 3.31 0.00 0.00 57.90 61.33 2bdg n TYR 176 Cb 0.82 -2.60 -0.12 0.00 0.49 0.00 0.00 39.34 37.93 2bdg n TYR 176 CO 0.00 0.00 0.00 -1.58 0.91 0.00 0.00 176.86 176.19 2bdg s HIS 177 N 0.44 0.24 -0.47 2.98 2.46 -1.26 -4.92 115.29 114.75 2bdg s HIS 177 Ca 0.69 -0.40 0.09 0.00 0.47 0.00 0.00 55.06 55.91 2bdg s HIS 177 Cb -0.54 -0.17 0.46 0.00 -0.13 0.00 0.00 32.58 32.21 2bdg s HIS 177 CO 0.43 -0.14 1.19 -2.30 -2.47 0.00 0.00 174.74 171.45 2bdg n PRO 178 N 1.94 0.06 -0.00 2.88 -0.02 -1.26 -0.55 135.00 138.05 2bdg n PRO 178 Ca -0.21 0.50 0.15 0.00 -2.02 0.00 0.00 63.50 61.93 2bdg n PRO 178 Cb 0.56 -1.80 0.89 0.00 -0.02 0.00 0.00 33.50 33.13 2bdg n PRO 178 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2bdg n SER 179 N -1.77 0.14 -4.48 2.55 3.41 -1.26 -4.80 113.62 107.42 2bdg n SER 179 Ca -0.01 -1.07 -0.24 0.00 -0.26 0.00 0.00 58.87 57.30 2bdg n SER 179 Cb 0.13 -0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.97 2bdg n SER 179 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2bdg s MET 180 N -2.00 1.67 0.04 4.33 -1.94 0.29 0.04 119.30 121.73 2bdg s MET 180 Ca 0.46 -1.83 -0.21 0.00 -1.71 0.00 0.00 55.69 52.40 2bdg s MET 180 Cb 0.21 -1.52 0.05 0.00 2.01 0.00 0.00 34.83 35.59 2bdg s MET 180 CO 0.36 0.16 0.49 -0.59 -0.01 0.00 0.00 175.02 175.43 2bdg s PHE 181 N -2.73 -0.38 0.07 -0.03 -0.12 -0.39 -4.68 117.98 109.72 2bdg s PHE 181 Ca 0.30 0.41 0.02 0.00 -0.05 0.00 0.00 56.93 57.60 2bdg s PHE 181 Cb 0.01 0.30 -0.04 0.00 -0.63 0.00 0.00 43.02 42.66 2bdg s PHE 181 CO 0.14 -0.62 0.13 0.00 -0.05 0.00 0.00 175.22 174.82 2bdg s ALA 183 N -1.43 -1.15 0.00 0.00 0.00 -0.87 -1.04 121.76 117.28 2bdg s ALA 183 Ca 0.31 1.34 0.00 0.00 0.00 0.00 0.00 51.96 53.61 2bdg s ALA 183 Cb -0.12 -0.78 0.00 0.00 0.00 0.00 0.00 23.12 22.22 2bdg s ALA 183 CO 0.24 -0.22 0.00 0.41 0.00 0.00 0.00 175.76 176.19 2bdg n GLY 184 N 2.93 0.35 1.92 0.00 0.00 -0.24 -1.80 105.19 108.35 2bdg n GLY 184 Ca -0.14 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.18 2bdg n GLY 184 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bdg n GLY 185 N 0.00 0.81 3.76 -0.02 0.00 -1.26 -4.47 105.19 104.01 2bdg n GLY 185 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2bdg n GLY 185 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bdg s GLY 186 N -1.75 1.60 0.22 -0.02 0.00 -1.26 0.70 107.32 106.80 2bdg s GLY 186 Ca 0.00 -0.69 0.23 0.00 0.00 0.00 0.00 44.72 44.26 2bdg s GLY 186 CO 0.00 -0.03 1.69 -1.06 0.00 0.00 0.00 173.10 173.69 2bdg n GLN 186 N -3.98 0.17 0.00 2.90 3.00 -1.26 -1.80 117.38 116.40 2bdg n GLN 186 Ca 0.09 0.38 0.07 0.00 -0.01 0.00 0.00 57.00 57.53 2bdg n GLN 186 Cb 0.59 -1.81 0.38 0.00 0.00 0.00 0.00 30.24 29.40 2bdg n GLN 186 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.06 176.66 2bdg n ASP 186 N -2.13 0.00 -3.44 1.08 5.68 -1.26 -4.85 116.55 111.63 2bdg n ASP 186 Ca 0.03 -0.02 -0.25 0.00 -0.50 0.00 0.00 54.79 54.05 2bdg n ASP 186 Cb 0.24 -0.23 0.00 0.00 -1.14 0.00 0.00 41.12 39.99 2bdg n ASP 186 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2bdg n GLN 187 N -1.23 -3.86 -3.06 0.11 6.02 -0.75 -4.89 117.38 109.72 2bdg n GLN 187 Ca 0.08 0.54 -0.40 0.00 -0.01 0.00 0.00 57.00 57.21 2bdg n GLN 187 Cb 0.11 -5.30 -0.05 0.00 1.02 0.00 0.00 30.24 26.02 2bdg n GLN 187 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2bdg s LYS 188 N -6.11 4.41 0.15 -1.09 1.02 -1.26 -4.42 119.74 112.43 2bdg s LYS 188 Ca 0.44 0.84 -0.25 0.00 0.02 0.00 0.00 55.97 57.03 2bdg s LYS 188 Cb -0.23 -3.46 0.06 0.00 -0.52 0.00 0.00 37.83 33.68 2bdg s LYS 188 CO 0.55 0.03 0.89 0.34 -0.92 0.00 0.00 175.35 176.24 2bdg s ASP 189 N 0.83 -0.24 0.57 2.83 2.15 -1.19 -4.06 116.67 117.57 2bdg s ASP 189 Ca 0.36 -0.34 0.06 0.00 0.43 0.00 0.00 52.55 53.06 2bdg s ASP 189 Cb -0.17 0.51 0.07 0.00 -0.30 0.00 0.00 42.92 43.03 2bdg s ASP 189 CO 0.17 -0.92 0.79 -0.94 -0.17 0.00 0.00 175.17 174.09 2bdg s SER 190 N -2.85 5.07 0.17 -0.34 1.04 -1.26 -0.34 113.70 115.19 2bdg s SER 190 Ca 0.10 -0.54 -0.04 0.00 0.48 0.00 0.00 55.95 55.95 2bdg s SER 190 Cb -0.02 -0.13 0.02 0.00 0.10 0.00 0.00 66.02 65.99 2bdg s SER 190 CO 0.00 -1.31 0.30 0.00 0.98 0.00 0.00 173.24 173.21 2bdg n ASN 192 N -1.51 2.53 0.00 0.00 4.13 -1.26 -0.83 115.26 118.33 2bdg n ASN 192 Ca -0.02 1.10 0.00 0.00 1.68 0.00 0.00 54.58 57.34 2bdg n ASN 192 Cb 0.27 -1.34 0.00 0.00 -1.54 0.00 0.00 39.78 37.17 2bdg n ASN 192 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2bdg n GLY 193 N 3.05 3.14 0.05 7.41 0.00 -1.26 -0.82 105.19 116.76 2bdg n GLY 193 Ca 0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.32 2bdg n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2bdg n ASP 194 N 0.00 0.47 -4.55 1.61 8.00 -0.01 -3.87 116.55 118.21 2bdg n ASP 194 Ca 0.00 -0.23 -0.52 0.00 0.71 0.00 0.00 54.79 54.75 2bdg n ASP 194 Cb 0.00 0.06 -0.05 0.00 -0.02 0.00 0.00 41.12 41.10 2bdg n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2bdg n SER 195 N -1.32 0.87 0.00 -2.24 7.64 -1.26 -1.30 113.62 116.02 2bdg n SER 195 Ca 0.08 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.10 2bdg n SER 195 Cb 0.33 -1.12 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 2bdg n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bdg n GLY 196 N 2.02 2.14 3.76 0.23 0.00 -0.04 -0.92 105.19 112.38 2bdg n GLY 196 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 2bdg n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bdg s GLY 197 N -1.98 1.63 0.35 -0.02 0.00 -0.42 -3.69 107.32 103.20 2bdg s GLY 197 Ca 0.00 -0.01 -0.25 0.00 0.00 0.00 0.00 44.72 44.46 2bdg s GLY 197 CO 0.00 0.42 0.96 2.56 0.00 0.00 0.00 173.10 177.04 2bdg s PRO 198 N -4.98 4.49 -0.23 2.90 0.04 -1.26 -0.80 135.00 135.14 2bdg s PRO 198 Ca 0.62 1.33 0.02 0.00 0.04 0.00 0.00 61.00 63.00 2bdg s PRO 198 Cb -0.17 -2.68 0.05 0.00 0.04 0.00 0.00 34.50 31.74 2bdg s PRO 198 CO 0.56 0.19 -0.11 -1.17 0.04 0.00 0.00 177.00 176.50 2bdg s LEU 199 N -2.28 2.92 -0.18 -3.56 0.20 -0.70 -2.88 118.68 112.21 2bdg s LEU 199 Ca 0.53 -1.18 -0.08 0.00 0.69 0.00 0.00 54.13 54.09 2bdg s LEU 199 Cb -0.18 -1.42 -0.04 0.00 -0.43 0.00 0.00 46.19 44.12 2bdg s LEU 199 CO 0.23 -0.17 0.08 -0.63 -0.29 0.00 0.00 176.35 175.57 2bdg s ILE 200 N 1.23 4.94 -0.03 6.68 1.09 0.13 -0.87 121.20 134.36 2bdg s ILE 200 Ca -0.05 0.02 0.03 0.00 -1.10 0.00 0.00 60.65 59.54 2bdg s ILE 200 Cb -0.18 -3.23 0.00 0.00 -1.06 0.00 0.00 42.46 37.99 2bdg s ILE 200 CO -0.07 0.46 -0.10 0.00 -0.10 0.00 0.00 174.94 175.13 2bdg n ASN 202 N 3.33 -4.24 0.00 0.00 5.03 -1.26 -0.75 115.26 117.37 2bdg n ASN 202 Ca -0.19 0.04 0.00 0.00 0.87 0.00 0.00 54.58 55.30 2bdg n ASN 202 Cb 0.54 -3.56 0.00 0.00 -1.02 0.00 0.00 39.78 35.74 2bdg n ASN 202 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2bdg n GLY 203 N -0.95 0.79 3.53 7.41 0.00 -1.26 -5.03 105.19 109.69 2bdg n GLY 203 Ca -0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.64 2bdg n GLY 203 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bdg s TYR 208 N -3.18 2.47 -0.51 1.61 1.51 0.07 -4.77 117.35 114.55 2bdg s TYR 208 Ca 0.00 -0.28 -0.28 0.00 -1.01 0.00 0.00 57.07 55.49 2bdg s TYR 208 Cb 0.00 -1.13 0.02 0.00 -0.11 0.00 0.00 41.96 40.74 2bdg s TYR 208 CO 0.00 0.62 1.32 -1.17 -1.11 0.00 0.00 175.55 175.21 2bdg s LEU 209 N -3.30 3.50 -0.12 -1.29 2.96 -0.32 -1.27 118.68 118.84 2bdg s LEU 209 Ca 0.28 0.42 -0.01 0.00 -0.22 0.00 0.00 54.13 54.60 2bdg s LEU 209 Cb -0.07 -3.29 -0.24 0.00 0.50 0.00 0.00 46.19 43.09 2bdg s LEU 209 CO 0.16 -1.52 0.35 1.67 -1.32 0.00 0.00 176.35 175.69 2bdg n GLN 210 N 8.33 0.72 -3.92 1.98 -0.06 -0.05 -0.71 117.38 123.66 2bdg n GLN 210 Ca 0.13 0.25 -0.11 0.00 -2.00 0.00 0.00 57.00 55.26 2bdg n GLN 210 Cb 0.49 -1.70 -0.00 0.00 -4.06 0.00 0.00 30.24 24.97 2bdg n GLN 210 CO 0.00 0.00 0.00 0.20 -0.20 0.00 0.00 177.06 177.06 2bdg s GLY 211 N -5.59 0.85 0.01 1.69 0.00 -0.93 -2.92 107.32 100.43 2bdg s GLY 211 Ca -0.20 -1.08 0.06 0.00 0.00 0.00 0.00 44.72 43.50 2bdg s GLY 211 CO 0.76 -0.60 -0.18 1.08 0.00 0.00 0.00 173.10 174.17 2bdg s LEU 212 N -3.15 2.10 0.10 0.66 1.43 -1.16 -1.72 118.68 116.94 2bdg s LEU 212 Ca 0.22 -0.41 -0.31 0.00 -1.03 0.00 0.00 54.13 52.60 2bdg s LEU 212 Cb -0.03 -0.87 -0.10 0.00 0.03 0.00 0.00 46.19 45.22 2bdg s LEU 212 CO 0.15 0.17 1.80 -0.69 0.23 0.00 0.00 176.35 178.01 2bdg s VAL 213 N -0.61 2.72 0.03 -1.59 1.01 0.02 -0.91 120.40 121.07 2bdg s VAL 213 Ca 0.06 0.16 -0.02 0.00 0.00 0.00 0.00 61.98 62.18 2bdg s VAL 213 Cb -0.08 -3.10 -0.01 0.00 0.00 0.00 0.00 36.38 33.20 2bdg s VAL 213 CO 0.00 -0.00 -0.03 -0.24 0.00 0.00 0.00 175.10 174.83 2bdg n SER 214 N 5.90 0.73 -1.41 3.32 2.88 -0.67 -0.86 113.62 123.52 2bdg n SER 214 Ca 0.18 0.10 -0.02 0.00 -1.33 0.00 0.00 58.87 57.79 2bdg n SER 214 Cb 0.39 -0.27 0.00 0.00 -0.75 0.00 0.00 64.21 63.58 2bdg n SER 214 CO 0.00 0.00 0.00 2.22 -1.23 0.00 0.00 175.04 176.03 2bdg n PHE 215 N -3.17 -1.12 -1.87 0.66 1.16 -0.87 -4.92 117.46 107.32 2bdg n PHE 215 Ca -0.01 -0.44 0.00 0.00 -1.87 0.00 0.00 57.45 55.12 2bdg n PHE 215 Cb 0.05 0.18 0.00 0.00 -1.61 0.00 0.00 39.48 38.10 2bdg n PHE 215 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2bdg n GLY 216 N -0.12 -0.65 3.66 4.97 0.00 -1.26 0.34 105.19 112.13 2bdg n GLY 216 Ca -0.01 -0.50 -0.24 0.00 0.00 0.00 0.00 46.02 45.26 2bdg n GLY 216 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bdg s LYS 217 N -0.18 2.17 -0.02 1.61 1.02 -1.26 -4.99 119.74 118.08 2bdg s LYS 217 Ca 0.00 -1.67 0.06 0.00 0.02 0.00 0.00 55.97 54.38 2bdg s LYS 217 Cb 0.00 -2.01 -0.01 0.00 -0.52 0.00 0.00 37.83 35.29 2bdg s LYS 217 CO 0.00 0.15 -0.21 0.00 -0.92 0.00 0.00 175.35 174.36 2bdg s ALA 218 N -2.48 1.80 0.70 5.17 0.00 -1.26 -3.27 121.76 122.41 2bdg s ALA 218 Ca 0.35 -0.92 -0.15 0.00 0.00 0.00 0.00 51.96 51.25 2bdg s ALA 218 Cb -0.01 -0.48 0.02 0.00 0.00 0.00 0.00 23.12 22.65 2bdg s ALA 218 CO 0.20 0.42 1.16 -1.25 0.00 0.00 0.00 175.76 176.29 2bdg s PRO 219 N -0.43 2.44 0.68 0.00 0.04 -1.26 -5.13 135.00 131.34 2bdg s PRO 219 Ca 0.06 1.58 -0.14 0.00 0.04 0.00 0.00 61.00 62.54 2bdg s PRO 219 Cb -0.09 -1.89 0.01 0.00 0.04 0.00 0.00 34.50 32.57 2bdg s PRO 219 CO -0.00 -1.57 1.10 0.00 0.04 0.00 0.00 177.00 176.57 2bdg n GLY 220 N -0.75 0.48 3.75 0.00 0.00 -1.26 -5.02 105.19 102.40 2bdg n GLY 220 Ca 0.10 -0.27 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 2bdg n GLY 220 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2bdg s GLN 221 N -0.50 4.29 0.18 1.61 -0.21 -1.26 -4.42 119.66 119.35 2bdg s GLN 221 Ca 0.00 2.29 -0.31 0.00 0.02 0.00 0.00 55.36 57.35 2bdg s GLN 221 Cb 0.00 -3.09 -0.10 0.00 1.00 0.00 0.00 33.01 30.82 2bdg s GLN 221 CO 0.00 -0.35 1.57 0.08 -2.12 0.00 0.00 175.29 174.47 2bdg s VAL 222 N -0.42 2.54 0.00 1.09 1.01 -1.26 -1.81 120.40 121.55 2bdg s VAL 222 Ca 0.56 0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.93 2bdg s VAL 222 Cb -0.41 -3.25 0.00 0.00 0.00 0.00 0.00 36.38 32.71 2bdg s VAL 222 CO 0.47 0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.22 2bdg n GLY 223 N 3.58 0.81 2.70 4.51 0.00 0.22 -4.97 105.19 112.04 2bdg n GLY 223 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 2bdg n GLY 223 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2bdg n VAL 224 N -2.21 1.47 -1.91 1.61 0.31 -0.75 -4.99 118.33 111.86 2bdg n VAL 224 Ca 0.00 -4.79 -0.37 0.00 -0.01 0.00 0.00 64.34 59.16 2bdg n VAL 224 Cb 0.00 -2.11 0.04 0.00 -0.91 0.00 0.00 33.84 30.86 2bdg n VAL 224 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2bdg s PRO 225 N -1.58 3.10 0.82 5.55 0.04 -1.26 -4.42 135.00 137.24 2bdg s PRO 225 Ca 0.30 2.04 -0.11 0.00 0.04 0.00 0.00 61.00 63.27 2bdg s PRO 225 Cb 0.02 -2.13 0.09 0.00 0.04 0.00 0.00 34.50 32.52 2bdg s PRO 225 CO -0.13 -1.16 1.09 0.20 0.04 0.00 0.00 177.00 177.04 2bdg s GLY 226 N -1.25 1.65 -0.06 0.56 0.00 -0.75 -4.76 107.32 102.72 2bdg s GLY 226 Ca 0.74 0.08 0.02 0.00 0.00 0.00 0.00 44.72 45.56 2bdg s GLY 226 CO 0.41 0.49 -0.10 0.14 0.00 0.00 0.00 173.10 174.04 2bdg s VAL 227 N -2.94 3.41 0.07 1.40 1.01 0.15 -2.04 120.40 121.45 2bdg s VAL 227 Ca 0.62 -0.60 0.06 0.00 0.00 0.00 0.00 61.98 62.07 2bdg s VAL 227 Cb -0.17 -2.37 -0.03 0.00 0.00 0.00 0.00 36.38 33.81 2bdg s VAL 227 CO 0.56 0.59 -0.17 -0.31 0.00 0.00 0.00 175.10 175.77 2bdg s TYR 228 N -0.78 1.50 0.07 5.22 1.51 0.25 -1.67 117.35 123.46 2bdg s TYR 228 Ca 0.12 -0.40 -0.31 0.00 -1.01 0.00 0.00 57.07 55.47 2bdg s TYR 228 Cb -0.11 -0.86 -0.07 0.00 -0.11 0.00 0.00 41.96 40.81 2bdg s TYR 228 CO 0.01 0.10 1.44 0.99 -1.11 0.00 0.00 175.55 176.98 2bdg s THR 229 N -1.04 3.38 -1.30 -0.71 2.01 -0.08 -1.26 115.64 116.65 2bdg s THR 229 Ca 0.03 0.91 -0.17 0.00 0.31 0.00 0.00 61.69 62.77 2bdg s THR 229 Cb -0.09 -3.58 0.08 0.00 0.01 0.00 0.00 72.50 68.92 2bdg s THR 229 CO 0.02 0.04 1.73 -3.20 -0.69 0.00 0.00 174.62 172.52 2bdg n ASN 230 N 4.66 4.92 0.07 3.53 5.15 0.11 -3.01 115.26 130.69 2bdg n ASN 230 Ca 0.13 -2.93 0.20 0.00 -0.60 0.00 0.00 54.58 51.38 2bdg n ASN 230 Cb 0.42 -1.72 0.74 0.00 -0.53 0.00 0.00 39.78 38.69 2bdg n ASN 230 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2bdg h LEU 231 N 12.01 0.00 -1.96 1.20 3.38 -1.82 -0.70 115.31 127.42 2bdg h LEU 231 Ca 0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.41 2bdg h LEU 231 Cb 0.86 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.61 2bdg h LEU 231 CO 1.46 0.00 0.01 0.00 0.09 0.00 0.00 178.44 179.99 2bdg n LYS 233 N -2.53 1.05 -0.00 0.00 4.76 -0.27 -4.35 118.16 116.82 2bdg n LYS 233 Ca -0.02 -0.66 0.00 0.00 -2.87 0.00 0.00 58.31 54.76 2bdg n LYS 233 Cb 0.05 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.76 2bdg n LYS 233 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2bdg n PHE 234 N -0.40 0.00 -0.22 2.13 3.72 0.45 -4.81 117.46 118.34 2bdg n PHE 234 Ca 0.13 -0.37 -0.02 0.00 -0.05 0.00 0.00 57.45 57.14 2bdg n PHE 234 Cb 0.37 -0.04 0.19 0.00 -0.94 0.00 0.00 39.48 39.06 2bdg n PHE 234 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 2bdg h THR 235 N 0.83 1.22 -0.09 4.37 1.35 -1.73 -0.31 112.91 118.55 2bdg h THR 235 Ca 0.00 -0.58 -0.01 0.00 -0.55 0.00 0.00 66.41 65.27 2bdg h THR 235 Cb 0.64 0.26 -0.00 0.00 -1.73 0.00 0.00 68.15 67.32 2bdg h THR 235 CO 0.00 0.25 0.03 -0.08 -0.25 0.00 0.00 175.52 175.48 2bdg h GLU 236 N 1.02 0.14 -0.80 4.72 4.81 -1.92 -1.30 114.58 121.25 2bdg h GLU 236 Ca 0.25 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.45 2bdg h GLU 236 Cb 0.05 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.37 2bdg h GLU 236 CO -0.04 0.26 0.46 2.35 -0.73 0.00 0.00 179.01 181.31 2bdg h TRP 237 N -0.02 1.06 0.01 0.92 7.01 -1.80 -0.54 115.95 122.59 2bdg h TRP 237 Ca 0.03 -0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.02 2bdg h TRP 237 Cb 0.18 -0.35 0.00 0.00 -2.10 0.00 0.00 29.16 26.89 2bdg h TRP 237 CO -0.01 0.72 -0.00 0.82 -2.79 0.00 0.00 178.44 177.17 2bdg h ILE 238 N 1.10 1.11 -0.12 2.65 1.08 -0.91 -1.14 117.51 121.29 2bdg h ILE 238 Ca 0.28 -0.36 0.01 0.00 -0.39 0.00 0.00 64.86 64.40 2bdg h ILE 238 Cb -0.01 1.36 -0.01 0.00 -3.07 0.00 0.00 36.82 35.08 2bdg h ILE 238 CO -0.05 0.09 0.05 -0.08 -0.69 0.00 0.00 178.15 177.47 2bdg h GLU 239 N -0.17 0.11 -0.76 2.37 4.57 -0.94 -0.02 114.58 119.73 2bdg h GLU 239 Ca -0.00 -0.01 0.07 0.00 -1.18 0.00 0.00 59.36 58.25 2bdg h GLU 239 Cb 0.16 -0.02 -0.06 0.00 -0.16 0.00 0.00 28.75 28.67 2bdg h GLU 239 CO 0.00 0.07 0.44 -0.22 -1.18 0.00 0.00 179.01 178.12 2bdg h LYS 240 N 0.11 0.75 -0.28 1.92 3.64 -1.04 0.32 116.57 121.99 2bdg h LYS 240 Ca 0.05 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.33 2bdg h LYS 240 Cb 0.02 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 2bdg h LYS 240 CO -0.05 0.50 -0.04 1.15 -2.27 0.00 0.00 179.45 178.74 2bdg h THR 241 N 0.77 1.27 -0.60 1.00 2.02 -0.80 0.22 112.91 116.79 2bdg h THR 241 Ca 0.35 -1.02 -0.00 0.00 0.77 0.00 0.00 66.41 66.51 2bdg h THR 241 Cb 0.25 1.37 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 2bdg h THR 241 CO -0.21 0.33 0.37 0.58 0.37 0.00 0.00 175.52 176.96 2bdg h VAL 242 N 0.30 1.17 -0.01 3.16 2.07 -0.55 -2.54 116.25 119.85 2bdg h VAL 242 Ca 0.08 -0.36 -0.14 0.00 0.82 0.00 0.00 66.70 67.10 2bdg h VAL 242 Cb 0.49 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 2bdg h VAL 242 CO 0.02 0.17 -0.64 -0.61 0.02 0.00 0.00 177.57 176.54 2bdg h GLN 243 N 0.81 0.04 0.00 1.57 5.75 -0.87 -3.51 115.11 118.89 2bdg h GLN 243 Ca 0.22 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.69 2bdg h GLN 243 Cb -0.04 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.51 2bdg h GLN 243 CO -0.04 0.66 0.00 0.00 -2.65 0.00 0.00 178.83 176.80