#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eik s GLN 4 N 0.00 4.06 -0.15 1.57 -2.07 -1.26 -5.00 119.66 116.81 2eik s GLN 4 Ca 0.00 0.80 0.14 0.00 -1.82 0.00 0.00 55.36 54.49 2eik s GLN 4 Cb 0.00 -2.34 0.37 0.00 -1.09 0.00 0.00 33.01 29.94 2eik s GLN 4 CO 0.00 0.08 1.18 0.25 -1.32 0.00 0.00 175.29 175.48 2eik n THR 5 N -0.54 1.65 -4.49 3.63 -2.24 -1.26 -5.03 114.28 106.01 2eik n THR 5 Ca 0.05 -2.48 -0.26 0.00 -2.27 0.00 0.00 64.05 59.08 2eik n THR 5 Cb 0.53 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.67 2eik n THR 5 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 2eik s HIS 6 N -2.45 2.49 -2.16 4.78 0.00 -1.26 -5.06 115.29 111.64 2eik s HIS 6 Ca 0.34 -0.56 0.19 0.00 -3.00 0.00 0.00 55.06 52.03 2eik s HIS 6 Cb 0.33 -1.62 0.52 0.00 -4.00 0.00 0.00 32.58 27.82 2eik s HIS 6 CO -0.06 0.47 1.43 0.00 -1.00 0.00 0.00 174.74 175.59 2eik n ALA 7 N -0.94 2.43 -2.00 -1.38 0.00 -1.26 -4.98 120.51 112.39 2eik n ALA 7 Ca -0.04 -0.90 -0.29 0.00 0.00 0.00 0.00 53.44 52.20 2eik n ALA 7 Cb 0.65 -0.96 0.03 0.00 0.00 0.00 0.00 19.45 19.17 2eik n ALA 7 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2eik s TYR 8 N -1.40 3.38 -0.35 0.00 2.02 -1.26 -4.59 117.35 115.15 2eik s TYR 8 Ca 0.37 0.93 -0.15 0.00 -0.37 0.00 0.00 57.07 57.84 2eik s TYR 8 Cb 0.20 -2.81 -0.01 0.00 -0.40 0.00 0.00 41.96 38.95 2eik s TYR 8 CO 0.27 -0.87 0.36 -1.58 -1.57 0.00 0.00 175.55 172.16 2eik s HIS 9 N -3.13 3.21 -0.27 2.71 5.04 -1.26 -5.06 115.29 116.53 2eik s HIS 9 Ca 0.55 -0.11 -0.15 0.00 -1.54 0.00 0.00 55.06 53.80 2eik s HIS 9 Cb -0.11 -2.68 -0.04 0.00 0.04 0.00 0.00 32.58 29.80 2eik s HIS 9 CO 0.49 -0.47 0.40 -1.64 -2.34 0.00 0.00 174.74 171.19 2eik s MET 10 N 1.99 4.03 0.08 2.88 -1.94 -1.26 -5.06 119.30 120.03 2eik s MET 10 Ca 0.11 0.10 -0.20 0.00 -1.71 0.00 0.00 55.69 54.00 2eik s MET 10 Cb -0.17 -3.65 -0.07 0.00 2.01 0.00 0.00 34.83 32.95 2eik s MET 10 CO 0.12 -0.29 0.58 0.08 -0.01 0.00 0.00 175.02 175.51 2eik s VAL 11 N 2.10 4.71 0.46 -6.03 1.01 -1.26 -5.06 120.40 116.33 2eik s VAL 11 Ca 0.16 1.24 -0.24 0.00 0.00 0.00 0.00 61.98 63.14 2eik s VAL 11 Cb -0.16 -3.91 -0.07 0.00 0.00 0.00 0.00 36.38 32.24 2eik s VAL 11 CO 0.10 0.54 1.32 0.20 0.00 0.00 0.00 175.10 177.25 2eik s ASN 12 N -1.14 5.96 0.07 3.32 0.02 -1.26 -4.88 114.94 117.02 2eik s ASN 12 Ca 0.30 2.68 -0.36 0.00 -1.02 0.00 0.00 52.86 54.45 2eik s ASN 12 Cb -0.20 -2.64 -0.16 0.00 0.02 0.00 0.00 41.25 38.28 2eik s ASN 12 CO 0.20 -1.10 1.41 -2.65 0.02 0.00 0.00 177.10 174.98 2eik n PRO 13 N -0.30 1.32 -4.66 -0.60 -0.02 -1.26 -4.94 135.00 124.53 2eik n PRO 13 Ca 0.06 0.48 -0.25 0.00 -2.02 0.00 0.00 63.50 61.77 2eik n PRO 13 Cb 0.44 -2.15 -0.14 0.00 -0.02 0.00 0.00 33.50 31.63 2eik n PRO 13 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2eik s SER 14 N 0.82 2.29 0.00 2.55 0.15 -1.26 -5.03 113.70 113.21 2eik s SER 14 Ca 0.85 -0.47 0.26 0.00 0.70 0.00 0.00 55.95 57.29 2eik s SER 14 Cb -0.92 -0.20 0.66 0.00 -1.71 0.00 0.00 66.02 63.85 2eik s SER 14 CO 0.47 0.16 1.52 -0.81 1.20 0.00 0.00 173.24 175.77 2eik n PRO 15 N 2.04 0.08 -0.25 5.44 -0.04 -1.26 -4.36 135.00 136.66 2eik n PRO 15 Ca -0.17 -0.04 -0.06 0.00 -0.04 0.00 0.00 63.50 63.19 2eik n PRO 15 Cb 0.54 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.58 2eik n PRO 15 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2eik h TRP 16 N 0.10 1.14 -0.93 0.54 -0.00 -1.96 -1.79 115.95 113.06 2eik h TRP 16 Ca 0.00 -0.11 0.02 0.00 -0.00 0.00 0.00 58.89 58.80 2eik h TRP 16 Cb 0.50 -0.33 -0.05 0.00 -0.00 0.00 0.00 29.16 29.27 2eik h TRP 16 CO 0.00 0.90 0.61 -1.35 -0.00 0.00 0.00 178.44 178.60 2eik h PRO 17 N 1.06 1.18 -0.21 0.49 0.11 -1.98 0.16 132.00 132.81 2eik h PRO 17 Ca 0.23 -0.07 -0.08 0.00 0.11 0.00 0.00 66.00 66.19 2eik h PRO 17 Cb 0.30 -0.27 -0.00 0.00 0.11 0.00 0.00 31.00 31.13 2eik h PRO 17 CO -0.01 0.78 -0.17 1.25 -0.21 0.00 0.00 178.00 179.64 2eik h LEU 18 N 1.22 0.52 -1.38 2.35 5.85 -1.77 -0.73 115.31 121.37 2eik h LEU 18 Ca 0.36 -0.46 -0.06 0.00 0.84 0.00 0.00 57.88 58.56 2eik h LEU 18 Cb -0.07 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.80 2eik h LEU 18 CO -0.10 0.87 -0.27 0.71 -0.34 0.00 0.00 178.44 179.31 2eik h THR 19 N 0.18 1.21 -0.24 1.05 1.35 -1.15 -0.18 112.91 115.13 2eik h THR 19 Ca 0.04 -0.99 -0.09 0.00 -0.55 0.00 0.00 66.41 64.81 2eik h THR 19 Cb 0.71 1.49 -0.00 0.00 -1.73 0.00 0.00 68.15 68.61 2eik h THR 19 CO 0.05 0.29 -0.21 1.23 -0.25 0.00 0.00 175.52 176.62 2eik h GLY 20 N 0.87 0.61 1.02 5.82 0.00 -0.53 0.14 103.07 111.01 2eik h GLY 20 Ca 0.01 -0.61 -0.07 0.00 0.00 0.00 0.00 47.33 46.66 2eik h GLY 20 CO 0.04 0.55 0.09 0.00 0.00 0.00 0.00 176.54 177.22 2eik h ALA 21 N 0.68 0.75 -0.36 3.60 0.00 -0.73 -1.91 119.26 121.28 2eik h ALA 21 Ca 0.04 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.58 2eik h ALA 21 Cb 0.76 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2eik h ALA 21 CO 0.05 0.50 -0.26 -0.07 0.00 0.00 0.00 179.25 179.47 2eik h LEU 22 N 0.83 0.75 -1.45 0.00 3.38 -0.97 -2.11 115.31 115.73 2eik h LEU 22 Ca 0.17 -0.28 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 2eik h LEU 22 Cb 0.41 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2eik h LEU 22 CO 0.01 0.97 -0.28 0.77 0.09 0.00 0.00 178.44 180.01 2eik h SER 23 N 0.63 0.00 -0.50 -0.43 4.64 -0.74 0.24 113.55 117.38 2eik h SER 23 Ca 0.08 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.31 2eik h SER 23 Cb 0.76 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.84 2eik h SER 23 CO 0.06 0.28 -0.04 0.00 -0.87 0.00 0.00 176.83 176.25 2eik h ALA 24 N 1.72 0.68 -0.55 5.18 0.00 -0.72 -0.65 119.26 124.93 2eik h ALA 24 Ca -0.00 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.52 2eik h ALA 24 Cb 0.51 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2eik h ALA 24 CO 0.04 0.53 0.06 1.25 0.00 0.00 0.00 179.25 181.13 2eik h LEU 25 N 0.78 0.90 -0.85 0.00 5.85 -0.70 -2.24 115.31 119.04 2eik h LEU 25 Ca 0.14 -0.28 -0.08 0.00 0.84 0.00 0.00 57.88 58.50 2eik h LEU 25 Cb 0.58 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 2eik h LEU 25 CO 0.03 0.96 -0.04 -0.07 -0.34 0.00 0.00 178.44 178.98 2eik h LEU 26 N 0.82 0.78 -0.26 2.25 3.38 -0.68 -0.29 115.31 121.31 2eik h LEU 26 Ca 0.16 -0.21 -0.20 0.00 0.09 0.00 0.00 57.88 57.73 2eik h LEU 26 Cb 0.46 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2eik h LEU 26 CO 0.02 0.88 -0.62 0.24 0.09 0.00 0.00 178.44 179.05 2eik h MET 27 N 0.74 0.86 -0.12 1.13 2.86 -1.00 0.16 114.93 119.57 2eik h MET 27 Ca 0.14 -0.59 -0.15 0.00 -2.06 0.00 0.00 59.70 57.04 2eik h MET 27 Cb 0.51 0.09 0.01 0.00 0.06 0.00 0.00 31.60 32.27 2eik h MET 27 CO 0.03 1.21 -0.50 1.79 1.06 0.00 0.00 176.91 180.51 2eik h THR 28 N 0.64 1.36 -0.13 2.22 1.35 -1.35 -0.57 112.91 116.42 2eik h THR 28 Ca -0.01 -1.80 0.02 0.00 -0.55 0.00 0.00 66.41 64.07 2eik h THR 28 Cb 1.23 2.15 -0.02 0.00 -1.73 0.00 0.00 68.15 69.78 2eik h THR 28 CO 0.13 0.54 -0.00 0.28 -0.25 0.00 0.00 175.52 176.23 2eik h SER 29 N 0.15 -0.06 -0.54 5.36 0.02 -1.09 -1.93 113.55 115.47 2eik h SER 29 Ca -0.03 0.03 0.07 0.00 -0.84 0.00 0.00 61.79 61.02 2eik h SER 29 Cb 1.13 0.05 -0.06 0.00 0.14 0.00 0.00 62.40 63.67 2eik h SER 29 CO 0.10 -0.01 0.23 1.23 -1.14 0.00 0.00 176.83 177.24 2eik h GLY 30 N 0.04 0.75 1.14 -3.77 0.00 -0.63 0.52 103.07 101.13 2eik h GLY 30 Ca 0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.25 2eik h GLY 30 CO -0.11 0.04 0.50 1.41 0.00 0.00 0.00 176.54 178.38 2eik h LEU 31 N 0.43 1.00 -0.28 3.11 3.38 -0.88 0.78 115.31 122.86 2eik h LEU 31 Ca 0.26 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.12 2eik h LEU 31 Cb 0.25 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2eik h LEU 31 CO -0.23 0.78 -0.02 0.74 0.09 0.00 0.00 178.44 179.79 2eik h THR 32 N 1.15 1.27 -0.71 0.22 2.02 -0.60 0.50 112.91 116.76 2eik h THR 32 Ca 0.30 -0.98 -0.02 0.00 0.77 0.00 0.00 66.41 66.48 2eik h THR 32 Cb -0.04 1.36 -0.03 0.00 -1.74 0.00 0.00 68.15 67.70 2eik h THR 32 CO -0.06 0.31 0.35 -0.03 0.37 0.00 0.00 175.52 176.47 2eik h MET 33 N 0.28 1.00 -0.05 6.66 -1.53 -0.58 -0.81 114.93 119.90 2eik h MET 33 Ca 0.08 -0.13 -0.02 0.00 -3.44 0.00 0.00 59.70 56.18 2eik h MET 33 Cb 0.47 -0.19 -0.00 0.00 -0.55 0.00 0.00 31.60 31.32 2eik h MET 33 CO 0.02 0.76 -0.06 2.35 0.14 0.00 0.00 176.91 180.12 2eik h TRP 34 N 1.00 0.15 -0.03 1.39 7.01 -0.46 0.22 115.95 125.24 2eik h TRP 34 Ca 0.25 -0.05 -0.09 0.00 2.11 0.00 0.00 58.89 61.11 2eik h TRP 34 Cb 0.08 -0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 27.10 2eik h TRP 34 CO 0.01 0.60 -0.41 0.74 -2.79 0.00 0.00 178.44 176.59 2eik h PHE 35 N -0.34 0.07 0.00 2.65 0.04 -0.74 -3.30 116.94 115.32 2eik h PHE 35 Ca 0.01 -0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.75 2eik h PHE 35 Cb 0.58 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.72 2eik h PHE 35 CO 0.10 0.47 -1.04 0.72 -0.60 0.00 0.00 178.31 177.95 2eik n HIS 36 N -4.04 0.00 -1.43 -0.55 8.25 -0.32 -4.80 115.22 112.32 2eik n HIS 36 Ca -0.02 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.49 2eik n HIS 36 Cb 0.45 -0.03 0.20 0.00 1.12 0.00 0.00 29.99 31.73 2eik n HIS 36 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2eik n PHE 37 N -2.01 0.25 -2.92 4.41 3.72 0.70 -5.02 117.46 116.58 2eik n PHE 37 Ca -0.01 -1.39 -0.10 0.00 -0.05 0.00 0.00 57.45 55.90 2eik n PHE 37 Cb 0.51 -0.28 0.00 0.00 -0.94 0.00 0.00 39.48 38.77 2eik n PHE 37 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2eik n ASN 38 N -1.16 -1.87 -3.64 4.37 5.15 -0.68 -4.86 115.26 112.57 2eik n ASN 38 Ca 0.21 -0.36 -0.10 0.00 -0.60 0.00 0.00 54.58 53.73 2eik n ASN 38 Cb 0.75 -0.62 -0.07 0.00 -0.53 0.00 0.00 39.78 39.32 2eik n ASN 38 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2eik s SER 39 N -2.24 -0.84 0.00 1.20 0.15 -1.14 -4.98 113.70 105.85 2eik s SER 39 Ca 0.01 1.46 0.13 0.00 0.70 0.00 0.00 55.95 58.26 2eik s SER 39 Cb -0.00 1.40 0.35 0.00 -1.71 0.00 0.00 66.02 66.06 2eik s SER 39 CO 0.35 -0.24 1.28 0.23 1.20 0.00 0.00 173.24 176.06 2eik n MET 40 N 3.60 2.64 0.12 5.44 2.81 -1.26 -2.36 117.12 128.11 2eik n MET 40 Ca -0.17 -2.10 -0.13 0.00 -1.81 0.00 0.00 57.70 53.49 2eik n MET 40 Cb 0.57 -1.33 -0.06 0.00 -0.71 0.00 0.00 33.22 31.69 2eik n MET 40 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 2eik h THR 41 N 2.56 0.39 -0.43 2.03 2.02 -1.97 -0.26 112.91 117.25 2eik h THR 41 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2eik h THR 41 Cb 0.77 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 67.55 2eik h THR 41 CO 0.00 0.00 0.27 -0.07 0.37 0.00 0.00 175.52 176.09 2eik h LEU 42 N -0.50 0.50 -0.95 2.58 3.38 -1.89 -2.11 115.31 116.32 2eik h LEU 42 Ca 0.03 -0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.03 2eik h LEU 42 Cb 0.53 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 41.08 2eik h LEU 42 CO -0.16 0.39 0.60 0.25 0.09 0.00 0.00 178.44 179.61 2eik h LEU 43 N 0.57 0.95 -0.06 1.67 5.85 -1.66 0.17 115.31 122.80 2eik h LEU 43 Ca 0.16 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 2eik h LEU 43 Cb -0.04 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 40.81 2eik h LEU 43 CO -0.03 0.60 0.03 0.24 -0.34 0.00 0.00 178.44 178.94 2eik h MET 44 N 1.08 0.09 -0.65 1.25 2.86 -0.65 0.06 114.93 118.97 2eik h MET 44 Ca 0.41 -0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.99 2eik h MET 44 Cb 0.19 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.81 2eik h MET 44 CO -0.18 0.14 0.20 0.82 1.06 0.00 0.00 176.91 178.95 2eik h ILE 45 N 0.01 1.25 0.09 -1.22 2.04 -0.89 -2.24 117.51 116.56 2eik h ILE 45 Ca 0.02 -0.86 0.00 0.00 1.00 0.00 0.00 64.86 65.02 2eik h ILE 45 Cb 0.08 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 2eik h ILE 45 CO -0.00 0.33 -0.08 1.23 0.00 0.00 0.00 178.15 179.63 2eik h GLY 46 N 0.94 -0.17 1.30 5.37 0.00 -0.36 -0.60 103.07 109.55 2eik h GLY 46 Ca 0.21 0.09 -0.00 0.00 0.00 0.00 0.00 47.33 47.62 2eik h GLY 46 CO -0.01 -0.08 0.42 1.41 0.00 0.00 0.00 176.54 178.28 2eik h LEU 47 N -0.18 0.82 0.27 3.11 3.38 -0.93 -0.80 115.31 120.97 2eik h LEU 47 Ca -0.00 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 2eik h LEU 47 Cb 0.17 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2eik h LEU 47 CO -0.01 0.62 -0.13 0.74 0.09 0.00 0.00 178.44 179.75 2eik h THR 48 N 0.94 0.78 0.00 0.22 2.02 -1.03 -1.51 112.91 114.34 2eik h THR 48 Ca 0.25 -0.48 -0.05 0.00 0.77 0.00 0.00 66.41 66.90 2eik h THR 48 Cb -0.05 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 2eik h THR 48 CO -0.05 0.10 -0.23 0.71 0.37 0.00 0.00 175.52 176.43 2eik h THR 49 N -0.62 1.10 -0.13 3.16 1.35 -0.99 -1.09 112.91 115.68 2eik h THR 49 Ca -0.04 -0.80 -0.02 0.00 -0.55 0.00 0.00 66.41 65.01 2eik h THR 49 Cb 0.44 1.44 -0.00 0.00 -1.73 0.00 0.00 68.15 68.30 2eik h THR 49 CO 0.06 0.22 0.01 -1.13 -0.25 0.00 0.00 175.52 174.44 2eik h ASN 50 N 0.00 0.21 -0.71 5.36 -1.24 -1.00 0.65 115.58 118.86 2eik h ASN 50 Ca -0.00 -0.28 -0.01 0.00 0.71 0.00 0.00 56.30 56.72 2eik h ASN 50 Cb 0.42 -0.06 -0.03 0.00 0.73 0.00 0.00 38.32 39.38 2eik h ASN 50 CO 0.03 0.43 0.41 0.24 -1.29 0.00 0.00 177.43 177.26 2eik h MET 51 N -0.02 0.98 -0.46 6.67 2.86 -0.80 -1.60 114.93 122.56 2eik h MET 51 Ca 0.04 -0.10 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 2eik h MET 51 Cb 0.32 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 31.76 2eik h MET 51 CO 0.00 0.71 0.26 -0.07 1.06 0.00 0.00 176.91 178.87 2eik h LEU 52 N 0.97 0.56 0.16 1.22 3.38 -1.06 -1.27 115.31 119.28 2eik h LEU 52 Ca 0.25 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 2eik h LEU 52 Cb 0.00 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.61 2eik h LEU 52 CO -0.04 0.48 -0.08 0.74 0.09 0.00 0.00 178.44 179.63 2eik h THR 53 N 0.60 0.84 -0.43 0.22 2.02 -0.56 -1.60 112.91 114.01 2eik h THR 53 Ca 0.16 -0.01 0.03 0.00 0.77 0.00 0.00 66.41 67.36 2eik h THR 53 Cb 0.03 0.85 -0.04 0.00 -1.74 0.00 0.00 68.15 67.26 2eik h THR 53 CO -0.03 0.00 0.21 0.24 0.37 0.00 0.00 175.52 176.32 2eik h MET 54 N -0.22 0.42 0.22 6.66 2.86 -1.22 0.51 114.93 124.15 2eik h MET 54 Ca -0.02 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2eik h MET 54 Cb 0.17 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 2eik h MET 54 CO 0.04 0.28 -0.18 -0.92 1.06 0.00 0.00 176.91 177.18 2eik h TYR 55 N 0.43 -0.48 -0.42 -0.22 3.20 -1.13 -1.55 116.97 116.80 2eik h TYR 55 Ca 0.18 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.94 2eik h TYR 55 Cb 0.09 0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.53 2eik h TYR 55 CO -0.10 -0.28 -0.19 1.96 -1.64 0.00 0.00 178.16 177.91 2eik h GLN 56 N -0.42 0.82 0.25 1.82 4.20 -1.12 -1.01 115.11 119.65 2eik h GLN 56 Ca -0.01 -0.31 -0.01 0.00 0.06 0.00 0.00 58.65 58.37 2eik h GLN 56 Cb 0.38 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.11 2eik h GLN 56 CO -0.02 0.94 -0.12 2.35 -0.67 0.00 0.00 178.83 181.30 2eik h TRP 57 N 0.72 -0.32 0.00 2.96 2.91 -0.81 -0.77 115.95 120.64 2eik h TRP 57 Ca 0.11 -0.01 -0.05 0.00 1.13 0.00 0.00 58.89 60.06 2eik h TRP 57 Cb 0.70 0.10 -0.01 0.00 -0.51 0.00 0.00 29.16 29.45 2eik h TRP 57 CO 0.04 -0.08 -0.26 -1.49 -1.03 0.00 0.00 178.44 175.62 2eik h TRP 58 N -0.51 0.00 -0.23 2.65 6.55 -1.30 -1.95 115.95 121.15 2eik h TRP 58 Ca -0.03 0.00 -0.02 0.00 0.95 0.00 0.00 58.89 59.79 2eik h TRP 58 Cb 0.38 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.67 2eik h TRP 58 CO -0.01 0.26 0.07 -0.09 -1.05 0.00 0.00 178.44 177.62 2eik h ARG 59 N 0.00 0.37 -0.61 0.49 2.43 -0.97 -1.68 114.38 114.41 2eik h ARG 59 Ca -0.00 -0.08 -0.03 0.00 -0.81 0.00 0.00 59.98 59.06 2eik h ARG 59 Cb 0.74 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.21 2eik h ARG 59 CO 0.03 0.45 0.26 -0.44 -1.51 0.00 0.00 179.97 178.76 2eik h ASP 60 N 0.21 0.79 -0.34 -3.80 3.32 -0.68 -0.16 116.42 115.77 2eik h ASP 60 Ca 0.08 -0.10 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 2eik h ASP 60 Cb 0.24 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 2eik h ASP 60 CO -0.00 0.70 0.05 0.58 -1.72 0.00 0.00 179.24 178.85 2eik h VAL 61 N 0.87 1.21 -0.40 -1.35 2.07 -1.03 0.10 116.25 117.72 2eik h VAL 61 Ca 0.21 -0.80 -0.15 0.00 0.82 0.00 0.00 66.70 66.77 2eik h VAL 61 Cb 0.14 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 2eik h VAL 61 CO -0.02 0.29 -0.35 0.40 0.02 0.00 0.00 177.57 177.91 2eik h ILE 62 N 0.64 1.27 -0.61 4.57 2.04 -0.36 -2.23 117.51 122.83 2eik h ILE 62 Ca 0.14 -1.52 -0.03 0.00 1.00 0.00 0.00 64.86 64.45 2eik h ILE 62 Cb 0.32 1.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 2eik h ILE 62 CO 0.01 0.51 0.28 0.03 0.00 0.00 0.00 178.15 178.98 2eik h ARG 63 N 0.77 0.89 0.00 2.37 3.08 -0.40 -1.03 114.38 120.06 2eik h ARG 63 Ca 0.07 -0.14 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 2eik h ARG 63 Cb 0.94 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.83 2eik h ARG 63 CO 0.09 0.73 -0.37 0.93 -1.07 0.00 0.00 179.97 180.27 2eik h GLU 64 N 0.84 0.00 0.00 0.04 5.08 -0.74 0.35 114.58 120.15 2eik h GLU 64 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2eik h GLU 64 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2eik h GLU 64 CO -0.02 0.37 -0.30 -1.13 -1.00 0.00 0.00 179.01 176.94 2eik n SER 65 N -4.09 0.65 -0.12 1.42 3.41 -0.85 -0.70 113.62 113.34 2eik n SER 65 Ca -0.02 0.18 -0.09 0.00 -0.26 0.00 0.00 58.87 58.68 2eik n SER 65 Cb 0.41 -0.59 -0.01 0.00 -0.26 0.00 0.00 64.21 63.76 2eik n SER 65 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2eik h THR 66 N -0.34 1.17 0.09 6.66 2.02 -1.39 -2.04 112.91 119.09 2eik h THR 66 Ca 0.00 -0.49 -0.32 0.00 0.77 0.00 0.00 66.41 66.37 2eik h THR 66 Cb 0.30 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 67.49 2eik h THR 66 CO 0.00 0.18 -1.72 -0.26 0.37 0.00 0.00 175.52 174.09 2eik h PHE 67 N 0.46 0.36 0.00 3.16 0.05 -1.50 -3.40 116.94 116.08 2eik h PHE 67 Ca 0.13 -0.27 0.00 0.00 3.82 0.00 0.00 57.97 61.65 2eik h PHE 67 Cb 0.13 -0.01 0.00 0.00 2.00 0.00 0.00 35.95 38.06 2eik h PHE 67 CO -0.01 1.42 -0.99 1.04 -0.18 0.00 0.00 178.31 179.59 2eik n GLN 68 N -3.37 1.08 -1.81 1.51 6.02 0.09 -5.01 117.38 115.89 2eik n GLN 68 Ca -0.21 -0.03 -0.09 0.00 -0.01 0.00 0.00 57.00 56.66 2eik n GLN 68 Cb 1.05 -1.35 -0.02 0.00 1.02 0.00 0.00 30.24 30.94 2eik n GLN 68 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2eik n GLY 69 N 1.42 0.42 0.06 1.08 0.00 -0.77 -4.94 105.19 102.47 2eik n GLY 69 Ca 0.02 -0.56 0.12 0.00 0.00 0.00 0.00 46.02 45.60 2eik n GLY 69 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2eik n HIS 70 N -3.51 0.51 -2.89 1.61 8.25 0.13 -4.48 115.22 114.84 2eik n HIS 70 Ca -0.10 0.16 -0.44 0.00 -0.26 0.00 0.00 57.72 57.09 2eik n HIS 70 Cb 0.47 -0.77 0.00 0.00 1.12 0.00 0.00 29.99 30.81 2eik n HIS 70 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2eik n HIS 71 N -1.93 4.91 -1.42 4.41 8.25 -1.26 -4.71 115.22 123.47 2eik n HIS 71 Ca 0.05 -3.28 -0.29 0.00 -0.26 0.00 0.00 57.72 53.94 2eik n HIS 71 Cb 0.33 -2.25 0.16 0.00 1.12 0.00 0.00 29.99 29.35 2eik n HIS 71 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2eik s THR 72 N 1.91 1.96 0.48 1.59 -4.23 -1.26 -4.72 115.64 111.37 2eik s THR 72 Ca 0.44 0.00 0.19 0.00 -1.18 0.00 0.00 61.69 61.14 2eik s THR 72 Cb -0.02 -2.67 0.35 0.00 1.34 0.00 0.00 72.50 71.51 2eik s THR 72 CO 0.01 0.00 2.00 -0.65 -0.54 0.00 0.00 174.62 175.44 2eik h PRO 73 N -1.73 0.19 -0.32 3.99 0.11 -1.94 -1.42 132.00 130.89 2eik h PRO 73 Ca -0.51 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.50 2eik h PRO 73 Cb 1.32 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 2eik h PRO 73 CO 0.57 0.13 -0.14 0.00 -0.21 0.00 0.00 178.00 178.34 2eik h ALA 74 N 1.74 0.45 -0.69 -0.75 0.00 -1.91 -0.78 119.26 117.32 2eik h ALA 74 Ca 0.25 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 2eik h ALA 74 Cb 0.70 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 2eik h ALA 74 CO -0.04 0.34 0.12 0.28 0.00 0.00 0.00 179.25 179.95 2eik h VAL 75 N 0.43 1.26 -0.58 0.00 2.07 -1.62 -2.23 116.25 115.58 2eik h VAL 75 Ca 0.07 -1.03 -0.09 0.00 0.82 0.00 0.00 66.70 66.47 2eik h VAL 75 Cb 0.67 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 2eik h VAL 75 CO 0.04 0.39 -0.01 -0.61 0.02 0.00 0.00 177.57 177.41 2eik h GLN 76 N 1.05 1.01 -0.72 1.57 4.15 -1.18 -1.69 115.11 119.30 2eik h GLN 76 Ca 0.21 -0.31 0.01 0.00 0.77 0.00 0.00 58.65 59.33 2eik h GLN 76 Cb 0.43 -0.10 -0.04 0.00 0.21 0.00 0.00 27.48 27.99 2eik h GLN 76 CO 0.01 0.99 0.47 -0.22 -1.93 0.00 0.00 178.83 178.16 2eik h LYS 77 N 0.92 0.94 -0.60 1.69 3.11 -0.90 -1.30 116.57 120.43 2eik h LYS 77 Ca 0.17 -0.06 -0.08 0.00 -2.81 0.00 0.00 60.65 57.87 2eik h LYS 77 Cb 0.55 -0.21 -0.02 0.00 -1.00 0.00 0.00 32.23 31.54 2eik h LYS 77 CO 0.03 0.62 0.05 0.78 -2.81 0.00 0.00 179.45 178.12 2eik h GLY 78 N 0.96 1.11 1.84 5.01 0.00 -1.08 -2.50 103.07 108.41 2eik h GLY 78 Ca 0.27 -0.78 -0.05 0.00 0.00 0.00 0.00 47.33 46.77 2eik h GLY 78 CO -0.07 0.72 -0.14 1.41 0.00 0.00 0.00 176.54 178.46 2eik h LEU 79 N 0.92 0.19 -0.11 3.11 3.38 -0.78 -0.55 115.31 121.48 2eik h LEU 79 Ca 0.18 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 2eik h LEU 79 Cb 0.49 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 2eik h LEU 79 CO 0.02 0.35 0.03 0.03 0.09 0.00 0.00 178.44 178.96 2eik h ARG 80 N 0.19 0.17 -0.78 1.13 3.08 -0.92 -1.38 114.38 115.87 2eik h ARG 80 Ca 0.04 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.06 2eik h ARG 80 Cb 0.37 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.36 2eik h ARG 80 CO 0.02 0.33 0.52 1.88 -1.07 0.00 0.00 179.97 181.65 2eik h TYR 81 N -0.03 0.98 -0.81 3.04 0.05 -1.02 -1.76 116.97 117.43 2eik h TYR 81 Ca 0.03 0.02 0.03 0.00 0.05 0.00 0.00 58.73 58.86 2eik h TYR 81 Cb 0.24 -0.33 -0.05 0.00 1.01 0.00 0.00 36.73 37.60 2eik h TYR 81 CO 0.00 0.61 0.52 0.78 -1.05 0.00 0.00 178.16 179.03 2eik h GLY 82 N 1.06 1.16 0.77 3.88 0.00 -0.83 -0.67 103.07 108.44 2eik h GLY 82 Ca 0.29 -0.40 -0.08 0.00 0.00 0.00 0.00 47.33 47.14 2eik h GLY 82 CO -0.07 0.35 -0.21 1.98 0.00 0.00 0.00 176.54 178.59 2eik h MET 83 N 1.03 0.41 -0.52 4.80 1.85 -0.92 -0.96 114.93 120.61 2eik h MET 83 Ca 0.31 -0.24 0.04 0.00 -0.61 0.00 0.00 59.70 59.20 2eik h MET 83 Cb -0.03 0.02 -0.04 0.00 0.43 0.00 0.00 31.60 31.98 2eik h MET 83 CO -0.10 0.82 0.29 0.82 -0.40 0.00 0.00 176.91 178.34 2eik h ILE 84 N 0.03 1.01 -0.77 1.77 2.04 -1.10 -0.57 117.51 119.92 2eik h ILE 84 Ca 0.02 -0.19 -0.05 0.00 1.00 0.00 0.00 64.86 65.63 2eik h ILE 84 Cb 0.78 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 2eik h ILE 84 CO 0.05 0.10 0.28 -0.07 0.00 0.00 0.00 178.15 178.52 2eik h LEU 85 N 0.57 1.08 -0.10 1.44 3.38 -1.07 -1.16 115.31 119.44 2eik h LEU 85 Ca 0.22 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2eik h LEU 85 Cb 0.08 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 2eik h LEU 85 CO -0.13 0.97 0.06 0.15 0.09 0.00 0.00 178.44 179.59 2eik h PHE 86 N 1.12 0.13 -0.95 1.13 3.57 -0.63 -2.06 116.94 119.25 2eik h PHE 86 Ca 0.25 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.81 2eik h PHE 86 Cb 0.25 -0.04 -0.06 0.00 2.79 0.00 0.00 35.95 38.88 2eik h PHE 86 CO 0.02 0.10 0.61 0.82 -2.23 0.00 0.00 178.31 177.63 2eik h ILE 87 N 0.12 1.10 -0.63 1.41 2.04 -0.84 -1.86 117.51 118.84 2eik h ILE 87 Ca 0.04 -0.39 0.01 0.00 1.00 0.00 0.00 64.86 65.52 2eik h ILE 87 Cb 0.01 -0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 35.92 2eik h ILE 87 CO -0.01 0.21 0.41 0.40 0.00 0.00 0.00 178.15 179.16 2eik h ILE 88 N 1.13 1.15 -0.53 -0.67 2.04 -0.86 -0.55 117.51 119.23 2eik h ILE 88 Ca 0.40 -0.29 -0.02 0.00 1.00 0.00 0.00 64.86 65.95 2eik h ILE 88 Cb 0.12 0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 36.41 2eik h ILE 88 CO -0.16 0.15 0.23 0.77 0.00 0.00 0.00 178.15 179.14 2eik h SER 89 N 0.84 0.68 0.09 1.72 4.64 -0.66 -1.34 113.55 119.52 2eik h SER 89 Ca 0.23 -0.07 -0.12 0.00 -0.47 0.00 0.00 61.79 61.36 2eik h SER 89 Cb -0.08 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 61.82 2eik h SER 89 CO -0.06 0.60 -0.40 -0.33 -0.87 0.00 0.00 176.83 175.78 2eik h GLU 90 N 0.75 0.40 -0.39 4.77 4.39 -0.67 -1.72 114.58 122.11 2eik h GLU 90 Ca 0.18 -0.19 -0.04 0.00 0.34 0.00 0.00 59.36 59.65 2eik h GLU 90 Cb 0.13 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 2eik h GLU 90 CO -0.02 0.73 0.10 0.28 -1.16 0.00 0.00 179.01 178.94 2eik h VAL 91 N 0.33 1.23 -0.12 3.13 2.07 -0.08 -2.20 116.25 120.61 2eik h VAL 91 Ca 0.03 -0.77 -0.06 0.00 0.82 0.00 0.00 66.70 66.73 2eik h VAL 91 Cb 0.85 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 2eik h VAL 91 CO 0.07 0.27 -0.18 -0.07 0.02 0.00 0.00 177.57 177.67 2eik h LEU 92 N 0.49 0.18 -0.08 2.57 -0.00 -1.05 -0.73 115.31 116.70 2eik h LEU 92 Ca 0.12 -0.04 -0.00 0.00 -0.00 0.00 0.00 57.88 57.96 2eik h LEU 92 Cb 0.30 -0.05 -0.00 0.00 -0.00 0.00 0.00 40.66 40.91 2eik h LEU 92 CO 0.00 0.38 0.03 0.15 -0.00 0.00 0.00 178.44 179.00 2eik h PHE 93 N 0.18 0.12 -0.41 1.13 3.57 -0.98 -2.62 116.94 117.92 2eik h PHE 93 Ca 0.03 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 2eik h PHE 93 Cb 0.43 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.12 2eik h PHE 93 CO 0.01 0.24 0.04 0.74 -2.23 0.00 0.00 178.31 177.11 2eik h PHE 94 N -0.04 0.67 -0.91 0.41 -1.00 -1.04 -2.28 116.94 112.75 2eik h PHE 94 Ca 0.03 -0.07 0.14 0.00 2.81 0.00 0.00 57.97 60.88 2eik h PHE 94 Cb 0.18 -0.19 -0.07 0.00 3.61 0.00 0.00 35.95 39.47 2eik h PHE 94 CO -0.01 0.62 0.58 1.15 -1.61 0.00 0.00 178.31 179.03 2eik h THR 95 N 0.61 0.85 -0.76 -1.55 2.02 -0.79 0.43 112.91 113.72 2eik h THR 95 Ca 0.13 -0.26 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 2eik h THR 95 Cb 0.33 0.04 -0.04 0.00 -1.74 0.00 0.00 68.15 66.75 2eik h THR 95 CO 0.01 0.14 0.42 1.23 0.37 0.00 0.00 175.52 177.69 2eik h GLY 96 N 0.74 1.12 1.79 2.16 0.00 -1.08 -0.59 103.07 107.21 2eik h GLY 96 Ca 0.46 -0.49 -0.19 0.00 0.00 0.00 0.00 47.33 47.11 2eik h GLY 96 CO -0.22 0.47 -0.83 0.74 0.00 0.00 0.00 176.54 176.71 2eik h PHE 97 N 1.06 0.28 -0.10 5.60 0.04 -1.02 -2.11 116.94 120.69 2eik h PHE 97 Ca 0.27 -0.15 -0.12 0.00 2.80 0.00 0.00 57.97 60.77 2eik h PHE 97 Cb 0.01 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.12 2eik h PHE 97 CO 0.01 0.93 -0.48 0.74 -0.60 0.00 0.00 178.31 178.91 2eik h PHE 98 N 0.12 0.30 -0.16 -0.55 0.04 -0.88 -0.62 116.94 115.19 2eik h PHE 98 Ca -0.04 -0.09 -0.02 0.00 2.80 0.00 0.00 57.97 60.62 2eik h PHE 98 Cb 1.43 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 39.51 2eik h PHE 98 CO 0.03 0.68 0.03 2.35 -0.60 0.00 0.00 178.31 180.80 2eik h TRP 99 N 0.20 0.28 -0.61 -0.55 2.91 -0.98 -0.83 115.95 116.37 2eik h TRP 99 Ca 0.01 -0.04 0.03 0.00 1.13 0.00 0.00 58.89 60.02 2eik h TRP 99 Cb 0.92 -0.08 -0.04 0.00 -0.51 0.00 0.00 29.16 29.46 2eik h TRP 99 CO 0.02 0.41 0.37 0.00 -1.03 0.00 0.00 178.44 178.21 2eik h ALA 100 N 0.83 0.79 0.34 2.65 0.00 -1.17 0.19 119.26 122.89 2eik h ALA 100 Ca 0.05 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2eik h ALA 100 Cb 0.28 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2eik h ALA 100 CO 0.00 0.10 -0.16 0.35 0.00 0.00 0.00 179.25 179.54 2eik h PHE 101 N 0.73 -0.42 -0.08 0.00 3.57 -0.86 -2.47 116.94 117.40 2eik h PHE 101 Ca 0.25 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.68 2eik h PHE 101 Cb 0.03 0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 2eik h PHE 101 CO -0.06 -0.23 -0.20 1.88 -2.23 0.00 0.00 178.31 177.47 2eik h TYR 102 N -0.50 0.13 -0.33 0.41 -1.99 -1.01 -0.94 116.97 112.74 2eik h TYR 102 Ca -0.05 -0.02 -0.05 0.00 2.00 0.00 0.00 58.73 60.62 2eik h TYR 102 Cb 0.38 -0.04 -0.01 0.00 2.00 0.00 0.00 36.73 39.06 2eik h TYR 102 CO -0.04 0.32 0.01 1.25 -0.00 0.00 0.00 178.16 179.70 2eik h HIS 103 N 0.12 0.62 -0.10 4.88 2.76 -0.84 -1.81 115.15 120.78 2eik h HIS 103 Ca 0.02 -0.11 -0.09 0.00 -2.20 0.00 0.00 60.37 58.00 2eik h HIS 103 Cb 0.42 -0.16 0.00 0.00 1.55 0.00 0.00 27.41 29.22 2eik h HIS 103 CO 0.00 0.69 -0.29 0.77 -1.30 0.00 0.00 177.93 177.80 2eik h SER 104 N 0.38 0.42 0.53 3.26 0.02 -1.26 -3.28 113.55 113.63 2eik h SER 104 Ca 0.09 -0.60 -0.13 0.00 -0.84 0.00 0.00 61.79 60.31 2eik h SER 104 Cb 0.43 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.83 2eik h SER 104 CO 0.02 0.95 -0.58 0.77 -1.14 0.00 0.00 176.83 176.85 2eik h SER 105 N -0.09 0.05 1.95 3.07 4.64 -1.22 -3.17 113.55 118.79 2eik h SER 105 Ca -0.01 -0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.28 2eik h SER 105 Cb 0.91 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.99 2eik h SER 105 CO 0.06 0.62 -0.05 -0.07 -0.87 0.00 0.00 176.83 176.53 2eik h LEU 106 N 0.04 0.00 -6.03 5.97 3.38 -1.45 -3.38 115.31 113.84 2eik h LEU 106 Ca -0.01 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.40 2eik h LEU 106 Cb 1.04 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.40 2eik h LEU 106 CO 0.08 0.02 -1.08 0.00 0.09 0.00 0.00 178.44 177.54 2eik n ALA 107 N -2.11 2.52 -1.74 1.53 0.00 -1.23 -5.10 120.51 114.39 2eik n ALA 107 Ca 0.04 -3.43 -0.42 0.00 0.00 0.00 0.00 53.44 49.62 2eik n ALA 107 Cb 0.54 -0.81 -0.03 0.00 0.00 0.00 0.00 19.45 19.15 2eik n ALA 107 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2eik s PRO 108 N -1.14 4.13 0.72 0.00 0.02 -1.20 -4.85 135.00 132.68 2eik s PRO 108 Ca 0.35 2.59 -0.11 0.00 0.02 0.00 0.00 61.00 63.85 2eik s PRO 108 Cb 0.16 -3.14 0.02 0.00 0.02 0.00 0.00 34.50 31.56 2eik s PRO 108 CO -0.11 -0.75 1.09 0.95 -0.33 0.00 0.00 177.00 177.84 2eik s THR 109 N 1.37 3.49 0.49 0.99 -4.23 -1.26 -4.40 115.64 112.09 2eik s THR 109 Ca 0.75 0.48 0.20 0.00 -1.18 0.00 0.00 61.69 61.94 2eik s THR 109 Cb -0.49 -3.41 0.35 0.00 1.34 0.00 0.00 72.50 70.29 2eik s THR 109 CO 0.32 -0.63 2.01 -0.65 -0.54 0.00 0.00 174.62 175.13 2eik h PRO 110 N -0.73 0.14 0.00 3.99 0.11 -1.93 -0.40 132.00 133.18 2eik h PRO 110 Ca -0.45 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 2eik h PRO 110 Cb 1.25 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 2eik h PRO 110 CO 0.62 0.10 -0.03 0.93 -0.21 0.00 0.00 178.00 179.41 2eik h GLU 111 N 0.15 0.00 -0.01 1.05 3.07 -2.01 0.04 114.58 116.86 2eik h GLU 111 Ca 0.22 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.08 2eik h GLU 111 Cb 0.69 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.60 2eik h GLU 111 CO -0.03 0.03 -0.41 1.28 -1.40 0.00 0.00 179.01 178.48 2eik n LEU 112 N -3.42 1.23 0.00 1.33 4.77 -0.56 -4.89 117.00 115.46 2eik n LEU 112 Ca -0.02 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.58 2eik n LEU 112 Cb 0.15 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2eik n LEU 112 CO 0.25 0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 2eik n GLY 113 N 1.40 0.98 2.92 -0.72 0.00 -0.00 -1.23 105.19 108.53 2eik n GLY 113 Ca 0.10 -0.01 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 2eik n GLY 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eik n GLY 114 N -2.03 -0.51 3.33 -0.02 0.00 -0.27 -4.94 105.19 100.75 2eik n GLY 114 Ca 0.00 0.09 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 2eik n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2eik s TRP 116 N -3.90 0.62 0.82 0.00 -0.11 -1.26 -3.41 118.94 111.69 2eik s TRP 116 Ca 0.11 -0.14 -0.10 0.00 1.22 0.00 0.00 56.10 57.18 2eik s TRP 116 Cb 0.03 -0.53 0.09 0.00 -1.50 0.00 0.00 33.47 31.55 2eik s TRP 116 CO -0.05 -0.13 1.11 -1.25 -4.62 0.00 0.00 176.95 172.01 2eik s PRO 117 N 0.64 1.81 0.84 5.86 0.04 -1.26 -4.97 135.00 137.96 2eik s PRO 117 Ca -0.08 1.29 -0.13 0.00 0.04 0.00 0.00 61.00 62.12 2eik s PRO 117 Cb -0.11 -1.84 0.05 0.00 0.04 0.00 0.00 34.50 32.64 2eik s PRO 117 CO -0.00 -2.00 0.83 -2.30 0.04 0.00 0.00 177.00 173.57 2eik n PRO 118 N -3.78 0.02 -1.83 0.56 -0.02 -1.22 -4.89 135.00 123.84 2eik n PRO 118 Ca 0.10 0.07 -0.42 0.00 -2.02 0.00 0.00 63.50 61.24 2eik n PRO 118 Cb 0.53 -2.13 -0.02 0.00 -0.02 0.00 0.00 33.50 31.85 2eik n PRO 118 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2eik s THR 119 N -2.20 2.21 0.00 3.45 2.01 -0.37 -2.08 115.64 118.67 2eik s THR 119 Ca 0.66 0.17 0.00 0.00 0.31 0.00 0.00 61.69 62.84 2eik s THR 119 Cb -0.28 -3.11 0.00 0.00 0.01 0.00 0.00 72.50 69.12 2eik s THR 119 CO 0.58 0.03 0.00 0.61 -0.69 0.00 0.00 174.62 175.14 2eik n GLY 120 N 2.46 0.82 3.57 4.40 0.00 -1.26 -4.99 105.19 110.19 2eik n GLY 120 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 2eik n GLY 120 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2eik s ILE 121 N -2.59 4.46 -0.46 -0.61 -1.09 -0.89 -5.06 121.20 114.96 2eik s ILE 121 Ca 0.00 -0.15 0.01 0.00 -2.23 0.00 0.00 60.65 58.28 2eik s ILE 121 Cb 0.00 -3.00 0.12 0.00 -1.58 0.00 0.00 42.46 38.00 2eik s ILE 121 CO 0.00 0.46 0.22 -1.00 -1.23 0.00 0.00 174.94 173.38 2eik s HIS 122 N 0.50 3.49 0.88 3.97 3.76 -1.26 -4.83 115.29 121.81 2eik s HIS 122 Ca 0.01 -2.89 -0.11 0.00 -0.15 0.00 0.00 55.06 51.92 2eik s HIS 122 Cb -0.13 -3.01 0.11 0.00 1.11 0.00 0.00 32.58 30.66 2eik s HIS 122 CO 0.01 -0.87 1.08 -2.30 -0.85 0.00 0.00 174.74 171.82 2eik n PRO 123 N 3.83 -0.23 -1.79 8.40 -0.02 -1.26 -4.82 135.00 139.10 2eik n PRO 123 Ca 0.04 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 61.20 2eik n PRO 123 Cb 0.38 -2.34 0.04 0.00 -0.02 0.00 0.00 33.50 31.56 2eik n PRO 123 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2eik s LEU 124 N -5.66 3.36 -0.35 2.45 1.43 -1.26 -4.97 118.68 113.68 2eik s LEU 124 Ca 0.68 1.86 -0.28 0.00 -1.03 0.00 0.00 54.13 55.36 2eik s LEU 124 Cb -0.25 -4.53 0.02 0.00 0.03 0.00 0.00 46.19 41.45 2eik s LEU 124 CO 0.57 -1.46 1.02 0.21 0.23 0.00 0.00 176.35 176.91 2eik s ASN 125 N -2.91 6.81 0.42 2.29 3.84 -1.26 -4.91 114.94 119.22 2eik s ASN 125 Ca 0.64 0.82 0.29 0.00 0.21 0.00 0.00 52.86 54.82 2eik s ASN 125 Cb -0.17 -2.51 1.50 0.00 -0.55 0.00 0.00 41.25 39.51 2eik s ASN 125 CO 0.43 -0.89 1.88 1.55 -2.79 0.00 0.00 177.10 177.28 2eik h PRO 126 N 8.33 0.00 -0.00 0.43 0.13 -1.94 -1.79 132.00 137.15 2eik h PRO 126 Ca -0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 2eik h PRO 126 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2eik h PRO 126 CO 1.02 0.00 -0.20 1.28 -0.23 0.00 0.00 178.00 179.87 2eik n LEU 127 N -2.54 0.39 0.00 1.56 7.99 -1.26 -2.21 117.00 120.92 2eik n LEU 127 Ca -0.01 0.12 0.00 0.00 -0.01 0.00 0.00 56.01 56.11 2eik n LEU 127 Cb 0.09 -0.28 0.00 0.00 -0.11 0.00 0.00 43.42 43.12 2eik n LEU 127 CO 0.15 0.08 0.00 -0.62 -1.51 0.00 0.00 177.39 175.49 2eik n GLU 128 N -1.24 0.00 -0.34 3.23 1.02 -0.67 -4.63 120.64 118.02 2eik n GLU 128 Ca 0.10 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.25 2eik n GLU 128 Cb 0.31 0.00 0.15 0.00 -0.02 0.00 0.00 31.44 31.88 2eik n GLU 128 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2eik h VAL 129 N 0.00 1.09 -0.56 2.62 2.07 -1.87 -2.18 116.25 117.42 2eik h VAL 129 Ca 0.00 -0.37 0.08 0.00 0.82 0.00 0.00 66.70 67.23 2eik h VAL 129 Cb 0.00 -0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 29.64 2eik h VAL 129 CO 0.00 0.20 0.38 -0.65 0.02 0.00 0.00 177.57 177.52 2eik h PRO 130 N 1.09 0.43 -0.24 1.57 0.11 -1.77 0.20 132.00 133.39 2eik h PRO 130 Ca 0.39 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 66.29 2eik h PRO 130 Cb 0.13 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.14 2eik h PRO 130 CO -0.16 0.28 -0.57 1.25 -0.21 0.00 0.00 178.00 178.59 2eik h LEU 131 N 0.44 0.92 -0.19 2.35 5.85 -0.92 -2.36 115.31 121.40 2eik h LEU 131 Ca 0.25 -0.56 0.00 0.00 0.84 0.00 0.00 57.88 58.41 2eik h LEU 131 Cb 0.43 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 2eik h LEU 131 CO -0.07 1.31 0.12 0.25 -0.34 0.00 0.00 178.44 179.71 2eik h LEU 132 N 0.56 0.22 -1.27 2.25 5.85 -0.92 -1.18 115.31 120.83 2eik h LEU 132 Ca -0.00 -0.03 0.11 0.00 0.84 0.00 0.00 57.88 58.80 2eik h LEU 132 Cb 1.19 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 42.10 2eik h LEU 132 CO 0.13 0.19 0.56 0.78 -0.34 0.00 0.00 178.44 179.75 2eik h ASN 133 N 0.24 0.71 -0.32 1.25 2.35 -0.59 -0.37 115.58 118.84 2eik h ASN 133 Ca 0.07 0.03 -0.07 0.00 -0.55 0.00 0.00 56.30 55.78 2eik h ASN 133 Cb 0.00 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 2eik h ASN 133 CO -0.01 0.40 -0.06 0.74 -1.65 0.00 0.00 177.43 176.84 2eik h THR 134 N 0.77 1.28 -0.11 2.81 2.02 -0.83 -1.75 112.91 117.10 2eik h THR 134 Ca 0.41 -1.09 -0.09 0.00 0.77 0.00 0.00 66.41 66.41 2eik h THR 134 Cb 0.53 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.27 2eik h THR 134 CO -0.18 0.35 -0.35 0.77 0.37 0.00 0.00 175.52 176.49 2eik h SER 135 N 0.38 0.22 0.08 4.18 4.64 -0.43 -1.43 113.55 121.19 2eik h SER 135 Ca 0.08 -0.08 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2eik h SER 135 Cb 0.55 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 2eik h SER 135 CO 0.03 0.57 -0.04 0.58 -0.87 0.00 0.00 176.83 177.10 2eik h VAL 136 N 0.19 1.07 -0.52 0.95 2.07 -0.84 -0.27 116.25 118.89 2eik h VAL 136 Ca 0.02 -0.50 -0.12 0.00 0.82 0.00 0.00 66.70 66.93 2eik h VAL 136 Cb 0.71 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 2eik h VAL 136 CO 0.05 0.12 -0.13 -0.07 0.02 0.00 0.00 177.57 177.56 2eik h LEU 137 N -0.33 1.01 -0.84 2.57 3.38 -1.25 -1.18 115.31 118.68 2eik h LEU 137 Ca -0.01 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.59 2eik h LEU 137 Cb 0.28 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 2eik h LEU 137 CO 0.02 1.14 0.50 -0.07 0.09 0.00 0.00 178.44 180.12 2eik h LEU 138 N 0.87 1.02 -0.51 1.67 3.38 -1.20 -1.32 115.31 119.21 2eik h LEU 138 Ca 0.13 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 2eik h LEU 138 Cb 0.70 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 2eik h LEU 138 CO 0.05 0.79 0.09 0.00 0.09 0.00 0.00 178.44 179.46 2eik h ALA 139 N 1.27 0.67 0.00 1.53 0.00 -0.78 -1.93 119.26 120.02 2eik h ALA 139 Ca 0.30 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2eik h ALA 139 Cb -0.04 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 2eik h ALA 139 CO -0.06 0.40 -0.10 0.66 0.00 0.00 0.00 179.25 180.16 2eik h SER 140 N 0.72 0.00 -0.11 0.00 4.64 -0.68 -0.25 113.55 117.87 2eik h SER 140 Ca 0.16 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.36 2eik h SER 140 Cb 0.38 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 2eik h SER 140 CO 0.01 0.10 -0.32 1.23 -0.87 0.00 0.00 176.83 176.97 2eik h GLY 141 N 0.41 0.64 0.44 -0.77 0.00 -0.49 -1.18 103.07 102.13 2eik h GLY 141 Ca -0.00 -0.59 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 2eik h GLY 141 CO 0.01 0.53 -0.03 -2.08 0.00 0.00 0.00 176.54 174.98 2eik h VAL 142 N 0.50 1.47 -0.34 4.60 2.07 -0.68 -3.07 116.25 120.80 2eik h VAL 142 Ca 0.06 -1.42 -0.02 0.00 0.82 0.00 0.00 66.70 66.13 2eik h VAL 142 Cb 0.80 2.40 -0.02 0.00 -1.52 0.00 0.00 31.29 32.96 2eik h VAL 142 CO 0.07 0.38 0.11 0.77 0.02 0.00 0.00 177.57 178.91 2eik h SER 143 N -0.54 0.44 0.98 0.57 4.64 -1.15 -1.03 113.55 117.46 2eik h SER 143 Ca -0.00 -0.05 -0.07 0.00 -0.47 0.00 0.00 61.79 61.20 2eik h SER 143 Cb 0.63 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 2eik h SER 143 CO 0.01 0.43 -0.32 -0.29 -0.87 0.00 0.00 176.83 175.79 2eik h ILE 144 N 0.49 0.72 -0.23 0.95 2.10 -1.28 -0.82 117.51 119.44 2eik h ILE 144 Ca 0.12 -1.42 -0.18 0.00 1.08 0.00 0.00 64.86 64.46 2eik h ILE 144 Cb 0.15 1.92 -0.00 0.00 -1.09 0.00 0.00 36.82 37.80 2eik h ILE 144 CO -0.01 0.31 -0.59 0.74 -1.08 0.00 0.00 178.15 177.53 2eik h THR 145 N 0.00 1.29 -0.44 2.19 2.02 -1.12 -1.64 112.91 115.21 2eik h THR 145 Ca -0.00 -1.80 -0.03 0.00 0.77 0.00 0.00 66.41 65.34 2eik h THR 145 Cb 0.89 1.74 -0.02 0.00 -1.74 0.00 0.00 68.15 69.02 2eik h THR 145 CO 0.04 0.58 0.16 -0.25 0.37 0.00 0.00 175.52 176.41 2eik h TRP 146 N 0.56 0.69 -0.56 3.16 7.01 -0.92 -1.98 115.95 123.90 2eik h TRP 146 Ca 0.00 -0.06 0.05 0.00 2.11 0.00 0.00 58.89 60.99 2eik h TRP 146 Cb 1.18 -0.20 -0.05 0.00 -2.10 0.00 0.00 29.16 27.98 2eik h TRP 146 CO 0.06 0.61 0.29 0.00 -2.79 0.00 0.00 178.44 176.61 2eik h ALA 147 N 1.00 0.73 -0.34 2.65 0.00 -0.98 -0.11 119.26 122.20 2eik h ALA 147 Ca 0.14 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2eik h ALA 147 Cb 0.23 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2eik h ALA 147 CO -0.01 -0.05 0.15 1.25 0.00 0.00 0.00 179.25 180.59 2eik h HIS 148 N 0.55 0.50 -0.42 0.00 -0.00 -1.05 -0.86 115.15 113.87 2eik h HIS 148 Ca 0.25 -0.03 -0.07 0.00 -0.00 0.00 0.00 60.37 60.52 2eik h HIS 148 Cb 0.16 -0.15 -0.02 0.00 -0.00 0.00 0.00 27.41 27.39 2eik h HIS 148 CO -0.10 0.45 -0.02 0.45 -0.00 0.00 0.00 177.93 178.71 2eik h HIS 149 N 0.41 0.73 -0.09 5.26 -0.00 -1.10 -1.59 115.15 118.78 2eik h HIS 149 Ca 0.12 -0.10 -0.00 0.00 -0.00 0.00 0.00 60.37 60.38 2eik h HIS 149 Cb 0.15 -0.20 -0.00 0.00 -0.00 0.00 0.00 27.41 27.35 2eik h HIS 149 CO -0.01 0.70 0.04 0.77 -0.00 0.00 0.00 177.93 179.43 2eik h SER 150 N 0.65 0.12 -0.42 2.45 0.02 -0.77 -0.71 113.55 114.88 2eik h SER 150 Ca 0.13 -0.14 0.05 0.00 -0.84 0.00 0.00 61.79 60.99 2eik h SER 150 Cb 0.43 -0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.90 2eik h SER 150 CO 0.02 0.22 0.17 0.25 -1.14 0.00 0.00 176.83 176.35 2eik h LEU 151 N 0.00 0.20 -1.35 5.07 5.85 -0.91 0.11 115.31 124.29 2eik h LEU 151 Ca 0.03 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.74 2eik h LEU 151 Cb 0.14 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 2eik h LEU 151 CO -0.00 0.15 -0.25 0.24 -0.34 0.00 0.00 178.44 178.24 2eik h MET 152 N 0.35 0.00 -0.23 1.25 2.86 -1.14 -1.75 114.93 116.26 2eik h MET 152 Ca 0.19 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 2eik h MET 152 Cb 0.16 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.82 2eik h MET 152 CO -0.18 0.25 0.00 0.39 1.06 0.00 0.00 176.91 178.43 2eik n GLU 153 N -3.61 1.82 -1.38 1.72 1.02 -0.29 -4.86 120.64 115.07 2eik n GLU 153 Ca -0.01 -1.24 -0.05 0.00 -0.02 0.00 0.00 57.16 55.84 2eik n GLU 153 Cb 0.39 -1.38 -0.02 0.00 -0.02 0.00 0.00 31.44 30.41 2eik n GLU 153 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2eik n GLY 154 N 1.15 0.60 3.33 0.62 0.00 -0.66 -5.01 105.19 105.22 2eik n GLY 154 Ca 0.16 -0.81 -0.46 0.00 0.00 0.00 0.00 46.02 44.90 2eik n GLY 154 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2eik s ASP 155 N -2.91 6.37 0.06 1.61 -1.08 -0.05 -4.95 116.67 115.72 2eik s ASP 155 Ca 0.00 -2.02 -0.27 0.00 -0.52 0.00 0.00 52.55 49.74 2eik s ASP 155 Cb 0.00 -2.23 -0.17 0.00 -1.46 0.00 0.00 42.92 39.06 2eik s ASP 155 CO 0.00 -0.82 1.58 -0.09 0.52 0.00 0.00 175.17 176.36 2eik h ARG 156 N 8.60 -0.39 -0.24 4.34 2.43 -1.94 -1.78 114.38 125.40 2eik h ARG 156 Ca -0.16 0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.08 2eik h ARG 156 Cb 1.08 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 30.68 2eik h ARG 156 CO 0.97 -0.20 -0.01 -0.22 -1.51 0.00 0.00 179.97 179.00 2eik h LYS 157 N -0.50 0.06 0.00 0.20 3.64 -1.98 -1.69 116.57 116.31 2eik h LYS 157 Ca -0.04 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.27 2eik h LYS 157 Cb 0.37 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 2eik h LYS 157 CO 0.07 0.04 -0.31 0.45 -2.27 0.00 0.00 179.45 177.43 2eik h HIS 158 N 0.06 0.00 -0.06 1.91 3.86 -1.96 -0.59 115.15 118.37 2eik h HIS 158 Ca 0.12 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.31 2eik h HIS 158 Cb 0.15 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.62 2eik h HIS 158 CO -0.20 0.31 -0.01 1.98 0.86 0.00 0.00 177.93 180.87 2eik h MET 159 N 0.00 0.11 -0.55 2.45 1.85 -0.92 -0.18 114.93 117.70 2eik h MET 159 Ca -0.00 -0.04 -0.06 0.00 -0.61 0.00 0.00 59.70 58.99 2eik h MET 159 Cb 0.83 -0.01 -0.02 0.00 0.43 0.00 0.00 31.60 32.82 2eik h MET 159 CO 0.04 0.42 0.09 -0.07 -0.40 0.00 0.00 176.91 176.99 2eik h LEU 160 N -0.20 0.81 0.20 3.39 3.38 -1.12 0.11 115.31 121.89 2eik h LEU 160 Ca 0.02 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 2eik h LEU 160 Cb 0.37 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2eik h LEU 160 CO 0.00 0.82 -0.10 -0.61 0.09 0.00 0.00 178.44 178.65 2eik h GLN 161 N 0.82 -0.26 -0.78 1.13 4.15 -0.98 -0.79 115.11 118.39 2eik h GLN 161 Ca 0.17 0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.59 2eik h GLN 161 Cb 0.36 0.06 -0.04 0.00 0.21 0.00 0.00 27.48 28.07 2eik h GLN 161 CO 0.01 0.02 0.41 0.00 -1.93 0.00 0.00 178.83 177.34 2eik h ALA 162 N 0.19 1.01 -0.60 3.38 0.00 -0.85 -1.64 119.26 120.75 2eik h ALA 162 Ca -0.03 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 2eik h ALA 162 Cb 0.40 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2eik h ALA 162 CO 0.05 0.53 0.04 1.25 0.00 0.00 0.00 179.25 181.12 2eik h LEU 163 N 1.09 0.97 -0.64 0.00 5.85 -0.76 -1.80 115.31 120.02 2eik h LEU 163 Ca 0.27 -0.25 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 2eik h LEU 163 Cb 0.06 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.80 2eik h LEU 163 CO -0.04 1.00 0.20 0.15 -0.34 0.00 0.00 178.44 179.41 2eik h PHE 164 N 0.93 1.04 -0.78 1.25 3.57 -0.69 -1.90 116.94 120.36 2eik h PHE 164 Ca 0.18 -0.10 -0.05 0.00 3.53 0.00 0.00 57.97 61.52 2eik h PHE 164 Cb 0.48 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 38.89 2eik h PHE 164 CO 0.03 0.84 0.29 0.82 -2.23 0.00 0.00 178.31 178.06 2eik h ILE 165 N 0.93 1.26 -0.31 1.41 2.04 -1.12 -1.25 117.51 120.47 2eik h ILE 165 Ca 0.21 -0.85 -0.01 0.00 1.00 0.00 0.00 64.86 65.21 2eik h ILE 165 Cb 0.29 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 2eik h ILE 165 CO -0.01 0.34 0.18 0.74 0.00 0.00 0.00 178.15 179.40 2eik h THR 166 N 1.14 1.13 -0.50 -0.27 2.02 -0.92 -1.74 112.91 113.77 2eik h THR 166 Ca 0.26 -0.33 -0.04 0.00 0.77 0.00 0.00 66.41 67.06 2eik h THR 166 Cb 0.24 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.41 2eik h THR 166 CO -0.02 0.13 0.14 0.40 0.37 0.00 0.00 175.52 176.54 2eik h ILE 167 N 0.39 1.23 -0.94 3.11 2.04 -1.18 -1.53 117.51 120.63 2eik h ILE 167 Ca 0.11 -0.81 -0.00 0.00 1.00 0.00 0.00 64.86 65.16 2eik h ILE 167 Cb 0.05 0.81 -0.05 0.00 -0.74 0.00 0.00 36.82 36.90 2eik h ILE 167 CO -0.02 0.29 0.58 0.74 0.00 0.00 0.00 178.15 179.74 2eik h THR 168 N 0.68 1.26 -0.67 -0.27 2.02 -1.01 -0.41 112.91 114.50 2eik h THR 168 Ca 0.16 -0.54 -0.08 0.00 0.77 0.00 0.00 66.41 66.72 2eik h THR 168 Cb 0.30 -0.08 -0.03 0.00 -1.74 0.00 0.00 68.15 66.60 2eik h THR 168 CO -0.00 0.27 0.11 -0.07 0.37 0.00 0.00 175.52 176.20 2eik h LEU 169 N 1.29 1.06 -0.91 2.58 3.38 -1.00 0.12 115.31 121.83 2eik h LEU 169 Ca 0.34 -0.25 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 2eik h LEU 169 Cb -0.07 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.37 2eik h LEU 169 CO -0.07 1.04 0.14 1.23 0.09 0.00 0.00 178.44 180.88 2eik h GLY 170 N 1.05 1.01 1.44 0.83 0.00 -0.42 0.14 103.07 107.12 2eik h GLY 170 Ca 0.21 -0.61 -0.17 0.00 0.00 0.00 0.00 47.33 46.76 2eik h GLY 170 CO 0.01 0.57 -0.60 -2.08 0.00 0.00 0.00 176.54 174.44 2eik h VAL 171 N 0.90 1.32 -0.57 4.60 2.07 -0.77 -1.83 116.25 121.97 2eik h VAL 171 Ca 0.19 -1.86 -0.02 0.00 0.82 0.00 0.00 66.70 65.83 2eik h VAL 171 Cb 0.33 1.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.90 2eik h VAL 171 CO 0.00 0.58 0.27 0.22 0.02 0.00 0.00 177.57 178.66 2eik h TYR 172 N 0.44 0.83 -0.26 1.57 3.20 -0.21 -0.10 116.97 122.44 2eik h TYR 172 Ca -0.00 -0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.83 2eik h TYR 172 Cb 1.16 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 39.16 2eik h TYR 172 CO 0.05 0.65 0.16 0.35 -1.64 0.00 0.00 178.16 177.72 2eik h PHE 173 N 0.78 0.30 -0.52 -3.82 3.57 -0.80 0.13 116.94 116.57 2eik h PHE 173 Ca 0.20 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.70 2eik h PHE 173 Cb 0.13 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.75 2eik h PHE 173 CO -0.00 0.18 0.32 1.15 -2.23 0.00 0.00 178.31 177.73 2eik h THR 174 N 0.32 1.16 -0.48 4.41 2.02 -0.91 -0.34 112.91 119.09 2eik h THR 174 Ca 0.10 -0.34 -0.05 0.00 0.77 0.00 0.00 66.41 66.89 2eik h THR 174 Cb -0.02 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 66.82 2eik h THR 174 CO -0.04 0.16 0.11 -0.07 0.37 0.00 0.00 175.52 176.05 2eik h LEU 175 N 0.70 0.73 -0.52 2.58 3.38 -0.72 -0.21 115.31 121.24 2eik h LEU 175 Ca 0.19 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 2eik h LEU 175 Cb -0.02 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 2eik h LEU 175 CO -0.04 0.78 0.32 -0.07 0.09 0.00 0.00 178.44 179.52 2eik h LEU 176 N 0.65 0.62 -0.78 1.67 3.38 -0.78 -1.26 115.31 118.82 2eik h LEU 176 Ca 0.15 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 2eik h LEU 176 Cb 0.34 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2eik h LEU 176 CO 0.00 0.49 0.07 -0.61 0.09 0.00 0.00 178.44 178.49 2eik h GLN 177 N 0.70 0.99 -0.66 1.13 5.75 -0.84 -0.37 115.11 121.80 2eik h GLN 177 Ca 0.19 -0.26 -0.06 0.00 -0.15 0.00 0.00 58.65 58.37 2eik h GLN 177 Cb -0.02 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.39 2eik h GLN 177 CO -0.04 0.93 0.19 0.00 -2.65 0.00 0.00 178.83 177.27 2eik h ALA 178 N 1.14 0.87 -0.30 3.38 0.00 -0.70 0.43 119.26 124.07 2eik h ALA 178 Ca 0.18 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 2eik h ALA 178 Cb 0.44 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2eik h ALA 178 CO 0.01 0.56 -0.31 0.66 0.00 0.00 0.00 179.25 180.17 2eik h SER 179 N 0.97 0.67 -0.70 0.00 4.64 -0.91 -2.01 113.55 116.21 2eik h SER 179 Ca 0.21 -0.27 -0.02 0.00 -0.47 0.00 0.00 61.79 61.24 2eik h SER 179 Cb 0.32 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.19 2eik h SER 179 CO -0.00 0.94 0.36 -0.33 -0.87 0.00 0.00 176.83 176.93 2eik h GLU 180 N 0.55 0.99 -0.41 4.77 4.39 -0.60 0.83 114.58 125.10 2eik h GLU 180 Ca 0.06 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.64 2eik h GLU 180 Cb 0.81 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 29.25 2eik h GLU 180 CO 0.07 0.76 0.27 1.88 -1.16 0.00 0.00 179.01 180.82 2eik h TYR 181 N 0.96 0.52 -0.39 4.33 -1.99 -0.63 -0.60 116.97 119.17 2eik h TYR 181 Ca 0.24 0.01 -0.06 0.00 2.00 0.00 0.00 58.73 60.92 2eik h TYR 181 Cb 0.08 -0.17 -0.01 0.00 2.00 0.00 0.00 36.73 38.62 2eik h TYR 181 CO 0.00 0.33 0.00 -0.92 -0.00 0.00 0.00 178.16 177.57 2eik h TYR 182 N 0.55 0.75 0.00 4.88 5.03 -0.92 -3.16 116.97 124.10 2eik h TYR 182 Ca 0.15 -0.13 -0.03 0.00 2.58 0.00 0.00 58.73 61.30 2eik h TYR 182 Cb -0.05 -0.20 -0.00 0.00 1.55 0.00 0.00 36.73 38.03 2eik h TYR 182 CO -0.05 0.77 -0.16 0.93 -1.32 0.00 0.00 178.16 178.34 2eik h GLU 183 N 0.52 0.00 -6.46 1.82 4.39 -0.67 -3.46 114.58 110.71 2eik h GLU 183 Ca 0.11 0.00 -0.59 0.00 0.34 0.00 0.00 59.36 59.23 2eik h GLU 183 Cb 0.47 0.00 0.05 0.00 -0.10 0.00 0.00 28.75 29.17 2eik h GLU 183 CO 0.02 0.16 0.88 0.00 -1.16 0.00 0.00 179.01 178.90 2eik n ALA 184 N -2.18 1.34 0.47 3.43 0.00 -0.25 -4.89 120.51 118.45 2eik n ALA 184 Ca 0.01 0.41 0.13 0.00 0.00 0.00 0.00 53.44 53.98 2eik n ALA 184 Cb 0.42 -2.40 0.46 0.00 0.00 0.00 0.00 19.45 17.94 2eik n ALA 184 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2eik n PRO 185 N 4.18 0.23 -4.12 0.00 -0.04 -1.26 -4.75 135.00 129.24 2eik n PRO 185 Ca 0.18 0.36 -0.28 0.00 -0.04 0.00 0.00 63.50 63.72 2eik n PRO 185 Cb 0.29 -1.87 -0.07 0.00 -0.04 0.00 0.00 33.50 31.82 2eik n PRO 185 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2eik s PHE 186 N -3.25 3.04 0.52 0.54 -0.12 -1.26 -5.04 117.98 112.40 2eik s PHE 186 Ca 0.06 -0.04 0.01 0.00 -0.05 0.00 0.00 56.93 56.91 2eik s PHE 186 Cb 0.10 -1.50 -0.01 0.00 -0.63 0.00 0.00 43.02 40.99 2eik s PHE 186 CO 0.47 0.51 0.00 0.95 -0.05 0.00 0.00 175.22 177.11 2eik s THR 187 N -1.59 1.09 0.33 -4.49 -4.23 -1.26 -5.02 115.64 100.47 2eik s THR 187 Ca 0.29 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 59.04 2eik s THR 187 Cb -0.11 -2.10 0.25 0.00 1.34 0.00 0.00 72.50 71.89 2eik s THR 187 CO 0.21 0.00 1.97 -0.29 -0.54 0.00 0.00 174.62 175.97 2eik h ILE 188 N 1.32 0.63 -0.11 2.99 2.10 -1.95 -1.93 117.51 120.57 2eik h ILE 188 Ca -0.44 -0.79 0.00 0.00 1.08 0.00 0.00 64.86 64.71 2eik h ILE 188 Cb 1.32 1.51 0.00 0.00 -1.09 0.00 0.00 36.82 38.56 2eik h ILE 188 CO 0.73 0.18 0.00 -1.54 -1.08 0.00 0.00 178.15 176.44 2eik n SER 189 N -3.60 0.96 -3.59 2.19 3.41 -1.26 -3.29 113.62 108.44 2eik n SER 189 Ca -0.01 -1.63 -0.41 0.00 -0.26 0.00 0.00 58.87 56.56 2eik n SER 189 Cb 0.31 -0.07 -0.00 0.00 -0.26 0.00 0.00 64.21 64.19 2eik n SER 189 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2eik n ASP 190 N -0.13 6.91 -0.22 4.04 8.00 -0.72 -4.96 116.55 129.47 2eik n ASP 190 Ca 0.14 -3.03 0.00 0.00 0.71 0.00 0.00 54.79 52.62 2eik n ASP 190 Cb 0.21 -1.45 0.00 0.00 -0.02 0.00 0.00 41.12 39.86 2eik n ASP 190 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2eik n GLY 191 N 2.51 -0.10 0.26 0.44 0.00 -1.26 -2.28 105.19 104.76 2eik n GLY 191 Ca 0.57 -0.99 0.13 0.00 0.00 0.00 0.00 46.02 45.73 2eik n GLY 191 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2eik h VAL 192 N 0.00 0.49 0.04 1.61 3.04 -1.92 -0.33 116.25 119.16 2eik h VAL 192 Ca 0.00 -0.63 -0.00 0.00 -1.01 0.00 0.00 66.70 65.05 2eik h VAL 192 Cb 0.00 1.43 0.00 0.00 -2.01 0.00 0.00 31.29 30.71 2eik h VAL 192 CO 0.00 0.13 -0.02 0.22 -1.01 0.00 0.00 177.57 176.89 2eik h TYR 193 N 0.00 -0.04 -0.22 3.17 3.20 -1.95 -0.70 116.97 120.42 2eik h TYR 193 Ca -0.00 -0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.76 2eik h TYR 193 Cb 0.42 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 2eik h TYR 193 CO 0.00 0.41 -0.34 0.78 -1.64 0.00 0.00 178.16 177.37 2eik h GLY 194 N -0.51 0.51 0.96 1.82 0.00 -1.24 -1.54 103.07 103.07 2eik h GLY 194 Ca -0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 47.33 46.83 2eik h GLY 194 CO 0.01 0.42 -0.31 1.76 0.00 0.00 0.00 176.54 178.43 2eik h SER 195 N 0.40 -0.74 -0.40 0.19 0.02 -0.94 -1.33 113.55 110.75 2eik h SER 195 Ca 0.05 0.03 -0.10 0.00 -0.84 0.00 0.00 61.79 60.93 2eik h SER 195 Cb 0.78 0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.51 2eik h SER 195 CO 0.06 -0.50 -0.11 0.71 -1.14 0.00 0.00 176.83 175.85 2eik h THR 196 N -0.82 1.26 0.60 -2.27 1.35 -1.14 -2.20 112.91 109.70 2eik h THR 196 Ca -0.08 -1.21 -0.03 0.00 -0.55 0.00 0.00 66.41 64.55 2eik h THR 196 Cb 0.64 1.02 0.01 0.00 -1.73 0.00 0.00 68.15 68.09 2eik h THR 196 CO 0.11 0.42 -0.29 0.15 -0.25 0.00 0.00 175.52 175.66 2eik h PHE 197 N 0.77 -0.74 -0.08 4.73 3.57 -1.20 -2.10 116.94 121.89 2eik h PHE 197 Ca 0.13 -0.02 -0.16 0.00 3.53 0.00 0.00 57.97 61.45 2eik h PHE 197 Cb 0.62 0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.60 2eik h PHE 197 CO 0.03 -0.43 -0.64 0.74 -2.23 0.00 0.00 178.31 175.79 2eik h PHE 198 N -0.89 0.41 -0.16 0.41 -1.00 -1.30 -1.54 116.94 112.88 2eik h PHE 198 Ca -0.08 -0.16 -0.19 0.00 2.81 0.00 0.00 57.97 60.34 2eik h PHE 198 Cb 0.65 -0.07 0.01 0.00 3.61 0.00 0.00 35.95 40.14 2eik h PHE 198 CO -0.02 0.86 -0.65 0.28 -1.61 0.00 0.00 178.31 177.18 2eik h VAL 199 N 0.23 1.30 0.05 -0.55 2.07 -1.46 0.19 116.25 118.07 2eik h VAL 199 Ca -0.01 -1.88 -0.00 0.00 0.82 0.00 0.00 66.70 65.63 2eik h VAL 199 Cb 1.17 2.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.93 2eik h VAL 199 CO 0.10 0.59 -0.02 0.00 0.02 0.00 0.00 177.57 178.26 2eik h ALA 200 N 0.54 -0.06 0.00 1.67 0.00 -1.41 -1.54 119.26 118.46 2eik h ALA 200 Ca -0.04 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 2eik h ALA 200 Cb 1.28 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 2eik h ALA 200 CO 0.14 -0.28 -0.39 1.79 0.00 0.00 0.00 179.25 180.50 2eik h THR 201 N -0.57 1.02 -0.05 0.00 1.35 -1.38 -2.08 112.91 111.20 2eik h THR 201 Ca -0.01 -1.49 -0.01 0.00 -0.55 0.00 0.00 66.41 64.36 2eik h THR 201 Cb 0.51 1.87 -0.00 0.00 -1.73 0.00 0.00 68.15 68.79 2eik h THR 201 CO 0.01 0.38 -0.00 1.23 -0.25 0.00 0.00 175.52 176.89 2eik h GLY 202 N 1.74 0.09 1.49 5.82 0.00 -0.57 0.26 103.07 111.90 2eik h GLY 202 Ca -0.00 -0.07 -0.06 0.00 0.00 0.00 0.00 47.33 47.20 2eik h GLY 202 CO 0.05 0.06 0.01 0.74 0.00 0.00 0.00 176.54 177.40 2eik h PHE 203 N -0.22 0.66 -0.17 5.60 0.04 -1.23 -1.16 116.94 120.46 2eik h PHE 203 Ca 0.01 -0.07 -0.01 0.00 2.80 0.00 0.00 57.97 60.70 2eik h PHE 203 Cb 0.34 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.29 2eik h PHE 203 CO 0.03 0.62 0.05 1.25 -0.60 0.00 0.00 178.31 179.67 2eik h HIS 204 N 0.60 0.27 -0.97 -0.55 2.76 -1.16 -1.39 115.15 114.71 2eik h HIS 204 Ca 0.13 -0.03 0.12 0.00 -2.20 0.00 0.00 60.37 58.39 2eik h HIS 204 Cb 0.37 -0.08 -0.09 0.00 1.55 0.00 0.00 27.41 29.16 2eik h HIS 204 CO 0.02 0.38 0.60 0.78 -1.30 0.00 0.00 177.93 178.40 2eik h GLY 205 N 0.09 1.60 1.02 5.26 0.00 -0.02 0.60 103.07 111.62 2eik h GLY 205 Ca 0.05 -0.40 -0.04 0.00 0.00 0.00 0.00 47.33 46.95 2eik h GLY 205 CO -0.00 0.13 0.30 -2.00 0.00 0.00 0.00 176.54 174.97 2eik h LEU 206 N 0.93 0.97 -1.21 3.11 5.85 -0.88 -1.82 115.31 122.26 2eik h LEU 206 Ca 0.49 -0.16 -0.06 0.00 0.84 0.00 0.00 57.88 58.98 2eik h LEU 206 Cb 0.51 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 2eik h LEU 206 CO -0.28 0.87 -0.11 0.45 -0.34 0.00 0.00 178.44 179.03 2eik h HIS 207 N 1.01 0.43 -0.58 1.25 3.86 0.18 -0.62 115.15 120.69 2eik h HIS 207 Ca 0.24 -0.06 -0.10 0.00 -1.16 0.00 0.00 60.37 59.29 2eik h HIS 207 Cb 0.19 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.52 2eik h HIS 207 CO 0.01 0.52 -0.04 0.28 0.86 0.00 0.00 177.93 179.56 2eik h VAL 208 N 0.38 1.27 -0.61 2.45 2.07 -0.75 0.17 116.25 121.23 2eik h VAL 208 Ca 0.07 -1.19 -0.09 0.00 0.82 0.00 0.00 66.70 66.32 2eik h VAL 208 Cb 0.44 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 2eik h VAL 208 CO 0.02 0.43 0.05 0.40 0.02 0.00 0.00 177.57 178.49 2eik h ILE 209 N 0.93 1.26 -0.35 4.57 2.04 -0.87 0.91 117.51 126.00 2eik h ILE 209 Ca 0.16 -1.08 -0.06 0.00 1.00 0.00 0.00 64.86 64.87 2eik h ILE 209 Cb 0.60 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 2eik h ILE 209 CO 0.04 0.40 -0.02 0.40 0.00 0.00 0.00 178.15 178.96 2eik h ILE 210 N 0.95 1.26 -0.70 -0.67 2.04 -0.82 -1.40 117.51 118.18 2eik h ILE 210 Ca 0.18 -1.02 -0.06 0.00 1.00 0.00 0.00 64.86 64.95 2eik h ILE 210 Cb 0.50 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 37.78 2eik h ILE 210 CO 0.02 0.34 0.18 1.23 0.00 0.00 0.00 178.15 179.92 2eik h GLY 211 N 0.44 1.18 0.88 5.37 0.00 -0.43 -0.92 103.07 109.59 2eik h GLY 211 Ca 0.10 -0.72 -0.01 0.00 0.00 0.00 0.00 47.33 46.70 2eik h GLY 211 CO 0.02 0.67 0.06 1.76 0.00 0.00 0.00 176.54 179.06 2eik h SER 212 N 1.05 0.21 -0.49 0.19 0.02 -0.66 -0.54 113.55 113.33 2eik h SER 212 Ca 0.22 -0.16 0.07 0.00 -0.84 0.00 0.00 61.79 61.09 2eik h SER 212 Cb 0.35 -0.05 -0.06 0.00 0.14 0.00 0.00 62.40 62.77 2eik h SER 212 CO -0.00 0.31 0.16 0.74 -1.14 0.00 0.00 176.83 176.89 2eik h THR 213 N 0.10 0.81 -0.99 -2.27 2.02 -1.04 0.20 112.91 111.74 2eik h THR 213 Ca 0.05 -0.11 0.02 0.00 0.77 0.00 0.00 66.41 67.15 2eik h THR 213 Cb 0.16 0.46 -0.05 0.00 -1.74 0.00 0.00 68.15 66.98 2eik h THR 213 CO -0.00 0.06 0.65 0.15 0.37 0.00 0.00 175.52 176.75 2eik h PHE 214 N 0.32 1.23 -0.49 3.16 3.04 -0.82 0.13 116.94 123.51 2eik h PHE 214 Ca 0.24 0.03 -0.12 0.00 3.98 0.00 0.00 57.97 62.10 2eik h PHE 214 Cb 0.27 -0.41 -0.02 0.00 2.56 0.00 0.00 35.95 38.35 2eik h PHE 214 CO -0.17 0.74 -0.17 -0.07 -2.02 0.00 0.00 178.31 176.61 2eik h LEU 215 N 1.30 0.97 -0.80 0.59 3.38 0.56 -2.02 115.31 119.28 2eik h LEU 215 Ca 0.38 -0.35 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 2eik h LEU 215 Cb -0.07 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.38 2eik h LEU 215 CO -0.10 1.12 0.35 0.40 0.09 0.00 0.00 178.44 180.30 2eik h ILE 216 N 0.84 1.26 -0.51 1.22 2.04 0.27 0.45 117.51 123.08 2eik h ILE 216 Ca 0.12 -0.77 0.02 0.00 1.00 0.00 0.00 64.86 65.23 2eik h ILE 216 Cb 0.73 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 2eik h ILE 216 CO 0.06 0.32 0.31 0.58 0.00 0.00 0.00 178.15 179.42 2eik h VAL 217 N 1.15 1.07 -0.45 1.67 2.07 -0.64 -1.48 116.25 119.64 2eik h VAL 217 Ca 0.27 -0.22 -0.04 0.00 0.82 0.00 0.00 66.70 67.53 2eik h VAL 217 Cb 0.17 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 2eik h VAL 217 CO -0.03 0.11 0.11 0.00 0.02 0.00 0.00 177.57 177.79 2eik h PHE 219 N 0.66 0.07 -0.26 0.00 3.57 0.06 0.34 116.94 121.39 2eik h PHE 219 Ca 0.15 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.52 2eik h PHE 219 Cb 0.25 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 2eik h PHE 219 CO 0.01 0.06 -0.38 0.74 -2.23 0.00 0.00 178.31 176.51 2eik h PHE 220 N 0.06 0.70 -0.18 0.41 0.04 -1.11 -0.75 116.94 116.12 2eik h PHE 220 Ca 0.02 -0.20 -0.07 0.00 2.80 0.00 0.00 57.97 60.52 2eik h PHE 220 Cb 0.01 -0.15 -0.01 0.00 2.20 0.00 0.00 35.95 37.99 2eik h PHE 220 CO -0.07 0.89 -0.20 0.00 -0.60 0.00 0.00 178.31 178.33 2eik h ARG 221 N 0.49 0.31 -0.27 1.51 3.08 -1.11 -1.90 114.38 116.49 2eik h ARG 221 Ca 0.05 -0.09 -0.11 0.00 0.07 0.00 0.00 59.98 59.89 2eik h ARG 221 Cb 0.88 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.90 2eik h ARG 221 CO 0.08 0.50 -0.27 0.37 -1.07 0.00 0.00 179.97 179.58 2eik h GLN 222 N 0.28 0.65 -0.84 0.04 5.75 -0.48 -0.90 115.11 119.62 2eik h GLN 222 Ca 0.05 -0.35 0.08 0.00 -0.15 0.00 0.00 58.65 58.29 2eik h GLN 222 Cb 0.52 0.01 -0.06 0.00 1.07 0.00 0.00 27.48 29.02 2eik h GLN 222 CO 0.03 0.95 0.55 -0.07 -2.65 0.00 0.00 178.83 177.64 2eik h LEU 223 N 0.38 0.76 -1.16 -2.39 3.38 -0.78 -0.79 115.31 114.71 2eik h LEU 223 Ca 0.04 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2eik h LEU 223 Cb 0.83 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.44 2eik h LEU 223 CO 0.07 0.47 0.00 0.29 0.09 0.00 0.00 178.44 179.35 2eik n LYS 224 N -4.51 1.77 -1.94 1.13 5.02 -0.75 -4.94 118.16 113.94 2eik n LYS 224 Ca 0.14 -0.95 -0.19 0.00 -2.02 0.00 0.00 58.31 55.29 2eik n LYS 224 Cb 0.28 -1.33 -0.05 0.00 -0.02 0.00 0.00 35.03 33.90 2eik n LYS 224 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2eik n PHE 225 N 0.23 -0.44 -0.25 2.13 3.01 -0.30 -4.92 117.46 116.92 2eik n PHE 225 Ca 0.09 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.50 2eik n PHE 225 Cb 0.30 -3.44 0.10 0.00 -0.01 0.00 0.00 39.48 36.43 2eik n PHE 225 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2eik h HIS 226 N 0.00 1.12 -3.63 1.38 3.86 -1.38 -3.44 115.15 113.06 2eik h HIS 226 Ca -0.42 -0.09 -0.51 0.00 -1.16 0.00 0.00 60.37 58.19 2eik h HIS 226 Cb 1.28 -0.33 -0.02 0.00 1.06 0.00 0.00 27.41 29.40 2eik h HIS 226 CO 0.52 0.87 0.32 -0.06 0.86 0.00 0.00 177.93 180.43 2eik s PHE 227 N -5.45 3.90 0.35 2.45 0.08 -1.26 -4.96 117.98 113.10 2eik s PHE 227 Ca -0.12 1.81 0.07 0.00 0.12 0.00 0.00 56.93 58.81 2eik s PHE 227 Cb 0.16 -2.97 -0.01 0.00 -0.57 0.00 0.00 43.02 39.62 2eik s PHE 227 CO 0.83 0.36 0.42 0.95 -0.10 0.00 0.00 175.22 177.68 2eik s THR 228 N -0.67 3.62 -0.27 0.64 -4.23 -0.96 -4.98 115.64 108.79 2eik s THR 228 Ca 0.42 -1.14 0.22 0.00 -1.18 0.00 0.00 61.69 60.01 2eik s THR 228 Cb -0.24 -3.24 0.22 0.00 1.34 0.00 0.00 72.50 70.58 2eik s THR 228 CO 0.30 -0.12 1.67 -1.54 -0.54 0.00 0.00 174.62 174.38 2eik n SER 229 N -1.58 0.59 -0.01 3.99 3.41 -1.26 -3.23 113.62 115.52 2eik n SER 229 Ca 0.01 0.74 -0.01 0.00 -0.26 0.00 0.00 58.87 59.35 2eik n SER 229 Cb 0.59 -0.83 -0.03 0.00 -0.26 0.00 0.00 64.21 63.68 2eik n SER 229 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2eik n ASN 230 N -2.25 3.96 -4.11 4.04 2.85 -1.26 -4.20 115.26 114.29 2eik n ASN 230 Ca -0.01 0.00 -0.33 0.00 -0.11 0.00 0.00 54.58 54.13 2eik n ASN 230 Cb 0.08 0.82 -0.14 0.00 1.24 0.00 0.00 39.78 41.77 2eik n ASN 230 CO 0.00 0.00 0.00 -2.28 -2.11 0.00 0.00 177.26 172.87 2eik s HIS 231 N -2.18 3.31 -0.42 1.20 2.46 -1.20 -4.94 115.29 113.53 2eik s HIS 231 Ca -0.02 -2.21 0.07 0.00 0.47 0.00 0.00 55.06 53.38 2eik s HIS 231 Cb 0.02 -2.11 0.35 0.00 -0.13 0.00 0.00 32.58 30.71 2eik s HIS 231 CO 0.18 -0.86 1.25 -2.39 -2.47 0.00 0.00 174.74 170.45 2eik n HIS 232 N 4.50 -2.51 -0.04 3.88 1.44 -1.26 -2.27 115.22 118.95 2eik n HIS 232 Ca -0.12 -1.93 0.03 0.00 -2.01 0.00 0.00 57.72 53.69 2eik n HIS 232 Cb 0.42 1.59 0.38 0.00 0.12 0.00 0.00 29.99 32.51 2eik n HIS 232 CO 0.00 0.00 0.00 0.35 -2.81 0.00 0.00 176.34 173.88 2eik h PHE 233 N 2.39 0.60 -0.87 -1.40 3.04 -1.97 -1.57 116.94 117.16 2eik h PHE 233 Ca -0.22 0.01 0.05 0.00 3.98 0.00 0.00 57.97 61.79 2eik h PHE 233 Cb 1.21 -0.20 -0.06 0.00 2.56 0.00 0.00 35.95 39.46 2eik h PHE 233 CO 0.20 0.39 0.55 0.78 -2.02 0.00 0.00 178.31 178.21 2eik h GLY 234 N 0.66 1.30 0.93 2.40 0.00 -1.99 0.76 103.07 107.12 2eik h GLY 234 Ca 0.17 -0.41 -0.08 0.00 0.00 0.00 0.00 47.33 47.01 2eik h GLY 234 CO -0.03 0.30 -0.11 -2.75 0.00 0.00 0.00 176.54 173.95 2eik h PHE 235 N 1.03 0.74 -0.77 5.60 3.57 -1.72 -2.14 116.94 123.25 2eik h PHE 235 Ca 0.37 -0.17 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 2eik h PHE 235 Cb 0.11 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 38.64 2eik h PHE 235 CO -0.03 0.85 0.42 0.93 -2.23 0.00 0.00 178.31 178.25 2eik h GLU 236 N 0.43 1.08 -0.57 1.11 5.08 -0.69 -1.18 114.58 119.84 2eik h GLU 236 Ca 0.08 -0.13 -0.09 0.00 -1.00 0.00 0.00 59.36 58.22 2eik h GLU 236 Cb 0.63 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 2eik h GLU 236 CO 0.04 0.80 -0.02 0.00 -1.00 0.00 0.00 179.01 178.83 2eik h ALA 237 N 1.22 0.90 -0.25 3.43 0.00 -0.83 -0.67 119.26 123.07 2eik h ALA 237 Ca 0.27 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 2eik h ALA 237 Cb 0.04 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2eik h ALA 237 CO -0.04 0.65 -0.23 0.00 0.00 0.00 0.00 179.25 179.63 2eik h ALA 238 N 1.07 1.16 -0.16 0.00 0.00 -1.10 0.28 119.26 120.50 2eik h ALA 238 Ca 0.16 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2eik h ALA 238 Cb 0.55 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2eik h ALA 238 CO 0.03 0.53 -0.18 0.00 0.00 0.00 0.00 179.25 179.64 2eik h ALA 239 N 1.36 0.24 -0.43 0.00 0.00 -0.84 0.80 119.26 120.38 2eik h ALA 239 Ca 0.06 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2eik h ALA 239 Cb 0.62 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2eik h ALA 239 CO 0.04 0.15 0.24 -1.49 0.00 0.00 0.00 179.25 178.20 2eik h TRP 240 N 0.04 0.59 -0.90 0.00 6.55 -0.96 -0.78 115.95 120.49 2eik h TRP 240 Ca 0.02 -0.01 -0.02 0.00 0.95 0.00 0.00 58.89 59.84 2eik h TRP 240 Cb 0.72 -0.19 -0.04 0.00 -0.86 0.00 0.00 29.16 28.79 2eik h TRP 240 CO 0.08 0.44 0.50 -0.92 -1.05 0.00 0.00 178.44 177.49 2eik h TYR 241 N 0.57 1.23 -0.74 0.49 3.20 -0.88 -1.49 116.97 119.34 2eik h TYR 241 Ca 0.15 -0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.93 2eik h TYR 241 Cb 0.04 -0.40 -0.03 0.00 1.54 0.00 0.00 36.73 37.88 2eik h TYR 241 CO -0.02 0.85 0.23 2.35 -1.64 0.00 0.00 178.16 179.92 2eik h TRP 242 N 1.26 1.20 -0.36 -3.82 2.91 -0.33 -1.57 115.95 115.24 2eik h TRP 242 Ca 0.32 -0.12 -0.08 0.00 1.13 0.00 0.00 58.89 60.14 2eik h TRP 242 Cb 0.02 -0.35 -0.02 0.00 -0.51 0.00 0.00 29.16 28.31 2eik h TRP 242 CO 0.01 0.95 -0.10 0.45 -1.03 0.00 0.00 178.44 178.71 2eik h HIS 243 N 1.10 0.66 0.08 2.65 3.86 -0.76 -1.22 115.15 121.52 2eik h HIS 243 Ca 0.24 -0.10 -0.00 0.00 -1.16 0.00 0.00 60.37 59.34 2eik h HIS 243 Cb 0.31 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 28.61 2eik h HIS 243 CO 0.03 0.69 -0.04 0.35 0.86 0.00 0.00 177.93 179.82 2eik h PHE 244 N 0.57 -0.10 -0.97 2.45 3.04 -0.74 0.34 116.94 121.53 2eik h PHE 244 Ca 0.10 -0.00 0.09 0.00 3.98 0.00 0.00 57.97 62.14 2eik h PHE 244 Cb 0.51 0.03 -0.07 0.00 2.56 0.00 0.00 35.95 38.98 2eik h PHE 244 CO 0.02 -0.01 0.62 0.28 -2.02 0.00 0.00 178.31 177.20 2eik h VAL 245 N -0.15 1.01 -0.37 1.41 2.07 -0.99 0.02 116.25 119.24 2eik h VAL 245 Ca -0.01 -0.36 -0.09 0.00 0.82 0.00 0.00 66.70 67.07 2eik h VAL 245 Cb 0.13 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 29.77 2eik h VAL 245 CO 0.02 0.19 -0.12 -0.78 0.02 0.00 0.00 177.57 176.90 2eik h ASP 246 N 1.04 0.74 -0.33 0.57 3.58 -0.76 -2.25 116.42 119.00 2eik h ASP 246 Ca 0.44 -0.38 -0.14 0.00 0.42 0.00 0.00 57.03 57.38 2eik h ASP 246 Cb 0.33 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.16 2eik h ASP 246 CO -0.20 0.95 -0.32 0.58 -2.88 0.00 0.00 179.24 177.37 2eik h VAL 247 N 0.53 1.28 -1.00 2.25 2.07 -0.16 -2.28 116.25 118.93 2eik h VAL 247 Ca 0.09 -1.48 0.01 0.00 0.82 0.00 0.00 66.70 66.14 2eik h VAL 247 Cb 0.64 1.31 -0.05 0.00 -1.52 0.00 0.00 31.29 31.67 2eik h VAL 247 CO 0.04 0.49 0.66 0.58 0.02 0.00 0.00 177.57 179.37 2eik h VAL 248 N 0.72 1.26 -0.35 2.57 2.07 -0.95 -1.99 116.25 119.58 2eik h VAL 248 Ca 0.08 -0.47 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2eik h VAL 248 Cb 0.88 -0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 2eik h VAL 248 CO 0.08 0.25 0.22 -0.25 0.02 0.00 0.00 177.57 177.89 2eik h TRP 249 N 1.36 0.45 -0.97 1.57 2.91 -1.03 -0.48 115.95 119.75 2eik h TRP 249 Ca 0.37 0.01 0.09 0.00 1.13 0.00 0.00 58.89 60.49 2eik h TRP 249 Cb -0.15 -0.15 -0.07 0.00 -0.51 0.00 0.00 29.16 28.27 2eik h TRP 249 CO 0.00 0.30 0.62 -0.07 -1.03 0.00 0.00 178.44 178.26 2eik h LEU 250 N 0.47 0.93 -0.31 0.65 3.38 -0.82 0.45 115.31 120.06 2eik h LEU 250 Ca 0.13 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.99 2eik h LEU 250 Cb -0.03 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 2eik h LEU 250 CO -0.03 0.55 -0.31 -0.26 0.09 0.00 0.00 178.44 178.48 2eik h PHE 251 N 1.03 0.91 -0.10 1.13 -1.00 -1.02 -1.40 116.94 116.49 2eik h PHE 251 Ca 0.45 -0.28 -0.00 0.00 2.81 0.00 0.00 57.97 60.95 2eik h PHE 251 Cb 0.36 -0.19 -0.00 0.00 3.61 0.00 0.00 35.95 39.72 2eik h PHE 251 CO -0.00 1.04 0.05 -0.07 -1.61 0.00 0.00 178.31 177.72 2eik h LEU 252 N 0.52 0.12 -0.01 1.54 3.38 -0.11 0.79 115.31 121.54 2eik h LEU 252 Ca 0.05 -0.09 0.03 0.00 0.09 0.00 0.00 57.88 57.95 2eik h LEU 252 Cb 0.89 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.58 2eik h LEU 252 CO 0.08 0.18 -0.16 0.22 0.09 0.00 0.00 178.44 178.85 2eik h TYR 253 N 0.06 -0.41 -0.48 1.13 3.20 -0.10 0.13 116.97 120.50 2eik h TYR 253 Ca 0.03 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.88 2eik h TYR 253 Cb 0.08 0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 2eik h TYR 253 CO -0.04 -0.23 0.15 0.28 -1.64 0.00 0.00 178.16 176.68 2eik h VAL 254 N -0.26 1.23 0.12 1.81 2.07 -1.15 0.32 116.25 120.38 2eik h VAL 254 Ca 0.05 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 2eik h VAL 254 Cb 0.33 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 2eik h VAL 254 CO -0.16 0.28 -0.06 0.28 0.02 0.00 0.00 177.57 177.93 2eik h SER 255 N 0.65 -0.14 0.05 0.57 0.02 -0.63 -0.10 113.55 113.96 2eik h SER 255 Ca 0.16 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.11 2eik h SER 255 Cb 0.27 0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.84 2eik h SER 255 CO -0.01 0.10 -0.02 0.40 -1.14 0.00 0.00 176.83 176.17 2eik h ILE 256 N -0.56 1.29 -0.09 3.27 2.04 -0.89 0.13 117.51 122.69 2eik h ILE 256 Ca -0.02 -1.62 -0.07 0.00 1.00 0.00 0.00 64.86 64.15 2eik h ILE 256 Cb 0.12 2.28 0.00 0.00 -0.74 0.00 0.00 36.82 38.49 2eik h ILE 256 CO 0.03 0.38 -0.22 1.88 0.00 0.00 0.00 178.15 180.21 2eik h TYR 257 N -0.85 0.40 0.00 1.37 0.05 -1.30 -3.25 116.97 113.39 2eik h TYR 257 Ca -0.01 -0.15 0.00 0.00 0.05 0.00 0.00 58.73 58.62 2eik h TYR 257 Cb 0.67 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 38.34 2eik h TYR 257 CO 0.16 0.83 -0.02 2.35 -1.05 0.00 0.00 178.16 180.43 2eik h TRP 258 N -0.14 0.00 -0.82 4.88 7.01 -1.05 -3.35 115.95 122.49 2eik h TRP 258 Ca -0.00 0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.01 2eik h TRP 258 Cb 0.82 0.00 -0.04 0.00 -2.10 0.00 0.00 29.16 27.84 2eik h TRP 258 CO 0.11 0.00 0.54 2.35 -2.79 0.00 0.00 178.44 178.65 2eik h TRP 259 N -0.04 1.02 0.00 2.65 7.01 -1.07 -2.75 115.95 122.76 2eik h TRP 259 Ca 0.00 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.02 2eik h TRP 259 Cb 0.02 -0.34 0.00 0.00 -2.10 0.00 0.00 29.16 26.74 2eik h TRP 259 CO -0.01 0.62 0.00 0.41 -2.79 0.00 0.00 178.44 176.68 2eik n GLY 260 N -1.32 -0.90 0.65 2.65 0.00 0.46 -5.02 105.19 101.70 2eik n GLY 260 Ca 0.09 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.18 2eik n GLY 260 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18