#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ols n TYR 5 N 0.00 0.79 -4.94 1.20 4.02 -1.26 -4.60 117.16 112.36 2ols n TYR 5 Ca 0.00 0.20 -0.33 0.00 -0.01 0.00 0.00 57.90 57.77 2ols n TYR 5 Cb 0.00 -1.10 -0.15 0.00 -0.02 0.00 0.00 39.34 38.07 2ols n TYR 5 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2ols s VAL 6 N -2.51 2.71 -0.05 -0.72 1.01 -1.26 -1.67 120.40 117.91 2ols s VAL 6 Ca -0.28 -0.79 0.04 0.00 0.00 0.00 0.00 61.98 60.94 2ols s VAL 6 Cb 0.08 -2.10 0.00 0.00 0.00 0.00 0.00 36.38 34.36 2ols s VAL 6 CO 0.67 0.54 -0.15 -0.63 0.00 0.00 0.00 175.10 175.53 2ols s ILE 7 N 0.24 1.31 0.23 2.22 1.01 0.07 -4.98 121.20 121.30 2ols s ILE 7 Ca -0.11 -0.64 -0.30 0.00 0.00 0.00 0.00 60.65 59.60 2ols s ILE 7 Cb -0.16 -1.14 -0.09 0.00 0.01 0.00 0.00 42.46 41.08 2ols s ILE 7 CO 0.06 0.38 1.15 0.26 0.00 0.00 0.00 174.94 176.80 2ols s TRP 8 N 0.16 3.49 0.24 3.97 0.52 -1.26 -0.13 118.94 125.93 2ols s TRP 8 Ca -0.06 1.56 -0.07 0.00 0.02 0.00 0.00 56.10 57.55 2ols s TRP 8 Cb -0.12 -3.36 0.42 0.00 -1.15 0.00 0.00 33.47 29.26 2ols s TRP 8 CO 0.02 -0.90 1.67 0.74 0.02 0.00 0.00 176.95 178.51 2ols h PHE 9 N 4.57 0.15 0.00 -1.98 0.04 -1.82 0.14 116.94 118.05 2ols h PHE 9 Ca -0.46 0.05 0.00 0.00 2.80 0.00 0.00 57.97 60.36 2ols h PHE 9 Cb 1.21 0.04 0.00 0.00 2.20 0.00 0.00 35.95 39.41 2ols h PHE 9 CO 0.61 -0.13 0.12 1.05 -0.60 0.00 0.00 178.31 179.36 2ols h GLU 10 N 0.21 0.00 -0.72 1.51 4.11 -1.87 0.21 114.58 118.03 2ols h GLU 10 Ca 0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.82 2ols h GLU 10 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 2ols h GLU 10 CO -0.54 0.00 0.00 0.09 0.07 0.00 0.00 179.01 178.63 2ols n ASN 11 N -2.85 3.91 -4.83 3.06 3.02 0.49 -4.69 115.26 113.36 2ols n ASN 11 Ca -0.02 -2.00 -0.25 0.00 -0.03 0.00 0.00 54.58 52.28 2ols n ASN 11 Cb 0.18 -0.48 -0.05 0.00 -0.61 0.00 0.00 39.78 38.82 2ols n ASN 11 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2ols s LEU 12 N -1.02 3.91 0.29 3.41 1.43 0.75 -4.96 118.68 122.48 2ols s LEU 12 Ca 0.49 -0.11 0.01 0.00 -1.03 0.00 0.00 54.13 53.49 2ols s LEU 12 Cb 0.25 -2.49 -0.02 0.00 0.03 0.00 0.00 46.19 43.96 2ols s LEU 12 CO 0.33 0.03 0.29 -0.13 0.23 0.00 0.00 176.35 177.11 2ols s ARG 13 N -3.36 1.62 0.39 1.70 1.81 -1.26 -3.50 118.95 116.34 2ols s ARG 13 Ca 0.32 -1.80 0.27 0.00 -1.72 0.00 0.00 55.73 52.81 2ols s ARG 13 Cb -0.10 0.35 0.96 0.00 -0.45 0.00 0.00 34.95 35.72 2ols s ARG 13 CO 0.25 -0.61 1.80 1.98 -0.68 0.00 0.00 175.30 178.04 2ols h MET 14 N 2.28 0.00 0.00 3.54 4.05 -1.93 -2.04 114.93 120.82 2ols h MET 14 Ca -0.29 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.13 2ols h MET 14 Cb 1.24 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.04 2ols h MET 14 CO 0.42 0.00 0.00 0.25 0.23 0.00 0.00 176.91 177.81 2ols n THR 15 N -2.71 0.12 -0.61 -0.77 -2.24 -1.26 -3.43 114.28 103.38 2ols n THR 15 Ca 0.03 0.03 0.07 0.00 -2.27 0.00 0.00 64.05 61.91 2ols n THR 15 Cb 0.35 -0.66 0.35 0.00 -2.10 0.00 0.00 70.33 68.27 2ols n THR 15 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2ols n ASP 16 N -1.11 5.01 0.25 3.42 8.00 -0.77 -4.63 116.55 126.72 2ols n ASP 16 Ca 0.15 -2.71 0.13 0.00 0.71 0.00 0.00 54.79 53.07 2ols n ASP 16 Cb 0.12 -0.64 0.79 0.00 -0.02 0.00 0.00 41.12 41.37 2ols n ASP 16 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2ols h VAL 17 N 3.64 0.71 0.00 2.53 2.07 -1.77 -1.01 116.25 122.42 2ols h VAL 17 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2ols h VAL 17 Cb 1.69 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 32.42 2ols h VAL 17 CO 0.38 0.00 -0.27 -0.33 0.02 0.00 0.00 177.57 177.37 2ols h GLU 18 N 0.00 0.00 0.06 1.57 4.39 -1.88 -1.29 114.58 117.43 2ols h GLU 18 Ca 0.03 0.00 -0.36 0.00 0.34 0.00 0.00 59.36 59.37 2ols h GLU 18 Cb 0.13 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.74 2ols h GLU 18 CO -0.00 0.00 -2.05 0.54 -1.16 0.00 0.00 179.01 176.34 2ols n ARG 19 N -2.97 0.69 0.00 2.33 1.74 -0.48 -4.66 116.66 113.31 2ols n ARG 19 Ca 0.03 0.28 0.00 0.00 -0.77 0.00 0.00 57.85 57.39 2ols n ARG 19 Cb 0.53 -1.65 0.00 0.00 -1.02 0.00 0.00 32.46 30.32 2ols n ARG 19 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 2ols n VAL 20 N -3.65 0.04 -0.08 1.55 0.24 -0.61 -0.37 118.33 115.45 2ols n VAL 20 Ca -0.38 -0.50 0.01 0.00 -2.04 0.00 0.00 64.34 61.44 2ols n VAL 20 Cb 0.96 1.03 -0.00 0.00 -1.47 0.00 0.00 33.84 34.35 2ols n VAL 20 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2ols n GLY 21 N -0.02 -2.27 0.33 7.63 0.00 -0.49 -4.22 105.19 106.16 2ols n GLY 21 Ca 0.00 -1.46 -0.06 0.00 0.00 0.00 0.00 46.02 44.51 2ols n GLY 21 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2ols h GLY 22 N -0.07 1.20 0.87 -0.02 0.00 -1.73 -2.29 103.07 101.03 2ols h GLY 22 Ca -0.01 -0.69 -0.01 0.00 0.00 0.00 0.00 47.33 46.62 2ols h GLY 22 CO 0.00 0.65 0.06 0.50 0.00 0.00 0.00 176.54 177.75 2ols h LYS 23 N 1.08 0.25 -0.26 4.80 1.57 -1.87 -1.49 116.57 120.65 2ols h LYS 23 Ca 0.24 -0.05 -0.18 0.00 -1.87 0.00 0.00 60.65 58.78 2ols h LYS 23 Cb 0.29 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 2ols h LYS 23 CO -0.01 0.35 -0.57 -0.91 -0.57 0.00 0.00 179.45 177.75 2ols h ASN 24 N 0.09 0.89 -0.65 0.86 2.35 -1.73 -2.32 115.58 115.08 2ols h ASN 24 Ca 0.05 -0.49 0.01 0.00 -0.55 0.00 0.00 56.30 55.32 2ols h ASN 24 Cb 0.20 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.28 2ols h ASN 24 CO -0.00 1.27 0.43 0.00 -1.65 0.00 0.00 177.43 177.48 2ols h ALA 25 N 0.74 0.83 -0.59 -0.83 0.00 -1.41 -1.61 119.26 116.39 2ols h ALA 25 Ca 0.01 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 2ols h ALA 25 Cb 1.16 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 2ols h ALA 25 CO 0.12 0.25 0.08 1.03 0.00 0.00 0.00 179.25 180.74 2ols h SER 26 N 0.88 0.92 -0.32 0.00 0.87 -1.24 -0.26 113.55 114.41 2ols h SER 26 Ca 0.24 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 2ols h SER 26 Cb -0.10 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 61.60 2ols h SER 26 CO -0.05 0.93 0.21 -0.07 -0.53 0.00 0.00 176.83 177.32 2ols h LEU 27 N 0.91 0.36 -0.65 2.23 4.07 -1.01 -1.21 115.31 120.00 2ols h LEU 27 Ca 0.18 -0.01 -0.07 0.00 0.08 0.00 0.00 57.88 58.06 2ols h LEU 27 Cb 0.41 -0.09 -0.03 0.00 1.08 0.00 0.00 40.66 42.04 2ols h LEU 27 CO 0.01 0.26 0.12 1.23 -1.08 0.00 0.00 178.44 178.98 2ols h GLY 28 N 0.43 1.15 0.83 0.83 0.00 -1.13 -1.16 103.07 104.01 2ols h GLY 28 Ca 0.12 -0.76 0.05 0.00 0.00 0.00 0.00 47.33 46.74 2ols h GLY 28 CO -0.03 0.70 0.65 -2.09 0.00 0.00 0.00 176.54 175.78 2ols h GLU 29 N 0.99 1.20 -0.02 4.80 4.57 -0.84 0.77 114.58 126.05 2ols h GLU 29 Ca 0.20 -0.07 -0.24 0.00 -1.18 0.00 0.00 59.36 58.07 2ols h GLU 29 Cb 0.42 -0.27 0.02 0.00 -0.16 0.00 0.00 28.75 28.76 2ols h GLU 29 CO 0.01 0.79 -0.92 0.52 -1.18 0.00 0.00 179.01 178.23 2ols h MET 30 N 1.23 0.66 -0.10 1.92 2.86 -1.06 -2.37 114.93 118.07 2ols h MET 30 Ca 0.41 -0.68 -0.01 0.00 -2.06 0.00 0.00 59.70 57.36 2ols h MET 30 Cb 0.06 0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.90 2ols h MET 30 CO -0.14 1.27 0.03 0.82 1.06 0.00 0.00 176.91 179.96 2ols h ILE 31 N 0.32 1.16 -0.02 -1.22 2.04 -1.04 -0.10 117.51 118.64 2ols h ILE 31 Ca -0.11 -0.49 -0.13 0.00 1.00 0.00 0.00 64.86 65.13 2ols h ILE 31 Cb 1.58 1.31 -0.02 0.00 -0.74 0.00 0.00 36.82 38.96 2ols h ILE 31 CO 0.18 0.14 -0.58 0.77 0.00 0.00 0.00 178.15 178.67 2ols h SER 32 N -0.02 0.09 0.00 1.72 4.64 -0.94 -3.34 113.55 115.70 2ols h SER 32 Ca 0.03 -0.05 -0.23 0.00 -0.47 0.00 0.00 61.79 61.07 2ols h SER 32 Cb 0.20 -0.03 -0.04 0.00 -0.31 0.00 0.00 62.40 62.22 2ols h SER 32 CO -0.00 0.65 -1.86 0.00 -0.87 0.00 0.00 176.83 174.75 2ols n GLN 33 N -3.86 1.52 -0.00 4.77 1.13 -0.89 -4.81 117.38 115.23 2ols n GLN 33 Ca -0.02 0.02 0.06 0.00 -1.94 0.00 0.00 57.00 55.13 2ols n GLN 33 Cb 0.59 -1.32 -0.07 0.00 0.11 0.00 0.00 30.24 29.55 2ols n GLN 33 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2ols n LEU 34 N -2.61 0.56 -0.26 1.08 4.77 -0.06 -4.49 117.00 116.00 2ols n LEU 34 Ca -0.22 -0.47 0.02 0.00 -0.03 0.00 0.00 56.01 55.30 2ols n LEU 34 Cb 0.87 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 42.20 2ols n LEU 34 CO 0.23 0.14 1.25 0.71 -1.33 0.00 0.00 177.39 178.39 2ols h THR 35 N 0.00 1.16 0.00 -5.08 1.35 -1.65 0.21 112.91 108.90 2ols h THR 35 Ca 0.00 -0.36 -0.03 0.00 -0.55 0.00 0.00 66.41 65.47 2ols h THR 35 Cb 0.31 0.02 -0.00 0.00 -1.73 0.00 0.00 68.15 66.75 2ols h THR 35 CO 0.00 0.19 -0.15 1.05 -0.25 0.00 0.00 175.52 176.36 2ols h GLU 36 N 1.05 0.00 -0.59 4.72 4.11 -1.86 -1.11 114.58 120.90 2ols h GLU 36 Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.75 2ols h GLU 36 Cb -0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.23 2ols h GLU 36 CO -0.09 0.15 0.00 1.63 0.07 0.00 0.00 179.01 180.78 2ols n LYS 37 N -4.33 1.41 -0.12 1.06 5.02 0.69 -4.92 118.16 116.97 2ols n LYS 37 Ca -0.03 -0.40 0.00 0.00 -2.02 0.00 0.00 58.31 55.86 2ols n LYS 37 Cb 0.22 -1.39 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 2ols n LYS 37 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ols n GLY 38 N 0.32 0.71 3.72 0.72 0.00 -0.42 -5.04 105.19 105.20 2ols n GLY 38 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 2ols n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ols s VAL 39 N -2.38 4.57 -0.32 1.61 1.01 -1.09 -5.00 120.40 118.79 2ols s VAL 39 Ca 0.00 1.94 -0.05 0.00 0.00 0.00 0.00 61.98 63.88 2ols s VAL 39 Cb 0.00 -4.24 0.04 0.00 0.00 0.00 0.00 36.38 32.18 2ols s VAL 39 CO 0.00 0.21 0.06 -0.13 0.00 0.00 0.00 175.10 175.24 2ols s ARG 40 N 0.62 2.57 -0.07 2.72 0.52 -1.26 -3.96 118.95 120.09 2ols s ARG 40 Ca 0.51 -1.20 0.06 0.00 -0.52 0.00 0.00 55.73 54.58 2ols s ARG 40 Cb -0.24 -3.34 -0.01 0.00 0.52 0.00 0.00 34.95 31.89 2ols s ARG 40 CO 0.29 -0.64 -0.24 0.54 0.02 0.00 0.00 175.30 175.28 2ols s VAL 41 N 1.35 2.00 0.46 3.52 0.11 -1.26 -0.75 120.40 125.82 2ols s VAL 41 Ca -0.03 -1.03 -0.24 0.00 -2.93 0.00 0.00 61.98 57.76 2ols s VAL 41 Cb -0.19 -1.70 -0.07 0.00 -1.53 0.00 0.00 36.38 32.88 2ols s VAL 41 CO 0.01 0.55 1.26 -2.84 -3.33 0.00 0.00 175.10 170.75 2ols s PRO 42 N -0.04 3.70 0.95 1.54 0.02 -1.26 -5.01 135.00 134.91 2ols s PRO 42 Ca -0.07 2.02 -0.15 0.00 0.02 0.00 0.00 61.00 62.82 2ols s PRO 42 Cb -0.14 -2.51 0.18 0.00 0.02 0.00 0.00 34.50 32.05 2ols s PRO 42 CO 0.05 -0.67 1.27 0.20 -0.33 0.00 0.00 177.00 177.52 2ols s GLY 43 N -1.04 1.72 0.00 0.52 0.00 -1.26 -4.74 107.32 102.52 2ols s GLY 43 Ca 0.63 -1.04 0.00 0.00 0.00 0.00 0.00 44.72 44.31 2ols s GLY 43 CO 0.43 -0.33 0.00 0.61 0.00 0.00 0.00 173.10 173.81 2ols n GLY 44 N -3.37 -0.33 3.23 0.20 0.00 -1.26 -1.37 105.19 102.29 2ols n GLY 44 Ca 0.13 -1.10 -0.10 0.00 0.00 0.00 0.00 46.02 44.95 2ols n GLY 44 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2ols s PHE 45 N -3.31 0.01 0.03 1.61 -0.12 -0.70 -2.37 117.98 113.13 2ols s PHE 45 Ca 0.00 -0.29 0.08 0.00 -0.05 0.00 0.00 56.93 56.67 2ols s PHE 45 Cb 0.00 0.03 -0.03 0.00 -0.63 0.00 0.00 43.02 42.39 2ols s PHE 45 CO 0.00 -0.52 -0.22 0.00 -0.05 0.00 0.00 175.22 174.43 2ols s ALA 46 N -3.13 2.41 0.55 1.99 0.00 0.82 -0.25 121.76 124.14 2ols s ALA 46 Ca -0.01 -1.20 -0.08 0.00 0.00 0.00 0.00 51.96 50.67 2ols s ALA 46 Cb 0.01 -0.63 -0.04 0.00 0.00 0.00 0.00 23.12 22.47 2ols s ALA 46 CO -0.07 0.55 0.91 0.95 0.00 0.00 0.00 175.76 178.10 2ols s THR 47 N -0.83 4.80 0.33 0.00 -4.23 -0.51 -0.75 115.64 114.44 2ols s THR 47 Ca 0.13 0.56 0.08 0.00 -1.18 0.00 0.00 61.69 61.28 2ols s THR 47 Cb -0.10 -3.86 -0.03 0.00 1.34 0.00 0.00 72.50 69.84 2ols s THR 47 CO 0.03 -0.99 0.21 0.42 -0.54 0.00 0.00 174.62 173.75 2ols s THR 48 N -2.95 3.42 0.31 3.99 -4.23 -0.67 -4.20 115.64 111.31 2ols s THR 48 Ca 0.51 -1.53 0.00 0.00 -1.18 0.00 0.00 61.69 59.50 2ols s THR 48 Cb -0.11 -3.11 0.27 0.00 1.34 0.00 0.00 72.50 70.90 2ols s THR 48 CO 0.49 -0.20 1.94 0.00 -0.54 0.00 0.00 174.62 176.31 2ols h ALA 49 N 1.42 1.50 0.00 3.99 0.00 -0.96 -1.91 119.26 123.29 2ols h ALA 49 Ca -0.45 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.33 2ols h ALA 49 Cb 1.25 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2ols h ALA 49 CO 0.61 0.41 -0.47 1.05 0.00 0.00 0.00 179.25 180.85 2ols h GLU 50 N 1.03 0.00 -0.47 0.00 4.11 -1.87 -1.73 114.58 115.64 2ols h GLU 50 Ca 0.34 0.00 0.05 0.00 0.07 0.00 0.00 59.36 59.82 2ols h GLU 50 Cb 0.07 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.28 2ols h GLU 50 CO -0.11 0.47 0.21 0.00 0.07 0.00 0.00 179.01 179.65 2ols h ALA 51 N 1.53 0.59 -0.61 1.06 0.00 -1.62 -1.44 119.26 118.78 2ols h ALA 51 Ca -0.00 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2ols h ALA 51 Cb 1.02 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2ols h ALA 51 CO 0.06 -0.15 0.14 -0.92 0.00 0.00 0.00 179.25 178.38 2ols h TYR 52 N 0.42 1.03 -0.73 0.00 3.20 -1.13 -1.15 116.97 118.60 2ols h TYR 52 Ca 0.21 -0.13 -0.06 0.00 3.14 0.00 0.00 58.73 61.90 2ols h TYR 52 Cb 0.16 -0.29 -0.03 0.00 1.54 0.00 0.00 36.73 38.11 2ols h TYR 52 CO -0.12 0.87 0.23 0.00 -1.64 0.00 0.00 178.16 177.50 2ols h ARG 53 N 0.89 1.13 -0.04 1.82 2.47 -1.24 -1.03 114.38 118.37 2ols h ARG 53 Ca 0.19 -0.24 -0.01 0.00 -1.26 0.00 0.00 59.98 58.66 2ols h ARG 53 Cb 0.36 -0.17 -0.00 0.00 -1.65 0.00 0.00 29.97 28.52 2ols h ARG 53 CO 0.00 0.96 -0.02 0.00 0.56 0.00 0.00 179.97 181.47 2ols h ALA 54 N 1.16 0.06 -0.57 0.04 0.00 -1.06 -1.41 119.26 117.47 2ols h ALA 54 Ca 0.24 -0.21 0.11 0.00 0.00 0.00 0.00 54.91 55.04 2ols h ALA 54 Cb 0.30 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.99 2ols h ALA 54 CO -0.01 -0.22 0.07 0.35 0.00 0.00 0.00 179.25 179.45 2ols h PHE 55 N -0.28 0.10 0.00 0.00 3.57 -1.15 -2.76 116.94 116.41 2ols h PHE 55 Ca 0.01 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.55 2ols h PHE 55 Cb 0.43 0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.21 2ols h PHE 55 CO 0.06 -0.08 0.00 1.25 -2.23 0.00 0.00 178.31 177.31 2ols h LEU 56 N 0.19 0.00 -1.52 0.59 5.85 -1.08 -3.10 115.31 116.24 2ols h LEU 56 Ca 0.30 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.02 2ols h LEU 56 Cb 0.45 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.48 2ols h LEU 56 CO -0.43 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 177.67 2ols h ALA 57 N 2.27 1.00 -1.16 1.25 0.00 -0.94 0.13 119.26 121.80 2ols h ALA 57 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.33 2ols h ALA 57 Cb 0.76 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2ols h ALA 57 CO 0.00 0.00 1.53 1.58 0.00 0.00 0.00 179.25 182.36 2ols n HIS 58 N -2.67 1.45 -2.64 0.00 -0.00 -1.17 -3.90 115.22 106.29 2ols n HIS 58 Ca -0.00 0.21 -0.16 0.00 -0.00 0.00 0.00 57.72 57.76 2ols n HIS 58 Cb 0.18 -2.56 0.02 0.00 -0.00 0.00 0.00 29.99 27.63 2ols n HIS 58 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 2ols n ASN 59 N 11.69 -4.90 -4.30 0.26 4.13 -1.26 -0.28 115.26 120.61 2ols n ASN 59 Ca 0.42 -0.15 -0.45 0.00 1.68 0.00 0.00 54.58 56.08 2ols n ASN 59 Cb 0.31 -3.84 -0.05 0.00 -1.54 0.00 0.00 39.78 34.65 2ols n ASN 59 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 2ols s GLY 60 N -2.61 2.30 0.33 7.41 0.00 -1.25 -5.02 107.32 108.47 2ols s GLY 60 Ca 0.15 -2.84 0.11 0.00 0.00 0.00 0.00 44.72 42.14 2ols s GLY 60 CO 0.18 1.21 1.62 -2.00 0.00 0.00 0.00 173.10 174.11 2ols h LEU 61 N 8.39 0.13 -0.81 0.66 5.85 -0.69 -2.16 115.31 126.67 2ols h LEU 61 Ca -0.14 0.23 0.14 0.00 0.84 0.00 0.00 57.88 58.95 2ols h LEU 61 Cb 1.07 0.28 -0.09 0.00 0.37 0.00 0.00 40.66 42.29 2ols h LEU 61 CO 0.91 -0.27 0.40 -1.28 -0.34 0.00 0.00 178.44 177.85 2ols h SER 62 N 0.14 0.47 1.29 1.25 0.87 -0.99 -0.39 113.55 116.19 2ols h SER 62 Ca 0.70 0.09 -0.13 0.00 -1.23 0.00 0.00 61.79 61.21 2ols h SER 62 Cb 1.61 0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 63.57 2ols h SER 62 CO -0.73 0.20 -0.72 1.05 -0.53 0.00 0.00 176.83 176.10 2ols h GLU 63 N 0.58 0.00 -0.34 2.24 9.09 -1.69 -1.93 114.58 122.54 2ols h GLU 63 Ca 0.44 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.82 2ols h GLU 63 Cb 0.61 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.70 2ols h GLU 63 CO -0.36 0.56 0.11 -0.09 0.05 0.00 0.00 179.01 179.28 2ols h ARG 64 N 0.00 0.53 0.55 1.06 2.43 -1.12 0.05 114.38 117.89 2ols h ARG 64 Ca -0.03 -0.11 -0.02 0.00 -0.81 0.00 0.00 59.98 59.01 2ols h ARG 64 Cb 1.49 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.95 2ols h ARG 64 CO 0.07 0.55 -0.41 0.82 -1.51 0.00 0.00 179.97 179.49 2ols h ILE 65 N 0.40 0.17 -1.05 1.20 2.04 -1.08 -2.18 117.51 117.00 2ols h ILE 65 Ca 0.11 0.00 0.28 0.00 1.00 0.00 0.00 64.86 66.25 2ols h ILE 65 Cb 0.24 0.17 -0.09 0.00 -0.74 0.00 0.00 36.82 36.40 2ols h ILE 65 CO -0.00 0.00 0.69 -1.28 0.00 0.00 0.00 178.15 177.56 2ols h SER 66 N -0.94 0.37 -0.29 1.72 0.87 -1.36 -0.53 113.55 113.40 2ols h SER 66 Ca -0.06 0.07 -0.08 0.00 -1.23 0.00 0.00 61.79 60.48 2ols h SER 66 Cb 0.79 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.75 2ols h SER 66 CO 0.02 0.07 -0.15 0.00 -0.53 0.00 0.00 176.83 176.24 2ols h ALA 67 N 1.59 0.41 0.10 6.23 0.00 -0.63 -2.33 119.26 124.64 2ols h ALA 67 Ca 0.58 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 2ols h ALA 67 Cb 1.61 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.30 2ols h ALA 67 CO -0.25 0.30 -0.05 0.00 0.00 0.00 0.00 179.25 179.26 2ols h ALA 68 N 0.75 -0.14 -0.59 0.00 0.00 -0.57 -2.96 119.26 115.75 2ols h ALA 68 Ca 0.06 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 54.88 2ols h ALA 68 Cb 0.67 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 2ols h ALA 68 CO 0.04 -0.41 0.39 -0.07 0.00 0.00 0.00 179.25 179.21 2ols h LEU 69 N -0.47 0.42 0.00 0.00 4.07 -1.26 -3.03 115.31 115.05 2ols h LEU 69 Ca -0.01 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.95 2ols h LEU 69 Cb 0.39 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.04 2ols h LEU 69 CO 0.02 0.26 0.00 0.00 -1.08 0.00 0.00 178.44 177.65 2ols n ALA 70 N -2.50 -0.19 -2.73 1.53 0.00 -0.88 -3.69 120.51 112.06 2ols n ALA 70 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.10 2ols n ALA 70 Cb 0.31 0.18 -0.00 0.00 0.00 0.00 0.00 19.45 19.93 2ols n ALA 70 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2ols s LYS 71 N -2.30 4.00 -0.30 0.00 -2.85 -1.14 -4.85 119.74 112.31 2ols s LYS 71 Ca 0.00 -2.18 -0.13 0.00 -1.00 0.00 0.00 55.97 52.66 2ols s LYS 71 Cb 0.00 -5.33 0.14 0.00 -2.06 0.00 0.00 37.83 30.58 2ols s LYS 71 CO 0.00 -2.05 0.81 -1.17 0.10 0.00 0.00 175.35 173.03 2ols s LEU 72 N 3.19 -0.85 -0.51 2.77 1.98 -1.24 -4.89 118.68 119.13 2ols s LEU 72 Ca 0.49 1.22 -0.28 0.00 -2.89 0.00 0.00 54.13 52.67 2ols s LEU 72 Cb 0.01 2.04 0.03 0.00 0.66 0.00 0.00 46.19 48.93 2ols s LEU 72 CO 0.04 -0.18 1.09 -0.62 -1.89 0.00 0.00 176.35 174.79 2ols s ASP 73 N 2.37 6.52 0.41 3.68 -1.08 -1.26 -4.91 116.67 122.40 2ols s ASP 73 Ca -0.06 0.21 0.29 0.00 -0.52 0.00 0.00 52.55 52.47 2ols s ASP 73 Cb -0.08 -2.52 1.31 0.00 -1.46 0.00 0.00 42.92 40.17 2ols s ASP 73 CO -0.18 -1.27 1.87 1.62 0.52 0.00 0.00 175.17 177.72 2ols h VAL 74 N 6.16 0.00 -0.53 1.11 3.04 -1.98 -0.85 116.25 123.20 2ols h VAL 74 Ca -0.24 -0.26 -0.01 0.00 -1.01 0.00 0.00 66.70 65.18 2ols h VAL 74 Cb 1.06 1.07 -0.01 0.00 -2.01 0.00 0.00 31.29 31.40 2ols h VAL 74 CO 1.12 0.00 0.01 1.21 -1.01 0.00 0.00 177.57 178.90 2ols n GLU 75 N -2.61 4.54 -3.83 4.17 4.07 -1.26 -4.62 120.64 121.10 2ols n GLU 75 Ca 0.00 -3.12 -0.36 0.00 -0.06 0.00 0.00 57.16 53.62 2ols n GLU 75 Cb 0.21 -2.20 -0.13 0.00 -0.06 0.00 0.00 31.44 29.25 2ols n GLU 75 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 2ols s ASP 76 N -0.99 5.10 0.28 4.31 3.68 -0.33 -5.00 116.67 123.72 2ols s ASP 76 Ca 0.53 -1.27 0.19 0.00 2.13 0.00 0.00 52.55 54.12 2ols s ASP 76 Cb 0.41 -1.79 0.10 0.00 -1.45 0.00 0.00 42.92 40.19 2ols s ASP 76 CO 0.15 -0.31 1.33 1.62 0.13 0.00 0.00 175.17 178.09 2ols h VAL 77 N 6.34 0.42 0.57 1.11 3.04 -1.83 -2.47 116.25 123.42 2ols h VAL 77 Ca -0.21 -1.64 -0.03 0.00 -1.01 0.00 0.00 66.70 63.81 2ols h VAL 77 Cb 1.07 2.10 0.01 0.00 -2.01 0.00 0.00 31.29 32.45 2ols h VAL 77 CO 0.57 0.24 -0.27 0.00 -1.01 0.00 0.00 177.57 177.10 2ols h ALA 78 N 1.71 -1.08 -0.82 3.17 0.00 -1.94 -2.70 119.26 117.60 2ols h ALA 78 Ca -0.03 -0.17 0.21 0.00 0.00 0.00 0.00 54.91 54.92 2ols h ALA 78 Cb 1.25 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 19.28 2ols h ALA 78 CO 0.03 -1.02 0.57 1.49 0.00 0.00 0.00 179.25 180.32 2ols h GLU 79 N -0.84 0.19 0.07 0.00 4.57 -1.80 0.49 114.58 117.25 2ols h GLU 79 Ca -0.08 -0.01 -0.24 0.00 -1.18 0.00 0.00 59.36 57.85 2ols h GLU 79 Cb 0.58 -0.04 0.02 0.00 -0.16 0.00 0.00 28.75 29.15 2ols h GLU 79 CO 0.13 0.13 -0.99 1.25 -1.18 0.00 0.00 179.01 178.34 2ols h LEU 80 N 0.20 0.75 -0.91 1.64 5.85 -1.49 0.17 115.31 121.52 2ols h LEU 80 Ca 0.41 -0.81 -0.02 0.00 0.84 0.00 0.00 57.88 58.30 2ols h LEU 80 Cb 1.30 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 42.05 2ols h LEU 80 CO -0.08 1.48 0.46 0.00 -0.34 0.00 0.00 178.44 179.96 2ols h ALA 81 N 0.29 1.16 0.09 1.25 0.00 -0.87 -0.84 119.26 120.34 2ols h ALA 81 Ca -0.14 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 2ols h ALA 81 Cb 1.69 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2ols h ALA 81 CO 0.19 0.66 -0.04 -0.09 0.00 0.00 0.00 179.25 179.97 2ols h ARG 82 N 1.24 -0.12 -0.46 0.00 2.43 -0.63 -2.53 114.38 114.31 2ols h ARG 82 Ca 0.31 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.46 2ols h ARG 82 Cb 0.05 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 2ols h ARG 82 CO -0.05 0.28 0.19 0.28 -1.51 0.00 0.00 179.97 179.16 2ols h VAL 83 N -0.55 1.21 -0.43 0.20 2.07 -0.73 -2.57 116.25 115.45 2ols h VAL 83 Ca -0.01 -0.63 0.06 0.00 0.82 0.00 0.00 66.70 66.93 2ols h VAL 83 Cb 0.45 0.76 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 2ols h VAL 83 CO 0.02 0.24 0.12 1.23 0.02 0.00 0.00 177.57 179.20 2ols h GLY 84 N 0.61 0.54 1.43 2.17 0.00 -1.19 -0.64 103.07 105.99 2ols h GLY 84 Ca 0.15 -0.06 -0.04 0.00 0.00 0.00 0.00 47.33 47.39 2ols h GLY 84 CO -0.01 -0.01 0.14 1.70 0.00 0.00 0.00 176.54 178.36 2ols h LYS 85 N 0.28 0.73 -0.02 4.80 3.64 -1.39 -0.87 116.57 123.72 2ols h LYS 85 Ca 0.21 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 2ols h LYS 85 Cb 0.22 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2ols h LYS 85 CO -0.24 0.64 -0.01 1.49 -2.27 0.00 0.00 179.45 179.07 2ols h GLU 86 N 0.71 0.05 -0.06 1.90 4.81 -0.97 -1.89 114.58 119.13 2ols h GLU 86 Ca 0.16 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.39 2ols h GLU 86 Cb 0.23 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.59 2ols h GLU 86 CO -0.01 0.41 -0.02 0.82 -0.73 0.00 0.00 179.01 179.48 2ols h ILE 87 N -0.32 0.92 -0.27 2.32 2.04 -0.93 -2.40 117.51 118.88 2ols h ILE 87 Ca 0.01 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.91 2ols h ILE 87 Cb 0.39 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 2ols h ILE 87 CO 0.00 0.00 0.18 0.03 0.00 0.00 0.00 178.15 178.37 2ols h ARG 88 N -0.01 0.15 0.00 2.37 3.08 -1.12 -1.60 114.38 117.24 2ols h ARG 88 Ca 0.03 -0.01 -0.15 0.00 0.07 0.00 0.00 59.98 59.92 2ols h ARG 88 Cb 0.06 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 2ols h ARG 88 CO -0.07 0.10 -0.73 0.37 -1.07 0.00 0.00 179.97 178.57 2ols h GLN 89 N 0.15 0.00 -0.25 0.04 5.75 -0.89 -2.09 115.11 117.81 2ols h GLN 89 Ca 0.12 0.00 -0.07 0.00 -0.15 0.00 0.00 58.65 58.55 2ols h GLN 89 Cb 0.28 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 2ols h GLN 89 CO -0.02 0.73 -0.11 -1.49 -2.65 0.00 0.00 178.83 175.29 2ols h TRP 90 N 0.00 0.59 -0.62 3.99 6.55 -0.84 0.25 115.95 125.87 2ols h TRP 90 Ca -0.01 -0.14 -0.01 0.00 0.95 0.00 0.00 58.89 59.68 2ols h TRP 90 Cb 1.37 -0.14 -0.03 0.00 -0.86 0.00 0.00 29.16 29.50 2ols h TRP 90 CO 0.00 0.77 0.35 0.82 -1.05 0.00 0.00 178.44 179.33 2ols h ILE 91 N 0.24 1.19 -0.81 1.49 2.04 -1.42 -1.08 117.51 119.17 2ols h ILE 91 Ca 0.06 -0.46 -0.04 0.00 1.00 0.00 0.00 64.86 65.41 2ols h ILE 91 Cb 0.60 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 37.02 2ols h ILE 91 CO 0.03 0.20 0.33 -0.07 0.00 0.00 0.00 178.15 178.65 2ols h LEU 92 N 0.84 1.10 -1.09 1.44 4.07 -1.26 -2.26 115.31 118.16 2ols h LEU 92 Ca 0.22 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 58.01 2ols h LEU 92 Cb 0.02 -0.29 0.00 0.00 1.08 0.00 0.00 40.66 41.47 2ols h LEU 92 CO -0.04 0.97 0.00 0.47 -1.08 0.00 0.00 178.44 178.76 2ols n ASP 93 N -4.28 1.59 -4.71 -0.43 8.00 0.06 -4.82 116.55 111.96 2ols n ASP 93 Ca 0.07 -1.96 -0.36 0.00 0.71 0.00 0.00 54.79 53.26 2ols n ASP 93 Cb 0.18 -0.19 -0.08 0.00 -0.02 0.00 0.00 41.12 41.01 2ols n ASP 93 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2ols s THR 94 N -1.62 5.38 0.55 -3.53 2.01 -0.43 -5.01 115.64 112.98 2ols s THR 94 Ca 0.22 0.23 -0.16 0.00 0.31 0.00 0.00 61.69 62.28 2ols s THR 94 Cb 0.11 -3.50 -0.06 0.00 0.01 0.00 0.00 72.50 69.07 2ols s THR 94 CO 0.15 0.41 1.02 -2.16 -0.69 0.00 0.00 174.62 173.35 2ols s PRO 95 N 0.56 3.67 0.30 4.92 0.04 -1.26 -4.97 135.00 138.25 2ols s PRO 95 Ca 0.09 1.07 -0.29 0.00 0.04 0.00 0.00 61.00 61.90 2ols s PRO 95 Cb -0.12 -2.09 -0.10 0.00 0.04 0.00 0.00 34.50 32.23 2ols s PRO 95 CO 0.00 -0.51 1.29 -0.06 0.04 0.00 0.00 177.00 177.77 2ols s PHE 96 N -2.55 3.14 0.86 0.56 0.08 -1.26 -4.98 117.98 113.83 2ols s PHE 96 Ca 0.61 1.38 -0.13 0.00 0.12 0.00 0.00 56.93 58.92 2ols s PHE 96 Cb -0.13 -3.63 0.07 0.00 -0.57 0.00 0.00 43.02 38.76 2ols s PHE 96 CO 0.34 -1.78 0.91 -2.30 -0.10 0.00 0.00 175.22 172.29 2ols n PRO 97 N 1.27 -0.08 0.02 0.24 -0.02 -1.26 -4.75 135.00 130.42 2ols n PRO 97 Ca 0.01 0.04 -0.01 0.00 -2.02 0.00 0.00 63.50 61.52 2ols n PRO 97 Cb 0.42 -2.21 0.26 0.00 -0.02 0.00 0.00 33.50 31.95 2ols n PRO 97 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2ols h GLU 98 N -1.25 0.47 -0.04 -0.52 4.57 -2.00 -1.42 114.58 114.40 2ols h GLU 98 Ca -0.45 -0.14 -0.21 0.00 -1.18 0.00 0.00 59.36 57.39 2ols h GLU 98 Cb 1.29 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.83 2ols h GLU 98 CO 0.41 0.60 -0.86 0.37 -1.18 0.00 0.00 179.01 178.36 2ols h GLN 99 N 0.44 0.43 -0.34 1.92 4.15 -1.99 -2.04 115.11 117.67 2ols h GLN 99 Ca 0.08 -0.42 -0.07 0.00 0.77 0.00 0.00 58.65 59.02 2ols h GLN 99 Cb 0.50 0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.28 2ols h GLN 99 CO 0.03 1.07 -0.05 1.25 -1.93 0.00 0.00 178.83 179.20 2ols h LEU 100 N 0.26 0.63 -0.04 -2.39 5.85 -1.76 -2.03 115.31 115.85 2ols h LEU 100 Ca -0.06 -0.34 0.01 0.00 0.84 0.00 0.00 57.88 58.33 2ols h LEU 100 Cb 1.48 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.32 2ols h LEU 100 CO 0.15 0.82 -0.02 0.44 -0.34 0.00 0.00 178.44 179.49 2ols h ASP 101 N 0.43 -0.07 -0.85 1.25 3.32 -1.28 -1.24 116.42 117.98 2ols h ASP 101 Ca 0.09 0.02 0.04 0.00 0.02 0.00 0.00 57.03 57.19 2ols h ASP 101 Cb 0.53 0.04 -0.05 0.00 0.22 0.00 0.00 39.33 40.07 2ols h ASP 101 CO 0.03 -0.03 0.56 0.00 -1.72 0.00 0.00 179.24 178.08 2ols h ALA 102 N 1.01 1.47 0.01 3.45 0.00 -1.36 -0.69 119.26 123.15 2ols h ALA 102 Ca 0.02 -0.04 -0.26 0.00 0.00 0.00 0.00 54.91 54.64 2ols h ALA 102 Cb 0.06 -0.30 0.02 0.00 0.00 0.00 0.00 17.79 17.56 2ols h ALA 102 CO -0.05 0.44 -1.02 0.93 0.00 0.00 0.00 179.25 179.55 2ols h GLU 103 N 1.06 0.59 0.07 0.00 5.08 -1.19 -1.23 114.58 118.96 2ols h GLU 103 Ca 0.34 -0.65 -0.00 0.00 -1.00 0.00 0.00 59.36 58.04 2ols h GLU 103 Cb 0.03 0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2ols h GLU 103 CO -0.10 1.25 -0.04 0.82 -1.00 0.00 0.00 179.01 179.95 2ols h ILE 104 N 0.33 0.96 -0.96 3.13 2.04 -1.10 -2.20 117.51 119.70 2ols h ILE 104 Ca -0.12 -0.09 0.12 0.00 1.00 0.00 0.00 64.86 65.77 2ols h ILE 104 Cb 1.67 1.02 -0.08 0.00 -0.74 0.00 0.00 36.82 38.68 2ols h ILE 104 CO 0.19 0.02 0.59 -0.08 0.00 0.00 0.00 178.15 178.87 2ols h GLU 105 N -0.14 0.89 -0.04 2.37 4.81 -1.03 0.13 114.58 121.58 2ols h GLU 105 Ca -0.01 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 59.03 2ols h GLU 105 Cb 0.11 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 2ols h GLU 105 CO 0.02 0.59 -0.62 0.00 -0.73 0.00 0.00 179.01 178.27 2ols h ALA 106 N 1.53 0.91 0.01 2.92 0.00 -1.05 -0.29 119.26 123.29 2ols h ALA 106 Ca 0.48 -0.55 -0.18 0.00 0.00 0.00 0.00 54.91 54.66 2ols h ALA 106 Cb 0.51 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.22 2ols h ALA 106 CO -0.28 0.75 -0.73 0.00 0.00 0.00 0.00 179.25 179.00 2ols h ALA 107 N 1.28 0.07 -0.36 0.00 0.00 -0.75 -2.62 119.26 116.87 2ols h ALA 107 Ca -0.01 -0.61 0.06 0.00 0.00 0.00 0.00 54.91 54.36 2ols h ALA 107 Cb 1.11 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.89 2ols h ALA 107 CO 0.09 0.43 0.02 2.35 0.00 0.00 0.00 179.25 182.13 2ols h TRP 108 N -0.01 0.01 0.00 0.00 2.91 -0.70 -2.29 115.95 115.87 2ols h TRP 108 Ca -0.09 0.03 -0.01 0.00 1.13 0.00 0.00 58.89 59.94 2ols h TRP 108 Cb 1.43 0.05 -0.00 0.00 -0.51 0.00 0.00 29.16 30.13 2ols h TRP 108 CO 0.14 -0.05 -0.07 -0.91 -1.03 0.00 0.00 178.44 176.52 2ols h ASN 109 N 0.12 0.00 0.26 2.65 2.35 -1.00 -2.30 115.58 117.66 2ols h ASN 109 Ca 0.18 0.00 -0.30 0.00 -0.55 0.00 0.00 56.30 55.63 2ols h ASN 109 Cb 0.24 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.63 2ols h ASN 109 CO -0.28 0.07 -1.26 0.50 -1.65 0.00 0.00 177.43 174.81 2ols h LYS 110 N 0.00 0.53 -0.31 0.81 3.64 -1.09 -2.58 116.57 117.57 2ols h LYS 110 Ca -0.00 -0.76 0.06 0.00 -1.27 0.00 0.00 60.65 58.68 2ols h LYS 110 Cb 0.14 0.26 -0.06 0.00 -0.41 0.00 0.00 32.23 32.16 2ols h LYS 110 CO 0.01 1.34 -0.10 0.52 -2.27 0.00 0.00 179.45 178.95 2ols h MET 111 N 0.22 -0.03 0.00 1.90 2.86 -1.06 0.17 114.93 118.99 2ols h MET 111 Ca -0.18 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.40 2ols h MET 111 Cb 1.94 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 33.60 2ols h MET 111 CO 0.23 -0.02 -0.29 -0.39 1.06 0.00 0.00 176.91 177.50 2ols h VAL 112 N -0.03 0.93 -0.27 -2.22 -1.51 -1.49 -0.98 116.25 110.68 2ols h VAL 112 Ca 0.15 -1.12 -0.13 0.00 -1.23 0.00 0.00 66.70 64.37 2ols h VAL 112 Cb 0.27 1.66 -0.00 0.00 -2.13 0.00 0.00 31.29 31.08 2ols h VAL 112 CO -0.34 0.29 -0.35 0.00 -1.23 0.00 0.00 177.57 175.94 2ols h ALA 113 N 1.71 0.40 -0.18 5.19 0.00 -1.09 -3.17 119.26 122.11 2ols h ALA 113 Ca -0.00 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 2ols h ALA 113 Cb 0.64 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2ols h ALA 113 CO 0.04 0.47 -0.10 -0.44 0.00 0.00 0.00 179.25 179.22 2ols h ASP 114 N 0.44 0.26 -0.30 0.00 3.32 -0.13 -2.43 116.42 117.58 2ols h ASP 114 Ca 0.03 -0.05 -0.20 0.00 0.02 0.00 0.00 57.03 56.83 2ols h ASP 114 Cb 0.94 -0.07 -0.09 0.00 0.22 0.00 0.00 39.33 40.33 2ols h ASP 114 CO 0.08 0.40 0.26 0.00 -1.72 0.00 0.00 179.24 178.26 2ols n ALA 115 N -2.49 4.65 0.00 3.45 0.00 -0.42 -4.91 120.51 120.79 2ols n ALA 115 Ca -0.00 -1.02 0.00 0.00 0.00 0.00 0.00 53.44 52.42 2ols n ALA 115 Cb 0.25 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2ols n ALA 115 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ols n GLY 116 N 0.76 -0.22 0.00 0.00 0.00 -0.92 -4.08 105.19 100.73 2ols n GLY 116 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2ols n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ols n GLY 117 N 0.00 0.93 3.59 -0.02 0.00 -1.26 -4.80 105.19 103.64 2ols n GLY 117 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 2ols n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ols s ALA 118 N -3.51 -2.05 -1.20 4.61 0.00 -1.21 -4.53 121.76 113.87 2ols s ALA 118 Ca 0.00 1.57 -0.07 0.00 0.00 0.00 0.00 51.96 53.46 2ols s ALA 118 Cb 0.00 -0.16 0.22 0.00 0.00 0.00 0.00 23.12 23.18 2ols s ALA 118 CO 0.00 -0.57 1.75 -3.47 0.00 0.00 0.00 175.76 173.47 2ols n ASP 119 N -0.04 5.79 -4.77 0.00 -0.08 -1.26 -4.88 116.55 111.30 2ols n ASP 119 Ca -0.01 -3.25 -0.33 0.00 -1.51 0.00 0.00 54.79 49.70 2ols n ASP 119 Cb 0.58 -1.39 0.05 0.00 2.34 0.00 0.00 41.12 42.71 2ols n ASP 119 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 2ols s ILE 120 N -1.03 3.32 0.33 5.18 -4.36 -1.26 -5.08 121.20 118.30 2ols s ILE 120 Ca 0.37 0.58 0.10 0.00 -0.26 0.00 0.00 60.65 61.43 2ols s ILE 120 Cb 0.09 -3.10 -0.06 0.00 1.25 0.00 0.00 42.46 40.64 2ols s ILE 120 CO 0.04 -0.42 -0.10 -0.94 0.24 0.00 0.00 174.94 173.76 2ols s SER 121 N -2.76 3.77 0.05 4.36 1.04 -1.26 -4.58 113.70 114.31 2ols s SER 121 Ca 0.65 -1.13 -0.00 0.00 0.48 0.00 0.00 55.95 55.95 2ols s SER 121 Cb -0.19 -0.37 -0.04 0.00 0.10 0.00 0.00 66.02 65.52 2ols s SER 121 CO 0.44 -0.15 -0.03 0.68 0.98 0.00 0.00 173.24 175.15 2ols s VAL 122 N -2.57 0.25 -0.11 5.02 -7.23 -0.86 -1.85 120.40 113.04 2ols s VAL 122 Ca 0.32 -1.64 -0.09 0.00 -1.81 0.00 0.00 61.98 58.77 2ols s VAL 122 Cb 0.00 -1.28 -0.04 0.00 0.56 0.00 0.00 36.38 35.62 2ols s VAL 122 CO 0.17 -0.88 0.20 0.00 -0.31 0.00 0.00 175.10 174.27 2ols s ALA 123 N -3.37 3.81 -0.31 1.32 0.00 0.26 -1.76 121.76 121.70 2ols s ALA 123 Ca 0.03 -0.56 -0.02 0.00 0.00 0.00 0.00 51.96 51.41 2ols s ALA 123 Cb 0.04 -2.09 0.06 0.00 0.00 0.00 0.00 23.12 21.12 2ols s ALA 123 CO -0.08 0.51 0.02 0.08 0.00 0.00 0.00 175.76 176.29 2ols s VAL 124 N -0.78 3.01 0.24 0.00 1.01 -0.12 -0.84 120.40 122.93 2ols s VAL 124 Ca 0.16 -1.45 0.11 0.00 0.00 0.00 0.00 61.98 60.80 2ols s VAL 124 Cb -0.13 -2.77 -0.05 0.00 0.00 0.00 0.00 36.38 33.44 2ols s VAL 124 CO 0.05 -0.17 -0.17 -0.13 0.00 0.00 0.00 175.10 174.69 2ols s ARG 125 N 1.24 1.78 -0.19 2.72 0.52 0.07 -1.52 118.95 123.57 2ols s ARG 125 Ca -0.04 -1.59 -0.17 0.00 -0.52 0.00 0.00 55.73 53.41 2ols s ARG 125 Cb -0.20 -1.90 -0.04 0.00 0.52 0.00 0.00 34.95 33.33 2ols s ARG 125 CO -0.01 0.37 0.43 0.45 0.02 0.00 0.00 175.30 176.55 2ols s SER 126 N -3.25 6.50 -0.51 0.23 0.15 -0.94 -0.88 113.70 115.00 2ols s SER 126 Ca 0.27 0.59 0.03 0.00 0.70 0.00 0.00 55.95 57.54 2ols s SER 126 Cb -0.06 -2.25 0.14 0.00 -1.71 0.00 0.00 66.02 62.14 2ols s SER 126 CO 0.15 -0.08 0.31 -0.55 1.20 0.00 0.00 173.24 174.26 2ols s SER 127 N 0.97 3.85 0.41 5.45 0.15 0.43 -4.79 113.70 120.17 2ols s SER 127 Ca 0.21 -3.01 -0.18 0.00 0.70 0.00 0.00 55.95 53.67 2ols s SER 127 Cb -0.15 -1.25 -0.10 0.00 -1.71 0.00 0.00 66.02 62.81 2ols s SER 127 CO 0.08 -0.21 0.87 0.00 1.20 0.00 0.00 173.24 175.19 2ols s ALA 128 N -0.20 3.15 0.00 5.45 0.00 -1.26 -2.73 121.76 126.17 2ols s ALA 128 Ca 0.20 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.38 2ols s ALA 128 Cb -0.18 -3.00 0.00 0.00 0.00 0.00 0.00 23.12 19.94 2ols s ALA 128 CO -0.05 0.14 1.31 2.41 0.00 0.00 0.00 175.76 179.57 2ols n THR 129 N -0.72 1.31 0.00 0.00 -1.04 -1.26 -3.74 114.28 108.83 2ols n THR 129 Ca 0.06 -0.23 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 2ols n THR 129 Cb 0.54 -1.20 0.00 0.00 -1.82 0.00 0.00 70.33 67.85 2ols n THR 129 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2ols n ALA 130 N 1.13 0.05 -0.68 2.41 0.00 -1.26 -4.97 120.51 117.20 2ols n ALA 130 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ols n ALA 130 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 2ols n ALA 130 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2ols n PHE 138 N 0.00 -0.55 0.04 0.00 0.99 -1.26 -5.09 117.46 111.59 2ols n PHE 138 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 2ols n PHE 138 Cb 0.00 0.16 0.00 0.00 -1.00 0.00 0.00 39.48 38.64 2ols n PHE 138 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2ols n ALA 139 N -1.49 3.00 -2.44 4.37 0.00 -1.26 -5.03 120.51 117.67 2ols n ALA 139 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 2ols n ALA 139 Cb 0.00 0.03 -0.10 0.00 0.00 0.00 0.00 19.45 19.38 2ols n ALA 139 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2ols s GLY 140 N -4.05 1.79 0.04 0.00 0.00 -1.26 -5.00 107.32 98.84 2ols s GLY 140 Ca 0.00 -1.85 -0.15 0.00 0.00 0.00 0.00 44.72 42.71 2ols s GLY 140 CO 0.00 -1.89 1.04 -1.61 0.00 0.00 0.00 173.10 170.64 2ols h GLN 141 N 2.32 0.59 0.00 2.90 4.15 -2.03 -3.47 115.11 119.56 2ols h GLN 141 Ca -0.40 -0.90 0.00 0.00 0.77 0.00 0.00 58.65 58.13 2ols h GLN 141 Cb 1.24 0.32 0.00 0.00 0.21 0.00 0.00 27.48 29.25 2ols h GLN 141 CO 0.63 1.42 0.00 0.94 -1.93 0.00 0.00 178.83 179.90 2ols n GLN 142 N -3.75 0.00 0.00 1.69 7.27 -1.26 -4.75 117.38 116.57 2ols n GLN 142 Ca -0.16 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.91 2ols n GLN 142 Cb 1.06 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.71 2ols n GLN 142 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 2ols n GLU 143 N 14.00 0.00 -3.99 3.69 2.13 -1.26 -4.93 120.64 130.28 2ols n GLU 143 Ca 0.00 0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.73 2ols n GLU 143 Cb 0.00 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 31.60 2ols n GLU 143 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 2ols s THR 144 N -0.21 0.13 -0.01 6.31 -1.32 -1.26 -2.22 115.64 117.06 2ols s THR 144 Ca 0.00 -1.07 0.02 0.00 -1.21 0.00 0.00 61.69 59.42 2ols s THR 144 Cb 0.00 -0.53 0.00 0.00 -1.51 0.00 0.00 72.50 70.46 2ols s THR 144 CO 0.00 -0.59 -0.05 -0.36 -2.21 0.00 0.00 174.62 171.41 2ols s PHE 145 N -1.96 0.55 0.09 9.09 0.40 -0.58 -4.99 117.98 120.58 2ols s PHE 145 Ca -0.11 -0.11 0.07 0.00 -0.60 0.00 0.00 56.93 56.18 2ols s PHE 145 Cb -0.06 -0.40 -0.03 0.00 0.51 0.00 0.00 43.02 43.04 2ols s PHE 145 CO -0.03 -0.04 -0.19 -0.51 0.70 0.00 0.00 175.22 175.15 2ols s LEU 146 N 0.09 2.28 -1.12 -0.37 1.43 -1.26 -0.94 118.68 118.77 2ols s LEU 146 Ca -0.01 -0.64 -0.11 0.00 -1.03 0.00 0.00 54.13 52.34 2ols s LEU 146 Cb -0.05 -0.77 -0.03 0.00 0.03 0.00 0.00 46.19 45.37 2ols s LEU 146 CO -0.00 0.03 0.84 -3.20 0.23 0.00 0.00 176.35 174.25 2ols n ASN 147 N 1.25 -5.26 -4.46 2.29 5.15 -1.03 -4.52 115.26 108.68 2ols n ASN 147 Ca -0.20 -0.84 -0.39 0.00 -0.60 0.00 0.00 54.58 52.55 2ols n ASN 147 Cb 0.54 -4.33 -0.12 0.00 -0.53 0.00 0.00 39.78 35.34 2ols n ASN 147 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2ols s ILE 148 N -3.45 4.71 -0.16 -1.44 -1.09 -0.72 -4.79 121.20 114.25 2ols s ILE 148 Ca 0.39 -0.36 0.17 0.00 -2.23 0.00 0.00 60.65 58.63 2ols s ILE 148 Cb -0.09 -3.39 -0.25 0.00 -1.58 0.00 0.00 42.46 37.15 2ols s ILE 148 CO 0.80 0.08 0.22 0.59 -1.23 0.00 0.00 174.94 175.39 2ols n ASN 149 N 5.00 0.19 -4.27 3.58 3.02 -1.26 -2.04 115.26 119.48 2ols n ASN 149 Ca -0.14 0.09 -0.19 0.00 -0.03 0.00 0.00 54.58 54.30 2ols n ASN 149 Cb 0.49 0.83 -0.10 0.00 -0.61 0.00 0.00 39.78 40.39 2ols n ASN 149 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2ols s GLY 150 N -5.35 2.01 0.23 7.41 0.00 -1.26 -4.62 107.32 105.73 2ols s GLY 150 Ca -0.09 -1.81 -0.08 0.00 0.00 0.00 0.00 44.72 42.74 2ols s GLY 150 CO 0.83 -1.69 1.65 -2.00 0.00 0.00 0.00 173.10 171.90 2ols h LEU 151 N 2.20 -0.27 -0.36 0.66 6.46 -1.99 0.23 115.31 122.24 2ols h LEU 151 Ca -0.38 0.17 -0.19 0.00 -0.12 0.00 0.00 57.88 57.36 2ols h LEU 151 Cb 1.25 0.29 -0.00 0.00 -0.73 0.00 0.00 40.66 41.47 2ols h LEU 151 CO 0.61 -0.13 -0.76 0.44 -0.62 0.00 0.00 178.44 177.98 2ols h ASP 152 N 0.13 0.50 -0.40 1.25 3.45 -1.99 -1.51 116.42 117.86 2ols h ASP 152 Ca 0.38 -0.34 0.00 0.00 0.43 0.00 0.00 57.03 57.50 2ols h ASP 152 Cb 0.64 -0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 39.24 2ols h ASP 152 CO -0.59 1.09 0.25 0.78 -1.57 0.00 0.00 179.24 179.20 2ols h ASN 153 N 0.28 0.47 -0.25 6.45 2.35 -1.69 -1.80 115.58 121.40 2ols h ASN 153 Ca -0.04 -0.04 0.01 0.00 -0.55 0.00 0.00 56.30 55.69 2ols h ASN 153 Cb 1.34 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 39.58 2ols h ASN 153 CO 0.13 0.37 0.14 0.58 -1.65 0.00 0.00 177.43 177.00 2ols h VAL 154 N 0.54 1.02 -0.46 2.81 2.07 -0.85 0.95 116.25 122.33 2ols h VAL 154 Ca 0.15 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.54 2ols h VAL 154 Cb -0.03 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 2ols h VAL 154 CO -0.03 0.05 0.20 0.11 0.02 0.00 0.00 177.57 177.92 2ols h LYS 155 N 0.29 0.65 0.14 1.57 1.57 -1.17 0.84 116.57 120.46 2ols h LYS 155 Ca 0.10 -0.08 -0.29 0.00 -1.87 0.00 0.00 60.65 58.50 2ols h LYS 155 Cb 0.01 -0.12 0.02 0.00 0.08 0.00 0.00 32.23 32.21 2ols h LYS 155 CO -0.05 0.53 -1.26 1.05 -0.57 0.00 0.00 179.45 179.15 2ols h GLU 156 N 0.65 0.49 -0.42 3.15 4.11 -0.85 -1.92 114.58 119.80 2ols h GLU 156 Ca 0.16 -0.71 -0.00 0.00 0.07 0.00 0.00 59.36 58.88 2ols h GLU 156 Cb 0.11 0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 2ols h GLU 156 CO -0.02 1.32 0.25 0.00 0.07 0.00 0.00 179.01 180.64 2ols h ALA 157 N 0.39 1.67 -0.35 1.06 0.00 -0.62 -2.21 119.26 119.21 2ols h ALA 157 Ca -0.18 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 2ols h ALA 157 Cb 1.94 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.55 2ols h ALA 157 CO 0.23 0.30 -0.20 0.52 0.00 0.00 0.00 179.25 180.09 2ols h MET 158 N 0.57 0.67 -0.83 0.00 2.86 -0.65 -2.23 114.93 115.32 2ols h MET 158 Ca 0.15 -0.25 0.02 0.00 -2.06 0.00 0.00 59.70 57.56 2ols h MET 158 Cb -0.03 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 31.55 2ols h MET 158 CO -0.03 0.83 0.55 0.45 1.06 0.00 0.00 176.91 179.77 2ols h HIS 159 N 0.60 1.03 -0.11 -0.22 -0.00 -0.74 -0.65 115.15 115.06 2ols h HIS 159 Ca 0.09 0.02 -0.08 0.00 -0.00 0.00 0.00 60.37 60.40 2ols h HIS 159 Cb 0.67 -0.35 0.00 0.00 -0.00 0.00 0.00 27.41 27.73 2ols h HIS 159 CO 0.03 0.63 -0.26 0.45 -0.00 0.00 0.00 177.93 178.79 2ols h HIS 160 N 1.10 0.47 -0.42 2.45 3.86 -1.33 -1.86 115.15 119.42 2ols h HIS 160 Ca 0.31 -0.18 0.07 0.00 -1.16 0.00 0.00 60.37 59.42 2ols h HIS 160 Cb -0.08 -0.09 -0.06 0.00 1.06 0.00 0.00 27.41 28.25 2ols h HIS 160 CO -0.00 0.87 0.07 0.28 0.86 0.00 0.00 177.93 180.01 2ols h VAL 161 N -0.06 0.76 -0.72 2.45 2.07 -1.11 -0.99 116.25 118.65 2ols h VAL 161 Ca -0.00 -0.07 0.07 0.00 0.82 0.00 0.00 66.70 67.53 2ols h VAL 161 Cb 0.85 0.55 -0.06 0.00 -1.52 0.00 0.00 31.29 31.11 2ols h VAL 161 CO 0.06 0.04 0.40 -0.26 0.02 0.00 0.00 177.57 177.82 2ols h PHE 162 N 0.19 0.73 0.00 1.57 -1.00 -1.07 -2.06 116.94 115.30 2ols h PHE 162 Ca 0.20 0.03 -0.06 0.00 2.81 0.00 0.00 57.97 60.95 2ols h PHE 162 Cb 0.26 -0.22 -0.01 0.00 3.61 0.00 0.00 35.95 39.59 2ols h PHE 162 CO -0.22 0.32 -0.30 0.00 -1.61 0.00 0.00 178.31 176.51 2ols h ALA 163 N 1.39 1.29 0.00 2.45 0.00 -0.76 -3.07 119.26 120.55 2ols h ALA 163 Ca 0.33 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2ols h ALA 163 Cb 0.25 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2ols h ALA 163 CO -0.21 0.37 -0.04 0.66 0.00 0.00 0.00 179.25 180.03 2ols h SER 164 N 0.00 0.00 -0.34 0.00 4.64 -0.45 -1.45 113.55 115.95 2ols h SER 164 Ca -0.00 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.42 2ols h SER 164 Cb 0.61 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.69 2ols h SER 164 CO 0.04 0.04 0.31 0.25 -0.87 0.00 0.00 176.83 176.60 2ols h LEU 165 N 0.00 0.00 -3.23 5.97 6.46 -1.60 -1.71 115.31 121.20 2ols h LEU 165 Ca -0.00 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.70 2ols h LEU 165 Cb 0.17 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 40.06 2ols h LEU 165 CO 0.01 0.00 -0.05 -1.22 -0.62 0.00 0.00 178.44 176.55 2ols n TYR 166 N -3.99 0.77 -1.53 1.25 4.02 -0.55 -4.53 117.16 112.60 2ols n TYR 166 Ca 0.05 -1.17 -0.40 0.00 -0.01 0.00 0.00 57.90 56.37 2ols n TYR 166 Cb 0.48 -0.34 0.02 0.00 -0.02 0.00 0.00 39.34 39.48 2ols n TYR 166 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2ols n ASN 167 N -0.92 -0.02 -0.20 7.72 3.02 -0.65 -4.76 115.26 119.46 2ols n ASN 167 Ca 0.24 0.90 -0.07 0.00 -0.03 0.00 0.00 54.58 55.62 2ols n ASN 167 Cb 0.88 -1.24 0.03 0.00 -0.61 0.00 0.00 39.78 38.84 2ols n ASN 167 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2ols h ASP 168 N 0.86 0.70 -0.03 6.41 3.45 -1.91 -1.55 116.42 124.36 2ols h ASP 168 Ca -0.44 -0.08 -0.07 0.00 0.43 0.00 0.00 57.03 56.86 2ols h ASP 168 Cb 1.37 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 39.95 2ols h ASP 168 CO 0.52 0.58 -0.19 0.08 -1.57 0.00 0.00 179.24 178.67 2ols h ARG 169 N 0.77 0.39 -0.62 3.56 0.11 -1.98 -1.57 114.38 115.04 2ols h ARG 169 Ca 0.20 -0.12 -0.09 0.00 0.10 0.00 0.00 59.98 60.07 2ols h ARG 169 Cb 0.03 -0.04 -0.02 0.00 1.11 0.00 0.00 29.97 31.05 2ols h ARG 169 CO -0.03 0.57 0.03 0.00 0.10 0.00 0.00 179.97 180.63 2ols h ALA 170 N 1.45 0.88 -0.35 0.08 0.00 -1.64 0.64 119.26 120.33 2ols h ALA 170 Ca 0.06 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 2ols h ALA 170 Cb 0.54 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2ols h ALA 170 CO 0.04 0.67 0.15 0.82 0.00 0.00 0.00 179.25 180.92 2ols h ILE 171 N 0.98 1.18 0.73 0.00 2.04 -0.80 -1.98 117.51 119.65 2ols h ILE 171 Ca 0.18 -0.52 -0.03 0.00 1.00 0.00 0.00 64.86 65.49 2ols h ILE 171 Cb 0.52 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 2ols h ILE 171 CO 0.03 0.19 -0.40 0.28 0.00 0.00 0.00 178.15 178.24 2ols h SER 172 N 0.42 -0.99 -1.19 1.72 0.02 -1.18 -1.86 113.55 110.49 2ols h SER 172 Ca 0.12 0.05 0.40 0.00 -0.84 0.00 0.00 61.79 61.51 2ols h SER 172 Cb 0.15 0.27 -0.14 0.00 0.14 0.00 0.00 62.40 62.83 2ols h SER 172 CO -0.01 -0.64 0.74 0.22 -1.14 0.00 0.00 176.83 175.99 2ols h TYR 173 N -1.04 0.66 0.13 3.45 3.20 0.40 0.57 116.97 124.34 2ols h TYR 173 Ca -0.10 0.03 -0.19 0.00 3.14 0.00 0.00 58.73 61.61 2ols h TYR 173 Cb 0.82 -0.16 0.02 0.00 1.54 0.00 0.00 36.73 38.95 2ols h TYR 173 CO -0.02 -0.23 -0.82 0.00 -1.64 0.00 0.00 178.16 175.46 2ols h ARG 174 N 0.14 0.32 -0.67 1.82 3.08 -1.36 -1.80 114.38 115.91 2ols h ARG 174 Ca 0.79 -0.52 0.02 0.00 0.07 0.00 0.00 59.98 60.34 2ols h ARG 174 Cb 2.28 0.19 -0.04 0.00 0.08 0.00 0.00 29.97 32.49 2ols h ARG 174 CO -0.50 1.24 0.45 0.28 -1.07 0.00 0.00 179.97 180.36 2ols h VAL 175 N -0.32 1.14 0.53 2.04 2.07 0.51 -1.03 116.25 121.18 2ols h VAL 175 Ca -0.14 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 67.06 2ols h VAL 175 Cb 1.63 0.20 0.01 0.00 -1.52 0.00 0.00 31.29 31.60 2ols h VAL 175 CO 0.15 0.16 -0.25 0.45 0.02 0.00 0.00 177.57 178.10 2ols h HIS 176 N 0.87 -0.65 0.00 1.57 3.86 -0.14 -2.34 115.15 118.32 2ols h HIS 176 Ca 0.26 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.45 2ols h HIS 176 Cb -0.03 0.22 0.00 0.00 1.06 0.00 0.00 27.41 28.65 2ols h HIS 176 CO -0.00 -0.37 0.22 1.63 0.86 0.00 0.00 177.93 180.28 2ols n LYS 177 N -5.25 0.00 -1.66 2.45 5.02 -0.68 -4.83 118.16 113.21 2ols n LYS 177 Ca -0.10 0.29 -0.00 0.00 -2.02 0.00 0.00 58.31 56.48 2ols n LYS 177 Cb 0.30 -1.73 0.00 0.00 -0.02 0.00 0.00 35.03 33.58 2ols n LYS 177 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ols n GLY 178 N -1.28 -1.90 0.00 0.72 0.00 -0.40 -5.06 105.19 97.26 2ols n GLY 178 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2ols n GLY 178 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2ols n PHE 179 N -0.19 0.00 0.00 1.61 3.72 -1.16 -5.02 117.46 116.42 2ols n PHE 179 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 2ols n PHE 179 Cb 0.03 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.57 2ols n PHE 179 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2ols n ASP 182 N 0.00 0.00 0.00 4.37 10.43 -1.26 -5.08 116.55 125.01 2ols n ASP 182 Ca 0.00 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.36 2ols n ASP 182 Cb 0.00 0.00 0.00 0.00 1.84 0.00 0.00 41.12 42.96 2ols n ASP 182 CO 0.00 0.00 0.00 2.30 -1.07 0.00 0.00 177.20 178.43 2ols n ILE 183 N -1.97 0.00 -4.16 0.53 -5.35 -1.26 -4.95 119.36 102.20 2ols n ILE 183 Ca 0.00 0.00 -0.13 0.00 -0.27 0.00 0.00 62.75 62.35 2ols n ILE 183 Cb 0.00 0.00 -0.08 0.00 -1.74 0.00 0.00 39.64 37.82 2ols n ILE 183 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2ols s VAL 184 N 0.00 0.00 0.28 7.28 1.01 -1.26 -5.18 120.40 122.53 2ols s VAL 184 Ca 0.00 -1.82 0.03 0.00 0.00 0.00 0.00 61.98 60.19 2ols s VAL 184 Cb 0.00 -2.46 -0.04 0.00 0.00 0.00 0.00 36.38 33.88 2ols s VAL 184 CO 0.00 0.00 0.16 0.00 0.00 0.00 0.00 175.10 175.26 2ols s ALA 185 N -3.86 1.78 0.23 5.51 0.00 -1.26 -5.00 121.76 119.16 2ols s ALA 185 Ca 0.35 -1.79 -0.10 0.00 0.00 0.00 0.00 51.96 50.41 2ols s ALA 185 Cb 0.04 1.21 -0.01 0.00 0.00 0.00 0.00 23.12 24.35 2ols s ALA 185 CO 0.15 -0.53 0.40 -0.48 0.00 0.00 0.00 175.76 175.30 2ols s LEU 186 N -3.33 0.54 -0.04 0.00 0.05 -1.26 -4.13 118.68 110.51 2ols s LEU 186 Ca 0.37 -0.98 0.05 0.00 0.05 0.00 0.00 54.13 53.61 2ols s LEU 186 Cb 0.05 1.47 -0.02 0.00 -2.05 0.00 0.00 46.19 45.64 2ols s LEU 186 CO 0.17 -1.05 -0.17 -0.55 -0.55 0.00 0.00 176.35 174.19 2ols s SER 187 N -3.03 3.78 -0.23 1.48 0.15 -1.10 -4.61 113.70 110.14 2ols s SER 187 Ca 0.24 -0.27 -0.11 0.00 0.70 0.00 0.00 55.95 56.51 2ols s SER 187 Cb 0.01 -0.73 -0.05 0.00 -1.71 0.00 0.00 66.02 63.54 2ols s SER 187 CO 0.08 0.34 0.18 0.00 1.20 0.00 0.00 173.24 175.03 2ols s ALA 188 N -0.69 3.62 -0.21 5.45 0.00 -1.26 -0.43 121.76 128.24 2ols s ALA 188 Ca 0.11 -0.81 -0.09 0.00 0.00 0.00 0.00 51.96 51.16 2ols s ALA 188 Cb -0.11 -2.32 -0.05 0.00 0.00 0.00 0.00 23.12 20.65 2ols s ALA 188 CO 0.00 -0.13 0.12 0.20 0.00 0.00 0.00 175.76 175.95 2ols s GLY 189 N 0.91 1.97 -0.33 0.00 0.00 -0.06 -1.43 107.32 108.38 2ols s GLY 189 Ca 0.09 -0.81 -0.00 0.00 0.00 0.00 0.00 44.72 44.00 2ols s GLY 189 CO 0.04 0.24 0.05 0.14 0.00 0.00 0.00 173.10 173.56 2ols s VAL 190 N 0.71 2.80 0.00 1.40 1.01 0.65 -0.75 120.40 126.22 2ols s VAL 190 Ca 0.06 -1.79 0.08 0.00 0.00 0.00 0.00 61.98 60.33 2ols s VAL 190 Cb -0.13 -2.79 -0.02 0.00 0.00 0.00 0.00 36.38 33.44 2ols s VAL 190 CO 0.01 -0.35 -0.24 -1.58 0.00 0.00 0.00 175.10 172.95 2ols s GLN 191 N 1.13 2.05 0.40 2.72 0.74 -0.02 -1.71 119.66 124.96 2ols s GLN 191 Ca 0.01 -0.97 -0.27 0.00 0.05 0.00 0.00 55.36 54.18 2ols s GLN 191 Cb -0.20 -2.07 -0.10 0.00 1.10 0.00 0.00 33.01 31.73 2ols s GLN 191 CO -0.04 0.55 1.47 0.50 -0.55 0.00 0.00 175.29 177.22 2ols s ARG 192 N -0.89 3.99 0.10 1.67 3.52 -0.47 0.89 118.95 127.76 2ols s ARG 192 Ca 0.11 2.52 -0.30 0.00 -0.13 0.00 0.00 55.73 57.93 2ols s ARG 192 Cb -0.10 -2.88 -0.06 0.00 -1.56 0.00 0.00 34.95 30.35 2ols s ARG 192 CO 0.01 -0.61 0.96 -1.64 -0.81 0.00 0.00 175.30 173.21 2ols s MET 193 N -2.19 4.69 0.08 5.12 -1.94 -0.77 -4.69 119.30 119.59 2ols s MET 193 Ca 0.55 1.44 -0.14 0.00 -1.71 0.00 0.00 55.69 55.83 2ols s MET 193 Cb -0.46 -3.38 -0.06 0.00 2.01 0.00 0.00 34.83 32.94 2ols s MET 193 CO 0.61 0.20 0.48 0.08 -0.01 0.00 0.00 175.02 176.38 2ols s VAL 194 N 0.06 4.95 -0.55 -6.03 1.01 -1.26 -4.91 120.40 113.67 2ols s VAL 194 Ca 0.47 0.78 -0.06 0.00 0.00 0.00 0.00 61.98 63.18 2ols s VAL 194 Cb -0.23 -3.73 -0.07 0.00 0.00 0.00 0.00 36.38 32.36 2ols s VAL 194 CO 0.30 0.38 3.05 0.54 0.00 0.00 0.00 175.10 179.36 2ols n ARG 195 N 1.20 2.72 0.00 2.72 5.12 -1.26 -4.49 116.66 122.67 2ols n ARG 195 Ca -0.09 -2.01 0.15 0.00 -1.93 0.00 0.00 57.85 53.98 2ols n ARG 195 Cb 0.52 -2.24 0.85 0.00 -1.16 0.00 0.00 32.46 30.43 2ols n ARG 195 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2ols n SER 196 N 1.88 0.00 -0.31 0.55 3.41 -1.25 0.00 113.62 117.90 2ols n SER 196 Ca 0.52 -0.54 0.06 0.00 -0.26 0.00 0.00 58.87 58.65 2ols n SER 196 Cb 0.60 -0.15 0.26 0.00 -0.26 0.00 0.00 64.21 64.66 2ols n SER 196 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 2ols h ASP 197 N 0.00 0.87 -0.44 4.04 2.03 -1.79 -1.65 116.42 119.49 2ols h ASP 197 Ca 0.00 0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.32 2ols h ASP 197 Cb 0.15 -0.16 0.00 0.00 -0.83 0.00 0.00 39.33 38.49 2ols h ASP 197 CO 0.00 0.52 0.00 -1.54 -1.03 0.00 0.00 179.24 177.19 2ols n SER 198 N -4.53 3.42 0.00 4.15 3.41 -1.19 -4.35 113.62 114.54 2ols n SER 198 Ca 0.16 -1.96 0.00 0.00 -0.26 0.00 0.00 58.87 56.81 2ols n SER 198 Cb 0.28 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 2ols n SER 198 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ols n GLY 199 N 1.36 2.94 3.14 5.00 0.00 -0.64 -4.50 105.19 112.49 2ols n GLY 199 Ca 0.19 -0.54 -0.09 0.00 0.00 0.00 0.00 46.02 45.58 2ols n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ols s ALA 200 N -2.08 0.65 0.28 4.61 0.00 -1.16 -2.79 121.76 121.28 2ols s ALA 200 Ca 0.00 -1.32 -0.20 0.00 0.00 0.00 0.00 51.96 50.44 2ols s ALA 200 Cb 0.00 0.66 0.05 0.00 0.00 0.00 0.00 23.12 23.83 2ols s ALA 200 CO 0.00 -0.46 0.85 -1.54 0.00 0.00 0.00 175.76 174.61 2ols s SER 201 N -2.99 -0.09 0.00 0.00 1.04 0.11 -0.20 113.70 111.57 2ols s SER 201 Ca 0.17 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.80 2ols s SER 201 Cb 0.07 0.69 0.00 0.00 0.10 0.00 0.00 66.02 66.88 2ols s SER 201 CO -0.03 -1.34 0.00 0.61 0.98 0.00 0.00 173.24 173.47 2ols n GLY 202 N -0.54 -0.58 2.98 7.32 0.00 -0.86 -0.93 105.19 112.56 2ols n GLY 202 Ca -0.06 -0.69 -0.17 0.00 0.00 0.00 0.00 46.02 45.11 2ols n GLY 202 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ols s VAL 203 N -3.33 0.51 0.05 1.61 1.01 -1.10 -1.96 120.40 117.18 2ols s VAL 203 Ca 0.00 -0.27 0.07 0.00 0.00 0.00 0.00 61.98 61.78 2ols s VAL 203 Cb 0.00 -0.43 -0.03 0.00 0.00 0.00 0.00 36.38 35.91 2ols s VAL 203 CO 0.00 0.15 -0.15 -0.04 0.00 0.00 0.00 175.10 175.06 2ols s MET 204 N -0.11 2.14 -0.01 2.72 -1.94 0.85 -1.71 119.30 121.24 2ols s MET 204 Ca 0.02 -0.96 0.06 0.00 -1.71 0.00 0.00 55.69 53.10 2ols s MET 204 Cb -0.03 -2.25 -0.02 0.00 2.01 0.00 0.00 34.83 34.54 2ols s MET 204 CO -0.00 0.54 -0.18 -0.06 -0.01 0.00 0.00 175.02 175.31 2ols s PHE 205 N -0.99 1.62 -0.56 -0.03 0.08 -0.18 -0.96 117.98 116.96 2ols s PHE 205 Ca 0.16 -0.31 0.06 0.00 0.12 0.00 0.00 56.93 56.96 2ols s PHE 205 Cb -0.11 -1.03 0.41 0.00 -0.57 0.00 0.00 43.02 41.72 2ols s PHE 205 CO 0.07 -0.01 1.19 0.25 -0.10 0.00 0.00 175.22 176.61 2ols n THR 206 N 2.54 1.52 -4.06 0.64 -2.24 -0.84 -0.51 114.28 111.32 2ols n THR 206 Ca -0.15 -0.75 -0.10 0.00 -2.27 0.00 0.00 64.05 60.77 2ols n THR 206 Cb 0.54 -0.44 -0.07 0.00 -2.10 0.00 0.00 70.33 68.26 2ols n THR 206 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 2ols s LEU 207 N -1.45 0.65 -0.47 3.22 0.05 -1.21 -4.69 118.68 114.79 2ols s LEU 207 Ca 0.28 -1.08 -0.29 0.00 0.05 0.00 0.00 54.13 53.09 2ols s LEU 207 Cb 0.22 1.26 0.03 0.00 -2.05 0.00 0.00 46.19 45.64 2ols s LEU 207 CO 0.08 -1.02 1.20 -0.62 -0.55 0.00 0.00 176.35 175.43 2ols s ASP 208 N -3.06 6.57 0.15 1.48 2.15 0.42 -4.29 116.67 120.09 2ols s ASP 208 Ca 0.28 0.54 -0.19 0.00 0.43 0.00 0.00 52.55 53.60 2ols s ASP 208 Cb 0.02 -2.55 0.04 0.00 -0.30 0.00 0.00 42.92 40.14 2ols s ASP 208 CO 0.09 -1.30 1.67 0.74 -0.17 0.00 0.00 175.17 176.21 2ols h THR 209 N 6.29 0.62 -0.05 1.71 2.02 -1.93 0.91 112.91 122.47 2ols h THR 209 Ca -0.24 0.00 0.01 0.00 0.77 0.00 0.00 66.41 66.95 2ols h THR 209 Cb 1.07 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 68.07 2ols h THR 209 CO 1.12 0.00 -0.19 -0.33 0.37 0.00 0.00 175.52 176.49 2ols h GLU 210 N -0.06 -0.19 0.04 6.66 3.07 -1.98 -3.30 114.58 118.81 2ols h GLU 210 Ca 0.15 0.01 -0.29 0.00 -0.50 0.00 0.00 59.36 58.73 2ols h GLU 210 Cb 0.29 0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 28.21 2ols h GLU 210 CO -0.34 -0.13 -1.57 0.66 -1.40 0.00 0.00 179.01 176.23 2ols h SER 211 N -0.20 0.12 0.00 1.42 4.64 -1.88 -3.48 113.55 114.17 2ols h SER 211 Ca 0.01 -0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2ols h SER 211 Cb 0.24 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 2ols h SER 211 CO -0.16 1.18 0.00 0.61 -0.87 0.00 0.00 176.83 177.59 2ols n GLY 212 N 1.58 0.55 3.68 -0.77 0.00 0.31 -4.92 105.19 105.63 2ols n GLY 212 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 2ols n GLY 212 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2ols s TYR 213 N -2.27 1.99 -2.00 1.61 5.04 -1.21 -4.68 117.35 115.83 2ols s TYR 213 Ca 0.00 -0.06 0.21 0.00 -2.44 0.00 0.00 57.07 54.78 2ols s TYR 213 Cb 0.00 -4.15 0.51 0.00 0.35 0.00 0.00 41.96 38.67 2ols s TYR 213 CO 0.00 -4.84 1.44 -0.40 -1.34 0.00 0.00 175.55 170.41 2ols n ASP 214 N 6.13 3.61 -1.01 4.32 5.75 -1.26 -0.43 116.55 133.65 2ols n ASP 214 Ca 0.18 -1.98 0.08 0.00 -0.01 0.00 0.00 54.79 53.06 2ols n ASP 214 Cb 0.39 -0.36 0.24 0.00 -1.03 0.00 0.00 41.12 40.36 2ols n ASP 214 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2ols n GLN 215 N 1.43 2.32 -4.22 0.11 1.13 -1.26 -4.79 117.38 112.10 2ols n GLN 215 Ca 0.21 -1.94 -0.17 0.00 -1.94 0.00 0.00 57.00 53.16 2ols n GLN 215 Cb 0.58 -1.45 -0.13 0.00 0.11 0.00 0.00 30.24 29.36 2ols n GLN 215 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2ols s VAL 216 N -1.34 0.80 -0.15 5.09 0.11 -1.26 -0.97 120.40 122.67 2ols s VAL 216 Ca 0.36 -0.89 -0.06 0.00 -2.93 0.00 0.00 61.98 58.46 2ols s VAL 216 Cb 0.19 -0.76 -0.04 0.00 -1.53 0.00 0.00 36.38 34.25 2ols s VAL 216 CO 0.24 -0.10 0.06 -0.69 -3.33 0.00 0.00 175.10 171.27 2ols s VAL 217 N -0.89 4.78 -0.22 2.04 1.01 0.14 -3.28 120.40 123.98 2ols s VAL 217 Ca -0.02 -0.05 -0.10 0.00 0.00 0.00 0.00 61.98 61.81 2ols s VAL 217 Cb -0.07 -3.11 -0.05 0.00 0.00 0.00 0.00 36.38 33.14 2ols s VAL 217 CO 0.01 0.51 0.14 0.12 0.00 0.00 0.00 175.10 175.88 2ols s PHE 218 N -0.07 3.35 -0.10 5.22 5.36 0.33 -0.95 117.98 131.12 2ols s PHE 218 Ca 0.06 0.24 0.00 0.00 -0.96 0.00 0.00 56.93 56.28 2ols s PHE 218 Cb -0.12 -2.20 0.02 0.00 -0.34 0.00 0.00 43.02 40.38 2ols s PHE 218 CO 0.01 0.17 -0.09 0.14 -1.46 0.00 0.00 175.22 173.99 2ols s VAL 219 N 0.69 1.06 0.01 3.12 -7.23 0.33 -1.01 120.40 117.37 2ols s VAL 219 Ca 0.07 -0.34 0.04 0.00 -1.81 0.00 0.00 61.98 59.95 2ols s VAL 219 Cb -0.12 -1.05 -0.03 0.00 0.56 0.00 0.00 36.38 35.74 2ols s VAL 219 CO 0.01 0.36 -0.09 0.42 -0.31 0.00 0.00 175.10 175.50 2ols s THR 220 N 1.45 3.47 -0.18 5.32 -4.23 -0.69 -0.61 115.64 120.17 2ols s THR 220 Ca 0.00 -0.87 -0.15 0.00 -1.18 0.00 0.00 61.69 59.50 2ols s THR 220 Cb -0.13 -2.50 0.05 0.00 1.34 0.00 0.00 72.50 71.25 2ols s THR 220 CO -0.05 0.37 0.47 -0.55 -0.54 0.00 0.00 174.62 174.32 2ols s SER 221 N -1.45 -0.52 0.24 3.99 0.15 -0.32 -2.72 113.70 113.06 2ols s SER 221 Ca 0.17 0.97 -0.01 0.00 0.70 0.00 0.00 55.95 57.77 2ols s SER 221 Cb -0.11 0.94 0.01 0.00 -1.71 0.00 0.00 66.02 65.15 2ols s SER 221 CO 0.07 -0.18 0.33 -0.24 1.20 0.00 0.00 173.24 174.43 2ols n SER 222 N 3.26 -0.92 -4.82 5.45 2.88 -0.11 -0.50 113.62 118.85 2ols n SER 222 Ca -0.16 -2.29 -0.35 0.00 -1.33 0.00 0.00 58.87 54.74 2ols n SER 222 Cb 0.56 1.72 -0.06 0.00 -0.75 0.00 0.00 64.21 65.69 2ols n SER 222 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2ols s TYR 223 N -3.58 3.54 0.00 0.66 2.02 -1.26 0.08 117.35 118.82 2ols s TYR 223 Ca 0.20 1.36 0.00 0.00 -0.37 0.00 0.00 57.07 58.26 2ols s TYR 223 Cb -0.01 -2.62 0.00 0.00 -0.40 0.00 0.00 41.96 38.94 2ols s TYR 223 CO 0.14 0.23 0.00 0.41 -1.57 0.00 0.00 175.55 174.76 2ols n GLY 224 N 0.29 -1.75 3.77 0.71 0.00 -1.10 -4.36 105.19 102.75 2ols n GLY 224 Ca 0.00 -1.98 -0.37 0.00 0.00 0.00 0.00 46.02 43.67 2ols n GLY 224 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ols s LEU 225 N 0.00 4.11 0.00 0.99 1.43 -0.64 -3.72 118.68 120.85 2ols s LEU 225 Ca 0.00 2.23 0.21 0.00 -1.03 0.00 0.00 54.13 55.54 2ols s LEU 225 Cb 0.00 -4.16 1.09 0.00 0.03 0.00 0.00 46.19 43.15 2ols s LEU 225 CO 0.00 -0.70 1.65 0.61 0.23 0.00 0.00 176.35 178.14 2ols n GLY 226 N 0.47 -0.90 0.35 -3.19 0.00 -1.26 -3.44 105.19 97.22 2ols n GLY 226 Ca 0.06 -0.11 0.07 0.00 0.00 0.00 0.00 46.02 46.04 2ols n GLY 226 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2ols h GLU 227 N 0.00 0.68 -0.71 1.61 4.57 -1.97 -1.63 114.58 117.14 2ols h GLU 227 Ca 0.00 -0.04 -0.06 0.00 -1.18 0.00 0.00 59.36 58.08 2ols h GLU 227 Cb 0.15 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.56 2ols h GLU 227 CO 0.00 0.45 0.21 -0.91 -1.18 0.00 0.00 179.01 177.59 2ols h ASN 228 N 0.70 1.04 0.02 1.04 -0.26 -1.97 -0.73 115.58 115.43 2ols h ASN 228 Ca 0.31 -0.21 -0.20 0.00 -0.56 0.00 0.00 56.30 55.63 2ols h ASN 228 Cb 0.30 -0.27 0.00 0.00 -1.06 0.00 0.00 38.32 37.29 2ols h ASN 228 CO -0.10 0.97 -0.75 -0.37 -1.06 0.00 0.00 177.43 176.12 2ols h VAL 229 N 1.05 1.32 -0.94 2.81 -1.51 -1.67 0.92 116.25 118.23 2ols h VAL 229 Ca 0.23 -2.03 0.04 0.00 -1.23 0.00 0.00 66.70 63.70 2ols h VAL 229 Cb 0.31 2.02 -0.06 0.00 -2.13 0.00 0.00 31.29 31.44 2ols h VAL 229 CO -0.01 0.63 0.61 0.58 -1.23 0.00 0.00 177.57 178.15 2ols h VAL 230 N 0.43 1.15 -0.01 7.19 2.07 -1.13 -2.51 116.25 123.45 2ols h VAL 230 Ca -0.04 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.08 2ols h VAL 230 Cb 1.35 -0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2ols h VAL 230 CO 0.14 0.22 -0.18 0.00 0.02 0.00 0.00 177.57 177.77 2ols n GLN 231 N -4.49 0.88 -1.92 1.57 1.13 -0.30 -4.90 117.38 109.35 2ols n GLN 231 Ca 0.12 -0.45 -0.12 0.00 -1.94 0.00 0.00 57.00 54.61 2ols n GLN 231 Cb 0.10 -1.49 -0.02 0.00 0.11 0.00 0.00 30.24 28.94 2ols n GLN 231 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2ols n GLY 232 N 1.30 0.37 0.06 1.08 0.00 -0.76 -4.92 105.19 102.33 2ols n GLY 232 Ca 0.14 -0.42 0.13 0.00 0.00 0.00 0.00 46.02 45.87 2ols n GLY 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ols n ALA 233 N -0.60 2.40 -2.71 4.61 0.00 0.25 -4.78 120.51 119.68 2ols n ALA 233 Ca -0.13 -0.08 -0.18 0.00 0.00 0.00 0.00 53.44 53.05 2ols n ALA 233 Cb 0.53 -1.43 -0.13 0.00 0.00 0.00 0.00 19.45 18.43 2ols n ALA 233 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2ols s VAL 234 N -3.07 0.97 -0.50 0.00 0.11 -1.21 -4.90 120.40 111.80 2ols s VAL 234 Ca 0.11 -1.09 -0.22 0.00 -2.93 0.00 0.00 61.98 57.86 2ols s VAL 234 Cb 0.15 -0.93 0.04 0.00 -1.53 0.00 0.00 36.38 34.11 2ols s VAL 234 CO 0.59 -0.14 0.79 0.21 -3.33 0.00 0.00 175.10 173.22 2ols s ASN 235 N -1.38 6.33 0.69 3.54 3.04 -1.26 -4.80 114.94 121.09 2ols s ASN 235 Ca -0.02 -0.42 -0.04 0.00 0.04 0.00 0.00 52.86 52.42 2ols s ASN 235 Cb -0.09 -2.37 0.08 0.00 -1.54 0.00 0.00 41.25 37.33 2ols s ASN 235 CO 0.01 -1.01 0.97 -2.16 -3.04 0.00 0.00 177.10 171.87 2ols s PRO 236 N 3.33 2.01 0.29 0.43 0.04 -1.26 -1.73 135.00 138.11 2ols s PRO 236 Ca 0.26 -0.65 -0.29 0.00 0.04 0.00 0.00 61.00 60.35 2ols s PRO 236 Cb -0.14 -2.27 -0.10 0.00 0.04 0.00 0.00 34.50 32.03 2ols s PRO 236 CO 0.18 -1.25 1.21 -0.51 0.04 0.00 0.00 177.00 176.67 2ols s ASP 237 N -4.58 7.01 -0.06 6.66 1.01 0.34 -3.32 116.67 123.73 2ols s ASP 237 Ca 0.62 2.46 0.04 0.00 0.71 0.00 0.00 52.55 56.38 2ols s ASP 237 Cb -0.09 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.21 2ols s ASP 237 CO 0.44 -0.36 -0.19 -1.61 0.21 0.00 0.00 175.17 173.66 2ols s GLU 238 N -1.38 2.15 -0.00 8.23 2.02 -0.03 -1.18 118.70 128.51 2ols s GLU 238 Ca 0.48 -0.67 0.02 0.00 0.02 0.00 0.00 54.97 54.82 2ols s GLU 238 Cb -0.36 -1.77 -0.01 0.00 0.10 0.00 0.00 34.13 32.10 2ols s GLU 238 CO 0.45 0.20 -0.07 -0.06 0.02 0.00 0.00 175.26 175.81 2ols s PHE 239 N 0.22 0.62 -0.07 1.61 0.08 0.22 -0.30 117.98 120.36 2ols s PHE 239 Ca -0.10 -0.12 0.03 0.00 0.12 0.00 0.00 56.93 56.86 2ols s PHE 239 Cb -0.14 -0.40 -0.02 0.00 -0.57 0.00 0.00 43.02 41.89 2ols s PHE 239 CO 0.04 -0.01 -0.15 0.71 -0.10 0.00 0.00 175.22 175.71 2ols s TYR 240 N -0.19 2.70 -0.04 0.36 2.02 -0.91 -0.51 117.35 120.79 2ols s TYR 240 Ca 0.02 -0.36 0.04 0.00 -0.37 0.00 0.00 57.07 56.41 2ols s TYR 240 Cb -0.03 -1.69 -0.00 0.00 -0.40 0.00 0.00 41.96 39.84 2ols s TYR 240 CO -0.00 0.03 -0.16 0.08 -1.57 0.00 0.00 175.55 173.93 2ols s VAL 241 N -0.35 1.30 -0.22 0.71 1.01 -0.12 -0.84 120.40 121.88 2ols s VAL 241 Ca 0.03 -0.65 -0.18 0.00 0.00 0.00 0.00 61.98 61.18 2ols s VAL 241 Cb -0.12 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.11 2ols s VAL 241 CO 0.02 0.38 0.50 0.12 0.00 0.00 0.00 175.10 176.12 2ols s PHE 242 N 0.01 3.33 0.06 5.22 5.36 0.73 -0.68 117.98 132.02 2ols s PHE 242 Ca -0.02 0.70 -0.22 0.00 -0.96 0.00 0.00 56.93 56.42 2ols s PHE 242 Cb -0.10 -2.66 -0.13 0.00 -0.34 0.00 0.00 43.02 39.78 2ols s PHE 242 CO 0.01 -0.15 1.55 0.87 -1.46 0.00 0.00 175.22 176.05 2ols h LYS 243 N 7.65 0.17 -0.51 10.12 1.57 -1.39 -1.79 116.57 132.38 2ols h LYS 243 Ca -0.32 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 58.44 2ols h LYS 243 Cb 1.15 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.41 2ols h LYS 243 CO 0.73 0.34 0.31 -1.35 -0.57 0.00 0.00 179.45 178.90 2ols h PRO 244 N -0.03 0.60 0.00 3.15 0.11 -1.95 -0.88 132.00 133.00 2ols h PRO 244 Ca 0.03 -0.04 -0.17 0.00 0.11 0.00 0.00 66.00 65.94 2ols h PRO 244 Cb 0.24 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.19 2ols h PRO 244 CO -0.00 0.40 -0.80 1.79 -0.21 0.00 0.00 178.00 179.17 2ols h THR 245 N 0.62 1.53 -0.71 -1.15 1.35 -1.90 -2.45 112.91 110.19 2ols h THR 245 Ca 0.20 -2.80 -0.02 0.00 -0.55 0.00 0.00 66.41 63.25 2ols h THR 245 Cb 0.01 2.53 -0.03 0.00 -1.73 0.00 0.00 68.15 68.92 2ols h THR 245 CO -0.09 0.79 0.38 0.25 -0.25 0.00 0.00 175.52 176.61 2ols h LEU 246 N 0.00 0.89 -1.22 3.87 5.85 -1.08 -1.19 115.31 122.42 2ols h LEU 246 Ca -0.01 -0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.54 2ols h LEU 246 Cb 1.46 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.26 2ols h LEU 246 CO 0.10 0.74 -0.27 0.11 -0.34 0.00 0.00 178.44 178.78 2ols h LYS 247 N 0.98 0.18 0.00 1.25 1.57 -0.96 -2.13 116.57 117.46 2ols h LYS 247 Ca 0.25 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2ols h LYS 247 Cb 0.05 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.34 2ols h LYS 247 CO -0.04 0.45 0.00 0.00 -0.57 0.00 0.00 179.45 179.29 2ols n ALA 248 N -2.48 2.42 -0.76 3.86 0.00 -0.94 -4.93 120.51 117.67 2ols n ALA 248 Ca -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2ols n ALA 248 Cb 0.37 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.35 2ols n ALA 248 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ols n GLY 249 N 1.11 0.61 3.91 0.00 0.00 -0.79 -5.06 105.19 104.97 2ols n GLY 249 Ca 0.14 -0.10 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 2ols n GLY 249 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ols s LYS 250 N -0.39 3.56 0.18 1.61 1.02 -0.52 -5.01 119.74 120.19 2ols s LYS 250 Ca 0.00 0.07 -0.32 0.00 0.02 0.00 0.00 55.97 55.75 2ols s LYS 250 Cb 0.00 -2.47 -0.11 0.00 -0.52 0.00 0.00 37.83 34.73 2ols s LYS 250 CO 0.00 -0.06 1.65 -2.14 -0.92 0.00 0.00 175.35 173.87 2ols s PRO 251 N -4.44 4.17 0.00 -1.68 0.02 -1.26 -4.27 135.00 127.54 2ols s PRO 251 Ca 0.46 2.47 0.00 0.00 0.02 0.00 0.00 61.00 63.95 2ols s PRO 251 Cb -0.10 -3.15 0.00 0.00 0.02 0.00 0.00 34.50 31.27 2ols s PRO 251 CO 0.40 -0.68 0.49 0.00 -0.33 0.00 0.00 177.00 176.88 2ols n ALA 252 N 4.10 1.25 -2.62 -1.55 0.00 -1.26 -4.43 120.51 115.99 2ols n ALA 252 Ca 0.15 -0.49 -0.43 0.00 0.00 0.00 0.00 53.44 52.67 2ols n ALA 252 Cb 0.37 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.79 2ols n ALA 252 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2ols s ILE 253 N -0.24 4.60 -0.13 0.00 1.01 -1.26 -0.19 121.20 124.98 2ols s ILE 253 Ca 0.00 1.47 0.20 0.00 0.00 0.00 0.00 60.65 62.33 2ols s ILE 253 Cb 0.00 -4.33 -0.18 0.00 0.01 0.00 0.00 42.46 37.97 2ols s ILE 253 CO 0.00 -0.43 0.68 0.18 0.00 0.00 0.00 174.94 175.37 2ols n LEU 254 N 6.68 0.48 -3.64 2.97 4.77 -0.02 -4.94 117.00 123.30 2ols n LEU 254 Ca 0.09 0.20 -0.07 0.00 -0.03 0.00 0.00 56.01 56.20 2ols n LEU 254 Cb 0.48 0.07 -0.07 0.00 -2.33 0.00 0.00 43.42 41.56 2ols n LEU 254 CO 0.57 0.05 0.52 -0.60 -1.33 0.00 0.00 177.39 176.59 2ols s ARG 255 N -3.18 0.59 -0.10 3.23 3.52 -1.24 -4.33 118.95 117.44 2ols s ARG 255 Ca -0.05 0.93 0.00 0.00 -0.13 0.00 0.00 55.73 56.49 2ols s ARG 255 Cb 0.10 0.16 0.02 0.00 -1.56 0.00 0.00 34.95 33.68 2ols s ARG 255 CO 0.84 -0.11 -0.09 0.15 -0.81 0.00 0.00 175.30 175.28 2ols s LYS 256 N 1.21 1.62 -0.18 5.12 1.02 -1.26 -2.13 119.74 125.13 2ols s LYS 256 Ca -0.07 -0.32 0.01 0.00 0.02 0.00 0.00 55.97 55.61 2ols s LYS 256 Cb -0.05 -1.56 0.02 0.00 -0.52 0.00 0.00 37.83 35.73 2ols s LYS 256 CO -0.14 -0.17 -0.18 0.99 -0.92 0.00 0.00 175.35 174.93 2ols s THR 257 N 1.37 1.98 0.10 2.17 2.01 0.59 -5.01 115.64 118.85 2ols s THR 257 Ca -0.01 -0.95 -0.31 0.00 0.31 0.00 0.00 61.69 60.73 2ols s THR 257 Cb -0.14 -1.83 -0.06 0.00 0.01 0.00 0.00 72.50 70.48 2ols s THR 257 CO -0.05 0.47 1.23 -0.32 -0.69 0.00 0.00 174.62 175.26 2ols s MET 258 N 1.31 4.43 0.39 4.92 1.75 -1.26 -0.85 119.30 129.99 2ols s MET 258 Ca 0.04 1.84 -0.05 0.00 -1.25 0.00 0.00 55.69 56.27 2ols s MET 258 Cb -0.14 -3.31 -0.04 0.00 2.84 0.00 0.00 34.83 34.18 2ols s MET 258 CO -0.12 -0.25 0.68 0.20 -0.65 0.00 0.00 175.02 174.88 2ols s GLY 259 N 0.87 1.63 0.25 2.11 0.00 -1.21 -4.87 107.32 106.10 2ols s GLY 259 Ca 0.58 -0.55 0.11 0.00 0.00 0.00 0.00 44.72 44.86 2ols s GLY 259 CO 0.31 -0.41 1.55 1.48 0.00 0.00 0.00 173.10 176.02 2ols h SER 260 N 0.87 0.00 -6.34 1.64 4.64 -1.76 -3.45 113.55 109.15 2ols h SER 260 Ca -0.48 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.38 2ols h SER 260 Cb 1.20 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.32 2ols h SER 260 CO 0.63 0.67 -0.91 0.29 -0.87 0.00 0.00 176.83 176.64 2ols n LYS 261 N -3.67 -2.33 -0.14 4.77 5.02 -0.71 -4.86 118.16 116.24 2ols n LYS 261 Ca -0.01 0.44 -0.10 0.00 -2.02 0.00 0.00 58.31 56.62 2ols n LYS 261 Cb 0.68 -4.32 0.03 0.00 -0.02 0.00 0.00 35.03 31.40 2ols n LYS 261 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2ols h HIS 262 N -1.90 1.07 -3.76 2.13 3.86 -1.92 -3.41 115.15 111.22 2ols h HIS 262 Ca -0.65 -0.25 -0.30 0.00 -1.16 0.00 0.00 60.37 58.02 2ols h HIS 262 Cb 1.37 -0.25 -0.15 0.00 1.06 0.00 0.00 27.41 29.44 2ols h HIS 262 CO 0.41 1.05 -0.66 0.96 0.86 0.00 0.00 177.93 180.55 2ols s ILE 263 N -4.67 0.68 -0.08 2.45 -5.25 -1.26 -1.22 121.20 111.84 2ols s ILE 263 Ca -0.11 -1.98 -0.10 0.00 -0.99 0.00 0.00 60.65 57.47 2ols s ILE 263 Cb 0.13 -2.18 0.02 0.00 2.95 0.00 0.00 42.46 43.38 2ols s ILE 263 CO 0.86 -0.42 0.27 -1.59 -1.79 0.00 0.00 174.94 172.26 2ols s LYS 264 N -3.93 0.38 -0.13 0.37 -2.85 0.18 -4.75 119.74 109.02 2ols s LYS 264 Ca 0.25 0.23 -0.21 0.00 -1.00 0.00 0.00 55.97 55.24 2ols s LYS 264 Cb 0.06 0.18 -0.03 0.00 -2.06 0.00 0.00 37.83 35.98 2ols s LYS 264 CO 0.05 -0.07 0.63 1.41 0.10 0.00 0.00 175.35 177.47 2ols s MET 265 N -0.20 4.33 0.37 1.78 -2.45 -1.26 -1.51 119.30 120.35 2ols s MET 265 Ca -0.03 0.69 0.04 0.00 -1.25 0.00 0.00 55.69 55.13 2ols s MET 265 Cb -0.03 -3.50 -0.04 0.00 1.25 0.00 0.00 34.83 32.52 2ols s MET 265 CO 0.01 -0.04 0.11 0.96 1.05 0.00 0.00 175.02 177.12 2ols s ILE 266 N 1.20 0.71 0.37 10.11 -4.36 -0.19 -1.62 121.20 127.42 2ols s ILE 266 Ca 0.32 -2.00 -0.17 0.00 -0.26 0.00 0.00 60.65 58.54 2ols s ILE 266 Cb -0.16 -2.49 -0.09 0.00 1.25 0.00 0.00 42.46 40.96 2ols s ILE 266 CO 0.13 0.00 0.81 -0.36 0.24 0.00 0.00 174.94 175.77 2ols s PHE 267 N -3.30 3.36 0.15 1.37 0.40 -1.26 -2.06 117.98 116.64 2ols s PHE 267 Ca 0.29 1.34 0.03 0.00 -0.60 0.00 0.00 56.93 57.98 2ols s PHE 267 Cb 0.05 -2.64 -0.04 0.00 0.51 0.00 0.00 43.02 40.90 2ols s PHE 267 CO 0.15 0.00 0.27 0.95 0.70 0.00 0.00 175.22 177.29 2ols s THR 268 N -2.09 5.23 -2.16 0.64 -4.23 -0.52 -4.79 115.64 107.73 2ols s THR 268 Ca 0.57 -0.74 0.24 0.00 -1.18 0.00 0.00 61.69 60.58 2ols s THR 268 Cb -0.10 -3.70 0.62 0.00 1.34 0.00 0.00 72.50 70.66 2ols s THR 268 CO 0.17 -0.10 1.82 0.47 -0.54 0.00 0.00 174.62 176.44 2ols n ASP 269 N -0.55 0.66 -3.15 3.99 10.43 -1.26 -4.61 116.55 122.06 2ols n ASP 269 Ca -0.07 -1.39 -0.23 0.00 2.57 0.00 0.00 54.79 55.67 2ols n ASP 269 Cb 0.54 -0.02 -0.05 0.00 1.84 0.00 0.00 41.12 43.43 2ols n ASP 269 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 2ols n LYS 270 N -0.41 1.84 -3.42 -1.24 5.02 -1.26 -5.04 118.16 113.64 2ols n LYS 270 Ca 0.18 -3.99 -0.44 0.00 -2.02 0.00 0.00 58.31 52.03 2ols n LYS 270 Cb 0.19 -1.86 -0.04 0.00 -0.02 0.00 0.00 35.03 33.31 2ols n LYS 270 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ols s ALA 271 N -2.50 4.00 -0.02 7.82 0.00 -1.26 -4.47 121.76 125.33 2ols s ALA 271 Ca 0.42 -3.34 -0.15 0.00 0.00 0.00 0.00 51.96 48.89 2ols s ALA 271 Cb 0.26 -3.32 -0.08 0.00 0.00 0.00 0.00 23.12 19.98 2ols s ALA 271 CO -0.09 -2.24 0.69 0.93 0.00 0.00 0.00 175.76 175.05 2ols h GLU 272 N 7.54 -0.51 0.00 0.00 4.39 -1.97 -3.45 114.58 120.58 2ols h GLU 272 Ca 0.09 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.82 2ols h GLU 272 Cb 1.01 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.78 2ols h GLU 272 CO 0.75 -0.34 0.00 0.00 -1.16 0.00 0.00 179.01 178.26 2ols n ALA 273 N -2.59 2.26 0.87 3.43 0.00 -1.26 -4.92 120.51 118.29 2ols n ALA 273 Ca -0.07 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.49 2ols n ALA 273 Cb 0.21 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.78 2ols n ALA 273 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ols n GLY 274 N 0.85 1.11 0.53 0.00 0.00 -1.26 -4.26 105.19 102.15 2ols n GLY 274 Ca 0.00 -0.69 0.02 0.00 0.00 0.00 0.00 46.02 45.35 2ols n GLY 274 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ols n LYS 275 N 1.36 1.62 0.15 1.61 4.76 -1.26 -4.03 118.16 122.38 2ols n LYS 275 Ca 0.15 -0.69 0.13 0.00 -2.87 0.00 0.00 58.31 55.03 2ols n LYS 275 Cb 0.60 -1.35 0.45 0.00 -1.84 0.00 0.00 35.03 32.89 2ols n LYS 275 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2ols h SER 276 N 1.01 0.00 -4.38 4.39 4.64 -1.78 -3.38 113.55 114.05 2ols h SER 276 Ca 0.00 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 60.96 2ols h SER 276 Cb 0.48 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 62.38 2ols h SER 276 CO 0.05 0.00 -0.75 0.68 -0.87 0.00 0.00 176.83 175.93 2ols s VAL 277 N -3.28 1.03 0.09 0.95 -7.23 -1.26 -1.43 120.40 109.28 2ols s VAL 277 Ca 0.06 -1.51 -0.11 0.00 -1.81 0.00 0.00 61.98 58.62 2ols s VAL 277 Cb 0.10 -1.24 0.01 0.00 0.56 0.00 0.00 36.38 35.81 2ols s VAL 277 CO 0.52 -0.42 0.25 0.28 -0.31 0.00 0.00 175.10 175.42 2ols s THR 278 N -1.94 0.12 -0.02 5.32 -1.32 -0.87 -4.86 115.64 112.06 2ols s THR 278 Ca 0.03 -0.99 -0.10 0.00 -1.21 0.00 0.00 61.69 59.42 2ols s THR 278 Cb -0.06 -1.26 -0.05 0.00 -1.51 0.00 0.00 72.50 69.62 2ols s THR 278 CO 0.01 -0.55 0.30 0.20 -2.21 0.00 0.00 174.62 172.38 2ols s ASN 279 N -2.78 6.60 -0.00 8.08 -0.87 -1.26 -1.03 114.94 123.68 2ols s ASN 279 Ca 0.04 0.71 -0.05 0.00 -1.57 0.00 0.00 52.86 51.99 2ols s ASN 279 Cb 0.04 -2.15 -0.00 0.00 -0.02 0.00 0.00 41.25 39.11 2ols s ASN 279 CO -0.11 0.31 0.11 -0.69 -2.57 0.00 0.00 177.10 174.15 2ols s VAL 280 N -1.17 0.07 0.40 1.60 1.01 -0.57 -4.95 120.40 116.79 2ols s VAL 280 Ca 0.24 -0.59 -0.26 0.00 0.00 0.00 0.00 61.98 61.36 2ols s VAL 280 Cb -0.14 -0.35 -0.09 0.00 0.00 0.00 0.00 36.38 35.80 2ols s VAL 280 CO 0.12 -0.33 1.25 -1.81 0.00 0.00 0.00 175.10 174.34 2ols s ASP 281 N -1.11 6.42 -0.00 3.32 1.01 -1.26 -0.65 116.67 124.39 2ols s ASP 281 Ca -0.12 2.54 -0.26 0.00 0.71 0.00 0.00 52.55 55.42 2ols s ASP 281 Cb -0.07 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.19 2ols s ASP 281 CO 0.01 -0.77 0.81 -0.69 0.21 0.00 0.00 175.17 174.74 2ols s VAL 282 N -1.31 4.87 1.05 -1.27 1.01 -0.36 -4.76 120.40 119.64 2ols s VAL 282 Ca 0.56 1.69 -0.12 0.00 0.00 0.00 0.00 61.98 64.12 2ols s VAL 282 Cb -0.35 -4.15 0.22 0.00 0.00 0.00 0.00 36.38 32.10 2ols s VAL 282 CO 0.45 0.27 1.07 -2.84 0.00 0.00 0.00 175.10 174.05 2ols s PRO 283 N 0.53 -0.05 0.07 2.72 0.02 -1.26 -4.80 135.00 132.24 2ols s PRO 283 Ca 0.42 0.99 0.10 0.00 0.02 0.00 0.00 61.00 62.54 2ols s PRO 283 Cb -0.20 -1.64 -0.19 0.00 0.02 0.00 0.00 34.50 32.49 2ols s PRO 283 CO 0.23 -3.18 1.04 0.93 -0.33 0.00 0.00 177.00 175.69 2ols h GLU 284 N -2.24 0.00 0.00 5.54 4.39 -1.99 -2.01 114.58 118.28 2ols h GLU 284 Ca -0.55 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.15 2ols h GLU 284 Cb 1.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.96 2ols h GLU 284 CO 0.49 0.72 0.00 -1.91 -1.16 0.00 0.00 179.01 177.15 2ols n GLU 285 N -3.20 0.00 0.15 2.33 4.07 -1.26 -3.11 120.64 119.62 2ols n GLU 285 Ca -0.07 0.47 0.05 0.00 -0.06 0.00 0.00 57.16 57.55 2ols n GLU 285 Cb 0.95 -0.85 0.49 0.00 -0.06 0.00 0.00 31.44 31.98 2ols n GLU 285 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 2ols h ASP 286 N 0.00 0.18 -0.48 4.31 3.32 -1.86 -2.86 116.42 119.03 2ols h ASP 286 Ca 0.00 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.03 2ols h ASP 286 Cb 0.00 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 2ols h ASP 286 CO 0.00 0.22 0.29 0.03 -1.72 0.00 0.00 179.24 178.06 2ols h ARG 287 N 0.20 0.65 -0.61 3.56 3.08 -1.33 -2.07 114.38 117.86 2ols h ARG 287 Ca 0.05 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2ols h ARG 287 Cb 0.14 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2ols h ARG 287 CO 0.00 0.48 0.00 0.09 -1.07 0.00 0.00 179.97 179.47 2ols n ASN 288 N -4.71 3.49 -4.96 7.04 3.02 -1.09 -4.76 115.26 113.30 2ols n ASN 288 Ca 0.02 -2.15 -0.22 0.00 -0.03 0.00 0.00 54.58 52.20 2ols n ASN 288 Cb 0.05 -0.45 -0.01 0.00 -0.61 0.00 0.00 39.78 38.76 2ols n ASN 288 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2ols s ARG 289 N -1.45 3.42 0.22 3.52 3.00 -0.78 -3.45 118.95 123.43 2ols s ARG 289 Ca 0.40 -0.58 -0.30 0.00 0.00 0.00 0.00 55.73 55.25 2ols s ARG 289 Cb 0.23 -2.77 -0.08 0.00 0.00 0.00 0.00 34.95 32.32 2ols s ARG 289 CO 0.24 0.25 0.97 -0.06 0.00 0.00 0.00 175.30 176.71 2ols s PHE 290 N -2.16 3.88 -0.37 -0.53 0.08 -1.26 -4.88 117.98 112.74 2ols s PHE 290 Ca 0.38 1.85 0.22 0.00 0.12 0.00 0.00 56.93 59.50 2ols s PHE 290 Cb -0.09 -3.05 0.23 0.00 -0.57 0.00 0.00 43.02 39.54 2ols s PHE 290 CO 0.33 0.22 1.44 0.66 -0.10 0.00 0.00 175.22 177.77 2ols h SER 291 N 4.39 0.00 -3.78 1.36 4.64 -1.88 -3.44 113.55 114.84 2ols h SER 291 Ca -0.45 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.49 2ols h SER 291 Cb 1.20 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.14 2ols h SER 291 CO 0.69 0.04 -0.73 0.27 -0.87 0.00 0.00 176.83 176.23 2ols s ILE 292 N -3.23 1.36 0.54 0.95 -4.36 -1.26 -4.84 121.20 110.36 2ols s ILE 292 Ca 0.05 -2.02 -0.04 0.00 -0.26 0.00 0.00 60.65 58.38 2ols s ILE 292 Cb 0.06 -1.82 0.00 0.00 1.25 0.00 0.00 42.46 41.96 2ols s ILE 292 CO 0.71 -0.63 0.82 0.42 0.24 0.00 0.00 174.94 176.50 2ols s THR 293 N -2.94 3.78 0.19 8.37 -4.23 -1.26 -4.89 115.64 114.66 2ols s THR 293 Ca 0.16 -0.17 -0.12 0.00 -1.18 0.00 0.00 61.69 60.39 2ols s THR 293 Cb -0.00 -3.46 0.10 0.00 1.34 0.00 0.00 72.50 70.48 2ols s THR 293 CO 0.03 -0.42 1.78 0.44 -0.54 0.00 0.00 174.62 175.91 2ols h ASP 294 N 0.03 0.38 -0.80 3.99 3.32 -2.00 -0.48 116.42 120.86 2ols h ASP 294 Ca -0.46 0.04 0.11 0.00 0.02 0.00 0.00 57.03 56.75 2ols h ASP 294 Cb 1.25 -0.03 -0.08 0.00 0.22 0.00 0.00 39.33 40.69 2ols h ASP 294 CO 0.59 0.25 0.42 -0.33 -1.72 0.00 0.00 179.24 178.45 2ols h GLU 295 N 0.52 0.65 0.06 3.56 3.07 -1.99 -1.35 114.58 119.09 2ols h GLU 295 Ca 0.25 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 59.07 2ols h GLU 295 Cb 0.19 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 2ols h GLU 295 CO -0.19 0.43 -0.03 0.93 -1.40 0.00 0.00 179.01 178.75 2ols h GLU 296 N 0.66 -0.07 -0.85 2.33 5.08 -1.68 -0.55 114.58 119.50 2ols h GLU 296 Ca 0.41 0.00 0.22 0.00 -1.00 0.00 0.00 59.36 58.99 2ols h GLU 296 Cb 0.47 0.02 -0.14 0.00 0.50 0.00 0.00 28.75 29.60 2ols h GLU 296 CO -0.30 0.27 0.21 0.82 -1.00 0.00 0.00 179.01 179.02 2ols h ILE 297 N -0.42 0.35 -0.19 3.13 2.04 -0.93 -0.18 117.51 121.31 2ols h ILE 297 Ca -0.01 -0.07 -0.10 0.00 1.00 0.00 0.00 64.86 65.68 2ols h ILE 297 Cb 0.38 0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 36.57 2ols h ILE 297 CO 0.01 0.04 -0.27 0.74 0.00 0.00 0.00 178.15 178.67 2ols h THR 298 N 0.22 1.34 -0.84 -0.27 2.02 -1.13 -1.46 112.91 112.78 2ols h THR 298 Ca 0.52 -1.48 -0.03 0.00 0.77 0.00 0.00 66.41 66.20 2ols h THR 298 Cb 1.02 1.85 -0.04 0.00 -1.74 0.00 0.00 68.15 69.24 2ols h THR 298 CO -0.63 0.45 0.42 -0.08 0.37 0.00 0.00 175.52 176.05 2ols h GLU 299 N 0.17 1.20 -0.48 6.66 4.81 -0.24 -1.99 114.58 124.70 2ols h GLU 299 Ca 0.02 -0.17 -0.07 0.00 -0.13 0.00 0.00 59.36 59.02 2ols h GLU 299 Cb 0.84 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.98 2ols h GLU 299 CO 0.06 0.91 0.04 -0.07 -0.73 0.00 0.00 179.01 179.22 2ols h LEU 300 N 1.19 0.80 -1.15 1.64 3.38 -1.04 -2.73 115.31 117.40 2ols h LEU 300 Ca 0.29 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2ols h LEU 300 Cb 0.09 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 2ols h LEU 300 CO -0.04 0.89 0.48 0.00 0.09 0.00 0.00 178.44 179.86 2ols h ALA 301 N 0.94 1.37 -0.79 1.53 0.00 -0.75 -0.87 119.26 120.69 2ols h ALA 301 Ca 0.14 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.98 2ols h ALA 301 Cb 0.46 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2ols h ALA 301 CO 0.02 0.55 0.52 0.45 0.00 0.00 0.00 179.25 180.79 2ols h HIS 302 N 1.07 0.98 -0.57 0.00 3.86 -1.26 -1.89 115.15 117.33 2ols h HIS 302 Ca 0.28 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.50 2ols h HIS 302 Cb -0.06 -0.33 -0.03 0.00 1.06 0.00 0.00 27.41 28.06 2ols h HIS 302 CO 0.00 0.61 0.28 1.88 0.86 0.00 0.00 177.93 181.56 2ols h TYR 303 N 1.05 0.82 -0.76 2.45 0.05 -1.01 -2.07 116.97 117.51 2ols h TYR 303 Ca 0.30 -0.04 0.09 0.00 0.05 0.00 0.00 58.73 59.13 2ols h TYR 303 Cb -0.09 -0.26 -0.07 0.00 1.01 0.00 0.00 36.73 37.32 2ols h TYR 303 CO -0.02 0.63 0.41 0.00 -1.05 0.00 0.00 178.16 178.13 2ols h ALA 304 N 1.11 1.07 -0.12 3.88 0.00 -0.68 -0.71 119.26 123.82 2ols h ALA 304 Ca 0.20 0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.93 2ols h ALA 304 Cb 0.11 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.82 2ols h ALA 304 CO -0.03 0.03 -0.77 -0.07 0.00 0.00 0.00 179.25 178.41 2ols h LEU 305 N 0.70 0.88 -1.11 0.00 3.38 -1.10 -0.40 115.31 117.66 2ols h LEU 305 Ca 0.37 -0.65 -0.06 0.00 0.09 0.00 0.00 57.88 57.62 2ols h LEU 305 Cb 0.35 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2ols h LEU 305 CO -0.25 1.40 -0.04 0.71 0.09 0.00 0.00 178.44 180.35 2ols h THR 306 N 0.43 1.22 -0.32 0.22 1.35 -1.09 0.20 112.91 114.93 2ols h THR 306 Ca -0.06 -0.91 -0.03 0.00 -0.55 0.00 0.00 66.41 64.86 2ols h THR 306 Cb 1.41 0.99 -0.01 0.00 -1.73 0.00 0.00 68.15 68.81 2ols h THR 306 CO 0.16 0.31 0.10 0.40 -0.25 0.00 0.00 175.52 176.24 2ols h ILE 307 N 0.55 1.20 -0.36 6.82 2.04 -0.98 -2.38 117.51 124.41 2ols h ILE 307 Ca 0.11 -0.66 -0.13 0.00 1.00 0.00 0.00 64.86 65.18 2ols h ILE 307 Cb 0.41 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.52 2ols h ILE 307 CO 0.02 0.22 -0.30 -0.08 0.00 0.00 0.00 178.15 178.01 2ols h GLU 308 N 0.36 0.79 -0.66 2.37 4.81 -0.76 -1.63 114.58 119.86 2ols h GLU 308 Ca 0.10 -0.36 0.00 0.00 -0.13 0.00 0.00 59.36 58.97 2ols h GLU 308 Cb 0.25 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 2ols h GLU 308 CO -0.00 0.99 0.42 -0.22 -0.73 0.00 0.00 179.01 179.46 2ols h LYS 309 N 0.67 0.88 0.10 1.92 3.64 -0.63 0.10 116.57 123.25 2ols h LYS 309 Ca 0.08 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2ols h LYS 309 Cb 0.84 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 2ols h LYS 309 CO 0.07 0.61 -0.05 1.25 -2.27 0.00 0.00 179.45 179.06 2ols h HIS 310 N 0.90 -0.12 0.00 1.91 2.76 -1.11 -3.12 115.15 116.37 2ols h HIS 310 Ca 0.24 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.41 2ols h HIS 310 Cb -0.07 0.04 0.00 0.00 1.55 0.00 0.00 27.41 28.93 2ols h HIS 310 CO -0.02 0.14 0.00 1.88 -1.30 0.00 0.00 177.93 178.62 2ols h TYR 311 N -0.38 0.00 -1.79 5.26 0.05 -1.31 -3.47 116.97 115.33 2ols h TYR 311 Ca -0.01 0.00 -0.26 0.00 0.05 0.00 0.00 58.73 58.51 2ols h TYR 311 Cb 0.31 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.04 2ols h TYR 311 CO 0.01 0.00 -0.33 0.41 -1.05 0.00 0.00 178.16 177.20 2ols n GLY 312 N 0.53 -0.11 3.70 3.88 0.00 0.35 -5.01 105.19 108.53 2ols n GLY 312 Ca 0.03 -0.35 -0.08 0.00 0.00 0.00 0.00 46.02 45.62 2ols n GLY 312 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2ols s ARG 313 N -4.59 1.48 0.30 1.61 1.70 -1.20 -5.06 118.95 113.19 2ols s ARG 313 Ca 0.00 -0.74 -0.30 0.00 -0.47 0.00 0.00 55.73 54.22 2ols s ARG 313 Cb 0.00 0.55 -0.12 0.00 -0.57 0.00 0.00 34.95 34.81 2ols s ARG 313 CO 0.00 -0.67 1.49 -2.30 -1.08 0.00 0.00 175.30 172.74 2ols n PRO 314 N -0.42 2.43 -4.64 3.89 -0.02 -1.26 -4.67 135.00 130.30 2ols n PRO 314 Ca -0.08 0.86 -0.25 0.00 -2.02 0.00 0.00 63.50 62.01 2ols n PRO 314 Cb 0.61 -2.57 -0.14 0.00 -0.02 0.00 0.00 33.50 31.37 2ols n PRO 314 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 2ols s MET 315 N -0.89 1.35 -0.24 -0.52 -1.94 -1.26 -0.82 119.30 114.98 2ols s MET 315 Ca 0.62 -0.88 -0.04 0.00 -1.71 0.00 0.00 55.69 53.69 2ols s MET 315 Cb -0.55 -1.43 0.01 0.00 2.01 0.00 0.00 34.83 34.87 2ols s MET 315 CO 0.53 0.37 -0.03 0.34 -0.01 0.00 0.00 175.02 176.22 2ols s ASP 316 N -1.07 4.43 -0.04 3.03 3.68 0.20 -1.99 116.67 124.91 2ols s ASP 316 Ca 0.07 -0.59 0.03 0.00 2.13 0.00 0.00 52.55 54.19 2ols s ASP 316 Cb -0.08 -1.74 0.00 0.00 -1.45 0.00 0.00 42.92 39.65 2ols s ASP 316 CO 0.01 -0.08 -0.13 -0.63 0.13 0.00 0.00 175.17 174.47 2ols s ILE 317 N 1.43 1.11 -0.09 4.11 1.01 -0.14 -0.73 121.20 127.91 2ols s ILE 317 Ca 0.04 -0.53 -0.10 0.00 0.00 0.00 0.00 60.65 60.06 2ols s ILE 317 Cb -0.15 -0.98 -0.05 0.00 0.01 0.00 0.00 42.46 41.29 2ols s ILE 317 CO -0.03 0.33 0.23 -1.61 0.00 0.00 0.00 174.94 173.87 2ols s GLU 318 N 0.22 3.67 0.10 2.79 2.02 0.05 -0.11 118.70 127.44 2ols s GLU 318 Ca -0.06 0.04 -0.05 0.00 0.02 0.00 0.00 54.97 54.92 2ols s GLU 318 Cb -0.11 -3.22 -0.02 0.00 0.10 0.00 0.00 34.13 30.87 2ols s GLU 318 CO 0.02 0.70 0.12 1.67 0.02 0.00 0.00 175.26 177.78 2ols s TRP 319 N -0.89 0.43 -0.12 1.61 1.48 -0.83 -0.22 118.94 120.40 2ols s TRP 319 Ca 0.17 -0.87 -0.11 0.00 -1.06 0.00 0.00 56.10 54.23 2ols s TRP 319 Cb -0.13 -0.23 0.03 0.00 -1.16 0.00 0.00 33.47 31.98 2ols s TRP 319 CO 0.06 -0.52 0.31 0.20 -4.06 0.00 0.00 176.95 172.95 2ols s GLY 320 N -2.93 -0.23 -0.29 3.67 0.00 -0.15 -2.04 107.32 105.35 2ols s GLY 320 Ca 0.11 0.88 -0.13 0.00 0.00 0.00 0.00 44.72 45.58 2ols s GLY 320 CO -0.07 0.76 0.29 -1.60 0.00 0.00 0.00 173.10 172.48 2ols s ARG 321 N 0.16 3.90 -0.21 2.90 3.52 0.72 -0.95 118.95 128.99 2ols s ARG 321 Ca -0.00 -0.20 -0.29 0.00 -0.13 0.00 0.00 55.73 55.11 2ols s ARG 321 Cb -0.02 -3.69 -0.03 0.00 -1.56 0.00 0.00 34.95 29.66 2ols s ARG 321 CO 0.00 -0.28 1.57 0.34 -0.81 0.00 0.00 175.30 176.12 2ols s ASP 322 N 1.71 6.46 0.58 -2.12 -1.08 -0.44 -2.97 116.67 118.80 2ols s ASP 322 Ca 0.11 1.63 0.35 0.00 -0.52 0.00 0.00 52.55 54.12 2ols s ASP 322 Cb -0.16 -2.53 1.72 0.00 -1.46 0.00 0.00 42.92 40.49 2ols s ASP 322 CO 0.11 -1.19 2.13 1.23 0.52 0.00 0.00 175.17 177.97 2ols h GLY 323 N 11.40 0.00 0.00 2.66 0.00 -0.65 0.35 103.07 116.83 2ols h GLY 323 Ca -0.33 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.00 2ols h GLY 323 CO 1.00 0.00 -0.00 1.41 0.00 0.00 0.00 176.54 178.95 2ols h LEU 324 N 0.00 -0.00 -0.54 3.11 4.07 -1.90 -3.41 115.31 116.64 2ols h LEU 324 Ca -0.00 0.00 0.10 0.00 0.08 0.00 0.00 57.88 58.06 2ols h LEU 324 Cb 0.30 0.00 -0.08 0.00 1.08 0.00 0.00 40.66 41.96 2ols h LEU 324 CO 0.01 0.08 0.08 0.44 -1.08 0.00 0.00 178.44 177.97 2ols h ASP 325 N -0.16 -0.06 0.00 -0.43 3.45 -1.94 -3.46 116.42 113.82 2ols h ASP 325 Ca -0.00 0.11 0.00 0.00 0.43 0.00 0.00 57.03 57.57 2ols h ASP 325 Cb 0.00 0.16 0.00 0.00 -0.56 0.00 0.00 39.33 38.93 2ols h ASP 325 CO 0.00 -0.01 0.00 0.61 -1.57 0.00 0.00 179.24 178.27 2ols n GLY 326 N -1.31 1.38 3.85 2.75 0.00 0.12 -5.04 105.19 106.95 2ols n GLY 326 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 2ols n GLY 326 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ols s LYS 327 N -0.61 3.99 -0.11 1.61 1.02 -1.25 -4.66 119.74 119.73 2ols s LYS 327 Ca 0.00 0.54 -0.17 0.00 0.02 0.00 0.00 55.97 56.35 2ols s LYS 327 Cb 0.00 -2.77 -0.04 0.00 -0.52 0.00 0.00 37.83 34.50 2ols s LYS 327 CO 0.00 0.37 0.44 -0.51 -0.92 0.00 0.00 175.35 174.73 2ols s LEU 328 N -2.34 4.29 0.13 3.17 1.43 -1.26 -1.33 118.68 122.77 2ols s LEU 328 Ca 0.44 0.78 0.11 0.00 -1.03 0.00 0.00 54.13 54.43 2ols s LEU 328 Cb -0.14 -2.64 -0.04 0.00 0.03 0.00 0.00 46.19 43.41 2ols s LEU 328 CO 0.20 0.04 -0.26 -0.31 0.23 0.00 0.00 176.35 176.25 2ols s TYR 329 N 0.46 2.24 -0.24 0.29 2.02 -0.12 -4.59 117.35 117.41 2ols s TYR 329 Ca 0.24 -0.38 -0.10 0.00 -0.37 0.00 0.00 57.07 56.46 2ols s TYR 329 Cb -0.15 -1.21 -0.05 0.00 -0.40 0.00 0.00 41.96 40.16 2ols s TYR 329 CO 0.10 0.34 0.14 0.42 -1.57 0.00 0.00 175.55 174.97 2ols s ILE 330 N -1.13 5.12 -0.21 2.71 1.09 0.07 -0.97 121.20 127.88 2ols s ILE 330 Ca 0.14 0.10 -0.05 0.00 -1.10 0.00 0.00 60.65 59.74 2ols s ILE 330 Cb -0.10 -3.39 -0.20 0.00 -1.06 0.00 0.00 42.46 37.72 2ols s ILE 330 CO 0.06 0.35 -0.01 0.18 -0.10 0.00 0.00 174.94 175.42 2ols n LEU 331 N 4.37 2.66 -3.78 2.97 4.32 0.69 -4.19 117.00 124.03 2ols n LEU 331 Ca -0.15 0.08 -0.12 0.00 -0.02 0.00 0.00 56.01 55.80 2ols n LEU 331 Cb 0.52 -0.98 -0.08 0.00 -1.62 0.00 0.00 43.42 41.26 2ols n LEU 331 CO 0.34 0.82 -0.01 -1.10 -1.22 0.00 0.00 177.39 176.22 2ols s GLN 332 N -2.52 0.71 -0.14 3.23 -1.52 -1.18 -4.88 119.66 113.35 2ols s GLN 332 Ca -0.31 -0.39 -0.09 0.00 -1.95 0.00 0.00 55.36 52.63 2ols s GLN 332 Cb 0.09 0.31 0.05 0.00 -0.22 0.00 0.00 33.01 33.23 2ols s GLN 332 CO 0.64 -0.21 0.35 0.00 -0.25 0.00 0.00 175.29 175.83 2ols s ALA 333 N -1.96 -0.88 0.09 6.09 0.00 -1.26 -0.77 121.76 123.06 2ols s ALA 333 Ca -0.09 1.28 -0.06 0.00 0.00 0.00 0.00 51.96 53.09 2ols s ALA 333 Cb -0.03 -0.78 -0.02 0.00 0.00 0.00 0.00 23.12 22.29 2ols s ALA 333 CO 0.00 -0.23 0.12 -0.98 0.00 0.00 0.00 175.76 174.68 2ols s ARG 334 N 1.13 0.81 0.52 0.00 1.70 0.09 -4.81 118.95 118.38 2ols s ARG 334 Ca -0.08 -1.09 -0.21 0.00 -0.47 0.00 0.00 55.73 53.89 2ols s ARG 334 Cb -0.08 0.30 -0.08 0.00 -0.57 0.00 0.00 34.95 34.52 2ols s ARG 334 CO -0.09 -0.23 0.83 -2.30 -1.08 0.00 0.00 175.30 172.43 2ols n PRO 335 N -0.03 0.93 0.11 3.89 -0.02 -1.26 0.61 135.00 139.22 2ols n PRO 335 Ca -0.13 0.35 0.13 0.00 -2.02 0.00 0.00 63.50 61.82 2ols n PRO 335 Cb 0.62 -1.95 0.35 0.00 -0.02 0.00 0.00 33.50 32.51 2ols n PRO 335 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2ols h GLU 336 N 0.81 0.00 -3.81 -0.52 4.22 -1.27 -3.40 114.58 110.60 2ols h GLU 336 Ca -0.46 0.00 -0.12 0.00 0.08 0.00 0.00 59.36 58.87 2ols h GLU 336 Cb 1.37 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.53 2ols h GLU 336 CO 0.52 0.00 -0.17 -0.08 -2.18 0.00 0.00 179.01 177.10 2ols s THR 337 N -3.12 0.00 0.40 0.32 -1.32 -1.26 -5.01 115.64 105.65 2ols s THR 337 Ca 0.10 -1.49 0.03 0.00 -1.21 0.00 0.00 61.69 59.12 2ols s THR 337 Cb 0.12 -2.35 -0.01 0.00 -1.51 0.00 0.00 72.50 68.75 2ols s THR 337 CO 0.62 0.00 0.58 -0.22 -2.21 0.00 0.00 174.62 173.39 2ols s LEU 360 N -3.08 3.79 -0.08 9.08 0.20 -1.26 -5.09 118.68 122.24 2ols s LEU 360 Ca 0.25 0.08 -0.31 0.00 0.69 0.00 0.00 54.13 54.84 2ols s LEU 360 Cb -0.00 -2.98 0.12 0.00 -0.43 0.00 0.00 46.19 42.90 2ols s LEU 360 CO 0.12 -0.59 1.00 0.00 -0.29 0.00 0.00 176.35 176.59 2ols s GLU 362 N -2.75 0.66 0.00 0.00 2.02 -1.26 -1.66 118.70 115.71 2ols s GLU 362 Ca 0.06 -0.89 0.00 0.00 0.02 0.00 0.00 54.97 54.16 2ols s GLU 362 Cb -0.01 0.26 0.00 0.00 0.10 0.00 0.00 34.13 34.48 2ols s GLU 362 CO -0.07 -0.17 0.00 0.41 0.02 0.00 0.00 175.26 175.45 2ols n GLY 363 N 0.43 2.68 3.68 -1.39 0.00 -1.01 -4.24 105.19 105.34 2ols n GLY 363 Ca -0.17 -0.49 -0.38 0.00 0.00 0.00 0.00 46.02 44.99 2ols n GLY 363 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2ols s ARG 364 N 1.75 4.20 0.00 1.61 3.52 0.54 -3.77 118.95 126.80 2ols s ARG 364 Ca 0.00 0.21 0.00 0.00 -0.13 0.00 0.00 55.73 55.81 2ols s ARG 364 Cb 0.00 -3.51 0.00 0.00 -1.56 0.00 0.00 34.95 29.88 2ols s ARG 364 CO 0.00 0.03 0.00 0.00 -0.81 0.00 0.00 175.30 174.52 2ols n ALA 365 N 4.24 0.00 -1.94 6.12 0.00 -0.50 -1.93 120.51 126.51 2ols n ALA 365 Ca -0.09 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.09 2ols n ALA 365 Cb 0.51 0.00 0.09 0.00 0.00 0.00 0.00 19.45 20.05 2ols n ALA 365 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2ols s GLN 368 N 0.46 1.96 0.00 0.00 1.11 -1.26 -4.82 119.66 117.10 2ols s GLN 368 Ca 0.00 -0.37 0.00 0.00 0.01 0.00 0.00 55.36 55.00 2ols s GLN 368 Cb 0.00 -2.15 0.00 0.00 -1.01 0.00 0.00 33.01 29.85 2ols s GLN 368 CO 0.00 -1.40 0.00 1.63 0.01 0.00 0.00 175.29 175.53 2ols n LYS 369 N -3.01 0.00 -3.04 2.91 4.01 -1.26 -4.89 118.16 112.87 2ols n LYS 369 Ca 0.10 0.00 -0.19 0.00 -0.51 0.00 0.00 58.31 57.71 2ols n LYS 369 Cb 0.60 0.00 0.05 0.00 -0.51 0.00 0.00 35.03 35.17 2ols n LYS 369 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2ols s VAL 370 N -1.05 2.34 0.24 -0.18 1.01 -1.26 -0.66 120.40 120.84 2ols s VAL 370 Ca 0.00 -1.01 -0.21 0.00 0.00 0.00 0.00 61.98 60.76 2ols s VAL 370 Cb 0.00 -2.35 0.06 0.00 0.00 0.00 0.00 36.38 34.09 2ols s VAL 370 CO 0.00 0.00 0.90 -0.83 0.00 0.00 0.00 175.10 175.17 2ols s GLY 371 N -4.59 0.03 0.35 4.51 0.00 -1.18 -4.81 107.32 101.64 2ols s GLY 371 Ca 0.60 -0.29 -0.01 0.00 0.00 0.00 0.00 44.72 45.01 2ols s GLY 371 CO 0.37 0.54 0.48 1.20 0.00 0.00 0.00 173.10 175.70 2ols s GLN 372 N -2.86 1.96 0.00 2.90 -0.21 -1.26 -1.98 119.66 118.21 2ols s GLN 372 Ca 0.15 -1.81 0.00 0.00 0.02 0.00 0.00 55.36 53.73 2ols s GLN 372 Cb -0.03 0.44 0.00 0.00 1.00 0.00 0.00 33.01 34.42 2ols s GLN 372 CO 0.06 -0.81 0.00 0.41 -2.12 0.00 0.00 175.29 172.83 2ols n GLY 373 N -0.59 2.46 3.72 3.09 0.00 -0.91 -4.46 105.19 108.49 2ols n GLY 373 Ca 0.01 -1.92 -0.41 0.00 0.00 0.00 0.00 46.02 43.70 2ols n GLY 373 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ols s LYS 374 N -1.72 4.64 -0.19 1.61 2.20 -1.26 -2.01 119.74 123.00 2ols s LYS 374 Ca 0.00 1.47 -0.29 0.00 -0.36 0.00 0.00 55.97 56.78 2ols s LYS 374 Cb 0.00 -3.40 -0.03 0.00 -1.51 0.00 0.00 37.83 32.90 2ols s LYS 374 CO 0.00 0.11 1.53 0.08 -0.36 0.00 0.00 175.35 176.71 2ols s VAL 375 N 0.34 3.81 -0.05 4.02 1.01 -1.22 -0.56 120.40 127.75 2ols s VAL 375 Ca 0.49 0.94 -0.06 0.00 0.00 0.00 0.00 61.98 63.35 2ols s VAL 375 Cb -0.23 -3.76 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 2ols s VAL 375 CO 0.29 -0.25 -0.11 -2.11 0.00 0.00 0.00 175.10 172.92 2ols n ARG 376 N 7.38 0.16 -3.24 2.72 0.00 -1.26 -4.32 116.66 118.10 2ols n ARG 376 Ca 0.17 0.07 0.04 0.00 -0.00 0.00 0.00 57.85 58.12 2ols n ARG 376 Cb 0.45 -0.71 -0.02 0.00 -0.00 0.00 0.00 32.46 32.17 2ols n ARG 376 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2ols s ASP 391 N -4.96 -0.90 -0.37 2.89 1.11 -1.26 -2.27 116.67 110.90 2ols s ASP 391 Ca -0.09 0.73 -0.26 0.00 0.18 0.00 0.00 52.55 53.11 2ols s ASP 391 Cb 0.01 1.82 0.02 0.00 1.07 0.00 0.00 42.92 45.84 2ols s ASP 391 CO 0.13 -0.17 0.92 -0.69 1.18 0.00 0.00 175.17 176.54 2ols s VAL 392 N 2.83 4.59 -0.11 -1.27 1.01 0.28 0.34 120.40 128.06 2ols s VAL 392 Ca 0.07 1.16 -0.27 0.00 0.00 0.00 0.00 61.98 62.94 2ols s VAL 392 Cb -0.12 -4.33 -0.02 0.00 0.00 0.00 0.00 36.38 31.91 2ols s VAL 392 CO -0.17 -0.54 0.87 -0.22 0.00 0.00 0.00 175.10 175.04 2ols s LEU 393 N 3.47 4.24 -0.22 3.92 2.96 0.14 -4.20 118.68 128.98 2ols s LEU 393 Ca 0.38 1.33 0.02 0.00 -0.22 0.00 0.00 54.13 55.63 2ols s LEU 393 Cb -0.12 -3.33 0.04 0.00 0.50 0.00 0.00 46.19 43.28 2ols s LEU 393 CO 0.19 -0.34 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.04 2ols s VAL 394 N 1.73 2.13 0.30 1.68 1.01 -0.96 -0.13 120.40 126.16 2ols s VAL 394 Ca 0.42 -1.30 -0.19 0.00 0.00 0.00 0.00 61.98 60.91 2ols s VAL 394 Cb -0.18 -2.09 0.06 0.00 0.00 0.00 0.00 36.38 34.17 2ols s VAL 394 CO 0.17 0.24 0.85 0.28 0.00 0.00 0.00 175.10 176.64 2ols s THR 395 N 1.19 0.00 0.00 3.92 -1.32 -1.01 -4.93 115.64 113.50 2ols s THR 395 Ca -0.02 -0.87 0.00 0.00 -1.21 0.00 0.00 61.69 59.58 2ols s THR 395 Cb -0.17 -2.68 0.00 0.00 -1.51 0.00 0.00 72.50 68.15 2ols s THR 395 CO -0.09 0.00 0.32 -0.67 -2.21 0.00 0.00 174.62 171.98 2ols n ASP 396 N -1.14 0.00 -3.61 8.08 4.64 -1.26 -1.99 116.55 121.27 2ols n ASP 396 Ca -0.06 0.61 -0.16 0.00 -1.38 0.00 0.00 54.79 53.79 2ols n ASP 396 Cb 0.60 -0.43 -0.07 0.00 -1.04 0.00 0.00 41.12 40.17 2ols n ASP 396 CO 0.00 0.00 0.00 -0.32 -0.82 0.00 0.00 177.20 176.06 2ols s MET 397 N -1.51 0.90 0.05 -0.67 1.75 -1.26 -2.33 119.30 116.22 2ols s MET 397 Ca 0.00 0.22 -0.30 0.00 -1.25 0.00 0.00 55.69 54.36 2ols s MET 397 Cb 0.00 0.42 -0.05 0.00 2.84 0.00 0.00 34.83 38.04 2ols s MET 397 CO 0.00 -0.25 1.09 0.95 -0.65 0.00 0.00 175.02 176.16 2ols s THR 398 N -1.00 4.38 1.16 10.11 -4.23 -1.26 -5.08 115.64 119.71 2ols s THR 398 Ca -0.10 1.74 -0.19 0.00 -1.18 0.00 0.00 61.69 61.95 2ols s THR 398 Cb -0.02 -4.11 0.28 0.00 1.34 0.00 0.00 72.50 69.98 2ols s THR 398 CO 0.07 0.15 1.18 -1.81 -0.54 0.00 0.00 174.62 173.67 2ols s ASP 399 N 0.92 1.33 0.36 3.99 1.01 -1.26 -4.73 116.67 118.29 2ols s ASP 399 Ca 0.55 0.44 0.10 0.00 0.71 0.00 0.00 52.55 54.34 2ols s ASP 399 Cb -0.26 -0.55 0.70 0.00 1.01 0.00 0.00 42.92 43.83 2ols s ASP 399 CO 0.29 -3.85 1.85 -0.65 0.21 0.00 0.00 175.17 173.02 2ols h PRO 400 N -2.40 0.18 0.00 8.23 0.11 -1.98 -3.04 132.00 133.10 2ols h PRO 400 Ca -0.43 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2ols h PRO 400 Cb 1.27 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2ols h PRO 400 CO 0.31 0.42 0.15 -0.25 -0.21 0.00 0.00 178.00 178.43 2ols n ASP 401 N -4.18 0.15 -1.59 -2.05 9.92 -1.26 -0.79 116.55 116.74 2ols n ASP 401 Ca -0.01 0.46 0.03 0.00 -0.53 0.00 0.00 54.79 54.74 2ols n ASP 401 Cb 0.34 -0.46 0.29 0.00 -0.64 0.00 0.00 41.12 40.66 2ols n ASP 401 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 2ols n TRP 402 N -1.63 1.65 0.06 1.24 7.02 -1.15 -4.30 117.44 120.33 2ols n TRP 402 Ca -0.00 -0.64 0.07 0.00 -1.02 0.00 0.00 57.50 55.91 2ols n TRP 402 Cb 0.16 -0.45 -0.05 0.00 -2.42 0.00 0.00 31.31 28.55 2ols n TRP 402 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 2ols n GLU 403 N 0.36 0.62 0.06 -0.99 1.02 0.03 -2.74 120.64 119.00 2ols n GLU 403 Ca 0.23 0.11 -0.03 0.00 -0.02 0.00 0.00 57.16 57.45 2ols n GLU 403 Cb 1.01 -1.78 -0.02 0.00 -0.02 0.00 0.00 31.44 30.64 2ols n GLU 403 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2ols h PRO 404 N 0.00 -0.20 -0.01 3.49 0.13 -1.81 -3.17 132.00 130.43 2ols h PRO 404 Ca -0.07 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2ols h PRO 404 Cb 1.22 0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.40 2ols h PRO 404 CO 0.02 -0.14 0.04 0.28 -0.23 0.00 0.00 178.00 177.97 2ols h VAL 405 N -0.72 0.10 -0.61 1.56 2.07 -1.84 0.46 116.25 117.27 2ols h VAL 405 Ca -0.02 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.43 2ols h VAL 405 Cb 0.16 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 2ols h VAL 405 CO 0.04 0.00 0.11 -0.03 0.02 0.00 0.00 177.57 177.71 2ols h MET 406 N 0.00 0.99 -0.48 1.57 -1.53 -1.64 -2.84 114.93 111.00 2ols h MET 406 Ca 0.00 -0.26 -0.01 0.00 -3.44 0.00 0.00 59.70 55.99 2ols h MET 406 Cb 0.09 -0.12 -0.02 0.00 -0.55 0.00 0.00 31.60 31.00 2ols h MET 406 CO -0.00 0.93 0.24 0.87 0.14 0.00 0.00 176.91 179.09 2ols h LYS 407 N 0.90 0.67 -1.95 0.39 1.57 -0.06 -3.09 116.57 115.00 2ols h LYS 407 Ca 0.19 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2ols h LYS 407 Cb 0.41 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.58 2ols h LYS 407 CO 0.01 0.52 0.00 -2.13 -0.57 0.00 0.00 179.45 177.28 2ols n ARG 408 N -4.39 0.84 -3.80 3.15 0.63 -1.04 -4.85 116.66 107.21 2ols n ARG 408 Ca 0.04 0.00 -0.03 0.00 -0.92 0.00 0.00 57.85 56.94 2ols n ARG 408 Cb 0.12 -1.08 -0.00 0.00 0.45 0.00 0.00 32.46 31.95 2ols n ARG 408 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2ols s ALA 409 N 0.30 -1.62 -0.03 5.13 0.00 -1.17 -4.92 121.76 119.45 2ols s ALA 409 Ca 0.00 -0.05 0.06 0.00 0.00 0.00 0.00 51.96 51.97 2ols s ALA 409 Cb 0.00 0.67 0.10 0.00 0.00 0.00 0.00 23.12 23.89 2ols s ALA 409 CO 0.00 -1.05 1.05 -1.13 0.00 0.00 0.00 175.76 174.63 2ols n SER 410 N -0.77 0.53 0.00 0.00 3.41 0.15 -4.86 113.62 112.08 2ols n SER 410 Ca -0.05 -2.23 0.00 0.00 -0.26 0.00 0.00 58.87 56.33 2ols n SER 410 Cb 0.60 -0.26 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 2ols n SER 410 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ols n ALA 411 N -0.22 0.00 -3.68 7.33 0.00 -0.84 -4.67 120.51 118.42 2ols n ALA 411 Ca 0.04 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.29 2ols n ALA 411 Cb 0.73 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 20.01 2ols n ALA 411 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2ols s ILE 412 N -2.00 -0.13 -0.11 0.00 1.01 -1.23 0.25 121.20 118.99 2ols s ILE 412 Ca 0.00 0.38 0.00 0.00 0.00 0.00 0.00 60.65 61.03 2ols s ILE 412 Cb 0.00 -0.17 0.02 0.00 0.01 0.00 0.00 42.46 42.32 2ols s ILE 412 CO 0.00 0.16 -0.10 0.54 0.00 0.00 0.00 174.94 175.54 2ols s VAL 413 N 2.02 1.14 0.03 2.92 0.11 0.82 -1.51 120.40 125.92 2ols s VAL 413 Ca 0.02 -0.39 0.05 0.00 -2.93 0.00 0.00 61.98 58.73 2ols s VAL 413 Cb -0.12 -1.11 -0.02 0.00 -1.53 0.00 0.00 36.38 33.60 2ols s VAL 413 CO -0.04 0.38 -0.15 0.42 -3.33 0.00 0.00 175.10 172.38 2ols s THR 414 N 1.42 1.20 0.11 5.04 -4.23 -0.13 -2.40 115.64 116.65 2ols s THR 414 Ca 0.00 -0.93 -0.27 0.00 -1.18 0.00 0.00 61.69 59.32 2ols s THR 414 Cb -0.13 -1.06 -0.08 0.00 1.34 0.00 0.00 72.50 72.57 2ols s THR 414 CO -0.06 0.12 1.64 0.78 -0.54 0.00 0.00 174.62 176.56 2ols h ASN 415 N 5.15 -0.76 -2.02 3.99 2.35 -1.21 -2.08 115.58 121.00 2ols h ASN 415 Ca -0.38 0.09 -0.44 0.00 -0.55 0.00 0.00 56.30 55.03 2ols h ASN 415 Cb 1.17 0.29 0.02 0.00 0.05 0.00 0.00 38.32 39.86 2ols h ASN 415 CO 0.45 -0.35 -0.20 -0.13 -1.65 0.00 0.00 177.43 175.56 2ols s ARG 416 N -6.06 2.87 0.00 0.81 0.52 -0.98 -1.95 118.95 114.16 2ols s ARG 416 Ca -0.16 -0.94 0.00 0.00 -0.52 0.00 0.00 55.73 54.11 2ols s ARG 416 Cb 0.08 -2.67 0.00 0.00 0.52 0.00 0.00 34.95 32.88 2ols s ARG 416 CO 0.65 -0.30 0.00 0.41 0.02 0.00 0.00 175.30 176.08 2ols n GLY 417 N -1.96 2.84 0.00 -3.53 0.00 -1.26 -3.03 105.19 98.25 2ols n GLY 417 Ca 0.05 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.26 2ols n GLY 417 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ols n GLY 418 N 0.34 6.30 0.14 -0.02 0.00 -1.26 -3.14 105.19 107.55 2ols n GLY 418 Ca 0.00 -1.88 -0.06 0.00 0.00 0.00 0.00 46.02 44.08 2ols n GLY 418 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2ols h ARG 419 N 0.00 0.01 -0.64 1.61 3.08 -1.99 -2.43 114.38 114.02 2ols h ARG 419 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2ols h ARG 419 Cb 0.00 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2ols h ARG 419 CO 0.00 0.01 0.00 0.25 -1.07 0.00 0.00 179.97 179.16 2ols n THR 420 N -5.25 1.56 -1.40 2.04 -2.24 -1.26 -4.59 114.28 103.14 2ols n THR 420 Ca 0.00 -0.92 -0.38 0.00 -2.27 0.00 0.00 64.05 60.48 2ols n THR 420 Cb 0.18 -0.09 0.03 0.00 -2.10 0.00 0.00 70.33 68.35 2ols n THR 420 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ols h HIS 422 N 0.15 -0.62 0.00 0.00 -0.00 -1.90 -2.82 115.15 109.96 2ols h HIS 422 Ca -0.44 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 59.95 2ols h HIS 422 Cb 1.41 0.28 -0.00 0.00 -0.00 0.00 0.00 27.41 29.10 2ols h HIS 422 CO 0.29 -0.22 -0.02 0.00 -0.00 0.00 0.00 177.93 177.98 2ols h ALA 423 N -1.03 1.89 0.00 5.26 0.00 -1.92 -1.24 119.26 122.22 2ols h ALA 423 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2ols h ALA 423 Cb 0.27 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2ols h ALA 423 CO -0.16 0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.12 2ols h ALA 424 N 1.98 1.00 0.12 0.00 0.00 -1.79 -2.78 119.26 117.78 2ols h ALA 424 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.58 2ols h ALA 424 Cb 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2ols h ALA 424 CO 0.00 0.00 -1.74 0.97 0.00 0.00 0.00 179.25 178.48 2ols h ILE 425 N 0.00 0.80 -0.18 0.00 -0.00 -1.05 -3.13 117.51 113.96 2ols h ILE 425 Ca 0.00 -2.37 0.05 0.00 -0.00 0.00 0.00 64.86 62.54 2ols h ILE 425 Cb 0.42 2.57 -0.01 0.00 -0.00 0.00 0.00 36.82 39.80 2ols h ILE 425 CO 0.00 0.79 0.14 0.40 -0.00 0.00 0.00 178.15 179.48 2ols h ILE 426 N -0.12 0.77 0.00 2.19 2.04 -1.48 -1.70 117.51 119.20 2ols h ILE 426 Ca -0.38 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.47 2ols h ILE 426 Cb 1.91 0.90 -0.00 0.00 -0.74 0.00 0.00 36.82 38.88 2ols h ILE 426 CO 0.07 0.00 -1.03 0.00 0.00 0.00 0.00 178.15 177.18 2ols h ALA 427 N 1.88 0.52 0.03 1.87 0.00 -1.60 -3.26 119.26 118.71 2ols h ALA 427 Ca 0.08 -0.09 -0.23 0.00 0.00 0.00 0.00 54.91 54.67 2ols h ALA 427 Cb 0.37 0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.21 2ols h ALA 427 CO -0.00 0.10 -0.92 0.00 0.00 0.00 0.00 179.25 178.43 2ols h ARG 428 N 0.00 0.57 -0.33 0.00 3.08 -1.39 -3.40 114.38 112.90 2ols h ARG 428 Ca -0.02 -0.65 0.00 0.00 0.07 0.00 0.00 59.98 59.38 2ols h ARG 428 Cb 1.06 0.20 0.00 0.00 0.08 0.00 0.00 29.97 31.31 2ols h ARG 428 CO 0.01 1.26 0.00 -0.85 -1.07 0.00 0.00 179.97 179.31 2ols n GLU 429 N -3.98 1.60 0.00 0.04 0.28 -0.68 -5.11 120.64 112.78 2ols n GLU 429 Ca -0.12 -0.78 0.00 0.00 -0.16 0.00 0.00 57.16 56.10 2ols n GLU 429 Cb 0.83 -1.26 0.00 0.00 1.43 0.00 0.00 31.44 32.44 2ols n GLU 429 CO 0.00 0.00 0.00 -0.35 -0.16 0.00 0.00 177.13 176.62 2ols n PRO 433 N 0.13 0.00 -3.24 3.44 -0.04 -1.26 -5.07 135.00 128.95 2ols n PRO 433 Ca 0.07 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.50 2ols n PRO 433 Cb 0.24 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.66 2ols n PRO 433 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ols s ALA 434 N -1.00 -1.69 -0.24 0.55 0.00 -1.26 -3.56 121.76 114.57 2ols s ALA 434 Ca 0.00 0.80 0.02 0.00 0.00 0.00 0.00 51.96 52.78 2ols s ALA 434 Cb 0.00 -2.17 0.04 0.00 0.00 0.00 0.00 23.12 21.00 2ols s ALA 434 CO 0.00 -1.64 -0.13 0.08 0.00 0.00 0.00 175.76 174.07 2ols s VAL 435 N 2.67 2.26 0.30 0.00 1.01 -0.57 -4.43 120.40 121.63 2ols s VAL 435 Ca 0.12 -1.33 0.09 0.00 0.00 0.00 0.00 61.98 60.86 2ols s VAL 435 Cb -0.13 -2.19 -0.05 0.00 0.00 0.00 0.00 36.38 34.02 2ols s VAL 435 CO -0.25 0.17 -0.00 0.68 0.00 0.00 0.00 175.10 175.70 2ols s VAL 436 N 1.19 3.09 -0.09 2.92 -7.23 -0.81 -0.96 120.40 118.51 2ols s VAL 436 Ca -0.03 -1.95 -0.00 0.00 -1.81 0.00 0.00 61.98 58.18 2ols s VAL 436 Cb -0.17 -2.79 0.00 0.00 0.56 0.00 0.00 36.38 33.97 2ols s VAL 436 CO -0.07 -0.31 0.04 0.61 -0.31 0.00 0.00 175.10 175.06 2ols n GLY 437 N -0.92 0.61 3.35 2.32 0.00 -0.82 0.20 105.19 109.94 2ols n GLY 437 Ca -0.05 -0.72 -0.45 0.00 0.00 0.00 0.00 46.02 44.79 2ols n GLY 437 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ols h GLY 439 N 9.05 1.85 -6.02 0.00 0.00 -1.84 -3.31 103.07 102.80 2ols h GLY 439 Ca -0.29 -0.07 -0.48 0.00 0.00 0.00 0.00 47.33 46.49 2ols h GLY 439 CO 0.99 -0.62 -0.85 0.54 0.00 0.00 0.00 176.54 176.60 2ols s ASN 440 N -4.79 0.69 -0.21 0.19 4.22 -1.26 -4.83 114.94 108.95 2ols s ASN 440 Ca -0.11 -2.71 0.08 0.00 -2.14 0.00 0.00 52.86 47.99 2ols s ASN 440 Cb 0.31 0.17 -0.18 0.00 1.28 0.00 0.00 41.25 42.83 2ols s ASN 440 CO 0.78 -0.14 -0.09 0.00 -2.04 0.00 0.00 177.10 175.61 2ols n ALA 441 N 2.90 1.53 -0.26 3.54 0.00 -1.24 -2.02 120.51 124.95 2ols n ALA 441 Ca 0.27 -1.07 0.16 0.00 0.00 0.00 0.00 53.44 52.80 2ols n ALA 441 Cb 0.50 -0.07 0.31 0.00 0.00 0.00 0.00 19.45 20.19 2ols n ALA 441 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2ols n THR 442 N -2.95 -0.32 -0.01 0.00 -1.04 -1.26 0.22 114.28 108.91 2ols n THR 442 Ca -0.36 1.65 -0.00 0.00 -2.04 0.00 0.00 64.05 63.31 2ols n THR 442 Cb 1.00 -2.51 -0.00 0.00 -1.82 0.00 0.00 70.33 67.00 2ols n THR 442 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2ols h GLU 443 N 0.00 0.00 -0.49 -2.82 4.39 -1.95 -3.40 114.58 110.31 2ols h GLU 443 Ca 0.54 0.00 0.10 0.00 0.34 0.00 0.00 59.36 60.34 2ols h GLU 443 Cb 1.25 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.80 2ols h GLU 443 CO -0.68 0.00 -0.21 -0.07 -1.16 0.00 0.00 179.01 176.89 2ols h LEU 444 N -0.19 -0.73 -9.86 1.33 3.38 -1.33 -3.41 115.31 104.49 2ols h LEU 444 Ca 0.00 0.18 -0.49 0.00 0.09 0.00 0.00 57.88 57.65 2ols h LEU 444 Cb 0.02 0.41 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 2ols h LEU 444 CO 0.00 -0.24 0.25 -0.76 0.09 0.00 0.00 178.44 177.78 2ols s LEU 445 N -10.71 4.37 0.13 1.67 1.43 0.13 -5.02 118.68 110.69 2ols s LEU 445 Ca -0.14 1.68 0.05 0.00 -1.03 0.00 0.00 54.13 54.68 2ols s LEU 445 Cb 0.16 -3.79 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 2ols s LEU 445 CO 0.71 -0.00 0.09 -1.59 0.23 0.00 0.00 176.35 175.79 2ols s LYS 446 N -1.92 2.82 0.58 1.70 -2.85 -1.26 -4.66 119.74 114.15 2ols s LYS 446 Ca 0.46 -0.83 0.36 0.00 -1.00 0.00 0.00 55.97 54.96 2ols s LYS 446 Cb -0.19 -2.64 1.73 0.00 -2.06 0.00 0.00 37.83 34.68 2ols s LYS 446 CO 0.23 0.51 2.13 -0.97 0.10 0.00 0.00 175.35 177.35 2ols h ASN 447 N 2.82 0.00 0.00 0.03 -0.00 -1.94 -3.38 115.58 113.11 2ols h ASN 447 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 55.83 2ols h ASN 447 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.51 2ols h ASN 447 CO 0.63 0.03 0.00 0.61 -0.00 0.00 0.00 177.43 178.70 2ols n GLY 448 N -0.45 -1.83 0.00 1.57 0.00 -1.26 -4.54 105.19 98.69 2ols n GLY 448 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2ols n GLY 448 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ols n GLN 449 N 0.00 0.00 -3.80 1.61 6.02 -1.26 -3.92 117.38 116.03 2ols n GLN 449 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.64 2ols n GLN 449 Cb 0.00 0.00 -0.11 0.00 1.02 0.00 0.00 30.24 31.15 2ols n GLN 449 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 2ols s GLU 450 N 1.83 2.28 0.28 -1.09 2.56 -1.26 -3.41 118.70 119.90 2ols s GLU 450 Ca 0.00 -2.41 0.04 0.00 0.00 0.00 0.00 54.97 52.59 2ols s GLU 450 Cb 0.00 -3.58 -0.06 0.00 2.00 0.00 0.00 34.13 32.49 2ols s GLU 450 CO 0.00 -1.13 0.03 0.14 -0.56 0.00 0.00 175.26 173.74 2ols s VAL 451 N 0.11 1.11 -0.16 3.70 -7.23 -0.85 -3.68 120.40 113.41 2ols s VAL 451 Ca 0.15 -2.02 -0.09 0.00 -1.81 0.00 0.00 61.98 58.21 2ols s VAL 451 Cb -0.22 -2.59 0.05 0.00 0.56 0.00 0.00 36.38 34.18 2ols s VAL 451 CO -0.03 -0.14 0.38 0.42 -0.31 0.00 0.00 175.10 175.42 2ols s THR 452 N -3.36 -0.03 -0.48 5.32 -4.23 0.29 -2.15 115.64 111.00 2ols s THR 452 Ca 0.33 0.09 -0.03 0.00 -1.18 0.00 0.00 61.69 60.91 2ols s THR 452 Cb 0.07 -0.56 0.13 0.00 1.34 0.00 0.00 72.50 73.47 2ols s THR 452 CO 0.13 0.04 0.29 -0.69 -0.54 0.00 0.00 174.62 173.84 2ols s VAL 453 N 1.28 3.47 0.33 2.29 1.01 -0.84 -2.60 120.40 125.34 2ols s VAL 453 Ca -0.09 -2.33 -0.24 0.00 0.00 0.00 0.00 61.98 59.32 2ols s VAL 453 Cb -0.08 -3.34 -0.10 0.00 0.00 0.00 0.00 36.38 32.86 2ols s VAL 453 CO -0.11 -0.76 0.92 -0.55 0.00 0.00 0.00 175.10 174.60 2ols s SER 454 N 1.51 7.24 -0.03 3.32 0.15 -1.13 -3.07 113.70 121.69 2ols s SER 454 Ca 0.11 1.76 0.06 0.00 0.70 0.00 0.00 55.95 58.57 2ols s SER 454 Cb -0.22 -2.55 0.09 0.00 -1.71 0.00 0.00 66.02 61.62 2ols s SER 454 CO -0.04 -0.10 1.04 0.00 1.20 0.00 0.00 173.24 175.34 2ols n ALA 456 N -0.32 6.70 -1.04 0.00 0.00 -1.26 -4.37 120.51 120.21 2ols n ALA 456 Ca 0.04 -2.31 0.05 0.00 0.00 0.00 0.00 53.44 51.23 2ols n ALA 456 Cb 0.70 -2.59 0.28 0.00 0.00 0.00 0.00 19.45 17.84 2ols n ALA 456 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2ols n ASP 459 N 2.74 4.10 -1.00 0.00 3.85 -1.26 -4.90 116.55 120.09 2ols n ASP 459 Ca 0.53 -3.12 0.05 0.00 -0.71 0.00 0.00 54.79 51.54 2ols n ASP 459 Cb 0.73 -0.60 0.20 0.00 -1.35 0.00 0.00 41.12 40.10 2ols n ASP 459 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.20 176.60 2ols n THR 460 N -0.39 1.02 -2.73 2.12 -1.04 -1.26 -1.41 114.28 110.59 2ols n THR 460 Ca 0.26 -0.65 -0.23 0.00 -2.04 0.00 0.00 64.05 61.39 2ols n THR 460 Cb 1.01 -0.05 0.02 0.00 -1.82 0.00 0.00 70.33 69.49 2ols n THR 460 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ols n GLY 461 N 0.74 -0.07 3.88 3.41 0.00 -1.25 -3.83 105.19 108.08 2ols n GLY 461 Ca 0.14 0.66 -0.30 0.00 0.00 0.00 0.00 46.02 46.53 2ols n GLY 461 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ols s PHE 462 N -1.26 1.93 -0.36 1.61 0.08 -1.09 -2.42 117.98 116.48 2ols s PHE 462 Ca 0.19 0.50 0.06 0.00 0.12 0.00 0.00 56.93 57.81 2ols s PHE 462 Cb -0.02 -3.83 0.18 0.00 -0.57 0.00 0.00 43.02 38.79 2ols s PHE 462 CO 0.55 -2.51 0.57 -1.50 -0.10 0.00 0.00 175.22 172.23 2ols s ILE 463 N -3.67 -0.90 0.31 0.64 -1.16 -0.66 -2.82 121.20 112.94 2ols s ILE 463 Ca 0.70 -0.12 -0.14 0.00 -0.51 0.00 0.00 60.65 60.57 2ols s ILE 463 Cb -0.07 -0.45 -0.09 0.00 0.61 0.00 0.00 42.46 42.46 2ols s ILE 463 CO 0.52 -0.08 0.71 -0.31 -2.81 0.00 0.00 174.94 172.97 2ols s TYR 464 N 2.16 3.38 -0.69 3.50 1.51 -1.07 -2.35 117.35 123.79 2ols s TYR 464 Ca 0.14 1.17 0.00 0.00 -1.01 0.00 0.00 57.07 57.36 2ols s TYR 464 Cb -0.08 -2.50 0.00 0.00 -0.11 0.00 0.00 41.96 39.28 2ols s TYR 464 CO -0.14 0.11 0.00 0.00 -1.11 0.00 0.00 175.55 174.41 2ols n ALA 465 N -0.37 -0.15 -3.00 3.71 0.00 -1.26 0.11 120.51 119.55 2ols n ALA 465 Ca 0.03 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2ols n ALA 465 Cb 0.53 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.94 2ols n ALA 465 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ols n GLY 466 N -1.69 1.39 0.00 0.00 0.00 -1.24 -4.99 105.19 98.66 2ols n GLY 466 Ca -0.08 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.59 2ols n GLY 466 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2ols n LEU 467 N 0.00 0.00 -3.73 0.99 0.00 -1.26 -4.12 117.00 108.88 2ols n LEU 467 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 56.01 55.89 2ols n LEU 467 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 43.42 43.31 2ols n LEU 467 CO 0.00 0.00 0.01 -0.04 0.00 0.00 0.00 177.39 177.36 2ols s MET 480 N -4.26 0.38 0.88 1.96 1.00 -1.26 -5.12 119.30 112.87 2ols s MET 480 Ca 0.00 0.58 -0.12 0.00 0.00 0.00 0.00 55.69 56.16 2ols s MET 480 Cb 0.00 0.10 0.12 0.00 0.00 0.00 0.00 34.83 35.04 2ols s MET 480 CO 0.00 -0.10 1.10 -1.25 0.00 0.00 0.00 175.02 174.77 2ols s PRO 481 N 0.67 1.42 0.12 2.03 0.04 -1.26 -4.94 135.00 133.08 2ols s PRO 481 Ca -0.04 0.74 -0.31 0.00 0.04 0.00 0.00 61.00 61.43 2ols s PRO 481 Cb -0.05 -1.83 -0.09 0.00 0.04 0.00 0.00 34.50 32.57 2ols s PRO 481 CO -0.04 -2.11 1.56 0.21 0.04 0.00 0.00 177.00 176.66 2ols s LYS 482 N -5.01 4.23 -0.02 4.56 2.47 -1.26 -4.97 119.74 119.75 2ols s LYS 482 Ca 0.63 2.28 -0.06 0.00 -1.56 0.00 0.00 55.97 57.26 2ols s LYS 482 Cb -0.17 -3.34 -0.04 0.00 -1.46 0.00 0.00 37.83 32.82 2ols s LYS 482 CO 0.56 -0.62 0.23 0.00 0.16 0.00 0.00 175.35 175.68 2ols s ALA 483 N 1.69 3.87 0.08 3.13 0.00 -1.26 -4.41 121.76 124.87 2ols s ALA 483 Ca 0.70 -0.62 0.21 0.00 0.00 0.00 0.00 51.96 52.25 2ols s ALA 483 Cb -0.41 -2.02 0.68 0.00 0.00 0.00 0.00 23.12 21.38 2ols s ALA 483 CO 0.31 0.66 1.73 -1.00 0.00 0.00 0.00 175.76 177.46 2ols h PRO 484 N 4.12 0.00 -5.65 0.00 0.13 -1.94 -3.45 132.00 125.21 2ols h PRO 484 Ca -0.51 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.00 2ols h PRO 484 Cb 1.20 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.20 2ols h PRO 484 CO 0.65 0.32 -0.60 0.14 -0.23 0.00 0.00 178.00 178.28 2ols s VAL 485 N -3.51 1.99 -0.12 1.56 -7.23 -1.26 -5.04 120.40 106.79 2ols s VAL 485 Ca 0.01 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 57.91 2ols s VAL 485 Cb 0.10 -3.00 -0.02 0.00 0.56 0.00 0.00 36.38 34.03 2ols s VAL 485 CO 0.67 0.00 0.91 -0.54 -0.31 0.00 0.00 175.10 175.83 2ols s LYS 486 N -3.71 4.38 -0.41 4.82 1.02 -0.91 -4.98 119.74 119.95 2ols s LYS 486 Ca 0.35 1.20 -0.17 0.00 0.02 0.00 0.00 55.97 57.37 2ols s LYS 486 Cb 0.10 -3.54 0.02 0.00 -0.52 0.00 0.00 37.83 33.89 2ols s LYS 486 CO 0.18 -0.27 0.42 0.08 -0.92 0.00 0.00 175.35 174.85 2ols s VAL 487 N 1.89 5.10 0.35 3.17 1.01 -1.26 -1.48 120.40 129.18 2ols s VAL 487 Ca 0.44 -0.30 0.08 0.00 0.00 0.00 0.00 61.98 62.20 2ols s VAL 487 Cb -0.18 -4.01 -0.05 0.00 0.00 0.00 0.00 36.38 32.15 2ols s VAL 487 CO 0.16 -0.38 0.11 -0.04 0.00 0.00 0.00 175.10 174.95 2ols s MET 488 N 2.11 2.25 0.07 2.72 -1.94 0.12 -1.51 119.30 123.12 2ols s MET 488 Ca 0.12 -1.67 0.02 0.00 -1.71 0.00 0.00 55.69 52.45 2ols s MET 488 Cb -0.17 -2.06 -0.04 0.00 2.01 0.00 0.00 34.83 34.57 2ols s MET 488 CO 0.13 0.08 0.14 -1.64 -0.01 0.00 0.00 175.02 173.72 2ols s MET 489 N -3.81 3.14 -0.36 2.03 -1.94 0.05 -1.68 119.30 116.72 2ols s MET 489 Ca 0.37 -0.57 -0.12 0.00 -1.71 0.00 0.00 55.69 53.66 2ols s MET 489 Cb -0.01 -2.87 0.00 0.00 2.01 0.00 0.00 34.83 33.97 2ols s MET 489 CO 0.22 0.59 0.23 1.21 -0.01 0.00 0.00 175.02 177.25 2ols s ASN 490 N -2.43 5.90 -0.06 3.03 2.47 0.18 -1.29 114.94 122.74 2ols s ASN 490 Ca 0.32 -0.69 0.02 0.00 0.42 0.00 0.00 52.86 52.92 2ols s ASN 490 Cb -0.13 -2.09 0.02 0.00 -1.45 0.00 0.00 41.25 37.60 2ols s ASN 490 CO 0.24 -0.31 -0.09 -0.69 -3.72 0.00 0.00 177.10 172.53 2ols s VAL 491 N 1.65 0.92 -0.06 -5.21 1.01 -0.32 -4.34 120.40 114.05 2ols s VAL 491 Ca 0.05 -0.35 0.05 0.00 0.00 0.00 0.00 61.98 61.72 2ols s VAL 491 Cb -0.18 -0.87 -0.07 0.00 0.00 0.00 0.00 36.38 35.26 2ols s VAL 491 CO 0.09 0.31 0.01 0.61 0.00 0.00 0.00 175.10 176.11 2ols n GLY 492 N 3.89 -0.28 3.31 4.51 0.00 -1.26 -1.44 105.19 113.92 2ols n GLY 492 Ca -0.24 -0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.26 2ols n GLY 492 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2ols s ASN 493 N -3.92 5.94 0.39 1.61 3.84 -1.26 -4.53 114.94 117.00 2ols s ASN 493 Ca -0.04 -1.58 0.28 0.00 0.21 0.00 0.00 52.86 51.73 2ols s ASN 493 Cb 0.02 -2.10 1.39 0.00 -0.55 0.00 0.00 41.25 40.00 2ols s ASN 493 CO 0.25 -0.67 1.84 1.55 -2.79 0.00 0.00 177.10 177.28 2ols h PRO 494 N 8.63 0.00 0.00 0.43 0.13 -1.95 -0.29 132.00 138.96 2ols h PRO 494 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2ols h PRO 494 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2ols h PRO 494 CO 0.88 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 179.04 2ols n GLU 495 N -2.49 0.19 -0.08 0.86 1.02 -1.26 -2.94 120.64 115.94 2ols n GLU 495 Ca -0.01 0.34 0.08 0.00 -0.02 0.00 0.00 57.16 57.56 2ols n GLU 495 Cb 0.11 -1.81 0.12 0.00 -0.02 0.00 0.00 31.44 29.84 2ols n GLU 495 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2ols n LEU 496 N -2.15 2.67 -0.27 -4.62 4.32 -0.12 -4.76 117.00 112.07 2ols n LEU 496 Ca 0.03 -1.29 -0.07 0.00 -0.02 0.00 0.00 56.01 54.66 2ols n LEU 496 Cb 0.27 -0.10 0.05 0.00 -1.62 0.00 0.00 43.42 42.03 2ols n LEU 496 CO 0.22 0.55 0.98 0.00 -1.22 0.00 0.00 177.39 177.92 2ols h ALA 497 N 3.19 0.97 0.00 -1.18 0.00 -1.53 -2.57 119.26 118.14 2ols h ALA 497 Ca 0.00 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.58 2ols h ALA 497 Cb 0.74 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2ols h ALA 497 CO 0.00 0.66 -0.46 0.74 0.00 0.00 0.00 179.25 180.20 2ols h PHE 498 N 1.11 0.00 0.00 0.00 0.04 -1.86 -2.00 116.94 114.23 2ols h PHE 498 Ca 0.24 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 61.00 2ols h PHE 498 Cb 0.32 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.47 2ols h PHE 498 CO 0.03 0.46 -0.04 0.66 -0.60 0.00 0.00 178.31 178.81 2ols h SER 499 N 0.00 0.00 -0.01 2.17 4.64 -1.81 -2.99 113.55 115.56 2ols h SER 499 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ols h SER 499 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 2ols h SER 499 CO 0.06 0.04 -0.74 0.49 -0.87 0.00 0.00 176.83 175.81 2ols n PHE 500 N -3.21 0.00 -0.34 4.77 3.72 -0.81 -4.16 117.46 117.43 2ols n PHE 500 Ca -0.01 0.00 0.23 0.00 -0.05 0.00 0.00 57.45 57.62 2ols n PHE 500 Cb 0.25 0.00 0.49 0.00 -0.94 0.00 0.00 39.48 39.28 2ols n PHE 500 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2ols h ALA 501 N 3.08 2.16 -0.14 4.37 0.00 -1.24 -2.75 119.26 124.73 2ols h ALA 501 Ca 0.00 0.09 -0.21 0.00 0.00 0.00 0.00 54.91 54.78 2ols h ALA 501 Cb 0.55 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.39 2ols h ALA 501 CO 0.00 -0.61 -0.76 -0.91 0.00 0.00 0.00 179.25 176.98 2ols h ASN 502 N 0.41 0.84 -3.34 0.00 -0.26 -1.72 -3.46 115.58 108.06 2ols h ASN 502 Ca 0.63 -0.55 -0.57 0.00 -0.56 0.00 0.00 56.30 55.25 2ols h ASN 502 Cb 1.54 -0.25 0.13 0.00 -1.06 0.00 0.00 38.32 38.67 2ols h ASN 502 CO -0.36 1.33 0.37 -0.11 -1.06 0.00 0.00 177.43 177.60 2ols n LEU 503 N -3.92 3.48 -4.62 1.61 7.94 -1.04 -4.89 117.00 115.56 2ols n LEU 503 Ca -0.07 1.09 -0.43 0.00 -1.11 0.00 0.00 56.01 55.50 2ols n LEU 503 Cb 0.73 -1.44 -0.02 0.00 0.53 0.00 0.00 43.42 43.22 2ols n LEU 503 CO 0.52 -0.94 1.20 -2.16 -1.11 0.00 0.00 177.39 174.90 2ols s PRO 504 N -2.11 3.80 0.30 1.96 0.04 -1.26 -4.96 135.00 132.76 2ols s PRO 504 Ca 0.61 1.23 -0.10 0.00 0.04 0.00 0.00 61.00 62.78 2ols s PRO 504 Cb -0.53 -3.95 0.01 0.00 0.04 0.00 0.00 34.50 30.07 2ols s PRO 504 CO 0.58 -1.28 0.53 -1.54 0.04 0.00 0.00 177.00 175.33 2ols s SER 505 N 3.36 0.23 -0.05 6.66 1.04 -1.26 -4.91 113.70 118.76 2ols s SER 505 Ca 0.60 -1.13 0.19 0.00 0.48 0.00 0.00 55.95 56.09 2ols s SER 505 Cb -0.17 0.65 0.63 0.00 0.10 0.00 0.00 66.02 67.24 2ols s SER 505 CO 0.27 -1.28 1.53 -0.62 0.98 0.00 0.00 173.24 174.12 2ols n GLU 506 N -0.46 3.07 0.00 4.02 -0.58 -0.57 -5.01 120.64 121.11 2ols n GLU 506 Ca -0.02 -2.54 0.00 0.00 -0.42 0.00 0.00 57.16 54.18 2ols n GLU 506 Cb 0.61 -1.70 0.00 0.00 -0.57 0.00 0.00 31.44 29.79 2ols n GLU 506 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ols n GLY 507 N 1.32 0.38 3.39 0.62 0.00 -1.26 -4.17 105.19 105.47 2ols n GLY 507 Ca 0.23 -2.28 -0.38 0.00 0.00 0.00 0.00 46.02 43.59 2ols n GLY 507 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ols s ILE 508 N -0.13 4.30 -0.85 -0.61 1.01 -0.02 -0.77 121.20 124.12 2ols s ILE 508 Ca 0.00 -0.58 0.24 0.00 0.00 0.00 0.00 60.65 60.31 2ols s ILE 508 Cb 0.00 -3.22 -0.03 0.00 0.01 0.00 0.00 42.46 39.22 2ols s ILE 508 CO 0.00 0.05 1.27 0.61 0.00 0.00 0.00 174.94 176.87 2ols n GLY 509 N 4.93 -1.25 2.88 6.18 0.00 -0.41 -0.97 105.19 116.54 2ols n GLY 509 Ca -0.14 -0.36 -0.11 0.00 0.00 0.00 0.00 46.02 45.41 2ols n GLY 509 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ols s LEU 510 N -3.44 -0.65 -0.47 0.99 2.96 -1.19 -4.67 118.68 112.22 2ols s LEU 510 Ca 0.08 -0.51 -0.20 0.00 -0.22 0.00 0.00 54.13 53.28 2ols s LEU 510 Cb 0.16 0.97 0.04 0.00 0.50 0.00 0.00 46.19 47.85 2ols s LEU 510 CO 0.74 -0.36 0.64 0.00 -1.32 0.00 0.00 176.35 176.06 2ols s ALA 511 N 2.46 3.35 0.40 5.97 0.00 -0.29 -1.17 121.76 132.48 2ols s ALA 511 Ca 0.10 -1.43 -0.15 0.00 0.00 0.00 0.00 51.96 50.47 2ols s ALA 511 Cb -0.13 -3.34 -0.09 0.00 0.00 0.00 0.00 23.12 19.57 2ols s ALA 511 CO -0.30 -1.90 0.84 1.03 0.00 0.00 0.00 175.76 175.43 2ols s ARG 512 N 2.79 3.99 0.00 0.00 0.52 -0.52 -1.70 118.95 124.03 2ols s ARG 512 Ca 0.20 0.77 0.18 0.00 -0.52 0.00 0.00 55.73 56.36 2ols s ARG 512 Cb -0.16 -2.31 -0.08 0.00 0.52 0.00 0.00 34.95 32.92 2ols s ARG 512 CO 0.16 -0.01 0.86 -0.12 0.02 0.00 0.00 175.30 176.21 2ols n MET 513 N -0.88 1.38 0.13 3.54 0.00 -1.25 -4.65 117.12 115.38 2ols n MET 513 Ca 0.05 -0.52 0.07 0.00 -0.00 0.00 0.00 57.70 57.30 2ols n MET 513 Cb 0.54 -1.34 0.03 0.00 0.00 0.00 0.00 33.22 32.44 2ols n MET 513 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 2ols h GLU 514 N 1.19 0.00 -0.05 2.12 3.07 -1.91 -2.45 114.58 116.55 2ols h GLU 514 Ca 0.00 0.00 -0.25 0.00 -0.50 0.00 0.00 59.36 58.61 2ols h GLU 514 Cb 0.54 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 28.47 2ols h GLU 514 CO 0.00 0.16 -0.96 0.35 -1.40 0.00 0.00 179.01 177.17 2ols h PHE 515 N 0.00 1.05 -0.85 4.33 3.57 -1.83 -1.08 116.94 122.13 2ols h PHE 515 Ca -0.03 -0.54 0.01 0.00 3.53 0.00 0.00 57.97 60.94 2ols h PHE 515 Cb 1.20 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.76 2ols h PHE 515 CO 0.00 1.37 0.56 0.82 -2.23 0.00 0.00 178.31 178.83 2ols h ILE 516 N 0.44 1.20 0.00 1.41 2.04 -1.75 0.90 117.51 121.75 2ols h ILE 516 Ca -0.10 -0.39 -0.01 0.00 1.00 0.00 0.00 64.86 65.36 2ols h ILE 516 Cb 1.60 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.66 2ols h ILE 516 CO 0.19 0.21 -0.03 0.40 0.00 0.00 0.00 178.15 178.92 2ols h ILE 517 N 1.13 1.64 0.00 -0.67 2.04 -1.44 -1.00 117.51 119.21 2ols h ILE 517 Ca 0.32 -1.92 0.00 0.00 1.00 0.00 0.00 64.86 64.26 2ols h ILE 517 Cb -0.10 2.94 -0.00 0.00 -0.74 0.00 0.00 36.82 38.91 2ols h ILE 517 CO -0.08 0.50 -0.01 0.78 0.00 0.00 0.00 178.15 179.34 2ols h ASN 518 N -0.78 -0.04 0.00 1.72 2.35 -1.19 0.44 115.58 118.08 2ols h ASN 518 Ca -0.00 0.01 -0.32 0.00 -0.55 0.00 0.00 56.30 55.43 2ols h ASN 518 Cb 0.84 0.02 -0.06 0.00 0.05 0.00 0.00 38.32 39.17 2ols h ASN 518 CO 0.01 -0.02 -2.21 0.54 -1.65 0.00 0.00 177.43 174.09 2ols n ARG 519 N -5.11 1.00 0.01 0.81 1.74 0.30 -3.51 116.66 111.91 2ols n ARG 519 Ca -0.07 0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.04 2ols n ARG 519 Cb 0.05 -1.44 -0.10 0.00 -1.02 0.00 0.00 32.46 29.94 2ols n ARG 519 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2ols n GLN 520 N -2.78 0.63 -0.03 5.56 6.02 -0.44 -4.72 117.38 121.62 2ols n GLN 520 Ca -0.31 0.15 -0.05 0.00 -0.01 0.00 0.00 57.00 56.77 2ols n GLN 520 Cb 1.02 -1.74 -0.02 0.00 1.02 0.00 0.00 30.24 30.52 2ols n GLN 520 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 2ols n ILE 521 N -2.80 1.37 -0.98 5.09 5.41 -0.82 -5.02 119.36 121.61 2ols n ILE 521 Ca -0.12 0.25 0.00 0.00 1.00 0.00 0.00 62.75 63.88 2ols n ILE 521 Cb 0.84 -2.00 0.00 0.00 -0.71 0.00 0.00 39.64 37.78 2ols n ILE 521 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2ols n GLY 522 N 2.37 0.82 3.01 7.39 0.00 0.16 -4.99 105.19 113.95 2ols n GLY 522 Ca -0.08 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.75 2ols n GLY 522 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ols s ILE 523 N -3.36 0.71 0.17 -0.61 1.01 -1.26 -1.49 121.20 116.37 2ols s ILE 523 Ca 0.00 -0.37 -0.31 0.00 0.00 0.00 0.00 60.65 59.97 2ols s ILE 523 Cb 0.00 -0.60 -0.10 0.00 0.01 0.00 0.00 42.46 41.77 2ols s ILE 523 CO 0.00 0.21 1.49 -2.28 0.00 0.00 0.00 174.94 174.36 2ols s HIS 524 N -0.11 3.10 0.49 3.97 5.65 -0.62 -4.83 115.29 122.94 2ols s HIS 524 Ca 0.02 0.81 0.37 0.00 0.25 0.00 0.00 55.06 56.51 2ols s HIS 524 Cb -0.05 -3.84 1.95 0.00 -1.18 0.00 0.00 32.58 29.46 2ols s HIS 524 CO -0.00 -2.97 2.22 -1.00 -0.65 0.00 0.00 174.74 172.34 2ols h PRO 525 N 6.34 0.00 0.01 2.88 0.13 -1.96 -1.78 132.00 137.61 2ols h PRO 525 Ca -0.43 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.49 2ols h PRO 525 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 2ols h PRO 525 CO 0.87 0.03 -0.91 -0.22 -0.23 0.00 0.00 178.00 177.53 2ols h LYS 526 N 0.00 0.20 -0.86 0.86 3.64 -1.95 0.47 116.57 118.93 2ols h LYS 526 Ca -0.00 -0.23 0.03 0.00 -1.27 0.00 0.00 60.65 59.19 2ols h LYS 526 Cb 0.17 0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.01 2ols h LYS 526 CO 0.00 0.98 0.57 0.00 -2.27 0.00 0.00 179.45 178.73 2ols h ALA 527 N 0.94 1.46 -0.05 5.00 0.00 -1.60 0.13 119.26 125.15 2ols h ALA 527 Ca -0.05 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 2ols h ALA 527 Cb 1.55 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 19.04 2ols h ALA 527 CO 0.14 0.46 -0.42 -0.07 0.00 0.00 0.00 179.25 179.36 2ols h LEU 528 N 1.08 0.45 -1.38 0.00 3.38 -1.30 -2.03 115.31 115.50 2ols h LEU 528 Ca 0.34 -0.70 0.04 0.00 0.09 0.00 0.00 57.88 57.66 2ols h LEU 528 Cb 0.02 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 2ols h LEU 528 CO -0.10 1.08 0.45 -0.07 0.09 0.00 0.00 178.44 179.89 2ols h LEU 529 N -0.15 0.68 -3.54 1.67 4.07 -0.78 -2.84 115.31 114.42 2ols h LEU 529 Ca -0.04 -0.00 -0.36 0.00 0.08 0.00 0.00 57.88 57.55 2ols h LEU 529 Cb 1.10 -0.15 -0.24 0.00 1.08 0.00 0.00 40.66 42.44 2ols h LEU 529 CO 0.08 0.46 -0.32 -0.62 -1.08 0.00 0.00 178.44 176.96 2ols n GLU 530 N -4.46 2.61 -0.27 1.13 1.02 0.44 -4.81 120.64 116.30 2ols n GLU 530 Ca 0.09 -3.62 0.02 0.00 -0.02 0.00 0.00 57.16 53.63 2ols n GLU 530 Cb 0.16 -2.03 0.09 0.00 -0.02 0.00 0.00 31.44 29.64 2ols n GLU 530 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2ols h PHE 531 N 1.60 -0.43 0.00 -0.32 3.57 -1.11 -0.18 116.94 120.07 2ols h PHE 531 Ca 0.30 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.87 2ols h PHE 531 Cb 1.40 0.31 0.00 0.00 2.79 0.00 0.00 35.95 40.45 2ols h PHE 531 CO 0.98 -0.33 0.00 -0.25 -2.23 0.00 0.00 178.31 176.47 2ols n ASP 532 N -5.50 0.53 -0.04 0.41 8.00 -1.26 -1.77 116.55 116.93 2ols n ASP 532 Ca 0.10 0.70 0.12 0.00 0.71 0.00 0.00 54.79 56.42 2ols n ASP 532 Cb 0.39 -0.79 0.17 0.00 -0.02 0.00 0.00 41.12 40.87 2ols n ASP 532 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2ols n LYS 533 N -2.17 0.12 -2.55 -1.24 5.02 -0.08 -4.87 118.16 112.39 2ols n LYS 533 Ca 0.00 -0.08 -0.34 0.00 -2.02 0.00 0.00 58.31 55.88 2ols n LYS 533 Cb 0.10 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.58 2ols n LYS 533 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2ols s GLN 534 N -2.94 3.81 -0.60 1.97 1.11 -0.73 -5.01 119.66 117.27 2ols s GLN 534 Ca 0.12 1.34 -0.01 0.00 0.01 0.00 0.00 55.36 56.82 2ols s GLN 534 Cb 0.17 -2.10 -0.01 0.00 -1.01 0.00 0.00 33.01 30.07 2ols s GLN 534 CO 0.72 -0.42 0.56 -3.47 0.01 0.00 0.00 175.29 172.69 2ols n ASP 535 N -0.98 -6.23 -0.33 5.90 2.03 -1.26 -4.83 116.55 110.85 2ols n ASP 535 Ca 0.09 -0.15 0.05 0.00 0.52 0.00 0.00 54.79 55.31 2ols n ASP 535 Cb 0.53 -4.23 0.13 0.00 -0.72 0.00 0.00 41.12 36.82 2ols n ASP 535 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2ols n ASP 536 N -1.82 -0.34 0.25 1.67 9.92 -1.26 0.15 116.55 125.13 2ols n ASP 536 Ca -0.01 1.58 0.09 0.00 -0.53 0.00 0.00 54.79 55.92 2ols n ASP 536 Cb 0.52 -0.47 0.66 0.00 -0.64 0.00 0.00 41.12 41.18 2ols n ASP 536 CO 0.00 0.00 0.00 -0.08 0.13 0.00 0.00 177.20 177.25 2ols h GLU 537 N 0.00 0.00 0.08 -1.24 4.81 -2.00 -2.24 114.58 113.99 2ols h GLU 537 Ca 0.44 0.00 -0.35 0.00 -0.13 0.00 0.00 59.36 59.31 2ols h GLU 537 Cb 0.67 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.01 2ols h GLU 537 CO -0.94 0.09 -2.00 -0.11 -0.73 0.00 0.00 179.01 175.31 2ols n LEU 538 N -4.18 2.18 -0.24 1.64 7.94 0.40 -2.85 117.00 121.89 2ols n LEU 538 Ca -0.03 0.21 0.11 0.00 -1.11 0.00 0.00 56.01 55.19 2ols n LEU 538 Cb 0.17 -0.74 0.39 0.00 0.53 0.00 0.00 43.42 43.77 2ols n LEU 538 CO 0.33 0.75 1.22 0.11 -1.11 0.00 0.00 177.39 178.68 2ols h LYS 539 N 0.05 0.65 -0.32 1.96 1.57 0.58 -1.52 116.57 119.54 2ols h LYS 539 Ca -0.42 -0.04 -0.18 0.00 -1.87 0.00 0.00 60.65 58.15 2ols h LYS 539 Cb 2.03 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 34.19 2ols h LYS 539 CO 0.06 0.43 -0.50 0.00 -0.57 0.00 0.00 179.45 178.88 2ols h ALA 540 N 1.60 0.49 -0.29 3.86 0.00 -1.48 -2.49 119.26 120.96 2ols h ALA 540 Ca 0.41 -0.50 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 2ols h ALA 540 Cb 0.63 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2ols h ALA 540 CO -0.17 0.68 -0.01 1.49 0.00 0.00 0.00 179.25 181.23 2ols h GLU 541 N 0.70 0.52 -0.09 0.00 4.57 -1.24 -2.49 114.58 116.56 2ols h GLU 541 Ca 0.03 -0.17 -0.00 0.00 -1.18 0.00 0.00 59.36 58.03 2ols h GLU 541 Cb 1.10 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 29.65 2ols h GLU 541 CO 0.11 0.68 0.05 0.82 -1.18 0.00 0.00 179.01 179.50 2ols h ILE 542 N 0.31 1.07 -0.67 2.32 2.04 -1.34 -2.02 117.51 119.22 2ols h ILE 542 Ca 0.08 -0.19 0.05 0.00 1.00 0.00 0.00 64.86 65.80 2ols h ILE 542 Cb 0.45 1.04 -0.05 0.00 -0.74 0.00 0.00 36.82 37.52 2ols h ILE 542 CO 0.02 0.06 0.39 0.00 0.00 0.00 0.00 178.15 178.62 2ols h THR 543 N 0.07 1.01 -0.23 -0.27 1.03 -1.45 0.81 112.91 113.88 2ols h THR 543 Ca 0.03 -0.25 0.06 0.00 -0.01 0.00 0.00 66.41 66.24 2ols h THR 543 Cb 0.06 0.21 -0.07 0.00 -1.07 0.00 0.00 68.15 67.28 2ols h THR 543 CO -0.01 0.13 -0.24 -0.09 -0.01 0.00 0.00 175.52 175.30 2ols h ARG 544 N 0.73 -0.25 -0.09 0.00 2.43 -1.27 -2.87 114.38 113.07 2ols h ARG 544 Ca 0.29 0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.38 2ols h ARG 544 Cb 0.13 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 2ols h ARG 544 CO -0.16 -0.16 -0.37 0.00 -1.51 0.00 0.00 179.97 177.77 2ols h ARG 545 N -0.26 0.19 -0.51 0.20 3.08 -0.45 -2.91 114.38 113.72 2ols h ARG 545 Ca 0.13 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.10 2ols h ARG 545 Cb 0.46 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.50 2ols h ARG 545 CO -0.38 0.54 0.00 0.44 -1.07 0.00 0.00 179.97 179.50 2ols n ILE 546 N -4.07 0.78 -1.72 2.04 -5.35 0.15 -4.94 119.36 106.25 2ols n ILE 546 Ca -0.01 -0.56 -0.42 0.00 -0.27 0.00 0.00 62.75 61.48 2ols n ILE 546 Cb 0.44 0.05 -0.01 0.00 -1.74 0.00 0.00 39.64 38.38 2ols n ILE 546 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2ols n ALA 547 N 0.51 1.65 -0.89 -1.28 0.00 -1.10 -1.21 120.51 118.19 2ols n ALA 547 Ca 0.13 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.93 2ols n ALA 547 Cb 0.45 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.58 2ols n ALA 547 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ols n GLY 548 N 0.78 0.87 3.29 0.00 0.00 -1.22 -5.00 105.19 103.90 2ols n GLY 548 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 2ols n GLY 548 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ols s TYR 549 N -3.42 1.78 0.32 1.61 2.02 -0.35 -4.91 117.35 114.41 2ols s TYR 549 Ca 0.00 -0.43 0.12 0.00 -0.37 0.00 0.00 57.07 56.39 2ols s TYR 549 Cb 0.00 -0.97 0.56 0.00 -0.40 0.00 0.00 41.96 41.16 2ols s TYR 549 CO 0.00 0.22 1.73 0.00 -1.57 0.00 0.00 175.55 175.93 2ols h ALA 550 N 3.98 1.19 -2.74 3.71 0.00 -1.91 -3.46 119.26 120.03 2ols h ALA 550 Ca -0.46 -0.44 0.06 0.00 0.00 0.00 0.00 54.91 54.08 2ols h ALA 550 Cb 1.18 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.80 2ols h ALA 550 CO 0.41 0.60 0.32 -1.54 0.00 0.00 0.00 179.25 179.04 2ols s SER 551 N -6.87 -0.38 0.25 0.00 1.04 -1.26 -5.01 113.70 101.47 2ols s SER 551 Ca -0.02 -0.23 -0.03 0.00 0.48 0.00 0.00 55.95 56.14 2ols s SER 551 Cb 0.14 0.57 0.50 0.00 0.10 0.00 0.00 66.02 67.32 2ols s SER 551 CO 0.74 -0.99 1.71 -0.65 0.98 0.00 0.00 173.24 175.03 2ols h PRO 552 N 2.00 0.37 -0.02 4.02 0.11 -1.89 -1.09 132.00 135.50 2ols h PRO 552 Ca -0.26 -0.02 -0.23 0.00 0.11 0.00 0.00 66.00 65.60 2ols h PRO 552 Cb 1.27 -0.08 0.01 0.00 0.11 0.00 0.00 31.00 32.30 2ols h PRO 552 CO 0.30 0.25 -0.93 -0.39 -0.21 0.00 0.00 178.00 177.02 2ols h VAL 553 N 0.38 1.36 -0.65 3.15 -1.51 -1.96 -3.09 116.25 113.93 2ols h VAL 553 Ca 0.43 -2.33 0.01 0.00 -1.23 0.00 0.00 66.70 63.58 2ols h VAL 553 Cb 0.71 2.34 -0.03 0.00 -2.13 0.00 0.00 31.29 32.18 2ols h VAL 553 CO -0.45 0.71 0.43 0.44 -1.23 0.00 0.00 177.57 177.46 2ols h ASP 554 N 0.30 0.74 -0.34 4.19 5.19 -1.91 -1.91 116.42 122.67 2ols h ASP 554 Ca -0.08 -0.02 0.04 0.00 -0.62 0.00 0.00 57.03 56.35 2ols h ASP 554 Cb 1.56 -0.18 -0.04 0.00 0.18 0.00 0.00 39.33 40.85 2ols h ASP 554 CO 0.17 0.53 0.13 0.15 -3.12 0.00 0.00 179.24 177.10 2ols h PHE 555 N 0.87 0.23 0.14 4.55 3.57 -1.13 0.16 116.94 125.33 2ols h PHE 555 Ca 0.24 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.75 2ols h PHE 555 Cb -0.08 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 38.61 2ols h PHE 555 CO -0.00 0.11 -0.07 -0.92 -2.23 0.00 0.00 178.31 175.20 2ols h TYR 556 N 0.28 -0.18 -0.14 0.41 3.20 -1.35 -1.28 116.97 117.91 2ols h TYR 556 Ca 0.15 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.03 2ols h TYR 556 Cb 0.11 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.43 2ols h TYR 556 CO -0.13 0.10 0.04 0.28 -1.64 0.00 0.00 178.16 176.81 2ols h VAL 557 N -0.46 0.97 -0.51 1.81 2.07 -1.39 -2.57 116.25 116.18 2ols h VAL 557 Ca -0.02 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 2ols h VAL 557 Cb 0.36 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 2ols h VAL 557 CO 0.03 0.02 0.32 0.44 0.02 0.00 0.00 177.57 178.40 2ols h ASP 558 N 0.11 0.60 -0.13 0.57 5.19 -0.91 -0.51 116.42 121.35 2ols h ASP 558 Ca 0.06 -0.05 -0.11 0.00 -0.62 0.00 0.00 57.03 56.31 2ols h ASP 558 Cb 0.03 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.38 2ols h ASP 558 CO -0.06 0.47 -0.29 0.11 -3.12 0.00 0.00 179.24 176.35 2ols h LYS 559 N 0.68 0.60 -0.27 3.56 1.79 -1.22 0.11 116.57 121.83 2ols h LYS 559 Ca 0.18 -0.25 -0.03 0.00 -2.18 0.00 0.00 60.65 58.37 2ols h LYS 559 Cb -0.03 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.59 2ols h LYS 559 CO -0.04 0.82 0.04 0.82 -1.08 0.00 0.00 179.45 180.02 2ols h ILE 560 N 0.52 1.23 -0.41 1.86 2.04 -1.18 -0.51 117.51 121.06 2ols h ILE 560 Ca 0.07 -0.78 0.04 0.00 1.00 0.00 0.00 64.86 65.19 2ols h ILE 560 Cb 0.76 1.23 -0.04 0.00 -0.74 0.00 0.00 36.82 38.03 2ols h ILE 560 CO 0.06 0.25 0.18 0.00 0.00 0.00 0.00 178.15 178.64 2ols h ALA 561 N 0.86 0.50 -0.17 1.87 0.00 -0.75 0.87 119.26 122.45 2ols h ALA 561 Ca 0.08 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.04 2ols h ALA 561 Cb 0.33 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2ols h ALA 561 CO 0.01 -0.20 0.06 0.93 0.00 0.00 0.00 179.25 180.05 2ols h GLU 562 N 0.37 0.14 -0.42 0.00 5.08 -0.72 0.23 114.58 119.26 2ols h GLU 562 Ca 0.18 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.51 2ols h GLU 562 Cb 0.13 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2ols h GLU 562 CO -0.16 0.09 0.15 0.78 -1.00 0.00 0.00 179.01 178.88 2ols h GLY 563 N 0.14 0.69 0.98 -3.84 0.00 -0.49 -1.17 103.07 99.38 2ols h GLY 563 Ca 0.07 -0.39 -0.18 0.00 0.00 0.00 0.00 47.33 46.83 2ols h GLY 563 CO -0.08 0.36 -0.67 -2.08 0.00 0.00 0.00 176.54 174.08 2ols h VAL 564 N 0.54 1.34 -0.89 4.60 2.07 -0.74 -2.28 116.25 120.88 2ols h VAL 564 Ca 0.14 -1.97 0.07 0.00 0.82 0.00 0.00 66.70 65.76 2ols h VAL 564 Cb 0.22 2.24 -0.06 0.00 -1.52 0.00 0.00 31.29 32.16 2ols h VAL 564 CO -0.01 0.60 0.56 0.00 0.02 0.00 0.00 177.57 178.74 2ols h ALA 565 N 0.46 1.24 0.25 1.67 0.00 -0.50 -0.60 119.26 121.78 2ols h ALA 565 Ca -0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2ols h ALA 565 Cb 1.32 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2ols h ALA 565 CO 0.14 0.30 -0.12 1.15 0.00 0.00 0.00 179.25 180.71 2ols h THR 566 N 1.00 0.78 -0.39 0.00 2.02 -1.13 0.36 112.91 115.55 2ols h THR 566 Ca 0.39 -0.16 0.04 0.00 0.77 0.00 0.00 66.41 67.46 2ols h THR 566 Cb 0.19 0.87 -0.04 0.00 -1.74 0.00 0.00 68.15 67.44 2ols h THR 566 CO -0.18 0.03 0.17 -0.07 0.37 0.00 0.00 175.52 175.84 2ols h LEU 567 N -0.41 0.22 -0.92 2.58 3.38 -1.24 -1.75 115.31 117.16 2ols h LEU 567 Ca -0.03 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 2ols h LEU 567 Cb 0.31 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 2ols h LEU 567 CO 0.06 0.16 0.06 0.00 0.09 0.00 0.00 178.44 178.81 2ols h ALA 568 N 1.23 1.11 -0.06 1.53 0.00 -1.01 -2.71 119.26 119.35 2ols h ALA 568 Ca 0.17 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2ols h ALA 568 Cb 0.12 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2ols h ALA 568 CO -0.15 0.58 -0.26 0.00 0.00 0.00 0.00 179.25 179.41 2ols h ALA 569 N 1.26 1.46 -0.42 0.00 0.00 -0.03 -1.38 119.26 120.14 2ols h ALA 569 Ca 0.16 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2ols h ALA 569 Cb 0.40 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2ols h ALA 569 CO 0.01 0.39 0.06 0.66 0.00 0.00 0.00 179.25 180.38 2ols h SER 570 N 0.09 0.59 -0.00 0.00 4.64 -0.98 -3.09 113.55 114.80 2ols h SER 570 Ca 0.01 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 2ols h SER 570 Cb 0.52 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2ols h SER 570 CO 0.04 0.62 -0.01 1.33 -0.87 0.00 0.00 176.83 177.94 2ols n VAL 571 N -4.29 0.00 -1.55 0.95 0.24 -1.22 -4.26 118.33 108.21 2ols n VAL 571 Ca 0.02 -0.49 -0.52 0.00 -2.04 0.00 0.00 64.34 61.31 2ols n VAL 571 Cb 0.23 1.06 -0.05 0.00 -1.47 0.00 0.00 33.84 33.60 2ols n VAL 571 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ols n TYR 572 N 0.06 1.02 -0.96 6.34 4.19 -0.52 0.24 117.16 127.53 2ols n TYR 572 Ca 0.02 0.79 -0.17 0.00 3.31 0.00 0.00 57.90 61.84 2ols n TYR 572 Cb 0.07 -2.22 0.20 0.00 0.49 0.00 0.00 39.34 37.88 2ols n TYR 572 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 2ols n PRO 573 N 1.81 2.55 -2.49 2.98 -0.04 -1.26 -5.04 135.00 133.51 2ols n PRO 573 Ca 0.17 -2.74 -0.30 0.00 -0.04 0.00 0.00 63.50 60.59 2ols n PRO 573 Cb 0.19 -2.09 -0.01 0.00 -0.04 0.00 0.00 33.50 31.55 2ols n PRO 573 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2ols s ARG 574 N -2.91 3.71 0.21 0.54 0.52 0.14 -4.75 118.95 116.40 2ols s ARG 574 Ca 0.51 0.55 -0.32 0.00 -0.52 0.00 0.00 55.73 55.95 2ols s ARG 574 Cb 0.42 -2.27 -0.13 0.00 0.52 0.00 0.00 34.95 33.50 2ols s ARG 574 CO 0.11 -0.25 1.65 1.17 0.02 0.00 0.00 175.30 178.00 2ols n LYS 575 N -1.94 2.56 -3.89 3.54 4.81 -1.26 -4.78 118.16 117.20 2ols n LYS 575 Ca 0.03 0.92 -0.30 0.00 -0.87 0.00 0.00 58.31 58.10 2ols n LYS 575 Cb 0.54 -2.72 -0.16 0.00 0.02 0.00 0.00 35.03 32.71 2ols n LYS 575 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2ols s THR 576 N 0.84 1.34 -0.49 3.15 2.01 -0.05 -0.84 115.64 121.60 2ols s THR 576 Ca 0.74 -1.14 -0.19 0.00 0.31 0.00 0.00 61.69 61.40 2ols s THR 576 Cb -0.56 -1.68 0.05 0.00 0.01 0.00 0.00 72.50 70.32 2ols s THR 576 CO 0.37 -0.17 0.61 -0.63 -0.69 0.00 0.00 174.62 174.11 2ols s ILE 577 N 1.48 4.89 -0.38 1.82 1.01 -0.15 -0.73 121.20 129.14 2ols s ILE 577 Ca -0.04 -0.40 -0.21 0.00 0.00 0.00 0.00 60.65 60.01 2ols s ILE 577 Cb -0.18 -4.26 0.01 0.00 0.01 0.00 0.00 42.46 38.04 2ols s ILE 577 CO -0.08 -0.74 0.65 -0.69 0.00 0.00 0.00 174.94 174.09 2ols s VAL 578 N 2.60 4.86 -0.23 2.92 1.01 0.12 -1.14 120.40 130.53 2ols s VAL 578 Ca 0.16 0.48 -0.29 0.00 0.00 0.00 0.00 61.98 62.33 2ols s VAL 578 Cb -0.18 -4.12 0.00 0.00 0.00 0.00 0.00 36.38 32.08 2ols s VAL 578 CO 0.13 -0.40 1.14 -0.60 0.00 0.00 0.00 175.10 175.37 2ols s ARG 579 N 2.77 4.19 1.08 2.72 3.52 -0.69 -0.24 118.95 132.31 2ols s ARG 579 Ca 0.24 1.39 -0.12 0.00 -0.13 0.00 0.00 55.73 57.12 2ols s ARG 579 Cb -0.14 -3.72 0.24 0.00 -1.56 0.00 0.00 34.95 29.77 2ols s ARG 579 CO 0.16 -0.74 1.07 -1.64 -0.81 0.00 0.00 175.30 173.33 2ols s MET 580 N 3.46 -0.30 0.16 5.12 -1.94 -0.78 -3.84 119.30 121.18 2ols s MET 580 Ca 0.49 1.09 -0.31 0.00 -1.71 0.00 0.00 55.69 55.25 2ols s MET 580 Cb -0.17 -1.61 -0.09 0.00 2.01 0.00 0.00 34.83 34.98 2ols s MET 580 CO 0.12 -3.39 1.39 -1.54 -0.01 0.00 0.00 175.02 171.59 2ols s SER 581 N -2.55 6.80 -0.26 3.03 1.04 -1.26 -4.73 113.70 115.76 2ols s SER 581 Ca 0.68 2.43 0.11 0.00 0.48 0.00 0.00 55.95 59.64 2ols s SER 581 Cb -0.24 -2.60 0.50 0.00 0.10 0.00 0.00 66.02 63.78 2ols s SER 581 CO 0.62 -0.64 1.44 -0.67 0.98 0.00 0.00 173.24 174.98 2ols n ASP 582 N 3.32 2.70 -4.75 7.02 2.03 -1.26 -4.54 116.55 121.06 2ols n ASP 582 Ca 0.09 -3.62 -0.41 0.00 0.52 0.00 0.00 54.79 51.38 2ols n ASP 582 Cb 0.42 -0.61 -0.03 0.00 -0.72 0.00 0.00 41.12 40.17 2ols n ASP 582 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 2ols s PHE 583 N -3.16 3.32 0.62 -0.67 0.08 -1.26 -4.91 117.98 111.99 2ols s PHE 583 Ca 0.44 1.47 -0.12 0.00 0.12 0.00 0.00 56.93 58.84 2ols s PHE 583 Cb 0.39 -3.50 -0.04 0.00 -0.57 0.00 0.00 43.02 39.31 2ols s PHE 583 CO 0.01 -1.33 1.03 0.15 -0.10 0.00 0.00 175.22 174.98 2ols s LYS 584 N -1.12 3.48 0.50 0.44 1.02 -1.26 -4.57 119.74 118.24 2ols s LYS 584 Ca 0.50 0.87 0.20 0.00 0.02 0.00 0.00 55.97 57.55 2ols s LYS 584 Cb -0.35 -2.07 1.27 0.00 -0.52 0.00 0.00 37.83 36.16 2ols s LYS 584 CO 0.44 -0.66 2.08 0.66 -0.92 0.00 0.00 175.35 176.95 2ols h SER 585 N -0.14 0.00 0.59 2.83 4.64 -1.86 -1.14 113.55 118.47 2ols h SER 585 Ca -0.45 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.86 2ols h SER 585 Cb 1.20 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2ols h SER 585 CO 0.60 0.11 -0.07 -0.55 -0.87 0.00 0.00 176.83 176.05 2ols h ASN 586 N 0.00 0.00 0.37 4.97 7.08 -1.90 0.07 115.58 126.17 2ols h ASN 586 Ca -0.00 0.00 -0.32 0.00 -3.08 0.00 0.00 56.30 52.90 2ols h ASN 586 Cb 0.21 0.00 0.01 0.00 -2.08 0.00 0.00 38.32 36.46 2ols h ASN 586 CO 0.01 0.07 -1.55 -0.33 -2.08 0.00 0.00 177.43 173.56 2ols h GLU 587 N 0.00 0.34 -0.33 4.14 5.08 -1.59 -3.16 114.58 119.05 2ols h GLU 587 Ca -0.00 -0.58 -0.06 0.00 -1.00 0.00 0.00 59.36 57.72 2ols h GLU 587 Cb 0.39 0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 2ols h GLU 587 CO 0.01 1.24 -0.05 1.88 -1.00 0.00 0.00 179.01 181.08 2ols h TYR 588 N 0.09 0.57 -0.63 4.33 0.05 -1.25 -3.06 116.97 117.08 2ols h TYR 588 Ca -0.26 -0.07 0.02 0.00 0.05 0.00 0.00 58.73 58.47 2ols h TYR 588 Cb 2.06 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 39.61 2ols h TYR 588 CO 0.08 0.59 0.42 0.00 -1.05 0.00 0.00 178.16 178.21 2ols h ALA 589 N 1.44 1.60 0.00 3.88 0.00 -1.03 -2.90 119.26 122.25 2ols h ALA 589 Ca 0.10 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2ols h ALA 589 Cb 0.41 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2ols h ALA 589 CO 0.02 0.35 0.00 0.09 0.00 0.00 0.00 179.25 179.71 2ols n ASN 590 N -4.45 0.66 -4.76 0.00 5.03 -1.15 -2.89 115.26 107.70 2ols n ASN 590 Ca 0.07 0.61 -0.31 0.00 0.87 0.00 0.00 54.58 55.82 2ols n ASN 590 Cb 0.09 -0.77 0.09 0.00 -1.02 0.00 0.00 39.78 38.17 2ols n ASN 590 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2ols s LEU 591 N -4.35 3.03 0.15 3.41 1.43 -1.10 -4.95 118.68 116.29 2ols s LEU 591 Ca 0.08 1.85 -0.30 0.00 -1.03 0.00 0.00 54.13 54.72 2ols s LEU 591 Cb 0.11 -4.52 -0.08 0.00 0.03 0.00 0.00 46.19 41.73 2ols s LEU 591 CO 0.48 -2.09 1.28 0.68 0.23 0.00 0.00 176.35 176.94 2ols s VAL 592 N -2.88 3.48 0.00 -1.59 -7.23 -0.56 -2.08 120.40 109.54 2ols s VAL 592 Ca 0.62 1.15 0.00 0.00 -1.81 0.00 0.00 61.98 61.93 2ols s VAL 592 Cb -0.17 -3.73 0.00 0.00 0.56 0.00 0.00 36.38 33.03 2ols s VAL 592 CO 0.56 0.14 0.00 0.61 -0.31 0.00 0.00 175.10 176.09 2ols n GLY 593 N 2.80 0.51 0.12 2.32 0.00 -1.26 -1.58 105.19 108.10 2ols n GLY 593 Ca 0.08 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.92 2ols n GLY 593 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ols n GLY 594 N -2.97 -0.67 0.28 -0.02 0.00 -0.88 -4.38 105.19 96.54 2ols n GLY 594 Ca 0.00 -0.22 0.03 0.00 0.00 0.00 0.00 46.02 45.82 2ols n GLY 594 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2ols h ASN 595 N 0.06 0.49 0.00 1.61 4.21 -1.77 -0.70 115.58 119.48 2ols h ASN 595 Ca -0.39 0.07 0.00 0.00 1.21 0.00 0.00 56.30 57.19 2ols h ASN 595 Cb 2.03 -0.02 0.00 0.00 -1.12 0.00 0.00 38.32 39.22 2ols h ASN 595 CO 0.09 0.26 0.02 1.62 -1.29 0.00 0.00 177.43 178.14 2ols h VAL 596 N 0.62 0.00 -0.01 2.81 3.04 -1.92 -2.17 116.25 118.62 2ols h VAL 596 Ca 0.38 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.07 2ols h VAL 596 Cb 0.43 0.95 0.00 0.00 -2.01 0.00 0.00 31.29 30.66 2ols h VAL 596 CO -0.29 0.00 -0.65 -1.22 -1.01 0.00 0.00 177.57 174.40 2ols n TYR 597 N -3.02 0.00 -3.57 3.17 4.01 -0.29 -4.81 117.16 112.65 2ols n TYR 597 Ca -0.03 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.43 2ols n TYR 597 Cb 0.09 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.01 2ols n TYR 597 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 2ols s GLU 598 N -2.55 1.37 0.61 -0.72 0.41 -0.82 -5.07 118.70 111.93 2ols s GLU 598 Ca 0.13 -2.41 -0.19 0.00 -0.41 0.00 0.00 54.97 52.09 2ols s GLU 598 Cb 0.16 -2.08 -0.03 0.00 -1.78 0.00 0.00 34.13 30.41 2ols s GLU 598 CO 0.65 -1.33 1.27 -2.14 -0.49 0.00 0.00 175.26 173.22 2ols s PRO 599 N -0.29 2.80 0.30 0.39 0.02 -1.26 -4.83 135.00 132.13 2ols s PRO 599 Ca 0.28 2.01 -0.30 0.00 0.02 0.00 0.00 61.00 63.01 2ols s PRO 599 Cb -0.03 -1.94 -0.11 0.00 0.02 0.00 0.00 34.50 32.44 2ols s PRO 599 CO -0.16 -1.39 1.54 -1.58 -0.33 0.00 0.00 177.00 175.08 2ols s HIS 600 N -1.45 2.78 0.04 6.54 5.65 -1.26 -4.90 115.29 122.69 2ols s HIS 600 Ca 0.79 0.92 0.05 0.00 0.25 0.00 0.00 55.06 57.07 2ols s HIS 600 Cb -0.35 -4.00 -0.04 0.00 -1.18 0.00 0.00 32.58 27.01 2ols s HIS 600 CO 0.38 -3.25 -0.08 -1.21 -0.65 0.00 0.00 174.74 169.93 2ols s GLU 601 N -0.83 2.39 0.21 2.88 2.02 -1.26 -5.05 118.70 119.07 2ols s GLU 601 Ca 0.60 -0.84 -0.05 0.00 0.02 0.00 0.00 54.97 54.70 2ols s GLU 601 Cb -0.46 -2.42 0.17 0.00 0.10 0.00 0.00 34.13 31.52 2ols s GLU 601 CO 0.50 0.57 1.63 0.93 0.02 0.00 0.00 175.26 178.91 2ols h GLU 602 N 4.22 0.83 -2.59 1.61 4.39 -2.03 -3.38 114.58 117.64 2ols h GLU 602 Ca -0.48 -0.32 -0.60 0.00 0.34 0.00 0.00 59.36 58.30 2ols h GLU 602 Cb 1.17 -0.05 -0.39 0.00 -0.10 0.00 0.00 28.75 29.38 2ols h GLU 602 CO 0.53 0.95 -0.86 -0.80 -1.16 0.00 0.00 179.01 177.67 2ols s ASN 603 N -6.72 2.45 0.41 1.42 0.01 -1.26 -5.02 114.94 106.24 2ols s ASN 603 Ca -0.10 -3.15 0.16 0.00 -0.71 0.00 0.00 52.86 49.07 2ols s ASN 603 Cb 0.13 -0.74 1.05 0.00 0.41 0.00 0.00 41.25 42.10 2ols s ASN 603 CO 0.84 -0.17 1.87 -0.65 -1.51 0.00 0.00 177.10 177.48 2ols h PRO 604 N 5.77 0.43 -0.18 -0.60 0.11 -1.99 -1.69 132.00 133.85 2ols h PRO 604 Ca 0.21 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 66.34 2ols h PRO 604 Cb 0.88 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.89 2ols h PRO 604 CO 0.45 0.28 0.17 0.52 -0.21 0.00 0.00 178.00 179.21 2ols h MET 605 N 0.44 0.00 -0.17 1.05 2.86 -1.97 -2.52 114.93 114.61 2ols h MET 605 Ca 0.45 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.09 2ols h MET 605 Cb 1.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.71 2ols h MET 605 CO -0.17 0.00 0.00 1.28 1.06 0.00 0.00 176.91 179.08 2ols n LEU 606 N -4.03 2.71 0.00 1.22 4.77 -0.65 -5.03 117.00 116.00 2ols n LEU 606 Ca 0.01 -2.32 0.00 0.00 -0.03 0.00 0.00 56.01 53.67 2ols n LEU 606 Cb 0.30 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2ols n LEU 606 CO 0.30 0.64 0.00 0.61 -1.33 0.00 0.00 177.39 177.61 2ols n GLY 607 N -0.26 2.74 3.52 -0.72 0.00 -0.95 -5.01 105.19 104.52 2ols n GLY 607 Ca 0.10 -1.81 -0.42 0.00 0.00 0.00 0.00 46.02 43.89 2ols n GLY 607 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2ols s PHE 608 N 3.53 2.45 0.03 1.61 5.36 -1.26 -4.89 117.98 124.80 2ols s PHE 608 Ca 0.00 -0.17 -0.27 0.00 -0.96 0.00 0.00 56.93 55.52 2ols s PHE 608 Cb 0.00 -4.49 0.09 0.00 -0.34 0.00 0.00 43.02 38.28 2ols s PHE 608 CO 0.00 -1.88 0.82 -0.98 -1.46 0.00 0.00 175.22 171.72 2ols s ARG 609 N 5.09 0.93 3.58 10.12 1.70 -1.26 -3.95 118.95 135.16 2ols s ARG 609 Ca 0.31 -0.34 0.00 0.00 -0.47 0.00 0.00 55.73 55.23 2ols s ARG 609 Cb -0.11 0.43 0.00 0.00 -0.57 0.00 0.00 34.95 34.70 2ols s ARG 609 CO 0.14 -0.41 0.00 0.41 -1.08 0.00 0.00 175.30 174.37 2ols n GLY 610 N -0.27 0.36 0.34 3.88 0.00 -1.26 -3.65 105.19 104.60 2ols n GLY 610 Ca -0.11 -0.86 0.11 0.00 0.00 0.00 0.00 46.02 45.16 2ols n GLY 610 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ols h ALA 611 N -0.46 1.56 -0.76 4.61 0.00 -1.37 -1.03 119.26 121.82 2ols h ALA 611 Ca 0.00 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2ols h ALA 611 Cb 0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 2ols h ALA 611 CO 0.00 -0.07 0.45 0.00 0.00 0.00 0.00 179.25 179.63 2ols h ALA 612 N 1.63 0.97 -0.58 0.00 0.00 -1.77 -1.03 119.26 118.48 2ols h ALA 612 Ca 0.55 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 55.28 2ols h ALA 612 Cb 0.84 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2ols h ALA 612 CO -0.39 0.44 0.03 -0.09 0.00 0.00 0.00 179.25 179.24 2ols h ARG 613 N 1.04 0.98 -0.28 0.00 2.43 -1.33 -2.36 114.38 114.85 2ols h ARG 613 Ca 0.27 -0.28 -0.06 0.00 -0.81 0.00 0.00 59.98 59.10 2ols h ARG 613 Cb -0.03 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 2ols h ARG 613 CO -0.05 0.95 -0.09 1.88 -1.51 0.00 0.00 179.97 181.15 2ols h TYR 614 N 0.90 0.48 -0.01 2.20 0.05 -0.01 -3.17 116.97 117.41 2ols h TYR 614 Ca 0.17 -0.06 0.00 0.00 0.05 0.00 0.00 58.73 58.89 2ols h TYR 614 Cb 0.49 -0.13 0.00 0.00 1.01 0.00 0.00 36.73 38.10 2ols h TYR 614 CO 0.03 0.54 -0.29 1.33 -1.05 0.00 0.00 178.16 178.72 2ols n VAL 615 N -4.24 0.00 -2.10 -2.88 0.24 -0.74 -4.41 118.33 104.20 2ols n VAL 615 Ca 0.01 -0.35 -0.42 0.00 -2.04 0.00 0.00 64.34 61.53 2ols n VAL 615 Cb 0.29 1.22 -0.03 0.00 -1.47 0.00 0.00 33.84 33.85 2ols n VAL 615 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ols s ALA 616 N -1.85 3.64 0.43 2.33 0.00 -0.89 -4.89 121.76 120.53 2ols s ALA 616 Ca 0.14 1.18 0.17 0.00 0.00 0.00 0.00 51.96 53.46 2ols s ALA 616 Cb 0.13 -3.56 1.09 0.00 0.00 0.00 0.00 23.12 20.78 2ols s ALA 616 CO 0.38 -0.67 1.89 0.22 0.00 0.00 0.00 175.76 177.58 2ols h ASP 617 N 6.84 0.38 0.60 0.00 3.58 -1.90 0.98 116.42 126.91 2ols h ASP 617 Ca -0.42 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.06 2ols h ASP 617 Cb 1.21 -0.04 -0.00 0.00 1.72 0.00 0.00 39.33 42.21 2ols h ASP 617 CO 0.88 0.17 -0.00 -0.55 -2.88 0.00 0.00 179.24 176.86 2ols h ASN 618 N 0.39 0.00 0.00 2.28 -0.00 -1.94 -3.32 115.58 112.99 2ols h ASN 618 Ca 0.41 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.71 2ols h ASN 618 Cb 1.03 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.35 2ols h ASN 618 CO -0.14 0.00 -0.20 0.49 -0.00 0.00 0.00 177.43 177.58 2ols n PHE 619 N -3.09 0.00 0.11 4.14 3.72 0.28 -4.88 117.46 117.74 2ols n PHE 619 Ca -0.01 -0.16 -0.04 0.00 -0.05 0.00 0.00 57.45 57.19 2ols n PHE 619 Cb 0.21 -0.04 0.12 0.00 -0.94 0.00 0.00 39.48 38.83 2ols n PHE 619 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 2ols h LYS 620 N 0.00 0.10 0.00 -1.08 2.10 -1.48 -2.49 116.57 113.72 2ols h LYS 620 Ca 0.00 -0.08 -0.02 0.00 -2.00 0.00 0.00 60.65 58.56 2ols h LYS 620 Cb 1.11 0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 32.45 2ols h LYS 620 CO 0.00 0.73 -0.08 -0.44 -2.00 0.00 0.00 179.45 177.65 2ols h ASP 621 N 0.07 0.00 0.29 7.07 5.19 -1.89 -1.35 116.42 125.80 2ols h ASP 621 Ca -0.01 0.00 -0.34 0.00 -0.62 0.00 0.00 57.03 56.06 2ols h ASP 621 Cb 1.18 0.00 0.04 0.00 0.18 0.00 0.00 39.33 40.73 2ols h ASP 621 CO 0.09 0.08 -1.48 0.00 -3.12 0.00 0.00 179.24 174.82 2ols h PHE 623 N 0.14 0.98 -0.70 0.00 3.57 -1.33 -2.35 116.94 117.25 2ols h PHE 623 Ca -0.25 -0.05 0.14 0.00 3.53 0.00 0.00 57.97 61.34 2ols h PHE 623 Cb 2.16 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 40.56 2ols h PHE 623 CO 0.12 0.73 0.47 0.00 -2.23 0.00 0.00 178.31 177.40 2ols h ALA 624 N 1.16 2.17 -0.13 2.41 0.00 -1.32 -0.66 119.26 122.87 2ols h ALA 624 Ca 0.23 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 2ols h ALA 624 Cb 0.11 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2ols h ALA 624 CO -0.03 -0.35 -0.16 -0.07 0.00 0.00 0.00 179.25 178.64 2ols h LEU 625 N 0.35 0.37 -0.88 0.00 4.07 -1.37 -1.16 115.31 116.68 2ols h LEU 625 Ca 0.34 -0.50 -0.09 0.00 0.08 0.00 0.00 57.88 57.71 2ols h LEU 625 Cb 0.84 -0.10 -0.02 0.00 1.08 0.00 0.00 40.66 42.46 2ols h LEU 625 CO -0.09 0.80 -0.15 -0.08 -1.08 0.00 0.00 178.44 177.84 2ols h GLU 626 N -0.05 0.67 -0.60 1.13 4.81 -1.16 -2.82 114.58 116.56 2ols h GLU 626 Ca 0.02 -0.22 -0.09 0.00 -0.13 0.00 0.00 59.36 58.94 2ols h GLU 626 Cb 0.70 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.01 2ols h GLU 626 CO 0.04 0.79 0.03 0.00 -0.73 0.00 0.00 179.01 179.14 2ols h LYS 628 N 0.94 1.32 -0.02 0.00 3.64 -1.08 -1.40 116.57 119.96 2ols h LYS 628 Ca 0.18 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2ols h LYS 628 Cb 0.50 -0.29 -0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2ols h LYS 628 CO 0.02 0.88 0.00 0.00 -2.27 0.00 0.00 179.45 178.09 2ols h ALA 629 N 1.37 0.03 -0.77 5.00 0.00 -1.31 -2.26 119.26 121.32 2ols h ALA 629 Ca 0.36 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 2ols h ALA 629 Cb -0.14 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 2ols h ALA 629 CO -0.08 -0.34 0.37 -0.07 0.00 0.00 0.00 179.25 179.14 2ols h LEU 630 N -0.22 1.00 -0.60 0.00 3.38 -1.35 -2.18 115.31 115.34 2ols h LEU 630 Ca 0.01 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.79 2ols h LEU 630 Cb 0.26 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2ols h LEU 630 CO 0.00 0.85 0.15 0.50 0.09 0.00 0.00 178.44 180.03 2ols h LYS 631 N 1.08 0.96 -0.26 1.13 3.64 -1.25 -2.25 116.57 119.61 2ols h LYS 631 Ca 0.26 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2ols h LYS 631 Cb 0.11 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2ols h LYS 631 CO -0.03 0.88 0.17 -0.09 -2.27 0.00 0.00 179.45 178.11 2ols h ARG 632 N 0.88 0.35 -0.72 1.90 2.43 -1.19 0.31 114.38 118.35 2ols h ARG 632 Ca 0.19 -0.03 0.12 0.00 -0.81 0.00 0.00 59.98 59.45 2ols h ARG 632 Cb 0.35 -0.08 -0.08 0.00 -0.42 0.00 0.00 29.97 29.74 2ols h ARG 632 CO 0.00 0.25 0.30 0.28 -1.51 0.00 0.00 179.97 179.30 2ols h VAL 633 N 0.35 0.73 0.08 0.20 2.07 -1.15 -0.54 116.25 117.99 2ols h VAL 633 Ca 0.10 -0.17 -0.17 0.00 0.82 0.00 0.00 66.70 67.28 2ols h VAL 633 Cb -0.02 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 29.96 2ols h VAL 633 CO -0.02 0.09 -0.81 0.03 0.02 0.00 0.00 177.57 176.88 2ols h ARG 634 N 0.48 0.17 0.00 1.57 3.08 -1.23 -0.59 114.38 117.86 2ols h ARG 634 Ca 0.38 -0.28 -0.07 0.00 0.07 0.00 0.00 59.98 60.08 2ols h ARG 634 Cb 0.51 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 2ols h ARG 634 CO -0.35 1.14 -0.98 -0.44 -1.07 0.00 0.00 179.97 178.26 2ols h ASP 635 N -0.60 0.00 0.00 7.04 3.32 -0.37 -3.08 116.42 122.73 2ols h ASP 635 Ca -0.17 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.76 2ols h ASP 635 Cb 1.46 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.99 2ols h ASP 635 CO 0.04 0.24 -1.25 -0.62 -1.72 0.00 0.00 179.24 175.93 2ols n GLU 636 N -2.85 0.18 0.09 3.56 1.02 -0.35 -4.65 120.64 117.64 2ols n GLU 636 Ca -0.03 0.08 0.11 0.00 -0.02 0.00 0.00 57.16 57.30 2ols n GLU 636 Cb 0.66 -0.80 0.44 0.00 -0.02 0.00 0.00 31.44 31.73 2ols n GLU 636 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 2ols n MET 637 N -3.46 0.14 -1.35 3.49 2.81 -0.39 -4.21 117.12 114.16 2ols n MET 637 Ca -0.14 0.35 -0.09 0.00 -1.81 0.00 0.00 57.70 56.01 2ols n MET 637 Cb 0.53 -1.76 -0.04 0.00 -0.71 0.00 0.00 33.22 31.24 2ols n MET 637 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ols n GLY 638 N 0.13 0.97 2.84 3.03 0.00 -1.13 -4.84 105.19 106.19 2ols n GLY 638 Ca 0.03 -0.62 -0.42 0.00 0.00 0.00 0.00 46.02 45.01 2ols n GLY 638 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ols n LEU 639 N -1.05 6.79 0.00 0.99 4.77 -0.24 -4.75 117.00 123.51 2ols n LEU 639 Ca -0.09 -4.76 0.12 0.00 -0.03 0.00 0.00 56.01 51.25 2ols n LEU 639 Cb 0.32 -1.43 0.60 0.00 -2.33 0.00 0.00 43.42 40.58 2ols n LEU 639 CO 0.14 1.51 0.89 0.35 -1.33 0.00 0.00 177.39 178.94 2ols n THR 640 N 2.84 0.24 0.86 -5.08 -2.24 -1.26 -2.84 114.28 106.80 2ols n THR 640 Ca 0.40 0.06 0.11 0.00 -2.27 0.00 0.00 64.05 62.35 2ols n THR 640 Cb 0.34 -0.67 0.50 0.00 -2.10 0.00 0.00 70.33 68.41 2ols n THR 640 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2ols n ASN 641 N -1.27 0.00 -4.68 3.42 6.94 -1.26 -4.74 115.26 113.67 2ols n ASN 641 Ca 0.12 0.32 -0.42 0.00 -0.02 0.00 0.00 54.58 54.57 2ols n ASN 641 Cb 0.18 -0.43 -0.03 0.00 -2.36 0.00 0.00 39.78 37.15 2ols n ASN 641 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2ols s VAL 642 N -2.86 4.14 0.16 3.53 1.01 -1.13 -0.87 120.40 124.38 2ols s VAL 642 Ca 0.14 1.44 0.06 0.00 0.00 0.00 0.00 61.98 63.63 2ols s VAL 642 Cb 0.15 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 2ols s VAL 642 CO 0.38 -0.05 0.06 -1.61 0.00 0.00 0.00 175.10 173.89 2ols s GLU 643 N 2.73 2.64 -0.21 2.72 2.02 0.09 -4.71 118.70 123.98 2ols s GLU 643 Ca 0.58 -0.98 -0.05 0.00 0.02 0.00 0.00 54.97 54.54 2ols s GLU 643 Cb -0.25 -2.50 -0.02 0.00 0.10 0.00 0.00 34.13 31.46 2ols s GLU 643 CO 0.21 0.48 0.00 0.42 0.02 0.00 0.00 175.26 176.38 2ols s ILE 644 N -1.71 3.86 -0.10 -1.63 1.01 -0.88 0.11 121.20 121.87 2ols s ILE 644 Ca 0.29 -0.34 -0.04 0.00 0.00 0.00 0.00 60.65 60.56 2ols s ILE 644 Cb -0.10 -2.76 -0.04 0.00 0.01 0.00 0.00 42.46 39.58 2ols s ILE 644 CO 0.21 0.41 0.06 -0.32 0.00 0.00 0.00 174.94 175.30 2ols s MET 645 N 1.25 3.17 -0.19 2.79 -2.45 0.67 -0.84 119.30 123.70 2ols s MET 645 Ca 0.04 -0.30 -0.02 0.00 -1.25 0.00 0.00 55.69 54.16 2ols s MET 645 Cb -0.15 -2.95 -0.00 0.00 1.25 0.00 0.00 34.83 32.98 2ols s MET 645 CO 0.01 0.73 -0.10 0.42 1.05 0.00 0.00 175.02 177.13 2ols s ILE 646 N -0.96 3.03 0.48 10.11 -1.09 0.05 -1.86 121.20 130.96 2ols s ILE 646 Ca 0.14 -0.63 0.04 0.00 -2.23 0.00 0.00 60.65 57.98 2ols s ILE 646 Cb -0.12 -2.33 0.02 0.00 -1.58 0.00 0.00 42.46 38.45 2ols s ILE 646 CO 0.04 0.47 0.66 -2.16 -1.23 0.00 0.00 174.94 172.72 2ols s PRO 647 N 1.12 2.73 -1.11 2.79 0.04 -1.26 -0.90 135.00 138.40 2ols s PRO 647 Ca 0.01 -0.97 -0.25 0.00 0.04 0.00 0.00 61.00 59.83 2ols s PRO 647 Cb -0.14 -2.63 0.03 0.00 0.04 0.00 0.00 34.50 31.80 2ols s PRO 647 CO -0.03 -0.45 0.68 1.19 0.04 0.00 0.00 177.00 178.43 2ols n PHE 648 N -2.08 -1.63 -3.33 0.56 3.01 -1.26 -2.91 117.46 109.83 2ols n PHE 648 Ca 0.07 0.30 -0.45 0.00 1.01 0.00 0.00 57.45 58.38 2ols n PHE 648 Cb 0.59 -2.90 -0.06 0.00 -0.01 0.00 0.00 39.48 37.10 2ols n PHE 648 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2ols s VAL 649 N -3.39 5.19 0.04 -4.37 1.01 -1.26 -2.63 120.40 114.99 2ols s VAL 649 Ca 0.38 -1.25 -0.12 0.00 0.00 0.00 0.00 61.98 61.00 2ols s VAL 649 Cb -0.20 -4.26 -0.33 0.00 0.00 0.00 0.00 36.38 31.60 2ols s VAL 649 CO 0.94 -0.76 1.03 0.03 0.00 0.00 0.00 175.10 176.34 2ols h ARG 650 N 8.85 0.45 -4.80 2.72 3.08 -1.96 -3.45 114.38 119.26 2ols h ARG 650 Ca -0.29 -0.76 -0.28 0.00 0.07 0.00 0.00 59.98 58.71 2ols h ARG 650 Cb 1.10 0.28 -0.15 0.00 0.08 0.00 0.00 29.97 31.29 2ols h ARG 650 CO 0.97 1.36 -0.67 0.95 -1.07 0.00 0.00 179.97 181.51 2ols s THR 651 N -2.62 0.73 0.40 2.04 -4.23 -1.26 -4.79 115.64 105.90 2ols s THR 651 Ca -0.08 -1.98 0.21 0.00 -1.18 0.00 0.00 61.69 58.66 2ols s THR 651 Cb 0.05 -2.03 0.22 0.00 1.34 0.00 0.00 72.50 72.08 2ols s THR 651 CO 0.92 -0.56 1.98 -0.07 -0.54 0.00 0.00 174.62 176.36 2ols h LEU 652 N 2.74 0.00 -0.45 4.79 3.38 -1.98 -2.11 115.31 121.68 2ols h LEU 652 Ca -0.36 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.54 2ols h LEU 652 Cb 1.20 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.93 2ols h LEU 652 CO 0.63 0.20 0.03 1.23 0.09 0.00 0.00 178.44 180.62 2ols h GLY 653 N 0.90 0.84 0.98 0.83 0.00 -1.98 -1.64 103.07 102.99 2ols h GLY 653 Ca -0.00 -0.59 -0.00 0.00 0.00 0.00 0.00 47.33 46.73 2ols h GLY 653 CO 0.03 0.55 -0.05 0.83 0.00 0.00 0.00 176.54 177.89 2ols h GLU 654 N 0.63 -0.13 -0.70 4.80 5.08 -1.90 -0.62 114.58 121.74 2ols h GLU 654 Ca 0.13 0.01 0.15 0.00 -1.00 0.00 0.00 59.36 58.65 2ols h GLU 654 Cb 0.45 0.03 -0.11 0.00 0.50 0.00 0.00 28.75 29.62 2ols h GLU 654 CO 0.02 -0.09 0.08 0.00 -1.00 0.00 0.00 179.01 178.03 2ols h ALA 655 N 0.78 0.80 -0.39 3.43 0.00 -1.31 0.04 119.26 122.62 2ols h ALA 655 Ca -0.01 0.19 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 2ols h ALA 655 Cb 0.11 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2ols h ALA 655 CO 0.01 -0.38 -0.10 1.49 0.00 0.00 0.00 179.25 180.27 2ols h GLU 656 N 0.18 0.76 -0.85 0.00 4.81 -1.22 -2.10 114.58 116.16 2ols h GLU 656 Ca 0.38 -0.29 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 2ols h GLU 656 Cb 0.65 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.95 2ols h GLU 656 CO -0.54 0.90 0.44 0.00 -0.73 0.00 0.00 179.01 179.07 2ols h ALA 657 N 0.83 1.18 -0.32 2.92 0.00 -0.56 -2.30 119.26 121.02 2ols h ALA 657 Ca 0.10 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 2ols h ALA 657 Cb 0.63 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2ols h ALA 657 CO 0.04 0.64 -0.08 0.28 0.00 0.00 0.00 179.25 180.14 2ols h VAL 658 N 1.19 1.28 0.00 0.00 2.07 -0.84 0.06 116.25 120.01 2ols h VAL 658 Ca 0.29 -1.12 -0.07 0.00 0.82 0.00 0.00 66.70 66.62 2ols h VAL 658 Cb 0.07 1.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 2ols h VAL 658 CO -0.04 0.36 -0.35 -0.37 0.02 0.00 0.00 177.57 177.19 2ols h VAL 659 N 0.39 1.09 -0.23 2.57 -1.51 -1.32 0.54 116.25 117.78 2ols h VAL 659 Ca 0.08 -1.26 -0.13 0.00 -1.23 0.00 0.00 66.70 64.17 2ols h VAL 659 Cb 0.57 1.71 -0.01 0.00 -2.13 0.00 0.00 31.29 31.43 2ols h VAL 659 CO 0.03 0.34 -0.39 0.50 -1.23 0.00 0.00 177.57 176.82 2ols h LYS 660 N 0.00 0.52 -0.27 5.19 3.64 -1.16 -1.85 116.57 122.64 2ols h LYS 660 Ca -0.00 -0.26 -0.13 0.00 -1.27 0.00 0.00 60.65 58.99 2ols h LYS 660 Cb 0.68 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.50 2ols h LYS 660 CO 0.05 0.83 -0.34 0.00 -2.27 0.00 0.00 179.45 177.71 2ols h ALA 661 N 1.14 0.41 -0.30 5.00 0.00 -0.17 -1.85 119.26 123.48 2ols h ALA 661 Ca 0.04 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 2ols h ALA 661 Cb 0.87 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2ols h ALA 661 CO 0.07 0.47 0.15 -0.07 0.00 0.00 0.00 179.25 179.87 2ols h LEU 662 N 0.45 0.39 -0.71 0.00 3.38 -0.90 -2.45 115.31 115.47 2ols h LEU 662 Ca 0.03 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 57.90 2ols h LEU 662 Cb 0.92 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.54 2ols h LEU 662 CO 0.08 0.40 0.47 0.50 0.09 0.00 0.00 178.44 179.98 2ols h LYS 663 N 0.36 0.92 -0.83 1.13 3.64 -1.08 0.40 116.57 121.10 2ols h LYS 663 Ca 0.10 -0.06 0.14 0.00 -1.27 0.00 0.00 60.65 59.57 2ols h LYS 663 Cb 0.11 -0.21 -0.06 0.00 -0.41 0.00 0.00 32.23 31.66 2ols h LYS 663 CO -0.01 0.61 0.54 0.93 -2.27 0.00 0.00 179.45 179.25 2ols h GLU 664 N 0.95 0.57 -0.75 1.90 5.08 -1.15 -1.85 114.58 119.33 2ols h GLU 664 Ca 0.26 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.50 2ols h GLU 664 Cb -0.10 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 28.97 2ols h GLU 664 CO -0.06 0.38 0.11 0.09 -1.00 0.00 0.00 179.01 178.53 2ols n ASN 665 N -4.52 4.41 -0.08 1.42 5.03 -0.00 -4.93 115.26 116.58 2ols n ASN 665 Ca 0.16 -2.83 -0.01 0.00 0.87 0.00 0.00 54.58 52.76 2ols n ASN 665 Cb 0.48 -0.67 -0.00 0.00 -1.02 0.00 0.00 39.78 38.57 2ols n ASN 665 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2ols n GLY 666 N 0.20 0.50 3.18 7.41 0.00 -0.69 -4.76 105.19 111.02 2ols n GLY 666 Ca 0.27 -0.43 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 2ols n GLY 666 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ols s LEU 667 N -0.24 3.41 -0.00 0.99 1.43 -0.42 -4.98 118.68 118.87 2ols s LEU 667 Ca 0.00 -1.04 0.02 0.00 -1.03 0.00 0.00 54.13 52.07 2ols s LEU 667 Cb 0.00 -1.66 -0.00 0.00 0.03 0.00 0.00 46.19 44.55 2ols s LEU 667 CO 0.00 -0.17 -0.05 -1.61 0.23 0.00 0.00 176.35 174.75 2ols s GLU 668 N 1.28 0.41 0.09 1.70 2.02 -1.26 -2.62 118.70 120.32 2ols s GLU 668 Ca -0.02 -0.21 -0.36 0.00 0.02 0.00 0.00 54.97 54.40 2ols s GLU 668 Cb -0.18 -0.39 -0.15 0.00 0.10 0.00 0.00 34.13 33.51 2ols s GLU 668 CO -0.04 0.11 1.48 0.54 0.02 0.00 0.00 175.26 177.37 2ols n ARG 669 N 2.89 1.60 0.00 1.61 1.74 -1.26 -1.29 116.66 121.95 2ols n ARG 669 Ca -0.13 0.58 0.00 0.00 -0.77 0.00 0.00 57.85 57.53 2ols n ARG 669 Cb 0.58 -2.28 0.00 0.00 -1.02 0.00 0.00 32.46 29.74 2ols n ARG 669 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ols n GLY 670 N 3.04 2.98 3.68 -0.13 0.00 -1.06 -4.93 105.19 108.77 2ols n GLY 670 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 2ols n GLY 670 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ols s LYS 671 N -0.22 4.37 -1.33 1.61 2.20 -0.41 -3.28 119.74 122.68 2ols s LYS 671 Ca 0.00 1.47 -0.11 0.00 -0.36 0.00 0.00 55.97 56.98 2ols s LYS 671 Cb 0.00 -3.57 0.08 0.00 -1.51 0.00 0.00 37.83 32.83 2ols s LYS 671 CO 0.00 -0.42 0.54 -1.71 -0.36 0.00 0.00 175.35 173.40 2ols n ASN 672 N 5.35 -3.68 0.00 1.43 4.05 -1.26 -1.48 115.26 119.67 2ols n ASN 672 Ca 0.10 -0.47 0.00 0.00 0.45 0.00 0.00 54.58 54.66 2ols n ASN 672 Cb 0.47 -3.04 0.00 0.00 1.23 0.00 0.00 39.78 38.45 2ols n ASN 672 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2ols n GLY 673 N -1.21 0.32 3.69 8.20 0.00 -1.21 -4.94 105.19 110.04 2ols n GLY 673 Ca -0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 2ols n GLY 673 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2ols n LEU 674 N 0.00 3.36 -4.40 0.99 7.94 -0.55 -4.70 117.00 119.64 2ols n LEU 674 Ca 0.00 1.17 -0.32 0.00 -1.11 0.00 0.00 56.01 55.74 2ols n LEU 674 Cb 0.19 -1.46 -0.14 0.00 0.53 0.00 0.00 43.42 42.53 2ols n LEU 674 CO 0.00 -0.45 -0.48 -0.13 -1.11 0.00 0.00 177.39 175.22 2ols s ARG 675 N -0.99 2.69 -0.16 1.96 0.52 -1.26 -2.56 118.95 119.14 2ols s ARG 675 Ca 0.63 -0.75 0.01 0.00 -0.52 0.00 0.00 55.73 55.10 2ols s ARG 675 Cb -0.61 -2.37 0.02 0.00 0.52 0.00 0.00 34.95 32.51 2ols s ARG 675 CO 0.54 0.48 -0.18 -1.17 0.02 0.00 0.00 175.30 175.00 2ols s LEU 676 N -0.37 1.95 -0.01 2.53 2.96 -1.26 -2.06 118.68 122.41 2ols s LEU 676 Ca 0.03 -0.58 0.05 0.00 -0.22 0.00 0.00 54.13 53.42 2ols s LEU 676 Cb -0.12 -1.35 -0.03 0.00 0.50 0.00 0.00 46.19 45.19 2ols s LEU 676 CO 0.02 -0.01 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.26 2ols s ILE 677 N 1.30 3.02 -0.16 6.68 -1.09 -0.02 -0.35 121.20 130.59 2ols s ILE 677 Ca 0.03 -0.89 -0.08 0.00 -2.23 0.00 0.00 60.65 57.48 2ols s ILE 677 Cb -0.13 -2.23 -0.04 0.00 -1.58 0.00 0.00 42.46 38.48 2ols s ILE 677 CO -0.10 0.48 0.12 -0.32 -1.23 0.00 0.00 174.94 173.89 2ols s MET 678 N -1.05 3.77 -0.12 2.79 1.75 -0.79 -0.77 119.30 124.89 2ols s MET 678 Ca 0.13 -0.21 -0.29 0.00 -1.25 0.00 0.00 55.69 54.07 2ols s MET 678 Cb -0.11 -3.26 -0.03 0.00 2.84 0.00 0.00 34.83 34.27 2ols s MET 678 CO 0.03 0.53 1.40 1.41 -0.65 0.00 0.00 175.02 177.74 2ols s MET 679 N -0.31 4.22 -0.79 4.11 1.75 -0.08 -0.97 119.30 127.22 2ols s MET 679 Ca 0.11 1.85 -0.18 0.00 -1.25 0.00 0.00 55.69 56.21 2ols s MET 679 Cb -0.12 -3.84 0.13 0.00 2.84 0.00 0.00 34.83 33.85 2ols s MET 679 CO 0.01 -0.75 0.93 0.00 -0.65 0.00 0.00 175.02 174.56 2ols n GLU 681 N 6.14 2.81 -4.00 0.00 0.28 -1.26 -1.89 120.64 122.72 2ols n GLU 681 Ca 0.10 0.00 -0.31 0.00 -0.16 0.00 0.00 57.16 56.79 2ols n GLU 681 Cb 0.46 -0.22 -0.06 0.00 1.43 0.00 0.00 31.44 33.06 2ols n GLU 681 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2ols s LEU 682 N -0.81 4.05 0.49 -1.84 1.02 -1.26 -1.86 118.68 118.47 2ols s LEU 682 Ca 0.00 0.13 0.22 0.00 0.02 0.00 0.00 54.13 54.50 2ols s LEU 682 Cb 0.00 -2.64 1.26 0.00 0.02 0.00 0.00 46.19 44.84 2ols s LEU 682 CO 0.00 0.19 1.96 -0.65 0.02 0.00 0.00 176.35 177.87 2ols h PRO 683 N 3.35 0.16 -0.11 1.29 0.11 -1.92 -1.08 132.00 133.80 2ols h PRO 683 Ca -0.46 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 2ols h PRO 683 Cb 1.17 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2ols h PRO 683 CO 0.69 0.11 -0.11 0.66 -0.21 0.00 0.00 178.00 179.14 2ols h SER 684 N 0.17 0.16 -0.03 -2.05 4.64 -1.95 -2.19 113.55 112.30 2ols h SER 684 Ca 0.31 -0.03 -0.06 0.00 -0.47 0.00 0.00 61.79 61.55 2ols h SER 684 Cb 0.99 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.02 2ols h SER 684 CO -0.05 0.29 -0.12 0.78 -0.87 0.00 0.00 176.83 176.86 2ols h ASN 685 N 0.16 0.30 0.04 4.97 2.35 -1.50 -1.43 115.58 120.47 2ols h ASN 685 Ca 0.04 -0.07 -0.05 0.00 -0.55 0.00 0.00 56.30 55.67 2ols h ASN 685 Cb 0.30 -0.08 0.01 0.00 0.05 0.00 0.00 38.32 38.59 2ols h ASN 685 CO 0.02 0.46 -0.23 0.00 -1.65 0.00 0.00 177.43 176.02 2ols h ALA 686 N 1.58 -0.02 0.00 -0.83 0.00 -1.40 -2.43 119.26 116.16 2ols h ALA 686 Ca 0.06 -0.56 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 2ols h ALA 686 Cb 0.41 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 2ols h ALA 686 CO 0.02 0.11 -0.03 -0.39 0.00 0.00 0.00 179.25 178.96 2ols h VAL 687 N -0.83 0.06 -0.50 0.00 -1.51 -1.43 -2.76 116.25 109.29 2ols h VAL 687 Ca -0.04 -0.89 -0.32 0.00 -1.23 0.00 0.00 66.70 64.22 2ols h VAL 687 Cb 1.18 1.84 -0.20 0.00 -2.13 0.00 0.00 31.29 31.97 2ols h VAL 687 CO 0.04 0.03 -0.21 0.18 -1.23 0.00 0.00 177.57 176.38 2ols n LEU 688 N -3.12 4.61 -0.19 4.19 4.77 -0.54 -4.86 117.00 121.87 2ols n LEU 688 Ca 0.03 -4.12 -0.02 0.00 -0.03 0.00 0.00 56.01 51.87 2ols n LEU 688 Cb 0.46 -0.59 0.05 0.00 -2.33 0.00 0.00 43.42 41.01 2ols n LEU 688 CO 0.32 1.54 0.74 0.00 -1.33 0.00 0.00 177.39 178.66 2ols h ALA 689 N 1.43 0.37 -0.36 -1.18 0.00 -1.12 -0.53 119.26 117.87 2ols h ALA 689 Ca 0.29 0.23 -0.08 0.00 0.00 0.00 0.00 54.91 55.34 2ols h ALA 689 Cb 1.47 0.45 -0.02 0.00 0.00 0.00 0.00 17.79 19.69 2ols h ALA 689 CO 0.59 -0.44 -0.10 0.93 0.00 0.00 0.00 179.25 180.23 2ols h GLU 690 N -0.01 0.63 -0.02 0.00 5.08 -1.87 -0.22 114.58 118.18 2ols h GLU 690 Ca 0.28 -0.19 -0.15 0.00 -1.00 0.00 0.00 59.36 58.30 2ols h GLU 690 Cb 0.43 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.63 2ols h GLU 690 CO -0.60 0.72 -0.56 1.96 -1.00 0.00 0.00 179.01 179.53 2ols h GLN 691 N 0.57 0.41 -0.89 2.33 7.50 -1.73 -3.17 115.11 120.14 2ols h GLN 691 Ca 0.10 -0.42 -0.02 0.00 0.50 0.00 0.00 58.65 58.81 2ols h GLN 691 Cb 0.52 0.11 -0.04 0.00 0.05 0.00 0.00 27.48 28.12 2ols h GLN 691 CO 0.03 1.08 0.47 0.74 -1.50 0.00 0.00 178.83 179.65 2ols h PHE 692 N -0.09 1.24 0.00 2.96 0.04 -0.99 -3.13 116.94 116.97 2ols h PHE 692 Ca -0.07 -0.04 -0.01 0.00 2.80 0.00 0.00 57.97 60.66 2ols h PHE 692 Cb 1.26 -0.39 -0.00 0.00 2.20 0.00 0.00 35.95 39.02 2ols h PHE 692 CO 0.14 0.87 -0.03 1.25 -0.60 0.00 0.00 178.31 179.95 2ols h LEU 693 N 1.25 0.00 -2.53 1.54 5.85 -1.01 -2.31 115.31 118.10 2ols h LEU 693 Ca 0.31 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.03 2ols h LEU 693 Cb 0.06 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.09 2ols h LEU 693 CO -0.05 0.03 0.02 1.56 -0.34 0.00 0.00 178.44 179.66 2ols h GLN 694 N 0.00 0.00 -0.00 1.25 4.20 -1.53 -2.49 115.11 116.54 2ols h GLN 694 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2ols h GLN 694 Cb 0.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.86 2ols h GLN 694 CO 0.00 0.00 -0.39 0.66 -0.67 0.00 0.00 178.83 178.44 2ols n TYR 695 N -3.72 0.00 -4.18 2.96 4.01 -0.87 -4.97 117.16 110.39 2ols n TYR 695 Ca -0.03 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.61 2ols n TYR 695 Cb 0.10 -0.25 -0.10 0.00 -0.31 0.00 0.00 39.34 38.77 2ols n TYR 695 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2ols s PHE 696 N -2.89 0.95 -2.55 -0.72 0.08 -0.94 -5.00 117.98 106.90 2ols s PHE 696 Ca 0.14 -1.13 0.28 0.00 0.12 0.00 0.00 56.93 56.34 2ols s PHE 696 Cb 0.18 -0.55 0.95 0.00 -0.57 0.00 0.00 43.02 43.04 2ols s PHE 696 CO 0.64 -0.38 1.69 -0.25 -0.10 0.00 0.00 175.22 176.82 2ols n ASP 697 N -0.12 1.66 0.00 1.36 8.00 0.53 -4.91 116.55 123.06 2ols n ASP 697 Ca -0.07 -1.55 0.00 0.00 0.71 0.00 0.00 54.79 53.88 2ols n ASP 697 Cb 0.63 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.73 2ols n ASP 697 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ols n GLY 698 N 1.20 0.07 3.46 0.44 0.00 -1.26 -3.01 105.19 106.09 2ols n GLY 698 Ca 0.18 -1.30 -0.31 0.00 0.00 0.00 0.00 46.02 44.59 2ols n GLY 698 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ols s PHE 699 N -1.95 2.54 -0.22 1.61 0.08 -0.15 -1.88 117.98 118.01 2ols s PHE 699 Ca 0.00 -0.26 -0.05 0.00 0.12 0.00 0.00 56.93 56.74 2ols s PHE 699 Cb 0.00 -1.45 -0.01 0.00 -0.57 0.00 0.00 43.02 40.99 2ols s PHE 699 CO 0.00 0.26 -0.02 -1.12 -0.10 0.00 0.00 175.22 174.24 2ols s SER 700 N -1.50 4.50 -0.18 1.36 0.01 -0.15 -1.27 113.70 116.47 2ols s SER 700 Ca 0.15 -0.33 -0.29 0.00 1.31 0.00 0.00 55.95 56.79 2ols s SER 700 Cb -0.10 -1.78 -0.00 0.00 0.21 0.00 0.00 66.02 64.35 2ols s SER 700 CO 0.06 -0.01 1.00 -0.63 0.41 0.00 0.00 173.24 174.06 2ols s ILE 701 N 1.42 4.75 -0.72 1.44 1.01 0.11 -0.70 121.20 128.50 2ols s ILE 701 Ca 0.05 1.97 -0.18 0.00 0.00 0.00 0.00 60.65 62.49 2ols s ILE 701 Cb -0.14 -4.28 0.13 0.00 0.01 0.00 0.00 42.46 38.17 2ols s ILE 701 CO -0.01 -0.09 0.85 -0.83 0.00 0.00 0.00 174.94 174.86 2ols s GLY 702 N 1.17 1.91 0.35 6.18 0.00 -0.79 -1.18 107.32 114.95 2ols s GLY 702 Ca 0.45 -2.50 0.18 0.00 0.00 0.00 0.00 44.72 42.85 2ols s GLY 702 CO 0.11 1.70 1.66 1.48 0.00 0.00 0.00 173.10 178.04 2ols h SER 703 N 8.92 0.00 0.52 1.64 4.64 -1.85 -1.76 113.55 125.67 2ols h SER 703 Ca -0.11 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.19 2ols h SER 703 Cb 1.06 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.13 2ols h SER 703 CO 1.06 0.40 -0.44 -1.13 -0.87 0.00 0.00 176.83 175.85 2ols h ASN 704 N 0.00 -1.17 -0.16 4.97 -1.24 -1.91 0.36 115.58 116.43 2ols h ASN 704 Ca -0.00 0.09 -0.16 0.00 0.71 0.00 0.00 56.30 56.93 2ols h ASN 704 Cb 1.03 0.38 -0.01 0.00 0.73 0.00 0.00 38.32 40.45 2ols h ASN 704 CO 0.05 -0.62 -0.47 0.44 -1.29 0.00 0.00 177.43 175.54 2ols h ASP 705 N -0.95 0.79 -0.48 1.15 3.32 -1.81 -1.79 116.42 116.65 2ols h ASP 705 Ca -0.06 -0.39 0.03 0.00 0.02 0.00 0.00 57.03 56.63 2ols h ASP 705 Cb 0.81 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 40.10 2ols h ASP 705 CO -0.02 1.13 0.27 -0.03 -1.72 0.00 0.00 179.24 178.88 2ols h MET 706 N 0.58 0.52 -0.56 3.56 4.05 -0.57 -1.68 114.93 120.83 2ols h MET 706 Ca 0.03 -0.03 -0.05 0.00 -0.28 0.00 0.00 59.70 59.37 2ols h MET 706 Cb 1.03 -0.12 -0.02 0.00 -0.80 0.00 0.00 31.60 31.69 2ols h MET 706 CO 0.10 0.34 0.17 1.15 0.23 0.00 0.00 176.91 178.90 2ols h THR 707 N 0.53 1.24 -0.53 -0.77 2.02 -0.70 -0.97 112.91 113.74 2ols h THR 707 Ca 0.20 -0.81 -0.04 0.00 0.77 0.00 0.00 66.41 66.53 2ols h THR 707 Cb 0.05 0.71 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 2ols h THR 707 CO -0.11 0.30 0.16 1.56 0.37 0.00 0.00 175.52 177.80 2ols h GLN 708 N 0.78 0.82 0.06 6.66 4.20 -1.14 -1.87 115.11 124.62 2ols h GLN 708 Ca 0.18 -0.18 -0.24 0.00 0.06 0.00 0.00 58.65 58.46 2ols h GLN 708 Cb 0.29 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.95 2ols h GLN 708 CO -0.00 0.76 -1.06 -0.07 -0.67 0.00 0.00 178.83 177.79 2ols h LEU 709 N 0.73 0.48 -0.58 1.46 3.38 -1.27 0.30 115.31 119.80 2ols h LEU 709 Ca 0.17 -0.43 -0.11 0.00 0.09 0.00 0.00 57.88 57.60 2ols h LEU 709 Cb 0.29 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2ols h LEU 709 CO -0.00 1.27 -0.09 0.74 0.09 0.00 0.00 178.44 180.44 2ols h THR 710 N 0.16 1.27 -0.02 0.22 2.02 -1.16 -3.16 112.91 112.23 2ols h THR 710 Ca -0.10 -1.25 0.00 0.00 0.77 0.00 0.00 66.41 65.83 2ols h THR 710 Cb 1.74 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 69.08 2ols h THR 710 CO 0.18 0.44 -0.23 0.18 0.37 0.00 0.00 175.52 176.46 2ols n LEU 711 N -4.15 2.41 -3.17 2.58 4.77 -0.71 -5.01 117.00 113.73 2ols n LEU 711 Ca 0.02 -0.84 -0.17 0.00 -0.03 0.00 0.00 56.01 54.99 2ols n LEU 711 Cb 0.39 -0.01 0.08 0.00 -2.33 0.00 0.00 43.42 41.55 2ols n LEU 711 CO 0.45 0.42 0.14 0.61 -1.33 0.00 0.00 177.39 177.68 2ols n GLY 712 N 1.37 -0.30 3.06 -0.72 0.00 0.82 -5.03 105.19 104.39 2ols n GLY 712 Ca 0.12 0.07 -0.19 0.00 0.00 0.00 0.00 46.02 46.02 2ols n GLY 712 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ols s LEU 713 N -6.10 2.08 -0.32 0.99 1.43 0.22 -5.02 118.68 111.97 2ols s LEU 713 Ca 0.19 -0.28 -0.16 0.00 -1.03 0.00 0.00 54.13 52.84 2ols s LEU 713 Cb -0.08 -0.49 -0.02 0.00 0.03 0.00 0.00 46.19 45.63 2ols s LEU 713 CO 0.64 0.07 0.43 -0.62 0.23 0.00 0.00 176.35 177.10 2ols s ASP 714 N -0.58 6.27 0.20 2.29 -1.08 -1.26 -4.55 116.67 117.96 2ols s ASP 714 Ca 0.02 0.05 0.24 0.00 -0.52 0.00 0.00 52.55 52.35 2ols s ASP 714 Cb -0.05 -2.23 0.91 0.00 -1.46 0.00 0.00 42.92 40.08 2ols s ASP 714 CO 0.00 -0.34 1.73 -2.11 0.52 0.00 0.00 175.17 174.97 2ols n ARG 715 N 5.51 0.19 0.19 4.34 1.85 -1.26 -2.01 116.66 125.47 2ols n ARG 715 Ca -0.07 0.30 0.09 0.00 -1.00 0.00 0.00 57.85 57.16 2ols n ARG 715 Cb 0.50 -1.79 0.13 0.00 -1.05 0.00 0.00 32.46 30.25 2ols n ARG 715 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 2ols h ASP 716 N 0.00 0.00 -3.28 2.89 3.32 -1.97 -3.44 116.42 113.94 2ols h ASP 716 Ca 0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 2ols h ASP 716 Cb 0.51 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.00 2ols h ASP 716 CO 0.00 0.18 1.03 -0.55 -1.72 0.00 0.00 179.24 178.18 2ols s SER 717 N -6.29 6.46 0.12 6.45 0.15 -0.85 -4.88 113.70 114.85 2ols s SER 717 Ca 0.06 0.90 0.11 0.00 0.70 0.00 0.00 55.95 57.72 2ols s SER 717 Cb 0.06 -2.54 0.54 0.00 -1.71 0.00 0.00 66.02 62.36 2ols s SER 717 CO 0.70 -1.32 1.33 0.61 1.20 0.00 0.00 173.24 175.76 2ols n GLY 718 N 4.84 -0.76 0.13 9.45 0.00 -1.26 -2.09 105.19 115.50 2ols n GLY 718 Ca 0.16 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2ols n GLY 718 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2ols h LEU 719 N 0.00 0.00 0.00 0.99 5.85 -1.93 -3.36 115.31 116.87 2ols h LEU 719 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2ols h LEU 719 Cb 0.07 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.10 2ols h LEU 719 CO 0.00 0.62 -0.76 1.33 -0.34 0.00 0.00 178.44 179.29 2ols n VAL 720 N -3.35 0.00 1.36 1.05 0.24 -1.12 -4.88 118.33 111.62 2ols n VAL 720 Ca 0.01 -0.11 0.08 0.00 -2.04 0.00 0.00 64.34 62.27 2ols n VAL 720 Cb 0.74 0.61 0.46 0.00 -1.47 0.00 0.00 33.84 34.18 2ols n VAL 720 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2ols n SER 721 N -1.37 0.00 0.00 -1.34 3.41 -0.89 -2.33 113.62 111.10 2ols n SER 721 Ca 0.00 -0.88 0.09 0.00 -0.26 0.00 0.00 58.87 57.82 2ols n SER 721 Cb 0.00 0.00 0.43 0.00 -0.26 0.00 0.00 64.21 64.38 2ols n SER 721 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2ols n GLU 722 N -0.85 0.15 -0.00 4.33 2.13 -1.26 -2.48 120.64 122.65 2ols n GLU 722 Ca 0.12 0.15 0.09 0.00 0.66 0.00 0.00 57.16 58.17 2ols n GLU 722 Cb 0.05 -1.50 -0.11 0.00 0.27 0.00 0.00 31.44 30.15 2ols n GLU 722 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2ols n SER 723 N -1.38 0.86 -4.68 4.31 7.64 -0.98 -4.88 113.62 114.51 2ols n SER 723 Ca 0.07 -0.85 -0.44 0.00 1.01 0.00 0.00 58.87 58.66 2ols n SER 723 Cb 0.17 1.10 -0.04 0.00 -1.01 0.00 0.00 64.21 64.43 2ols n SER 723 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 2ols n PHE 724 N -1.53 2.48 -3.30 1.43 7.35 -1.04 -4.96 117.46 117.90 2ols n PHE 724 Ca 0.03 0.02 0.03 0.00 -0.76 0.00 0.00 57.45 56.76 2ols n PHE 724 Cb 0.32 -2.66 -0.02 0.00 0.35 0.00 0.00 39.48 37.47 2ols n PHE 724 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2ols s ASP 725 N 2.30 -1.11 0.49 -2.13 -1.08 -1.26 -5.01 116.67 108.87 2ols s ASP 725 Ca 0.82 0.95 0.33 0.00 -0.52 0.00 0.00 52.55 54.13 2ols s ASP 725 Cb -0.58 2.03 1.77 0.00 -1.46 0.00 0.00 42.92 44.68 2ols s ASP 725 CO 0.40 -0.21 2.00 -0.33 0.52 0.00 0.00 175.17 177.55 2ols h GLU 726 N 7.95 0.00 -0.41 4.34 5.08 -1.93 -1.98 114.58 127.63 2ols h GLU 726 Ca -0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 2ols h GLU 726 Cb 1.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.39 2ols h GLU 726 CO 0.15 0.00 0.00 2.89 -1.00 0.00 0.00 179.01 181.05 2ols n ARG 727 N -2.65 3.14 -1.57 2.33 1.85 -1.26 -4.36 116.66 114.13 2ols n ARG 727 Ca -0.02 -2.55 -0.48 0.00 -1.00 0.00 0.00 57.85 53.80 2ols n ARG 727 Cb 0.06 -1.63 -0.04 0.00 -1.05 0.00 0.00 32.46 29.80 2ols n ARG 727 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 2ols n ASN 728 N 0.37 1.22 -0.22 2.89 2.85 -0.75 -4.79 115.26 116.82 2ols n ASN 728 Ca 0.19 1.15 0.19 0.00 -0.11 0.00 0.00 54.58 55.99 2ols n ASN 728 Cb 0.71 -1.22 0.52 0.00 1.24 0.00 0.00 39.78 41.03 2ols n ASN 728 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2ols h PRO 729 N 3.03 0.38 -0.48 1.20 0.11 -1.92 -0.03 132.00 134.30 2ols h PRO 729 Ca -0.42 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.59 2ols h PRO 729 Cb 1.35 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 2ols h PRO 729 CO 0.68 0.25 -0.01 0.00 -0.21 0.00 0.00 178.00 178.71 2ols h ALA 730 N 1.62 1.08 -0.16 -0.75 0.00 -1.96 -1.32 119.26 117.76 2ols h ALA 730 Ca 0.45 -0.27 -0.21 0.00 0.00 0.00 0.00 54.91 54.88 2ols h ALA 730 Cb 1.12 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.72 2ols h ALA 730 CO -0.16 0.58 -0.73 0.28 0.00 0.00 0.00 179.25 179.22 2ols h VAL 731 N 0.74 1.29 -0.73 0.00 2.07 -1.35 -3.02 116.25 115.26 2ols h VAL 731 Ca 0.14 -1.96 0.00 0.00 0.82 0.00 0.00 66.70 65.71 2ols h VAL 731 Cb 0.47 1.94 -0.04 0.00 -1.52 0.00 0.00 31.29 32.15 2ols h VAL 731 CO 0.02 0.62 0.47 0.11 0.02 0.00 0.00 177.57 178.81 2ols h LYS 732 N 0.51 0.97 -0.86 1.57 1.57 -1.03 -0.73 116.57 118.58 2ols h LYS 732 Ca -0.04 -0.07 0.10 0.00 -1.87 0.00 0.00 60.65 58.78 2ols h LYS 732 Cb 1.35 -0.21 -0.08 0.00 0.08 0.00 0.00 32.23 33.37 2ols h LYS 732 CO 0.15 0.66 0.50 0.28 -0.57 0.00 0.00 179.45 180.46 2ols h VAL 733 N 0.99 0.89 -0.48 0.50 2.07 -1.23 -0.38 116.25 118.62 2ols h VAL 733 Ca 0.26 -0.28 -0.07 0.00 0.82 0.00 0.00 66.70 67.44 2ols h VAL 733 Cb -0.09 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 29.67 2ols h VAL 733 CO -0.05 0.15 0.03 0.24 0.02 0.00 0.00 177.57 177.96 2ols h MET 734 N 0.82 0.83 -0.54 1.57 2.86 -1.13 -1.38 114.93 117.95 2ols h MET 734 Ca 0.42 -0.25 -0.08 0.00 -2.06 0.00 0.00 59.70 57.74 2ols h MET 734 Cb 0.41 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.97 2ols h MET 734 CO -0.26 0.86 0.04 -0.07 1.06 0.00 0.00 176.91 178.54 2ols h LEU 735 N 0.69 0.91 0.01 1.22 3.38 -0.84 -2.23 115.31 118.45 2ols h LEU 735 Ca 0.14 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 2ols h LEU 735 Cb 0.46 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2ols h LEU 735 CO 0.02 0.97 -0.01 -0.74 0.09 0.00 0.00 178.44 178.77 2ols h HIS 736 N 0.82 -0.02 -0.55 1.13 2.76 -0.92 0.77 115.15 119.13 2ols h HIS 736 Ca 0.16 -0.00 0.11 0.00 -2.20 0.00 0.00 60.37 58.44 2ols h HIS 736 Cb 0.48 0.01 -0.09 0.00 1.55 0.00 0.00 27.41 29.36 2ols h HIS 736 CO 0.04 -0.00 0.05 -0.07 -1.30 0.00 0.00 177.93 176.64 2ols h LEU 737 N -0.02 -0.13 -0.29 0.26 3.38 -1.13 -1.14 115.31 116.24 2ols h LEU 737 Ca -0.00 0.12 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 2ols h LEU 737 Cb 0.02 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2ols h LEU 737 CO 0.00 -0.04 -0.07 0.00 0.09 0.00 0.00 178.44 178.42 2ols h ALA 738 N 1.47 0.40 -0.28 1.53 0.00 -1.00 -2.48 119.26 118.90 2ols h ALA 738 Ca 0.28 -0.28 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 2ols h ALA 738 Cb 0.43 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 2ols h ALA 738 CO -0.42 0.23 -0.45 0.97 0.00 0.00 0.00 179.25 179.58 2ols h ILE 739 N 0.33 1.29 -0.20 0.00 6.09 -0.61 -2.43 117.51 121.98 2ols h ILE 739 Ca 0.07 -1.64 0.04 0.00 -1.37 0.00 0.00 64.86 61.96 2ols h ILE 739 Cb 0.56 1.65 -0.03 0.00 0.47 0.00 0.00 36.82 39.47 2ols h ILE 739 CO 0.03 0.53 -0.02 0.28 -3.07 0.00 0.00 178.15 175.90 2ols h SER 740 N 0.55 -0.12 -0.82 2.19 0.02 -1.27 -0.90 113.55 113.20 2ols h SER 740 Ca 0.02 0.05 0.15 0.00 -0.84 0.00 0.00 61.79 61.17 2ols h SER 740 Cb 1.05 0.10 -0.09 0.00 0.14 0.00 0.00 62.40 63.59 2ols h SER 740 CO 0.10 -0.04 0.40 0.00 -1.14 0.00 0.00 176.83 176.16 2ols h ALA 741 N 1.18 1.22 -0.21 3.77 0.00 -1.38 -1.43 119.26 122.42 2ols h ALA 741 Ca 0.09 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 2ols h ALA 741 Cb 0.13 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2ols h ALA 741 CO -0.18 -0.13 -0.29 0.00 0.00 0.00 0.00 179.25 178.65 2ols h ARG 743 N 0.25 0.64 0.00 0.00 3.08 -0.83 -0.52 114.38 117.00 2ols h ARG 743 Ca 0.02 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2ols h ARG 743 Cb 0.87 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.77 2ols h ARG 743 CO 0.07 0.42 0.00 0.36 -1.07 0.00 0.00 179.97 179.75 2ols n LYS 744 N -4.76 0.10 -0.14 0.04 2.85 -0.57 -1.85 118.16 113.81 2ols n LYS 744 Ca 0.03 0.22 0.07 0.00 -1.05 0.00 0.00 58.31 57.59 2ols n LYS 744 Cb 0.05 -1.50 0.15 0.00 -0.65 0.00 0.00 35.03 33.08 2ols n LYS 744 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 2ols n GLN 745 N -1.39 2.14 -3.93 -1.58 1.13 -0.80 -4.97 117.38 107.99 2ols n GLN 745 Ca 0.05 -1.91 -0.29 0.00 -1.94 0.00 0.00 57.00 52.91 2ols n GLN 745 Cb 0.12 -1.33 0.01 0.00 0.11 0.00 0.00 30.24 29.15 2ols n GLN 745 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2ols n ASN 746 N 0.86 -3.22 -4.57 1.08 5.03 -0.77 -4.98 115.26 108.68 2ols n ASN 746 Ca 0.13 -0.85 -0.32 0.00 0.87 0.00 0.00 54.58 54.41 2ols n ASN 746 Cb 0.44 -3.63 -0.11 0.00 -1.02 0.00 0.00 39.78 35.46 2ols n ASN 746 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2ols s LYS 747 N -6.53 2.46 -0.11 3.52 1.02 -0.27 -5.03 119.74 114.80 2ols s LYS 747 Ca 0.45 -0.78 -0.40 0.00 0.02 0.00 0.00 55.97 55.26 2ols s LYS 747 Cb -0.23 -2.44 -0.18 0.00 -0.52 0.00 0.00 37.83 34.45 2ols s LYS 747 CO 0.85 0.59 1.38 0.98 -0.92 0.00 0.00 175.35 178.23 2ols n TYR 748 N 1.50 1.39 -3.79 3.18 9.36 -1.16 -4.40 117.16 123.23 2ols n TYR 748 Ca -0.15 0.84 -0.26 0.00 3.32 0.00 0.00 57.90 61.64 2ols n TYR 748 Cb 0.52 -2.26 -0.17 0.00 -0.63 0.00 0.00 39.34 36.80 2ols n TYR 748 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2ols s VAL 749 N 1.35 0.63 0.35 2.97 0.11 -1.26 -0.98 120.40 123.58 2ols s VAL 749 Ca 0.93 -0.30 0.09 0.00 -2.93 0.00 0.00 61.98 59.77 2ols s VAL 749 Cb -1.17 -0.90 -0.06 0.00 -1.53 0.00 0.00 36.38 32.72 2ols s VAL 749 CO 0.60 0.08 -0.03 -0.83 -3.33 0.00 0.00 175.10 171.59 2ols s GLY 750 N 1.84 2.18 0.03 6.54 0.00 -0.40 -0.70 107.32 116.81 2ols s GLY 750 Ca 0.02 -2.06 0.04 0.00 0.00 0.00 0.00 44.72 42.72 2ols s GLY 750 CO -0.07 -1.98 -0.13 -1.50 0.00 0.00 0.00 173.10 169.42 2ols s ILE 751 N -2.58 1.00 0.09 0.90 2.07 -1.02 0.06 121.20 121.72 2ols s ILE 751 Ca 0.34 -0.91 0.09 0.00 -1.41 0.00 0.00 60.65 58.76 2ols s ILE 751 Cb 0.02 -0.91 -0.03 0.00 0.13 0.00 0.00 42.46 41.67 2ols s ILE 751 CO 0.18 0.00 -0.23 0.00 -1.91 0.00 0.00 174.94 172.98 2ols n GLY 753 N 1.24 3.11 0.42 0.00 0.00 -1.24 -3.52 105.19 105.19 2ols n GLY 753 Ca -0.18 -2.00 0.13 0.00 0.00 0.00 0.00 46.02 43.97 2ols n GLY 753 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ols n GLN 754 N -0.83 1.34 -0.31 1.61 1.13 -1.26 -4.39 117.38 114.67 2ols n GLN 754 Ca 0.00 -0.85 0.00 0.00 -1.94 0.00 0.00 57.00 54.21 2ols n GLN 754 Cb 0.00 -1.48 0.07 0.00 0.11 0.00 0.00 30.24 28.93 2ols n GLN 754 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 2ols h GLY 755 N 4.87 0.29 1.36 1.08 0.00 -1.96 0.33 103.07 109.04 2ols h GLY 755 Ca 0.00 0.40 0.05 0.00 0.00 0.00 0.00 47.33 47.78 2ols h GLY 755 CO 0.00 -0.26 0.31 -2.55 0.00 0.00 0.00 176.54 174.04 2ols h PRO 756 N -0.04 0.41 0.03 4.80 0.11 -1.80 0.15 132.00 135.66 2ols h PRO 756 Ca 0.36 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.44 2ols h PRO 756 Cb 0.61 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.63 2ols h PRO 756 CO -0.88 0.27 -0.01 1.03 -0.21 0.00 0.00 178.00 178.20 2ols h SER 757 N 0.42 -0.03 0.41 -2.05 0.87 -1.15 -3.35 113.55 108.67 2ols h SER 757 Ca 0.20 -0.70 -0.09 0.00 -1.23 0.00 0.00 61.79 59.97 2ols h SER 757 Cb 0.25 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.20 2ols h SER 757 CO -0.05 0.73 -0.41 0.44 -0.53 0.00 0.00 176.83 177.02 2ols h ASP 758 N -0.85 0.00 -3.48 6.23 3.32 -0.35 -3.38 116.42 117.93 2ols h ASP 758 Ca -0.00 -0.00 -0.61 0.00 0.02 0.00 0.00 57.03 56.43 2ols h ASP 758 Cb 0.73 -0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.88 2ols h ASP 758 CO 0.01 0.41 -0.74 -1.00 -1.72 0.00 0.00 179.24 176.20 2ols s HIS 759 N -4.10 1.99 0.45 4.55 3.76 0.52 -5.01 115.29 117.46 2ols s HIS 759 Ca -0.03 -2.44 0.24 0.00 -0.15 0.00 0.00 55.06 52.69 2ols s HIS 759 Cb 0.14 -1.89 1.26 0.00 1.11 0.00 0.00 32.58 33.21 2ols s HIS 759 CO 0.73 -0.78 1.81 -1.35 -0.85 0.00 0.00 174.74 174.30 2ols h PRO 760 N 6.70 0.24 0.00 8.40 0.11 -1.75 0.20 132.00 145.90 2ols h PRO 760 Ca -0.00 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.05 2ols h PRO 760 Cb 0.92 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.98 2ols h PRO 760 CO 0.48 0.16 -0.19 -0.44 -0.21 0.00 0.00 178.00 177.80 2ols h ASP 761 N 0.25 0.00 -0.11 -2.05 5.19 -1.93 -1.76 116.42 116.00 2ols h ASP 761 Ca 0.55 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.91 2ols h ASP 761 Cb 1.66 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 41.17 2ols h ASP 761 CO -0.17 0.19 -0.11 0.15 -3.12 0.00 0.00 179.24 176.18 2ols h PHE 762 N 0.00 0.33 -0.70 4.55 3.57 -0.92 -0.19 116.94 123.58 2ols h PHE 762 Ca -0.00 -0.10 0.14 0.00 3.53 0.00 0.00 57.97 61.54 2ols h PHE 762 Cb 0.68 -0.07 -0.13 0.00 2.79 0.00 0.00 35.95 39.22 2ols h PHE 762 CO 0.00 0.68 -0.18 0.00 -2.23 0.00 0.00 178.31 176.59 2ols h ALA 763 N 0.59 0.45 -0.13 2.41 0.00 -1.39 0.96 119.26 122.16 2ols h ALA 763 Ca 0.02 0.27 0.03 0.00 0.00 0.00 0.00 54.91 55.23 2ols h ALA 763 Cb 0.63 0.54 -0.03 0.00 0.00 0.00 0.00 17.79 18.93 2ols h ALA 763 CO 0.03 -0.42 -0.05 -0.22 0.00 0.00 0.00 179.25 178.58 2ols h LYS 764 N -0.00 -0.04 -0.92 0.00 1.63 -1.13 -1.07 116.57 115.04 2ols h LYS 764 Ca 0.33 0.00 0.04 0.00 -0.85 0.00 0.00 60.65 60.18 2ols h LYS 764 Cb 0.51 0.01 -0.06 0.00 -0.60 0.00 0.00 32.23 32.09 2ols h LYS 764 CO -0.72 -0.02 0.59 2.35 -3.45 0.00 0.00 179.45 178.19 2ols h TRP 765 N -0.04 1.10 -0.58 1.91 7.01 -0.43 -1.54 115.95 123.39 2ols h TRP 765 Ca 0.07 0.03 -0.08 0.00 2.11 0.00 0.00 58.89 61.01 2ols h TRP 765 Cb 0.14 -0.36 -0.02 0.00 -2.10 0.00 0.00 29.16 26.81 2ols h TRP 765 CO -0.19 0.62 0.03 -0.07 -2.79 0.00 0.00 178.44 176.04 2ols h LEU 766 N 1.13 0.97 -0.40 0.65 3.38 -0.40 -0.77 115.31 119.87 2ols h LEU 766 Ca 0.37 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 2ols h LEU 766 Cb 0.05 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 2ols h LEU 766 CO -0.13 1.03 0.06 0.58 0.09 0.00 0.00 178.44 180.06 2ols h VAL 767 N 0.89 1.24 -0.18 1.22 2.07 -0.96 -2.02 116.25 118.52 2ols h VAL 767 Ca 0.17 -0.87 0.02 0.00 0.82 0.00 0.00 66.70 66.83 2ols h VAL 767 Cb 0.51 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 2ols h VAL 767 CO 0.02 0.30 0.13 -0.08 0.02 0.00 0.00 177.57 177.96 2ols h GLU 768 N 0.50 0.16 0.00 1.57 4.81 -1.16 -1.04 114.58 119.42 2ols h GLU 768 Ca 0.12 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 2ols h GLU 768 Cb 0.37 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.72 2ols h GLU 768 CO 0.01 0.11 0.00 0.93 -0.73 0.00 0.00 179.01 179.33 2ols h GLU 769 N 0.17 0.00 -0.23 1.92 4.39 -0.70 -3.48 114.58 116.65 2ols h GLU 769 Ca 0.08 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.78 2ols h GLU 769 Cb 0.10 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 2ols h GLU 769 CO -0.01 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.25 2ols n GLY 770 N 0.95 1.05 3.77 -3.84 0.00 -0.40 -4.80 105.19 101.92 2ols n GLY 770 Ca 0.04 -0.45 -0.40 0.00 0.00 0.00 0.00 46.02 45.22 2ols n GLY 770 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2ols s ILE 771 N -2.23 2.39 0.02 -0.61 1.10 -0.80 -4.93 121.20 116.15 2ols s ILE 771 Ca 0.00 0.37 0.09 0.00 -0.51 0.00 0.00 60.65 60.60 2ols s ILE 771 Cb 0.00 -3.22 -0.23 0.00 0.15 0.00 0.00 42.46 39.16 2ols s ILE 771 CO 0.00 0.06 0.92 -0.08 -2.11 0.00 0.00 174.94 173.74 2ols h GLU 772 N 2.75 0.02 -3.28 3.50 4.81 -1.27 -3.46 114.58 117.65 2ols h GLU 772 Ca -0.50 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 58.69 2ols h GLU 772 Cb 1.25 0.01 -0.09 0.00 0.63 0.00 0.00 28.75 30.55 2ols h GLU 772 CO 0.63 0.75 0.06 -1.54 -0.73 0.00 0.00 179.01 178.17 2ols s SER 773 N -6.41 -0.24 -0.01 1.04 1.04 -1.14 -2.15 113.70 105.83 2ols s SER 773 Ca -0.03 -0.57 0.01 0.00 0.48 0.00 0.00 55.95 55.84 2ols s SER 773 Cb 0.09 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.82 2ols s SER 773 CO 0.82 -1.13 -0.05 -0.69 0.98 0.00 0.00 173.24 173.17 2ols s VAL 774 N -3.91 0.40 -0.22 5.02 1.01 -0.55 -2.43 120.40 119.72 2ols s VAL 774 Ca 0.12 -0.18 -0.01 0.00 0.00 0.00 0.00 61.98 61.90 2ols s VAL 774 Cb -0.02 -0.36 0.02 0.00 0.00 0.00 0.00 36.38 36.02 2ols s VAL 774 CO 0.01 0.13 -0.11 -0.44 0.00 0.00 0.00 175.10 174.69 2ols s SER 775 N 0.07 3.89 0.12 3.32 0.01 -0.20 -0.70 113.70 120.21 2ols s SER 775 Ca -0.00 -0.69 0.08 0.00 1.31 0.00 0.00 55.95 56.65 2ols s SER 775 Cb -0.04 -1.61 -0.04 0.00 0.21 0.00 0.00 66.02 64.54 2ols s SER 775 CO -0.00 -0.06 -0.20 -0.76 0.41 0.00 0.00 173.24 172.63 2ols s LEU 776 N 1.34 2.35 0.23 2.44 1.43 -0.67 -3.70 118.68 122.10 2ols s LEU 776 Ca 0.03 -0.75 -0.32 0.00 -1.03 0.00 0.00 54.13 52.06 2ols s LEU 776 Cb -0.15 -0.85 -0.13 0.00 0.03 0.00 0.00 46.19 45.10 2ols s LEU 776 CO -0.07 0.02 1.54 0.59 0.23 0.00 0.00 176.35 178.66 2ols n ASN 777 N 0.80 3.31 -0.33 2.29 3.02 -1.26 0.50 115.26 123.59 2ols n ASN 777 Ca -0.17 1.12 0.25 0.00 -0.03 0.00 0.00 54.58 55.74 2ols n ASN 777 Cb 0.55 -1.49 0.49 0.00 -0.61 0.00 0.00 39.78 38.71 2ols n ASN 777 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 2ols h PRO 778 N 5.14 0.21 0.00 3.52 0.11 -1.95 0.16 132.00 139.19 2ols h PRO 778 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2ols h PRO 778 Cb 1.25 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2ols h PRO 778 CO 0.83 0.14 0.00 -0.40 -0.21 0.00 0.00 178.00 178.35 2ols n ASP 779 N -5.14 0.00 -0.14 -2.05 3.85 -1.26 -2.22 116.55 109.59 2ols n ASP 779 Ca 0.32 -1.43 0.02 0.00 -0.71 0.00 0.00 54.79 52.99 2ols n ASP 779 Cb 1.04 0.00 0.02 0.00 -1.35 0.00 0.00 41.12 40.83 2ols n ASP 779 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 2ols n THR 780 N -0.70 0.26 0.01 2.12 -2.24 0.56 -4.85 114.28 109.44 2ols n THR 780 Ca 0.09 -0.63 -0.13 0.00 -2.27 0.00 0.00 64.05 61.11 2ols n THR 780 Cb 0.04 0.92 -0.10 0.00 -2.10 0.00 0.00 70.33 69.09 2ols n THR 780 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2ols h VAL 781 N 0.61 1.26 -0.61 2.28 2.07 -1.41 -2.91 116.25 117.54 2ols h VAL 781 Ca 0.00 -1.24 -0.04 0.00 0.82 0.00 0.00 66.70 66.25 2ols h VAL 781 Cb 0.24 2.06 -0.03 0.00 -1.52 0.00 0.00 31.29 32.04 2ols h VAL 781 CO 0.00 0.30 0.23 0.40 0.02 0.00 0.00 177.57 178.52 2ols h ILE 782 N -0.65 1.23 -0.14 4.57 5.03 -1.89 -1.43 117.51 124.24 2ols h ILE 782 Ca -0.01 -0.74 -0.01 0.00 -0.12 0.00 0.00 64.86 63.98 2ols h ILE 782 Cb 0.55 0.58 -0.01 0.00 -3.03 0.00 0.00 36.82 34.92 2ols h ILE 782 CO 0.01 0.29 0.05 -0.33 -0.68 0.00 0.00 178.15 177.49 2ols h GLU 783 N 0.85 0.21 -0.20 2.37 3.07 -1.91 -0.79 114.58 118.17 2ols h GLU 783 Ca 0.20 -0.04 -0.04 0.00 -0.50 0.00 0.00 59.36 58.98 2ols h GLU 783 Cb 0.22 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.09 2ols h GLU 783 CO -0.01 0.32 -0.03 1.15 -1.40 0.00 0.00 179.01 179.04 2ols h THR 784 N 0.05 1.27 -0.55 1.13 2.02 -1.44 -0.73 112.91 114.66 2ols h THR 784 Ca 0.04 -0.96 0.11 0.00 0.77 0.00 0.00 66.41 66.38 2ols h THR 784 Cb 0.19 1.51 -0.10 0.00 -1.74 0.00 0.00 68.15 68.01 2ols h THR 784 CO -0.00 0.29 -0.11 -0.25 0.37 0.00 0.00 175.52 175.81 2ols h TRP 785 N 0.10 -0.25 -0.34 3.16 2.91 -1.16 -0.07 115.95 120.31 2ols h TRP 785 Ca 0.05 0.05 -0.08 0.00 1.13 0.00 0.00 58.89 60.04 2ols h TRP 785 Cb 0.45 0.20 -0.01 0.00 -0.51 0.00 0.00 29.16 29.28 2ols h TRP 785 CO 0.04 -0.22 -0.10 -0.07 -1.03 0.00 0.00 178.44 177.06 2ols h LEU 786 N 0.02 0.67 -0.44 0.65 3.38 -0.89 0.49 115.31 119.19 2ols h LEU 786 Ca 0.27 -0.37 0.06 0.00 0.09 0.00 0.00 57.88 57.93 2ols h LEU 786 Cb 0.42 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 2ols h LEU 786 CO -0.55 0.89 0.13 0.22 0.09 0.00 0.00 178.44 179.22 2ols h TYR 787 N 0.44 0.23 -0.44 1.13 5.03 -0.90 0.19 116.97 122.65 2ols h TYR 787 Ca 0.08 0.02 -0.14 0.00 2.58 0.00 0.00 58.73 61.27 2ols h TYR 787 Cb 0.61 -0.04 -0.01 0.00 1.55 0.00 0.00 36.73 38.84 2ols h TYR 787 CO 0.05 0.06 -0.29 -0.07 -1.32 0.00 0.00 178.16 176.60 2ols h LEU 788 N 0.28 1.01 -0.55 2.82 3.38 -0.79 -2.41 115.31 119.06 2ols h LEU 788 Ca 0.21 -0.43 -0.07 0.00 0.09 0.00 0.00 57.88 57.68 2ols h LEU 788 Cb 0.23 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2ols h LEU 788 CO -0.24 1.22 0.06 0.00 0.09 0.00 0.00 178.44 179.58 2ols h ALA 789 N 0.82 0.73 -0.39 1.53 0.00 -0.73 -2.81 119.26 118.40 2ols h ALA 789 Ca 0.09 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 2ols h ALA 789 Cb 0.88 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2ols h ALA 789 CO 0.08 0.50 0.04 -0.97 0.00 0.00 0.00 179.25 178.90 2ols h ASN 790 N 0.81 0.56 0.69 0.00 -0.73 -0.98 -2.66 115.58 113.27 2ols h ASN 790 Ca 0.16 -0.10 -0.01 0.00 1.87 0.00 0.00 56.30 58.22 2ols h ASN 790 Cb 0.45 -0.15 -0.00 0.00 0.27 0.00 0.00 38.32 38.89 2ols h ASN 790 CO 0.02 0.60 -0.05 -0.08 -0.37 0.00 0.00 177.43 177.55 2ols h GLU 791 N 0.58 0.00 -0.01 6.67 4.57 -1.18 -3.51 114.58 121.70 2ols h GLU 791 Ca 0.13 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2ols h GLU 791 Cb 0.30 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.89 2ols h GLU 791 CO 0.01 0.05 0.00 -0.11 -1.18 0.00 0.00 179.01 177.77