#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aij n GLN 4 N 0.00 0.30 -3.26 2.98 1.13 -1.26 -5.06 117.38 112.21 1aij n GLN 4 Ca 0.00 -1.69 -0.23 0.00 -1.94 0.00 0.00 57.00 53.14 1aij n GLN 4 Cb 0.00 -0.58 0.01 0.00 0.11 0.00 0.00 30.24 29.77 1aij n GLN 4 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1aij n ASN 5 N -0.14 -4.34 0.02 1.08 4.05 -1.26 -4.88 115.26 109.78 1aij n ASN 5 Ca 0.05 -0.36 -0.17 0.00 0.45 0.00 0.00 54.58 54.56 1aij n ASN 5 Cb 0.82 -3.56 -0.14 0.00 1.23 0.00 0.00 39.78 38.13 1aij n ASN 5 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 177.26 174.61 1aij h ILE 6 N -1.07 0.83 -4.05 -1.44 1.08 -1.97 -3.45 117.51 107.43 1aij h ILE 6 Ca -0.45 -2.56 -0.51 0.00 -0.39 0.00 0.00 64.86 60.95 1aij h ILE 6 Cb 1.31 2.56 -0.30 0.00 -3.07 0.00 0.00 36.82 37.32 1aij h ILE 6 CO 0.54 0.77 -0.82 -0.36 -0.69 0.00 0.00 178.15 177.59 1aij s PHE 7 N -2.58 1.40 0.48 1.37 0.08 -1.26 -4.79 117.98 112.67 1aij s PHE 7 Ca -0.14 -0.33 -0.24 0.00 0.12 0.00 0.00 56.93 56.34 1aij s PHE 7 Cb 0.07 -0.93 -0.07 0.00 -0.57 0.00 0.00 43.02 41.51 1aij s PHE 7 CO 0.81 -0.09 1.40 -1.12 -0.10 0.00 0.00 175.22 176.12 1aij s SER 8 N -0.12 5.72 -0.07 1.36 0.01 -0.11 -4.97 113.70 115.53 1aij s SER 8 Ca 0.01 2.86 -0.23 0.00 1.31 0.00 0.00 55.95 59.89 1aij s SER 8 Cb -0.08 -2.65 -0.30 0.00 0.21 0.00 0.00 66.02 63.20 1aij s SER 8 CO 0.01 -1.27 0.86 1.56 0.41 0.00 0.00 173.24 174.80 1aij h GLN 9 N 2.09 0.23 -4.13 12.44 4.20 -1.98 -3.46 115.11 124.50 1aij h GLN 9 Ca -0.51 -0.40 -0.38 0.00 0.06 0.00 0.00 58.65 57.42 1aij h GLN 9 Cb 1.27 0.15 -0.32 0.00 0.30 0.00 0.00 27.48 28.88 1aij h GLN 9 CO 0.60 1.19 -0.77 0.54 -0.67 0.00 0.00 178.83 179.72 1aij s VAL 10 N -2.38 0.50 -0.09 -0.54 0.11 -1.26 -5.14 120.40 111.60 1aij s VAL 10 Ca -0.15 -0.15 -0.08 0.00 -2.93 0.00 0.00 61.98 58.67 1aij s VAL 10 Cb 0.00 -0.50 -0.04 0.00 -1.53 0.00 0.00 36.38 34.31 1aij s VAL 10 CO 0.80 0.19 0.19 -1.10 -3.33 0.00 0.00 175.10 171.85 1aij s GLN 11 N 0.59 3.51 0.00 1.54 -0.21 -1.26 -5.10 119.66 118.72 1aij s GLN 11 Ca -0.08 -0.07 0.08 0.00 0.02 0.00 0.00 55.36 55.32 1aij s GLN 11 Cb -0.11 -3.18 -0.02 0.00 1.00 0.00 0.00 33.01 30.70 1aij s GLN 11 CO -0.00 0.75 -0.26 0.08 -2.12 0.00 0.00 175.29 173.75 1aij s VAL 12 N -1.08 2.03 0.01 1.09 1.01 -1.26 -5.14 120.40 117.07 1aij s VAL 12 Ca 0.18 -1.17 0.00 0.00 0.00 0.00 0.00 61.98 60.99 1aij s VAL 12 Cb -0.13 -1.70 -0.01 0.00 0.00 0.00 0.00 36.38 34.54 1aij s VAL 12 CO 0.07 0.50 -0.02 -0.60 0.00 0.00 0.00 175.10 175.05 1aij s ARG 13 N -0.79 0.16 0.00 2.72 3.52 -1.26 -5.05 118.95 118.26 1aij s ARG 13 Ca 0.10 -0.24 0.00 0.00 -0.13 0.00 0.00 55.73 55.47 1aij s ARG 13 Cb -0.10 -0.03 0.00 0.00 -1.56 0.00 0.00 34.95 33.26 1aij s ARG 13 CO -0.00 0.00 0.00 0.41 -0.81 0.00 0.00 175.30 174.90 1aij n GLY 14 N 2.56 4.75 3.63 8.12 0.00 -1.26 -5.14 105.19 117.84 1aij n GLY 14 Ca -0.16 -1.58 -0.39 0.00 0.00 0.00 0.00 46.02 43.88 1aij n GLY 14 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1aij n PRO 15 N 0.00 1.22 -1.68 1.61 -0.02 -1.26 -4.90 135.00 129.97 1aij n PRO 15 Ca 0.00 0.45 -0.45 0.00 -2.02 0.00 0.00 63.50 61.48 1aij n PRO 15 Cb 0.00 -2.16 -0.04 0.00 -0.02 0.00 0.00 33.50 31.29 1aij n PRO 15 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1aij n ALA 16 N -1.05 1.79 -2.65 3.55 0.00 -1.26 -4.91 120.51 115.98 1aij n ALA 16 Ca 0.11 0.41 -0.42 0.00 0.00 0.00 0.00 53.44 53.55 1aij n ALA 16 Cb 0.43 -2.42 -0.03 0.00 0.00 0.00 0.00 19.45 17.43 1aij n ALA 16 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1aij s ASP 17 N 1.31 6.22 0.48 0.00 -1.08 -1.26 -4.87 116.67 117.47 1aij s ASP 17 Ca 0.79 -0.77 0.31 0.00 -0.52 0.00 0.00 52.55 52.36 1aij s ASP 17 Cb -0.62 -2.52 1.31 0.00 -1.46 0.00 0.00 42.92 39.63 1aij s ASP 17 CO 0.37 -1.67 1.93 -0.07 0.52 0.00 0.00 175.17 176.25 1aij h LEU 18 N 12.45 0.00 0.00 -1.34 3.38 -1.95 -3.44 115.31 124.41 1aij h LEU 18 Ca -0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1aij h LEU 18 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1aij h LEU 18 CO 1.26 0.00 0.00 0.61 0.09 0.00 0.00 178.44 180.40 1aij n GLY 19 N -0.03 1.30 3.74 0.83 0.00 -1.26 -4.88 105.19 104.89 1aij n GLY 19 Ca 0.01 -2.14 -0.39 0.00 0.00 0.00 0.00 46.02 43.50 1aij n GLY 19 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1aij s MET 20 N -1.53 4.36 -0.01 1.61 -1.94 -1.26 -5.01 119.30 115.51 1aij s MET 20 Ca 0.00 0.71 -0.08 0.00 -1.71 0.00 0.00 55.69 54.62 1aij s MET 20 Cb 0.00 -3.40 -0.04 0.00 2.01 0.00 0.00 34.83 33.40 1aij s MET 20 CO 0.00 0.22 0.54 1.15 -0.01 0.00 0.00 175.02 176.92 1aij h THR 21 N 4.48 0.00 0.00 2.05 2.02 -1.95 -3.46 112.91 116.05 1aij h THR 21 Ca -0.43 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 66.48 1aij h THR 21 Cb 1.19 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 1aij h THR 21 CO 0.73 0.00 0.00 1.21 0.37 0.00 0.00 175.52 177.83 1aij n GLU 22 N -3.48 0.00 -0.37 6.66 4.07 -1.26 -1.34 120.64 124.92 1aij n GLU 22 Ca -0.03 0.00 0.08 0.00 -0.06 0.00 0.00 57.16 57.14 1aij n GLU 22 Cb 0.11 0.00 0.23 0.00 -0.06 0.00 0.00 31.44 31.72 1aij n GLU 22 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1aij n ASP 23 N 4.46 3.59 -4.77 4.31 9.92 -0.19 -5.01 116.55 128.86 1aij n ASP 23 Ca 0.00 -2.77 -0.38 0.00 -0.53 0.00 0.00 54.79 51.11 1aij n ASP 23 Cb 0.00 -0.46 -0.06 0.00 -0.64 0.00 0.00 41.12 39.96 1aij n ASP 23 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 1aij s VAL 24 N -2.39 4.04 -0.63 2.53 -7.23 -0.45 -4.87 120.40 111.40 1aij s VAL 24 Ca 0.37 1.79 -0.27 0.00 -1.81 0.00 0.00 61.98 62.07 1aij s VAL 24 Cb 0.28 -4.04 -0.01 0.00 0.56 0.00 0.00 36.38 33.17 1aij s VAL 24 CO 0.10 0.24 1.70 0.21 -0.31 0.00 0.00 175.10 177.04 1aij s ASN 25 N -1.42 5.54 0.47 4.85 3.84 -1.26 -4.85 114.94 122.11 1aij s ASN 25 Ca 0.48 0.20 0.28 0.00 0.21 0.00 0.00 52.86 54.03 1aij s ASN 25 Cb -0.22 -2.54 1.54 0.00 -0.55 0.00 0.00 41.25 39.48 1aij s ASN 25 CO 0.28 -2.20 1.85 -0.07 -2.79 0.00 0.00 177.10 174.18 1aij h LEU 26 N 15.38 0.00 -1.04 3.21 4.07 -1.93 -2.57 115.31 132.43 1aij h LEU 26 Ca -0.27 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.69 1aij h LEU 26 Cb 1.13 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.87 1aij h LEU 26 CO 1.22 0.00 -0.01 0.00 -1.08 0.00 0.00 178.44 178.57 1aij h ALA 27 N 1.79 1.00 -0.55 1.53 0.00 -2.03 -2.99 119.26 118.02 1aij h ALA 27 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1aij h ALA 27 Cb 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1aij h ALA 27 CO 0.00 0.01 0.00 0.09 0.00 0.00 0.00 179.25 179.35 1aij n ASN 28 N -3.10 4.15 -4.89 0.00 3.02 -0.97 -4.91 115.26 108.56 1aij n ASN 28 Ca 0.02 -2.40 -0.34 0.00 -0.03 0.00 0.00 54.58 51.82 1aij n ASN 28 Cb 0.37 -0.54 -0.05 0.00 -0.61 0.00 0.00 39.78 38.95 1aij n ASN 28 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1aij s ARG 29 N -1.84 3.42 0.53 3.52 3.52 -1.13 -0.56 118.95 126.41 1aij s ARG 29 Ca 0.43 -0.28 -0.08 0.00 -0.13 0.00 0.00 55.73 55.68 1aij s ARG 29 Cb 0.28 -3.11 0.12 0.00 -1.56 0.00 0.00 34.95 30.68 1aij s ARG 29 CO 0.20 0.70 0.72 -1.13 -0.81 0.00 0.00 175.30 174.98 1aij n SER 30 N 1.21 0.19 -4.67 -2.12 3.41 0.39 -4.94 113.62 107.08 1aij n SER 30 Ca -0.13 -1.34 -0.27 0.00 -0.26 0.00 0.00 58.87 56.87 1aij n SER 30 Cb 0.53 -0.54 0.11 0.00 -0.26 0.00 0.00 64.21 64.05 1aij n SER 30 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1aij s GLY 31 N -4.51 1.71 0.38 5.00 0.00 -1.26 -4.68 107.32 103.95 1aij s GLY 31 Ca 0.42 -1.06 -0.25 0.00 0.00 0.00 0.00 44.72 43.83 1aij s GLY 31 CO 0.29 -0.51 1.01 0.14 0.00 0.00 0.00 173.10 174.03 1aij s VAL 32 N -3.48 3.91 0.00 1.40 1.01 -1.26 -4.35 120.40 117.62 1aij s VAL 32 Ca 0.65 1.48 0.00 0.00 0.00 0.00 0.00 61.98 64.12 1aij s VAL 32 Cb -0.08 -3.78 0.00 0.00 0.00 0.00 0.00 36.38 32.52 1aij s VAL 32 CO 0.48 0.03 0.00 0.61 0.00 0.00 0.00 175.10 176.22 1aij n GLY 33 N 0.36 1.28 3.79 4.51 0.00 -0.26 -4.99 105.19 109.87 1aij n GLY 33 Ca 0.04 -1.86 -0.30 0.00 0.00 0.00 0.00 46.02 43.89 1aij n GLY 33 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1aij s PRO 34 N 2.34 2.24 -0.22 1.61 0.02 -1.26 -4.65 135.00 135.08 1aij s PRO 34 Ca 0.00 0.89 -0.06 0.00 0.02 0.00 0.00 61.00 61.84 1aij s PRO 34 Cb 0.00 -1.92 -0.03 0.00 0.02 0.00 0.00 34.50 32.58 1aij s PRO 34 CO 0.00 -1.58 0.04 -0.06 -0.33 0.00 0.00 177.00 175.07 1aij s PHE 35 N -3.03 3.09 -0.22 6.54 0.40 -1.26 -0.41 117.98 123.10 1aij s PHE 35 Ca 0.60 -0.35 -0.05 0.00 -0.60 0.00 0.00 56.93 56.54 1aij s PHE 35 Cb -0.16 -2.15 -0.02 0.00 0.51 0.00 0.00 43.02 41.20 1aij s PHE 35 CO 0.55 -0.22 -0.01 -1.54 0.70 0.00 0.00 175.22 174.70 1aij s SER 36 N 1.17 4.64 0.46 1.36 1.04 0.44 -4.94 113.70 117.87 1aij s SER 36 Ca 0.04 -0.29 0.18 0.00 0.48 0.00 0.00 55.95 56.36 1aij s SER 36 Cb -0.14 -1.80 1.16 0.00 0.10 0.00 0.00 66.02 65.33 1aij s SER 36 CO 0.03 0.01 1.95 0.74 0.98 0.00 0.00 173.24 176.95 1aij h THR 37 N 5.57 0.79 0.74 2.02 2.02 -1.96 -1.66 112.91 120.42 1aij h THR 37 Ca -0.39 -0.10 -0.03 0.00 0.77 0.00 0.00 66.41 66.66 1aij h THR 37 Cb 1.17 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 68.06 1aij h THR 37 CO 0.60 0.05 -0.49 0.25 0.37 0.00 0.00 175.52 176.30 1aij h LEU 38 N 0.28 -1.25 -1.62 2.58 5.85 -1.96 -2.39 115.31 116.79 1aij h LEU 38 Ca 0.32 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 59.08 1aij h LEU 38 Cb 0.85 0.37 -0.01 0.00 0.37 0.00 0.00 40.66 42.24 1aij h LEU 38 CO -0.07 -0.73 -0.12 -0.07 -0.34 0.00 0.00 178.44 177.11 1aij h LEU 39 N -1.16 0.09 -2.26 2.25 3.38 -1.74 -2.56 115.31 113.30 1aij h LEU 39 Ca -0.10 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 57.89 1aij h LEU 39 Cb 0.94 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.66 1aij h LEU 39 CO 0.08 0.22 0.11 1.23 0.09 0.00 0.00 178.44 180.17 1aij h GLY 40 N 0.52 0.00 2.00 0.83 0.00 -0.83 0.12 103.07 105.71 1aij h GLY 40 Ca 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.31 1aij h GLY 40 CO 0.02 0.00 -0.18 1.49 0.00 0.00 0.00 176.54 177.87 1aij h TRP 41 N 0.00 0.00 0.00 5.60 4.06 -1.05 -3.35 115.95 121.22 1aij h TRP 41 Ca 0.05 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.94 1aij h TRP 41 Cb 0.28 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.43 1aij h TRP 41 CO 0.00 0.18 -1.27 0.34 -3.56 0.00 0.00 178.44 174.13 1aij n PHE 42 N -3.48 0.00 0.00 0.49 7.35 -0.60 -0.93 117.46 120.30 1aij n PHE 42 Ca -0.01 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.68 1aij n PHE 42 Cb 0.34 -0.19 0.00 0.00 0.35 0.00 0.00 39.48 39.98 1aij n PHE 42 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1aij n GLY 43 N 2.71 4.84 3.83 7.13 0.00 0.32 -4.93 105.19 119.09 1aij n GLY 43 Ca -0.06 -0.57 -0.34 0.00 0.00 0.00 0.00 46.02 45.05 1aij n GLY 43 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1aij s ASN 44 N 1.41 6.93 -0.00 1.61 0.01 -1.26 -4.03 114.94 119.60 1aij s ASN 44 Ca 0.00 1.38 0.06 0.00 -0.71 0.00 0.00 52.86 53.59 1aij s ASN 44 Cb 0.00 -2.41 -0.24 0.00 0.41 0.00 0.00 41.25 39.01 1aij s ASN 44 CO 0.00 -0.10 0.81 0.00 -1.51 0.00 0.00 177.10 176.30 1aij h ALA 45 N 2.79 0.54 -2.55 0.60 0.00 -1.83 -3.27 119.26 115.54 1aij h ALA 45 Ca -0.48 -1.26 -0.53 0.00 0.00 0.00 0.00 54.91 52.64 1aij h ALA 45 Cb 1.18 0.32 0.03 0.00 0.00 0.00 0.00 17.79 19.33 1aij h ALA 45 CO 0.65 1.39 0.87 -1.14 0.00 0.00 0.00 179.25 181.02 1aij s GLN 46 N -2.62 4.24 -0.11 0.00 0.74 -1.26 -0.42 119.66 120.22 1aij s GLN 46 Ca -0.06 2.28 -0.04 0.00 0.05 0.00 0.00 55.36 57.59 1aij s GLN 46 Cb 0.08 -3.28 -0.03 0.00 1.10 0.00 0.00 33.01 30.88 1aij s GLN 46 CO 0.83 -0.59 0.03 -0.51 -0.55 0.00 0.00 175.29 174.49 1aij s LEU 47 N 1.47 3.72 0.00 3.68 1.02 0.45 -4.94 118.68 124.08 1aij s LEU 47 Ca 0.69 0.17 0.00 0.00 0.02 0.00 0.00 54.13 55.01 1aij s LEU 47 Cb -0.41 -1.88 0.00 0.00 0.02 0.00 0.00 46.19 43.92 1aij s LEU 47 CO 0.31 0.34 0.00 0.61 0.02 0.00 0.00 176.35 177.63 1aij n GLY 48 N 2.42 -0.99 3.84 -3.19 0.00 -1.26 -1.10 105.19 104.91 1aij n GLY 48 Ca -0.18 -1.65 -0.29 0.00 0.00 0.00 0.00 46.02 43.89 1aij n GLY 48 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1aij s PRO 49 N -1.69 1.21 0.10 1.61 0.02 -1.26 -4.70 135.00 130.28 1aij s PRO 49 Ca 0.00 0.10 0.06 0.00 0.02 0.00 0.00 61.00 61.18 1aij s PRO 49 Cb 0.00 -1.86 -0.03 0.00 0.02 0.00 0.00 34.50 32.62 1aij s PRO 49 CO 0.00 -2.11 -0.15 -1.50 -0.33 0.00 0.00 177.00 172.91 1aij s ILE 50 N -3.46 1.30 -0.24 2.83 2.07 -1.26 -4.92 121.20 117.52 1aij s ILE 50 Ca 0.65 -1.54 -0.14 0.00 -1.41 0.00 0.00 60.65 58.22 1aij s ILE 50 Cb -0.11 -1.36 -0.04 0.00 0.13 0.00 0.00 42.46 41.07 1aij s ILE 50 CO 0.52 -0.29 0.30 -0.47 -1.91 0.00 0.00 174.94 173.08 1aij s TYR 51 N -1.68 3.31 -0.46 3.50 6.14 -1.26 -0.46 117.35 126.44 1aij s TYR 51 Ca 0.04 0.40 0.03 0.00 0.64 0.00 0.00 57.07 58.18 1aij s TYR 51 Cb -0.08 -2.44 0.13 0.00 0.42 0.00 0.00 41.96 39.99 1aij s TYR 51 CO 0.03 -0.05 0.22 -0.51 0.64 0.00 0.00 175.55 175.88 1aij s LEU 52 N 1.46 3.67 0.00 6.97 1.43 0.28 -4.90 118.68 127.59 1aij s LEU 52 Ca 0.13 -2.73 0.00 0.00 -1.03 0.00 0.00 54.13 50.50 1aij s LEU 52 Cb -0.15 -1.38 0.00 0.00 0.03 0.00 0.00 46.19 44.69 1aij s LEU 52 CO 0.08 -0.27 0.00 0.61 0.23 0.00 0.00 176.35 177.00 1aij n GLY 53 N 3.45 0.71 0.34 -3.19 0.00 -1.26 -4.84 105.19 100.41 1aij n GLY 53 Ca 0.06 -1.95 0.04 0.00 0.00 0.00 0.00 46.02 44.17 1aij n GLY 53 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1aij h SER 54 N 0.00 0.87 -0.26 1.61 0.02 -1.99 -1.34 113.55 112.46 1aij h SER 54 Ca 0.00 0.03 -0.11 0.00 -0.84 0.00 0.00 61.79 60.87 1aij h SER 54 Cb 0.00 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.39 1aij h SER 54 CO 0.00 0.51 -0.28 0.25 -1.14 0.00 0.00 176.83 176.16 1aij h LEU 55 N 0.98 0.70 -0.87 5.07 5.85 -1.94 -0.28 115.31 124.82 1aij h LEU 55 Ca 0.43 -0.48 0.00 0.00 0.84 0.00 0.00 57.88 58.67 1aij h LEU 55 Cb 0.33 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 1aij h LEU 55 CO -0.22 1.04 0.55 1.23 -0.34 0.00 0.00 178.44 180.70 1aij h GLY 56 N 0.37 1.23 0.85 3.75 0.00 -1.80 -0.56 103.07 106.92 1aij h GLY 56 Ca 0.04 -0.48 -0.07 0.00 0.00 0.00 0.00 47.33 46.82 1aij h GLY 56 CO 0.07 0.47 -0.10 -2.08 0.00 0.00 0.00 176.54 174.90 1aij h VAL 57 N 1.18 1.30 -0.59 4.60 2.07 -1.14 -0.81 116.25 122.86 1aij h VAL 57 Ca 0.31 -1.16 -0.03 0.00 0.82 0.00 0.00 66.70 66.64 1aij h VAL 57 Cb -0.10 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 1aij h VAL 57 CO -0.06 0.36 0.25 0.25 0.02 0.00 0.00 177.57 178.39 1aij h LEU 58 N 0.23 0.80 -0.10 2.57 5.85 -0.87 0.13 115.31 123.91 1aij h LEU 58 Ca 0.06 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.62 1aij h LEU 58 Cb 0.59 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 1aij h LEU 58 CO 0.03 0.74 0.07 -1.28 -0.34 0.00 0.00 178.44 177.66 1aij h SER 59 N 0.81 0.12 -0.54 1.25 0.87 -1.07 0.63 113.55 115.62 1aij h SER 59 Ca 0.20 -0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.77 1aij h SER 59 Cb 0.18 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.07 1aij h SER 59 CO -0.02 0.09 0.33 -0.07 -0.53 0.00 0.00 176.83 176.63 1aij h LEU 60 N 0.14 0.54 -0.08 2.23 3.38 -0.94 -0.15 115.31 120.43 1aij h LEU 60 Ca 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1aij h LEU 60 Cb -0.01 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 1aij h LEU 60 CO -0.01 0.38 0.01 0.15 0.09 0.00 0.00 178.44 179.07 1aij h PHE 61 N 0.66 0.14 -0.80 1.13 3.57 -0.63 -0.79 116.94 120.21 1aij h PHE 61 Ca 0.21 -0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.70 1aij h PHE 61 Cb 0.00 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.66 1aij h PHE 61 CO -0.06 0.34 0.53 0.77 -2.23 0.00 0.00 178.31 177.66 1aij h SER 62 N -0.11 0.92 -0.28 0.41 0.02 -0.64 -0.29 113.55 113.58 1aij h SER 62 Ca 0.02 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1aij h SER 62 Cb 0.28 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 1aij h SER 62 CO 0.00 0.67 0.12 1.23 -1.14 0.00 0.00 176.83 177.71 1aij h GLY 63 N 1.09 0.44 1.65 -3.77 0.00 -0.94 0.56 103.07 102.09 1aij h GLY 63 Ca 0.29 -0.23 -0.07 0.00 0.00 0.00 0.00 47.33 47.33 1aij h GLY 63 CO -0.06 0.22 -0.15 1.41 0.00 0.00 0.00 176.54 177.95 1aij h LEU 64 N 0.31 0.41 -0.83 3.11 3.38 -0.78 -1.35 115.31 119.55 1aij h LEU 64 Ca 0.09 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 1aij h LEU 64 Cb 0.15 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1aij h LEU 64 CO -0.01 0.59 -0.32 0.24 0.09 0.00 0.00 178.44 179.03 1aij h MET 65 N 0.39 0.49 0.30 1.13 2.86 -0.51 0.29 114.93 119.88 1aij h MET 65 Ca 0.07 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.48 1aij h MET 65 Cb 0.50 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.15 1aij h MET 65 CO 0.03 0.76 -0.14 2.35 1.06 0.00 0.00 176.91 180.96 1aij h TRP 66 N 0.42 -0.37 -0.64 -0.22 7.01 -0.40 0.10 115.95 121.85 1aij h TRP 66 Ca 0.05 -0.01 0.09 0.00 2.11 0.00 0.00 58.89 61.13 1aij h TRP 66 Cb 0.77 0.12 -0.07 0.00 -2.10 0.00 0.00 29.16 27.89 1aij h TRP 66 CO 0.03 -0.21 0.28 0.74 -2.79 0.00 0.00 178.44 176.49 1aij h PHE 67 N -0.42 0.50 -0.69 2.65 -1.00 -1.08 -1.80 116.94 115.10 1aij h PHE 67 Ca -0.04 0.03 -0.03 0.00 2.81 0.00 0.00 57.97 60.73 1aij h PHE 67 Cb 0.32 -0.13 -0.03 0.00 3.61 0.00 0.00 35.95 39.72 1aij h PHE 67 CO -0.05 0.17 0.30 0.35 -1.61 0.00 0.00 178.31 177.47 1aij h PHE 68 N 0.50 1.03 0.10 -0.55 3.57 -0.61 0.55 116.94 121.54 1aij h PHE 68 Ca 0.31 -0.07 -0.01 0.00 3.53 0.00 0.00 57.97 61.74 1aij h PHE 68 Cb 0.34 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.77 1aij h PHE 68 CO -0.13 0.79 -0.05 1.15 -2.23 0.00 0.00 178.31 177.84 1aij h THR 69 N 0.98 1.02 -0.46 4.41 2.02 -0.41 0.23 112.91 120.70 1aij h THR 69 Ca 0.23 -0.46 0.03 0.00 0.77 0.00 0.00 66.41 66.98 1aij h THR 69 Cb 0.18 1.32 -0.03 0.00 -1.74 0.00 0.00 68.15 67.87 1aij h THR 69 CO -0.02 0.11 0.25 0.40 0.37 0.00 0.00 175.52 176.63 1aij h ILE 70 N -0.35 1.01 -0.74 3.11 2.04 -1.22 -2.69 117.51 118.67 1aij h ILE 70 Ca -0.01 -0.17 -0.04 0.00 1.00 0.00 0.00 64.86 65.63 1aij h ILE 70 Cb 0.29 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.80 1aij h ILE 70 CO 0.02 0.09 0.30 1.23 0.00 0.00 0.00 178.15 179.80 1aij h GLY 71 N 0.51 1.18 1.75 5.37 0.00 -0.79 -0.55 103.07 110.53 1aij h GLY 71 Ca 0.19 -0.64 -0.11 0.00 0.00 0.00 0.00 47.33 46.78 1aij h GLY 71 CO -0.11 0.60 -0.39 1.19 0.00 0.00 0.00 176.54 177.83 1aij h ILE 72 N 1.06 1.30 -0.11 2.60 2.10 -0.69 0.45 117.51 124.21 1aij h ILE 72 Ca 0.25 -1.48 -0.02 0.00 1.08 0.00 0.00 64.86 64.69 1aij h ILE 72 Cb 0.20 1.63 -0.00 0.00 -1.09 0.00 0.00 36.82 37.56 1aij h ILE 72 CO -0.02 0.45 -0.01 -0.25 -1.08 0.00 0.00 178.15 177.24 1aij h TRP 73 N 0.24 0.23 -0.81 2.19 2.91 -1.12 -0.51 115.95 119.08 1aij h TRP 73 Ca 0.02 -0.04 -0.01 0.00 1.13 0.00 0.00 58.89 59.99 1aij h TRP 73 Cb 0.80 -0.06 -0.04 0.00 -0.51 0.00 0.00 29.16 29.35 1aij h TRP 73 CO 0.02 0.47 0.46 0.74 -1.03 0.00 0.00 178.44 179.10 1aij h PHE 74 N -0.08 1.09 -0.62 2.65 -1.00 -0.69 -0.25 116.94 118.03 1aij h PHE 74 Ca 0.03 -0.02 -0.07 0.00 2.81 0.00 0.00 57.97 60.72 1aij h PHE 74 Cb 0.38 -0.35 -0.03 0.00 3.61 0.00 0.00 35.95 39.57 1aij h PHE 74 CO 0.04 0.75 0.09 -1.49 -1.61 0.00 0.00 178.31 176.09 1aij h TRP 75 N 1.11 1.08 0.23 -0.55 4.06 -0.83 -0.03 115.95 121.02 1aij h TRP 75 Ca 0.29 -0.14 -0.01 0.00 2.06 0.00 0.00 58.89 61.08 1aij h TRP 75 Cb -0.00 -0.30 0.00 0.00 -1.00 0.00 0.00 29.16 27.86 1aij h TRP 75 CO -0.00 0.92 -0.11 -0.92 -3.56 0.00 0.00 178.44 174.77 1aij h TYR 76 N 0.96 -0.28 -0.09 0.49 3.20 -0.50 -0.98 116.97 119.77 1aij h TYR 76 Ca 0.19 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.08 1aij h TYR 76 Cb 0.42 0.09 -0.00 0.00 1.54 0.00 0.00 36.73 38.78 1aij h TYR 76 CO 0.03 -0.16 0.08 1.96 -1.64 0.00 0.00 178.16 178.43 1aij h GLN 77 N -0.32 0.00 -0.02 1.82 4.20 -0.76 -0.48 115.11 119.55 1aij h GLN 77 Ca -0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1aij h GLN 77 Cb 0.25 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.03 1aij h GLN 77 CO 0.05 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 178.21 1aij n ALA 78 N -2.40 2.64 -2.39 3.87 0.00 -0.05 -4.90 120.51 117.28 1aij n ALA 78 Ca -0.01 -0.24 -0.17 0.00 0.00 0.00 0.00 53.44 53.03 1aij n ALA 78 Cb 0.19 -1.37 -0.00 0.00 0.00 0.00 0.00 19.45 18.26 1aij n ALA 78 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aij n GLY 79 N 0.97 -0.32 2.16 0.00 0.00 -0.19 -2.36 105.19 105.46 1aij n GLY 79 Ca 0.20 -0.16 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 1aij n GLY 79 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1aij n TRP 80 N -4.05 -0.51 -3.46 1.61 7.02 -0.41 -4.96 117.44 112.68 1aij n TRP 80 Ca -0.19 0.00 -0.40 0.00 -1.02 0.00 0.00 57.50 55.90 1aij n TRP 80 Cb 0.65 -2.77 -0.10 0.00 -2.42 0.00 0.00 31.31 26.67 1aij n TRP 80 CO 0.00 0.00 0.00 1.21 -2.02 0.00 0.00 177.69 176.88 1aij s ASN 81 N -2.18 6.15 0.33 -0.99 3.84 -0.99 -4.98 114.94 116.12 1aij s ASN 81 Ca 0.00 -0.06 0.04 0.00 0.21 0.00 0.00 52.86 53.05 1aij s ASN 81 Cb 0.00 -2.18 0.65 0.00 -0.55 0.00 0.00 41.25 39.18 1aij s ASN 81 CO 0.00 -0.22 1.92 -0.65 -2.79 0.00 0.00 177.10 175.36 1aij h PRO 82 N 8.37 0.85 -0.13 0.43 0.11 -1.93 -0.58 132.00 139.12 1aij h PRO 82 Ca -0.32 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 65.61 1aij h PRO 82 Cb 1.16 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.07 1aij h PRO 82 CO 0.64 0.56 -0.50 0.00 -0.21 0.00 0.00 178.00 178.49 1aij h ALA 83 N 1.56 0.91 -0.21 -0.75 0.00 -1.96 -1.73 119.26 117.08 1aij h ALA 83 Ca 0.37 -0.48 -0.16 0.00 0.00 0.00 0.00 54.91 54.64 1aij h ALA 83 Cb 0.31 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1aij h ALA 83 CO -0.14 0.66 -0.51 0.28 0.00 0.00 0.00 179.25 179.54 1aij h VAL 84 N 0.27 1.31 -0.40 0.00 2.07 -1.62 -2.33 116.25 115.54 1aij h VAL 84 Ca 0.01 -1.73 0.04 0.00 0.82 0.00 0.00 66.70 65.84 1aij h VAL 84 Cb 0.98 1.85 -0.04 0.00 -1.52 0.00 0.00 31.29 32.56 1aij h VAL 84 CO 0.08 0.54 0.19 0.15 0.02 0.00 0.00 177.57 178.56 1aij h PHE 85 N 0.42 0.35 -0.28 1.57 3.57 -0.90 -1.49 116.94 120.18 1aij h PHE 85 Ca -0.00 0.02 -0.19 0.00 3.53 0.00 0.00 57.97 61.32 1aij h PHE 85 Cb 1.12 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.77 1aij h PHE 85 CO 0.09 0.17 -0.57 -0.07 -2.23 0.00 0.00 178.31 175.70 1aij h LEU 86 N 0.38 0.97 -0.69 0.59 3.38 -1.33 -1.63 115.31 117.00 1aij h LEU 86 Ca 0.18 -0.53 -0.14 0.00 0.09 0.00 0.00 57.88 57.47 1aij h LEU 86 Cb 0.10 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1aij h LEU 86 CO -0.14 1.34 -0.63 0.08 0.09 0.00 0.00 178.44 179.18 1aij h ARG 87 N 0.66 0.10 -0.53 1.13 0.11 -1.19 -3.23 114.38 111.43 1aij h ARG 87 Ca 0.01 -0.07 0.00 0.00 0.10 0.00 0.00 59.98 60.01 1aij h ARG 87 Cb 1.18 0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.28 1aij h ARG 87 CO 0.13 0.70 0.00 -0.25 0.10 0.00 0.00 179.97 180.65 1aij n ASP 88 N -3.82 4.69 -0.24 0.08 8.00 -0.58 -4.66 116.55 120.02 1aij n ASP 88 Ca -0.02 -2.64 0.04 0.00 0.71 0.00 0.00 54.79 52.88 1aij n ASP 88 Cb 0.63 -0.57 0.16 0.00 -0.02 0.00 0.00 41.12 41.33 1aij n ASP 88 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1aij h LEU 89 N 3.44 0.07 -0.01 0.64 6.46 -1.31 0.12 115.31 124.72 1aij h LEU 89 Ca 0.00 0.13 0.00 0.00 -0.12 0.00 0.00 57.88 57.89 1aij h LEU 89 Cb 1.52 0.16 0.00 0.00 -0.73 0.00 0.00 40.66 41.62 1aij h LEU 89 CO 0.28 0.00 -0.08 0.49 -0.62 0.00 0.00 178.44 178.51 1aij n PHE 90 N -5.12 0.00 0.03 1.25 3.01 -1.26 -3.33 117.46 112.03 1aij n PHE 90 Ca 0.13 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.61 1aij n PHE 90 Cb 0.42 -0.43 -0.09 0.00 -0.01 0.00 0.00 39.48 39.37 1aij n PHE 90 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 1aij n PHE 91 N -1.46 0.76 -1.09 1.38 3.01 0.34 -2.55 117.46 117.85 1aij n PHE 91 Ca 0.08 0.24 -0.31 0.00 1.01 0.00 0.00 57.45 58.47 1aij n PHE 91 Cb 0.33 -0.98 0.12 0.00 -0.01 0.00 0.00 39.48 38.94 1aij n PHE 91 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 1aij s PHE 92 N -3.04 2.29 -0.28 1.38 0.08 -0.72 -4.89 117.98 112.79 1aij s PHE 92 Ca -0.04 1.61 -0.15 0.00 0.12 0.00 0.00 56.93 58.47 1aij s PHE 92 Cb 0.09 -3.13 0.09 0.00 -0.57 0.00 0.00 43.02 39.50 1aij s PHE 92 CO 0.82 -2.12 0.68 0.45 -0.10 0.00 0.00 175.22 174.95 1aij s SER 93 N -3.19 -0.98 -0.49 1.36 0.15 -1.26 -4.45 113.70 104.84 1aij s SER 93 Ca 0.63 1.53 -0.19 0.00 0.70 0.00 0.00 55.95 58.62 1aij s SER 93 Cb -0.19 1.54 0.05 0.00 -1.71 0.00 0.00 66.02 65.72 1aij s SER 93 CO 0.57 -0.24 0.57 -0.22 1.20 0.00 0.00 173.24 175.13 1aij s LEU 94 N 1.85 4.99 0.09 3.45 0.20 -0.10 -4.95 118.68 124.22 1aij s LEU 94 Ca -0.09 -0.88 -0.15 0.00 0.69 0.00 0.00 54.13 53.70 1aij s LEU 94 Cb -0.06 -2.43 -0.06 0.00 -0.43 0.00 0.00 46.19 43.20 1aij s LEU 94 CO -0.20 -0.81 0.51 -1.61 -0.29 0.00 0.00 176.35 173.95 1aij s GLU 95 N 2.46 3.99 0.99 1.98 0.41 -1.26 -1.43 118.70 125.84 1aij s GLU 95 Ca 0.14 0.49 -0.12 0.00 -0.41 0.00 0.00 54.97 55.07 1aij s GLU 95 Cb -0.19 -3.06 0.18 0.00 -1.78 0.00 0.00 34.13 29.28 1aij s GLU 95 CO 0.12 0.57 1.08 -1.25 -0.49 0.00 0.00 175.26 175.29 1aij s PRO 96 N -1.60 0.49 0.57 0.39 0.04 -1.26 -4.09 135.00 129.55 1aij s PRO 96 Ca 0.33 0.94 -0.18 0.00 0.04 0.00 0.00 61.00 62.12 1aij s PRO 96 Cb -0.16 -1.71 -0.08 0.00 0.04 0.00 0.00 34.50 32.59 1aij s PRO 96 CO 0.18 -2.80 0.64 -2.30 0.04 0.00 0.00 177.00 172.76 1aij n PRO 97 N -4.28 0.61 -1.20 0.56 -0.02 -1.26 -4.56 135.00 124.84 1aij n PRO 97 Ca 0.07 0.24 -0.32 0.00 -2.02 0.00 0.00 63.50 61.47 1aij n PRO 97 Cb 0.54 -1.81 0.11 0.00 -0.02 0.00 0.00 33.50 32.32 1aij n PRO 97 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1aij s ALA 98 N -1.66 2.04 0.34 3.55 0.00 -1.26 -3.29 121.76 121.49 1aij s ALA 98 Ca 0.70 0.49 0.10 0.00 0.00 0.00 0.00 51.96 53.25 1aij s ALA 98 Cb -0.44 -3.36 0.85 0.00 0.00 0.00 0.00 23.12 20.17 1aij s ALA 98 CO 0.53 -1.99 1.79 -1.35 0.00 0.00 0.00 175.76 174.73 1aij h PRO 99 N -1.04 0.63 -0.52 0.00 0.11 -1.94 -1.82 132.00 127.42 1aij h PRO 99 Ca -0.44 -0.04 0.15 0.00 0.11 0.00 0.00 66.00 65.78 1aij h PRO 99 Cb 1.25 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1aij h PRO 99 CO 0.49 0.42 0.48 0.93 -0.21 0.00 0.00 178.00 180.10 1aij h GLU 100 N 0.65 0.00 -0.00 1.05 3.07 -2.00 -0.82 114.58 116.53 1aij h GLU 100 Ca 0.56 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.42 1aij h GLU 100 Cb 1.03 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.94 1aij h GLU 100 CO -0.34 0.00 -0.23 0.66 -1.40 0.00 0.00 179.01 177.71 1aij n TYR 101 N -3.90 0.00 0.00 4.33 4.01 -0.68 -5.00 117.16 115.91 1aij n TYR 101 Ca 0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.84 1aij n TYR 101 Cb 0.68 -0.27 0.00 0.00 -0.31 0.00 0.00 39.34 39.45 1aij n TYR 101 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1aij n GLY 102 N 1.41 3.44 1.23 2.72 0.00 -0.31 -1.56 105.19 112.11 1aij n GLY 102 Ca 0.10 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.16 1aij n GLY 102 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1aij n LEU 103 N 0.00 4.48 -4.86 0.99 4.77 -1.23 -1.56 117.00 119.59 1aij n LEU 103 Ca 0.00 -2.95 -0.31 0.00 -0.03 0.00 0.00 56.01 52.72 1aij n LEU 103 Cb 0.00 -0.58 -0.02 0.00 -2.33 0.00 0.00 43.42 40.48 1aij n LEU 103 CO 0.00 0.67 0.64 -0.94 -1.33 0.00 0.00 177.39 176.43 1aij s SER 104 N -1.51 6.52 -0.05 -1.43 1.04 -0.60 -4.95 113.70 112.71 1aij s SER 104 Ca 0.46 1.44 0.15 0.00 0.48 0.00 0.00 55.95 58.49 1aij s SER 104 Cb 0.36 -2.46 0.53 0.00 0.10 0.00 0.00 66.02 64.55 1aij s SER 104 CO 0.12 -0.61 1.42 0.49 0.98 0.00 0.00 173.24 175.64 1aij n PHE 105 N -1.77 0.99 0.80 5.02 3.72 -1.26 -4.40 117.46 120.55 1aij n PHE 105 Ca 0.06 -0.42 0.03 0.00 -0.05 0.00 0.00 57.45 57.06 1aij n PHE 105 Cb 0.54 -0.12 0.11 0.00 -0.94 0.00 0.00 39.48 39.07 1aij n PHE 105 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1aij n ALA 106 N 0.96 2.73 -2.26 4.37 0.00 -1.26 -4.89 120.51 120.15 1aij n ALA 106 Ca 0.19 -0.49 -0.42 0.00 0.00 0.00 0.00 53.44 52.73 1aij n ALA 106 Cb 0.61 -1.02 -0.03 0.00 0.00 0.00 0.00 19.45 19.01 1aij n ALA 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aij s ALA 107 N -1.59 3.38 0.58 0.00 0.00 -1.26 -5.00 121.76 117.86 1aij s ALA 107 Ca 0.15 0.84 -0.19 0.00 0.00 0.00 0.00 51.96 52.76 1aij s ALA 107 Cb 0.10 -3.40 -0.06 0.00 0.00 0.00 0.00 23.12 19.76 1aij s ALA 107 CO 0.07 -0.34 0.94 -2.30 0.00 0.00 0.00 175.76 174.13 1aij n PRO 108 N 3.20 0.94 -0.33 0.00 -0.02 -1.26 -3.66 135.00 133.86 1aij n PRO 108 Ca 0.06 0.36 0.08 0.00 -2.02 0.00 0.00 63.50 61.98 1aij n PRO 108 Cb 0.46 -2.13 0.24 0.00 -0.02 0.00 0.00 33.50 32.06 1aij n PRO 108 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1aij h LEU 109 N 0.61 0.75 0.00 2.45 3.38 -1.94 0.11 115.31 120.68 1aij h LEU 109 Ca -0.48 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1aij h LEU 109 Cb 1.36 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.04 1aij h LEU 109 CO 0.51 0.36 0.00 0.29 0.09 0.00 0.00 178.44 179.69 1aij n LYS 110 N -4.74 0.26 -1.67 1.13 5.02 -1.26 -2.02 118.16 114.89 1aij n LYS 110 Ca 0.19 0.05 -0.15 0.00 -2.02 0.00 0.00 58.31 56.38 1aij n LYS 110 Cb 0.41 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 33.99 1aij n LYS 110 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1aij n GLU 111 N -1.35 2.95 0.00 1.97 1.02 0.31 -4.91 120.64 120.63 1aij n GLU 111 Ca 0.10 -3.88 0.00 0.00 -0.02 0.00 0.00 57.16 53.36 1aij n GLU 111 Cb 0.23 -2.04 0.00 0.00 -0.02 0.00 0.00 31.44 29.61 1aij n GLU 111 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1aij n GLY 112 N -0.80 2.27 0.25 0.62 0.00 -1.17 -4.21 105.19 102.14 1aij n GLY 112 Ca 0.35 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.29 1aij n GLY 112 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1aij h GLY 113 N 0.00 0.88 0.98 -0.02 0.00 -1.31 -0.89 103.07 102.72 1aij h GLY 113 Ca 0.00 -0.48 -0.02 0.00 0.00 0.00 0.00 47.33 46.82 1aij h GLY 113 CO 0.00 0.45 0.25 1.41 0.00 0.00 0.00 176.54 178.65 1aij h LEU 114 N 0.75 0.72 -0.63 3.11 4.07 -1.63 -1.18 115.31 120.52 1aij h LEU 114 Ca 0.18 -0.14 0.05 0.00 0.08 0.00 0.00 57.88 58.05 1aij h LEU 114 Cb 0.20 -0.19 -0.05 0.00 1.08 0.00 0.00 40.66 41.71 1aij h LEU 114 CO -0.01 0.67 0.35 -0.25 -1.08 0.00 0.00 178.44 178.11 1aij h TRP 115 N 0.73 0.64 -0.90 1.13 7.01 -1.71 -1.48 115.95 121.38 1aij h TRP 115 Ca 0.19 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.20 1aij h TRP 115 Cb 0.14 -0.20 -0.04 0.00 -2.10 0.00 0.00 29.16 26.96 1aij h TRP 115 CO -0.00 0.32 0.53 -0.07 -2.79 0.00 0.00 178.44 176.43 1aij h LEU 116 N 0.66 1.09 -0.29 0.65 3.38 -0.58 -0.59 115.31 119.62 1aij h LEU 116 Ca 0.28 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 58.12 1aij h LEU 116 Cb 0.15 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1aij h LEU 116 CO -0.16 0.84 -0.03 0.40 0.09 0.00 0.00 178.44 179.58 1aij h ILE 117 N 1.24 1.27 -0.51 1.22 2.04 -0.69 -1.75 117.51 120.34 1aij h ILE 117 Ca 0.32 -1.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.16 1aij h ILE 117 Cb -0.04 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 1aij h ILE 117 CO -0.06 0.32 0.26 0.00 0.00 0.00 0.00 178.15 178.68 1aij h ALA 118 N 0.81 0.65 -0.25 1.87 0.00 -1.02 -1.64 119.26 119.68 1aij h ALA 118 Ca 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1aij h ALA 118 Cb 0.48 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1aij h ALA 118 CO 0.02 0.19 0.10 0.77 0.00 0.00 0.00 179.25 180.33 1aij h SER 119 N 0.67 0.31 -0.21 0.00 0.02 -0.99 0.18 113.55 113.53 1aij h SER 119 Ca 0.18 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.08 1aij h SER 119 Cb 0.08 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1aij h SER 119 CO -0.03 0.29 0.04 0.15 -1.14 0.00 0.00 176.83 176.14 1aij h PHE 120 N 0.35 0.37 -0.43 3.45 3.57 -0.60 -0.40 116.94 123.24 1aij h PHE 120 Ca 0.09 -0.05 -0.11 0.00 3.53 0.00 0.00 57.97 61.43 1aij h PHE 120 Cb 0.08 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.70 1aij h PHE 120 CO 0.00 0.48 -0.17 0.74 -2.23 0.00 0.00 178.31 177.13 1aij h PHE 121 N 0.15 0.91 -0.54 0.41 0.04 -0.64 -1.46 116.94 115.81 1aij h PHE 121 Ca 0.06 -0.19 -0.09 0.00 2.80 0.00 0.00 57.97 60.55 1aij h PHE 121 Cb 0.31 -0.23 -0.02 0.00 2.20 0.00 0.00 35.95 38.21 1aij h PHE 121 CO 0.02 0.92 -0.01 1.98 -0.60 0.00 0.00 178.31 180.62 1aij h MET 122 N 0.72 0.96 0.21 1.51 4.05 -0.96 -0.76 114.93 120.66 1aij h MET 122 Ca 0.11 -0.31 0.00 0.00 -0.28 0.00 0.00 59.70 59.22 1aij h MET 122 Cb 0.68 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 31.38 1aij h MET 122 CO 0.05 0.97 -0.20 0.35 0.23 0.00 0.00 176.91 178.31 1aij h PHE 123 N 0.84 -0.52 -0.58 1.39 3.57 -0.74 -0.81 116.94 120.09 1aij h PHE 123 Ca 0.15 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.60 1aij h PHE 123 Cb 0.54 0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.46 1aij h PHE 123 CO 0.04 -0.30 0.14 0.28 -2.23 0.00 0.00 178.31 176.24 1aij h VAL 124 N -0.44 1.25 -0.13 1.41 2.07 -1.20 -1.80 116.25 117.41 1aij h VAL 124 Ca -0.00 -0.91 0.02 0.00 0.82 0.00 0.00 66.70 66.63 1aij h VAL 124 Cb 0.40 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 1aij h VAL 124 CO -0.04 0.34 0.03 0.00 0.02 0.00 0.00 177.57 177.91 1aij h ALA 125 N 1.03 0.13 -0.39 1.67 0.00 -0.86 0.08 119.26 120.92 1aij h ALA 125 Ca 0.18 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.02 1aij h ALA 125 Cb 0.36 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1aij h ALA 125 CO 0.00 -0.42 -0.14 0.28 0.00 0.00 0.00 179.25 178.97 1aij h VAL 126 N 0.09 1.28 -0.08 0.00 2.07 -1.05 -1.50 116.25 117.05 1aij h VAL 126 Ca 0.06 -1.25 -0.17 0.00 0.82 0.00 0.00 66.70 66.16 1aij h VAL 126 Cb 0.05 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1aij h VAL 126 CO -0.07 0.42 -0.69 -0.50 0.02 0.00 0.00 177.57 176.75 1aij h TRP 127 N 0.59 0.46 -0.21 1.57 4.06 -1.20 -0.10 115.95 121.13 1aij h TRP 127 Ca 0.09 -0.20 -0.18 0.00 2.06 0.00 0.00 58.89 60.67 1aij h TRP 127 Cb 0.68 -0.07 -0.00 0.00 -1.00 0.00 0.00 29.16 28.76 1aij h TRP 127 CO 0.05 0.93 -0.58 0.66 -3.56 0.00 0.00 178.44 175.94 1aij h SER 128 N 0.24 0.75 -0.64 -3.49 4.64 -0.94 -1.52 113.55 112.60 1aij h SER 128 Ca -0.02 -0.42 -0.02 0.00 -0.47 0.00 0.00 61.79 60.86 1aij h SER 128 Cb 1.24 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 63.08 1aij h SER 128 CO 0.11 1.17 0.33 -0.25 -0.87 0.00 0.00 176.83 177.32 1aij h TRP 129 N 0.50 0.91 -0.15 4.77 2.91 -1.11 -0.80 115.95 123.00 1aij h TRP 129 Ca 0.00 -0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.99 1aij h TRP 129 Cb 1.16 -0.29 -0.01 0.00 -0.51 0.00 0.00 29.16 29.51 1aij h TRP 129 CO 0.06 0.66 0.09 2.35 -1.03 0.00 0.00 178.44 180.57 1aij h TRP 130 N 0.93 0.19 -0.82 2.65 7.01 -0.69 -1.65 115.95 123.57 1aij h TRP 130 Ca 0.23 0.00 0.14 0.00 2.11 0.00 0.00 58.89 61.37 1aij h TRP 130 Cb 0.07 -0.06 -0.09 0.00 -2.10 0.00 0.00 29.16 26.98 1aij h TRP 130 CO 0.01 0.15 0.40 0.78 -2.79 0.00 0.00 178.44 176.98 1aij h GLY 131 N 0.18 1.30 1.01 2.65 0.00 -0.35 -0.86 103.07 107.00 1aij h GLY 131 Ca 0.05 -0.22 0.01 0.00 0.00 0.00 0.00 47.33 47.17 1aij h GLY 131 CO -0.01 -0.05 0.42 -0.09 0.00 0.00 0.00 176.54 176.81 1aij h ARG 132 N 0.57 0.83 0.00 4.80 2.43 -0.75 -1.07 114.38 121.20 1aij h ARG 132 Ca 0.45 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.53 1aij h ARG 132 Cb 0.64 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 29.99 1aij h ARG 132 CO -0.37 0.55 -0.16 1.79 -1.51 0.00 0.00 179.97 180.27 1aij h THR 133 N 0.86 0.89 0.18 0.20 1.35 -0.21 -0.94 112.91 115.24 1aij h THR 133 Ca 0.23 -0.60 -0.01 0.00 -0.55 0.00 0.00 66.41 65.48 1aij h THR 133 Cb -0.10 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 67.67 1aij h THR 133 CO -0.05 0.16 -0.09 0.22 -0.25 0.00 0.00 175.52 175.51 1aij h TYR 134 N 0.00 -0.23 -0.75 4.73 5.03 -1.24 -3.24 116.97 121.27 1aij h TYR 134 Ca -0.00 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.29 1aij h TYR 134 Cb 0.33 0.07 -0.04 0.00 1.55 0.00 0.00 36.73 38.65 1aij h TYR 134 CO 0.00 0.13 0.43 -0.07 -1.32 0.00 0.00 178.16 177.33 1aij h LEU 135 N -0.96 0.91 -1.23 2.82 3.38 -0.92 -0.98 115.31 118.33 1aij h LEU 135 Ca -0.02 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 1aij h LEU 135 Cb 0.45 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1aij h LEU 135 CO 0.04 0.72 -0.34 0.03 0.09 0.00 0.00 178.44 178.98 1aij h ARG 136 N 1.04 0.07 -0.11 1.13 2.47 -1.32 -0.17 114.38 117.49 1aij h ARG 136 Ca 0.27 -0.03 -0.11 0.00 -1.26 0.00 0.00 59.98 58.85 1aij h ARG 136 Cb -0.01 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.31 1aij h ARG 136 CO -0.05 0.41 -0.37 0.00 0.56 0.00 0.00 179.97 180.52 1aij h ALA 137 N 1.59 0.19 -0.47 0.04 0.00 -1.43 -3.17 119.26 116.01 1aij h ALA 137 Ca 0.01 -0.45 0.06 0.00 0.00 0.00 0.00 54.91 54.52 1aij h ALA 137 Cb 0.64 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 1aij h ALA 137 CO 0.05 0.27 0.16 0.37 0.00 0.00 0.00 179.25 180.10 1aij h GLN 138 N 0.01 0.32 0.00 0.00 4.15 -0.70 -0.90 115.11 117.99 1aij h GLN 138 Ca -0.02 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.36 1aij h GLN 138 Cb 1.00 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 28.62 1aij h GLN 138 CO 0.08 0.21 -0.10 0.00 -1.93 0.00 0.00 178.83 177.09 1aij h ALA 139 N 1.31 1.57 -0.21 3.38 0.00 -1.12 -1.44 119.26 122.75 1aij h ALA 139 Ca 0.22 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1aij h ALA 139 Cb 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1aij h ALA 139 CO -0.23 0.13 0.00 1.28 0.00 0.00 0.00 179.25 180.43 1aij n LEU 140 N -4.04 2.53 0.00 0.00 4.77 -0.51 -1.02 117.00 118.73 1aij n LEU 140 Ca -0.02 -1.02 0.00 0.00 -0.03 0.00 0.00 56.01 54.94 1aij n LEU 140 Cb 0.19 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 1aij n LEU 140 CO 0.32 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 1aij n GLY 141 N 1.31 0.44 3.84 -0.72 0.00 -0.50 -4.94 105.19 104.62 1aij n GLY 141 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1aij n GLY 141 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1aij s MET 142 N -0.34 4.00 0.72 1.61 1.00 -0.46 -4.97 119.30 120.86 1aij s MET 142 Ca 0.00 0.85 -0.15 0.00 0.00 0.00 0.00 55.69 56.39 1aij s MET 142 Cb 0.00 -2.25 0.04 0.00 0.00 0.00 0.00 34.83 32.62 1aij s MET 142 CO 0.00 -0.09 1.20 0.20 0.00 0.00 0.00 175.02 176.34 1aij s GLY 143 N -2.71 2.34 -0.14 -0.03 0.00 -1.26 -4.30 107.32 101.22 1aij s GLY 143 Ca 0.57 0.86 0.00 0.00 0.00 0.00 0.00 44.72 46.16 1aij s GLY 143 CO 0.24 1.26 1.63 0.28 0.00 0.00 0.00 173.10 176.52 1aij n LYS 144 N -2.69 1.37 0.06 2.90 4.76 -1.26 -4.52 118.16 118.78 1aij n LYS 144 Ca 0.13 -0.79 -0.00 0.00 -2.87 0.00 0.00 58.31 54.78 1aij n LYS 144 Cb 0.50 -1.31 0.30 0.00 -1.84 0.00 0.00 35.03 32.68 1aij n LYS 144 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1aij h HIS 145 N 0.77 0.39 -0.29 2.13 3.86 -1.96 -2.70 115.15 117.34 1aij h HIS 145 Ca 0.16 -0.06 -0.06 0.00 -1.16 0.00 0.00 60.37 59.25 1aij h HIS 145 Cb 1.20 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.56 1aij h HIS 145 CO 0.47 0.52 -0.04 1.15 0.86 0.00 0.00 177.93 180.89 1aij h THR 146 N 0.33 1.27 -0.74 2.45 2.02 -1.91 -1.95 112.91 114.38 1aij h THR 146 Ca 0.06 -1.03 -0.01 0.00 0.77 0.00 0.00 66.41 66.20 1aij h THR 146 Cb 0.50 1.36 -0.04 0.00 -1.74 0.00 0.00 68.15 68.24 1aij h THR 146 CO 0.03 0.33 0.42 0.00 0.37 0.00 0.00 175.52 176.67 1aij h ALA 147 N 0.80 0.95 -0.51 6.16 0.00 -1.75 0.49 119.26 125.40 1aij h ALA 147 Ca 0.08 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1aij h ALA 147 Cb 0.50 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1aij h ALA 147 CO 0.02 0.45 0.21 -1.49 0.00 0.00 0.00 179.25 178.44 1aij h TRP 148 N 1.02 0.77 -0.50 0.00 -0.00 -1.42 -1.15 115.95 114.67 1aij h TRP 148 Ca 0.26 -0.06 -0.02 0.00 -0.00 0.00 0.00 58.89 59.08 1aij h TRP 148 Cb 0.01 -0.23 -0.02 0.00 -0.00 0.00 0.00 29.16 28.92 1aij h TRP 148 CO -0.00 0.64 0.23 0.00 -0.00 0.00 0.00 178.44 179.31 1aij h ALA 149 N 1.05 0.65 -0.77 1.49 0.00 -0.90 -2.61 119.26 118.16 1aij h ALA 149 Ca 0.17 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1aij h ALA 149 Cb 0.19 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 1aij h ALA 149 CO -0.01 0.22 0.51 0.35 0.00 0.00 0.00 179.25 180.32 1aij h PHE 150 N 0.67 0.97 -0.71 0.00 3.57 -0.67 -1.80 116.94 118.97 1aij h PHE 150 Ca 0.17 0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.80 1aij h PHE 150 Cb 0.14 -0.33 -0.05 0.00 2.79 0.00 0.00 35.95 38.50 1aij h PHE 150 CO -0.00 0.61 0.47 -0.07 -2.23 0.00 0.00 178.31 177.08 1aij h LEU 151 N 1.04 0.51 -0.95 0.59 3.38 -0.81 -0.99 115.31 118.08 1aij h LEU 151 Ca 0.28 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 58.20 1aij h LEU 151 Cb -0.11 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1aij h LEU 151 CO -0.06 0.30 0.00 -1.28 0.09 0.00 0.00 178.44 177.49 1aij h SER 152 N 0.57 0.73 -0.14 -0.43 0.87 -1.30 -0.58 113.55 113.27 1aij h SER 152 Ca 0.33 -0.17 -0.05 0.00 -1.23 0.00 0.00 61.79 60.67 1aij h SER 152 Cb 0.53 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.29 1aij h SER 152 CO -0.11 0.80 -0.10 0.00 -0.53 0.00 0.00 176.83 176.89 1aij h ALA 153 N 1.29 0.19 -0.91 6.23 0.00 -1.27 -2.98 119.26 121.81 1aij h ALA 153 Ca 0.14 -0.29 0.08 0.00 0.00 0.00 0.00 54.91 54.84 1aij h ALA 153 Cb 0.43 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 1aij h ALA 153 CO 0.02 0.02 0.59 0.82 0.00 0.00 0.00 179.25 180.71 1aij h ILE 154 N -0.06 1.03 -0.34 0.00 2.04 -1.14 -2.44 117.51 116.60 1aij h ILE 154 Ca 0.03 -0.34 0.08 0.00 1.00 0.00 0.00 64.86 65.62 1aij h ILE 154 Cb 0.60 -0.05 -0.08 0.00 -0.74 0.00 0.00 36.82 36.54 1aij h ILE 154 CO 0.03 0.18 -0.23 -0.25 0.00 0.00 0.00 178.15 177.88 1aij h TRP 155 N 1.00 -0.60 -0.30 1.37 -0.00 -0.94 0.28 115.95 116.77 1aij h TRP 155 Ca 0.40 0.04 -0.00 0.00 -0.00 0.00 0.00 58.89 59.34 1aij h TRP 155 Cb 0.27 0.32 -0.01 0.00 -0.00 0.00 0.00 29.16 29.73 1aij h TRP 155 CO -0.00 -0.31 0.17 1.25 -0.00 0.00 0.00 178.44 179.56 1aij h LEU 156 N -0.18 0.36 -0.89 0.65 6.46 -1.45 0.04 115.31 120.29 1aij h LEU 156 Ca 0.17 -0.07 -0.01 0.00 -0.12 0.00 0.00 57.88 57.85 1aij h LEU 156 Cb 0.45 -0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 40.25 1aij h LEU 156 CO -0.45 0.32 0.51 -0.25 -0.62 0.00 0.00 178.44 177.95 1aij h TRP 157 N 0.37 1.20 -0.41 1.25 7.01 -1.15 -0.96 115.95 123.26 1aij h TRP 157 Ca 0.11 -0.02 -0.05 0.00 2.11 0.00 0.00 58.89 61.04 1aij h TRP 157 Cb 0.03 -0.39 -0.02 0.00 -2.10 0.00 0.00 29.16 26.69 1aij h TRP 157 CO -0.04 0.82 0.07 0.52 -2.79 0.00 0.00 178.44 177.02 1aij h MET 158 N 1.23 0.68 0.15 2.65 2.86 -0.08 -1.03 114.93 121.40 1aij h MET 158 Ca 0.32 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 1aij h MET 158 Cb -0.01 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.58 1aij h MET 158 CO -0.05 0.73 -0.07 0.28 1.06 0.00 0.00 176.91 178.85 1aij h VAL 159 N 0.54 0.85 -0.20 -2.22 2.07 -0.58 0.13 116.25 116.84 1aij h VAL 159 Ca 0.13 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.64 1aij h VAL 159 Cb 0.37 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1aij h VAL 159 CO 0.01 0.00 0.12 -0.07 0.02 0.00 0.00 177.57 177.65 1aij h LEU 160 N -0.20 0.24 0.00 2.57 3.38 -1.01 -0.96 115.31 119.33 1aij h LEU 160 Ca -0.02 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1aij h LEU 160 Cb 0.16 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1aij h LEU 160 CO 0.03 0.23 -1.35 0.61 0.09 0.00 0.00 178.44 178.05 1aij n GLY 161 N -1.01 -1.06 1.74 0.83 0.00 -0.40 -4.19 105.19 101.10 1aij n GLY 161 Ca -0.03 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.47 1aij n GLY 161 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1aij n PHE 162 N -1.90 -1.51 0.24 1.61 3.01 -0.27 -4.84 117.46 113.80 1aij n PHE 162 Ca 0.01 0.27 -0.16 0.00 1.01 0.00 0.00 57.45 58.58 1aij n PHE 162 Cb 0.44 0.42 -0.08 0.00 -0.01 0.00 0.00 39.48 40.25 1aij n PHE 162 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1aij h ILE 163 N 0.00 0.59 -0.10 4.37 2.04 -0.87 -0.92 117.51 122.62 1aij h ILE 163 Ca 0.00 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 1aij h ILE 163 Cb 0.00 0.62 -0.00 0.00 -0.74 0.00 0.00 36.82 36.69 1aij h ILE 163 CO 0.00 0.01 0.01 -0.09 0.00 0.00 0.00 178.15 178.08 1aij h ARG 164 N -0.58 0.17 -0.72 2.37 2.43 -1.37 -1.04 114.38 115.64 1aij h ARG 164 Ca -0.06 -0.05 0.16 0.00 -0.81 0.00 0.00 59.98 59.22 1aij h ARG 164 Cb 0.44 -0.02 -0.13 0.00 -0.42 0.00 0.00 29.97 29.84 1aij h ARG 164 CO 0.09 0.38 -0.06 -1.35 -1.51 0.00 0.00 179.97 177.53 1aij h PRO 165 N -0.06 0.06 -0.13 0.20 0.11 -1.72 -0.35 132.00 130.11 1aij h PRO 165 Ca 0.03 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.13 1aij h PRO 165 Cb 0.30 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.39 1aij h PRO 165 CO 0.00 0.04 0.06 0.82 -0.21 0.00 0.00 178.00 178.72 1aij h ILE 166 N 0.07 1.12 0.00 4.15 2.04 -0.99 0.22 117.51 124.12 1aij h ILE 166 Ca 0.38 -0.36 -0.02 0.00 1.00 0.00 0.00 64.86 65.86 1aij h ILE 166 Cb 0.64 1.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.84 1aij h ILE 166 CO -0.67 0.11 -0.10 -0.07 0.00 0.00 0.00 178.15 177.42 1aij h LEU 167 N 0.08 0.00 -0.97 1.44 3.38 -0.42 -0.35 115.31 118.47 1aij h LEU 167 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1aij h LEU 167 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1aij h LEU 167 CO -0.01 0.10 -0.02 0.23 0.09 0.00 0.00 178.44 178.83 1aij n MET 168 N -4.28 1.62 -1.86 1.13 2.81 -0.21 -4.97 117.12 111.37 1aij n MET 168 Ca -0.03 -0.97 -0.07 0.00 -1.81 0.00 0.00 57.70 54.82 1aij n MET 168 Cb 0.18 -1.48 -0.01 0.00 -0.71 0.00 0.00 33.22 31.19 1aij n MET 168 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1aij n GLY 169 N 1.20 0.34 3.56 3.03 0.00 -0.07 -5.02 105.19 108.23 1aij n GLY 169 Ca 0.18 -0.62 -0.08 0.00 0.00 0.00 0.00 46.02 45.50 1aij n GLY 169 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1aij s SER 170 N -2.75 -0.85 0.44 1.61 0.15 -0.40 -3.58 113.70 108.32 1aij s SER 170 Ca 0.00 1.38 0.24 0.00 0.70 0.00 0.00 55.95 58.27 1aij s SER 170 Cb 0.00 1.26 0.88 0.00 -1.71 0.00 0.00 66.02 66.46 1aij s SER 170 CO 0.00 -0.23 1.81 -0.50 1.20 0.00 0.00 173.24 175.52 1aij h TRP 171 N 6.92 0.00 0.00 3.44 -0.00 -1.53 -3.11 115.95 121.67 1aij h TRP 171 Ca -0.31 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.58 1aij h TRP 171 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.38 1aij h TRP 171 CO 0.11 0.23 0.00 0.66 -0.00 0.00 0.00 178.44 179.43 1aij h SER 172 N 0.00 0.00 1.09 -3.49 4.64 -1.80 -1.00 113.55 113.00 1aij h SER 172 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1aij h SER 172 Cb 0.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 1aij h SER 172 CO 0.03 0.00 0.00 -0.33 -0.87 0.00 0.00 176.83 175.66 1aij h GLU 173 N 0.00 0.00 -7.71 4.77 4.39 -1.86 -3.47 114.58 110.70 1aij h GLU 173 Ca 0.00 0.00 -0.45 0.00 0.34 0.00 0.00 59.36 59.25 1aij h GLU 173 Cb 0.00 0.00 0.15 0.00 -0.10 0.00 0.00 28.75 28.80 1aij h GLU 173 CO 0.00 0.00 0.38 0.00 -1.16 0.00 0.00 179.01 178.23 1aij s ALA 174 N -3.28 2.09 0.08 3.43 0.00 -0.38 -4.84 121.76 118.86 1aij s ALA 174 Ca 0.06 -1.02 -0.18 0.00 0.00 0.00 0.00 51.96 50.82 1aij s ALA 174 Cb 0.10 -2.84 -0.07 0.00 0.00 0.00 0.00 23.12 20.31 1aij s ALA 174 CO 0.50 -2.42 0.56 0.08 0.00 0.00 0.00 175.76 174.48 1aij s VAL 175 N -3.68 4.77 0.67 0.00 1.01 -1.26 -4.90 120.40 117.01 1aij s VAL 175 Ca 0.71 1.14 -0.11 0.00 0.00 0.00 0.00 61.98 63.72 1aij s VAL 175 Cb -0.07 -3.86 -0.00 0.00 0.00 0.00 0.00 36.38 32.44 1aij s VAL 175 CO 0.53 0.51 1.05 -2.16 0.00 0.00 0.00 175.10 175.02 1aij s PRO 176 N -1.25 3.10 -0.52 2.72 0.04 -1.26 -4.80 135.00 133.04 1aij s PRO 176 Ca 0.30 0.91 -0.17 0.00 0.04 0.00 0.00 61.00 62.09 1aij s PRO 176 Cb -0.19 -2.01 0.09 0.00 0.04 0.00 0.00 34.50 32.43 1aij s PRO 176 CO 0.19 -0.97 0.52 0.71 0.04 0.00 0.00 177.00 177.49 1aij s TYR 177 N -3.06 3.17 -0.23 0.56 2.02 -0.51 -4.49 117.35 114.80 1aij s TYR 177 Ca 0.57 -0.98 -0.29 0.00 -0.37 0.00 0.00 57.07 56.01 1aij s TYR 177 Cb -0.13 -3.56 0.16 0.00 -0.40 0.00 0.00 41.96 38.02 1aij s TYR 177 CO 0.54 -0.99 1.19 0.20 -1.57 0.00 0.00 175.55 174.92 1aij s GLY 178 N 3.09 -0.05 0.01 0.71 0.00 -1.26 -0.92 107.32 108.89 1aij s GLY 178 Ca 0.07 2.56 -0.22 0.00 0.00 0.00 0.00 44.72 47.12 1aij s GLY 178 CO 0.06 1.23 1.02 -2.22 0.00 0.00 0.00 173.10 173.20 1aij h ILE 179 N 2.52 0.00 -0.27 0.90 1.08 -1.78 -2.48 117.51 117.48 1aij h ILE 179 Ca -0.16 -0.27 -0.19 0.00 -0.39 0.00 0.00 64.86 63.85 1aij h ILE 179 Cb 1.18 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.93 1aij h ILE 179 CO 0.24 0.00 -0.57 -0.26 -0.69 0.00 0.00 178.15 176.88 1aij h PHE 180 N -1.08 1.07 -0.74 1.37 0.04 -1.81 -3.24 116.94 112.54 1aij h PHE 180 Ca -0.08 -0.39 -0.02 0.00 2.80 0.00 0.00 57.97 60.28 1aij h PHE 180 Cb 0.62 -0.20 -0.04 0.00 2.20 0.00 0.00 35.95 38.53 1aij h PHE 180 CO 0.02 1.21 0.40 0.66 -0.60 0.00 0.00 178.31 180.00 1aij h SER 181 N 0.64 0.92 0.70 2.17 4.64 -1.79 -0.23 113.55 120.60 1aij h SER 181 Ca 0.01 -0.08 -0.05 0.00 -0.47 0.00 0.00 61.79 61.20 1aij h SER 181 Cb 1.17 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 63.02 1aij h SER 181 CO 0.12 0.75 -0.22 1.12 -0.87 0.00 0.00 176.83 177.73 1aij h HIS 182 N 1.03 0.00 -0.06 4.77 2.07 -1.47 -0.09 115.15 121.40 1aij h HIS 182 Ca 0.26 0.00 -0.24 0.00 -2.85 0.00 0.00 60.37 57.54 1aij h HIS 182 Cb 0.04 0.00 0.01 0.00 2.57 0.00 0.00 27.41 30.03 1aij h HIS 182 CO 0.01 0.22 -0.92 -0.07 -3.07 0.00 0.00 177.93 174.10 1aij h LEU 183 N 0.00 0.87 -0.61 6.12 3.38 -1.18 -1.66 115.31 122.23 1aij h LEU 183 Ca -0.00 -0.64 -0.04 0.00 0.09 0.00 0.00 57.88 57.29 1aij h LEU 183 Cb 0.64 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1aij h LEU 183 CO 0.03 1.44 0.23 0.44 0.09 0.00 0.00 178.44 180.67 1aij h ASP 184 N 0.43 0.85 -0.54 -0.43 3.32 -0.62 -1.28 116.42 118.15 1aij h ASP 184 Ca -0.09 -0.18 0.02 0.00 0.02 0.00 0.00 57.03 56.80 1aij h ASP 184 Cb 1.56 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 40.85 1aij h ASP 184 CO 0.18 0.80 0.33 -0.25 -1.72 0.00 0.00 179.24 178.58 1aij h TRP 185 N 0.85 0.61 -0.31 4.55 7.01 -1.00 -0.00 115.95 127.66 1aij h TRP 185 Ca 0.20 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.22 1aij h TRP 185 Cb 0.23 -0.20 -0.01 0.00 -2.10 0.00 0.00 29.16 27.08 1aij h TRP 185 CO 0.01 0.35 0.19 1.15 -2.79 0.00 0.00 178.44 177.35 1aij h THR 186 N 0.65 1.10 -0.15 2.65 2.02 -0.82 0.57 112.91 118.93 1aij h THR 186 Ca 0.22 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 67.17 1aij h THR 186 Cb 0.02 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.12 1aij h THR 186 CO -0.09 0.10 0.09 -1.13 0.37 0.00 0.00 175.52 174.85 1aij h ASN 187 N 0.40 0.18 -0.38 4.18 -1.24 -0.97 -2.70 115.58 115.05 1aij h ASN 187 Ca 0.11 -0.05 -0.01 0.00 0.71 0.00 0.00 56.30 57.06 1aij h ASN 187 Cb -0.00 -0.05 -0.02 0.00 0.73 0.00 0.00 38.32 38.98 1aij h ASN 187 CO -0.02 0.18 0.21 -1.13 -1.29 0.00 0.00 177.43 175.37 1aij h ASN 188 N 0.17 0.49 -0.24 1.15 -1.24 -0.77 -1.85 115.58 113.29 1aij h ASN 188 Ca 0.05 -0.03 -0.07 0.00 0.71 0.00 0.00 56.30 56.96 1aij h ASN 188 Cb 0.03 -0.13 -0.02 0.00 0.73 0.00 0.00 38.32 38.94 1aij h ASN 188 CO -0.01 0.41 -0.07 0.15 -1.29 0.00 0.00 177.43 176.62 1aij h PHE 189 N 0.56 0.66 0.24 0.67 3.04 -0.55 -0.23 116.94 121.33 1aij h PHE 189 Ca 0.14 -0.10 -0.01 0.00 3.98 0.00 0.00 57.97 61.99 1aij h PHE 189 Cb 0.04 -0.18 0.00 0.00 2.56 0.00 0.00 35.95 38.37 1aij h PHE 189 CO 0.00 0.68 -0.11 1.03 -2.02 0.00 0.00 178.31 177.89 1aij h SER 190 N 0.57 -0.27 -0.32 0.41 0.87 -1.23 -2.55 113.55 111.03 1aij h SER 190 Ca 0.11 -0.23 0.07 0.00 -1.23 0.00 0.00 61.79 60.51 1aij h SER 190 Cb 0.48 0.07 -0.08 0.00 -0.44 0.00 0.00 62.40 62.42 1aij h SER 190 CO 0.03 0.11 -0.30 -0.07 -0.53 0.00 0.00 176.83 176.07 1aij h LEU 191 N -0.69 -0.99 -2.37 2.23 4.07 -1.28 -0.84 115.31 115.44 1aij h LEU 191 Ca -0.03 0.17 -0.01 0.00 0.08 0.00 0.00 57.88 58.09 1aij h LEU 191 Cb 0.48 0.46 -0.00 0.00 1.08 0.00 0.00 40.66 42.68 1aij h LEU 191 CO 0.05 -0.32 -0.03 0.58 -1.08 0.00 0.00 178.44 177.65 1aij h VAL 192 N -0.27 0.52 -0.37 1.22 2.07 -1.09 -2.89 116.25 115.44 1aij h VAL 192 Ca 0.15 -0.12 -0.08 0.00 0.82 0.00 0.00 66.70 67.48 1aij h VAL 192 Cb 0.52 1.07 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 1aij h VAL 192 CO -0.48 0.03 0.03 1.41 0.02 0.00 0.00 177.57 178.58 1aij n HIS 193 N -3.78 1.25 -2.81 1.57 8.25 -0.44 -4.80 115.22 114.46 1aij n HIS 193 Ca -0.03 -1.10 -0.08 0.00 -0.26 0.00 0.00 57.72 56.26 1aij n HIS 193 Cb 0.11 -0.42 0.03 0.00 1.12 0.00 0.00 29.99 30.83 1aij n HIS 193 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1aij n GLY 194 N -0.59 0.43 1.96 -1.41 0.00 -0.95 -1.07 105.19 103.56 1aij n GLY 194 Ca 0.28 -0.36 -0.01 0.00 0.00 0.00 0.00 46.02 45.93 1aij n GLY 194 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1aij n ASN 195 N -0.20 -5.73 0.01 1.61 2.85 -0.52 -2.65 115.26 110.63 1aij n ASN 195 Ca -0.01 1.16 0.03 0.00 -0.11 0.00 0.00 54.58 55.65 1aij n ASN 195 Cb 0.52 -3.80 0.13 0.00 1.24 0.00 0.00 39.78 37.88 1aij n ASN 195 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1aij n LEU 196 N 1.19 0.05 0.27 1.20 4.77 -1.26 -1.56 117.00 121.67 1aij n LEU 196 Ca -0.06 0.52 0.13 0.00 -0.03 0.00 0.00 56.01 56.57 1aij n LEU 196 Cb 0.09 -0.52 0.77 0.00 -2.33 0.00 0.00 43.42 41.43 1aij n LEU 196 CO 0.06 -0.46 1.02 -0.26 -1.33 0.00 0.00 177.39 176.42 1aij h PHE 197 N 0.00 0.00 -0.08 -1.77 0.04 -1.96 -1.59 116.94 111.59 1aij h PHE 197 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1aij h PHE 197 Cb 0.08 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.23 1aij h PHE 197 CO 0.00 0.08 0.00 0.66 -0.60 0.00 0.00 178.31 178.45 1aij n TYR 198 N -3.77 0.09 -2.91 -0.55 4.01 -0.60 -4.77 117.16 108.65 1aij n TYR 198 Ca -0.02 -0.05 -0.42 0.00 -0.16 0.00 0.00 57.90 57.25 1aij n TYR 198 Cb 0.19 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.17 1aij n TYR 198 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1aij s ASN 199 N -1.70 6.67 0.29 7.72 3.84 -0.60 -4.75 114.94 126.42 1aij s ASN 199 Ca 0.34 0.66 0.01 0.00 0.21 0.00 0.00 52.86 54.08 1aij s ASN 199 Cb 0.17 -2.42 0.54 0.00 -0.55 0.00 0.00 41.25 38.99 1aij s ASN 199 CO 0.28 -0.66 1.88 1.55 -2.79 0.00 0.00 177.10 177.35 1aij h PRO 200 N 8.17 0.99 -0.03 0.43 0.13 -1.87 -1.43 132.00 138.39 1aij h PRO 200 Ca -0.24 -0.06 -0.15 0.00 -0.87 0.00 0.00 66.00 64.69 1aij h PRO 200 Cb 1.09 -0.22 -0.02 0.00 0.13 0.00 0.00 31.00 31.98 1aij h PRO 200 CO 0.90 0.65 -0.65 0.74 -0.23 0.00 0.00 178.00 179.41 1aij h PHE 201 N 1.02 0.15 -0.48 1.56 0.04 -1.92 -0.53 116.94 116.77 1aij h PHE 201 Ca 0.44 -0.06 -0.11 0.00 2.80 0.00 0.00 57.97 61.03 1aij h PHE 201 Cb 0.33 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.44 1aij h PHE 201 CO -0.00 0.73 -0.15 1.25 -0.60 0.00 0.00 178.31 179.54 1aij h HIS 202 N 0.08 1.03 -0.53 -0.55 2.76 -1.56 0.04 115.15 116.41 1aij h HIS 202 Ca -0.01 -0.22 -0.02 0.00 -2.20 0.00 0.00 60.37 57.93 1aij h HIS 202 Cb 1.17 -0.25 -0.02 0.00 1.55 0.00 0.00 27.41 29.85 1aij h HIS 202 CO 0.01 0.99 0.27 0.78 -1.30 0.00 0.00 177.93 178.69 1aij h GLY 203 N 0.94 0.81 0.88 5.26 0.00 -1.06 -0.69 103.07 109.22 1aij h GLY 203 Ca 0.12 -0.39 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 1aij h GLY 203 CO 0.05 0.37 0.04 1.41 0.00 0.00 0.00 176.54 178.41 1aij h LEU 204 N 0.71 0.11 -0.66 3.11 3.38 -0.87 -1.55 115.31 119.55 1aij h LEU 204 Ca 0.18 -0.14 0.11 0.00 0.09 0.00 0.00 57.88 58.12 1aij h LEU 204 Cb 0.09 -0.03 -0.08 0.00 0.09 0.00 0.00 40.66 40.73 1aij h LEU 204 CO -0.03 0.22 0.24 -1.28 0.09 0.00 0.00 178.44 177.69 1aij h SER 205 N -0.00 0.23 -0.58 -0.43 0.87 -0.74 0.79 113.55 113.68 1aij h SER 205 Ca 0.03 0.09 -0.02 0.00 -1.23 0.00 0.00 61.79 60.66 1aij h SER 205 Cb 0.14 0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.15 1aij h SER 205 CO -0.00 0.12 0.28 0.40 -0.53 0.00 0.00 176.83 177.09 1aij h ILE 206 N 0.41 1.21 -0.84 2.23 2.04 -1.00 0.24 117.51 121.80 1aij h ILE 206 Ca 0.34 -0.59 0.08 0.00 1.00 0.00 0.00 64.86 65.69 1aij h ILE 206 Cb 0.46 0.52 -0.06 0.00 -0.74 0.00 0.00 36.82 37.01 1aij h ILE 206 CO -0.34 0.24 0.55 0.00 0.00 0.00 0.00 178.15 178.59 1aij h ALA 207 N 1.11 1.63 0.00 1.87 0.00 0.13 -0.36 119.26 123.64 1aij h ALA 207 Ca 0.20 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.92 1aij h ALA 207 Cb 0.12 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1aij h ALA 207 CO -0.03 0.23 -0.84 0.74 0.00 0.00 0.00 179.25 179.35 1aij h PHE 208 N 0.88 0.00 -0.07 0.00 0.04 -0.50 -0.43 116.94 116.86 1aij h PHE 208 Ca 0.37 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 61.10 1aij h PHE 208 Cb 0.30 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.45 1aij h PHE 208 CO -0.00 0.80 -0.12 1.25 -0.60 0.00 0.00 178.31 179.64 1aij h LEU 209 N 0.00 0.24 -0.20 1.54 7.12 -0.05 0.18 115.31 124.14 1aij h LEU 209 Ca -0.02 -0.54 -0.02 0.00 0.13 0.00 0.00 57.88 57.43 1aij h LEU 209 Cb 1.63 -0.07 -0.01 0.00 -0.53 0.00 0.00 40.66 41.68 1aij h LEU 209 CO 0.10 0.73 0.06 1.88 -0.13 0.00 0.00 178.44 181.08 1aij h TYR 210 N -0.25 0.33 0.00 1.25 0.05 -1.20 -2.72 116.97 114.43 1aij h TYR 210 Ca 0.01 -0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.75 1aij h TYR 210 Cb 0.68 -0.10 -0.00 0.00 1.01 0.00 0.00 36.73 38.33 1aij h TYR 210 CO 0.11 0.41 -0.02 0.78 -1.05 0.00 0.00 178.16 178.38 1aij h GLY 211 N 0.16 0.00 1.31 3.88 0.00 -0.97 -0.39 103.07 107.05 1aij h GLY 211 Ca 0.07 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.25 1aij h GLY 211 CO -0.00 0.00 -0.37 1.76 0.00 0.00 0.00 176.54 177.93 1aij h SER 212 N 0.00 0.81 0.58 0.19 0.02 -0.31 -0.10 113.55 114.73 1aij h SER 212 Ca -0.00 -0.36 -0.18 0.00 -0.84 0.00 0.00 61.79 60.41 1aij h SER 212 Cb 0.05 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.34 1aij h SER 212 CO 0.00 1.09 -0.80 0.00 -1.14 0.00 0.00 176.83 175.99 1aij h ALA 213 N 0.95 0.63 0.41 3.77 0.00 -1.11 -0.48 119.26 123.43 1aij h ALA 213 Ca 0.06 -0.68 -0.02 0.00 0.00 0.00 0.00 54.91 54.26 1aij h ALA 213 Cb 0.92 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1aij h ALA 213 CO 0.08 0.89 -0.20 1.25 0.00 0.00 0.00 179.25 181.28 1aij h LEU 214 N 0.10 -0.47 -0.54 0.00 5.85 -1.03 -2.22 115.31 117.00 1aij h LEU 214 Ca -0.03 -0.09 -0.09 0.00 0.84 0.00 0.00 57.88 58.51 1aij h LEU 214 Cb 1.40 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.53 1aij h LEU 214 CO 0.12 -0.17 -0.03 0.25 -0.34 0.00 0.00 178.44 178.27 1aij h LEU 215 N -0.77 0.96 -0.69 2.25 5.85 -1.00 -0.43 115.31 121.49 1aij h LEU 215 Ca -0.06 -0.32 -0.14 0.00 0.84 0.00 0.00 57.88 58.20 1aij h LEU 215 Cb 0.53 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1aij h LEU 215 CO 0.09 1.05 -0.60 0.15 -0.34 0.00 0.00 178.44 178.80 1aij h PHE 216 N 0.85 0.25 -0.83 1.25 3.04 -1.18 0.12 116.94 120.43 1aij h PHE 216 Ca 0.15 -0.09 -0.04 0.00 3.98 0.00 0.00 57.97 61.97 1aij h PHE 216 Cb 0.57 -0.04 -0.04 0.00 2.56 0.00 0.00 35.95 39.00 1aij h PHE 216 CO 0.04 0.74 0.38 0.00 -2.02 0.00 0.00 178.31 177.46 1aij h ALA 217 N 1.24 1.08 0.75 2.41 0.00 -1.16 0.20 119.26 123.78 1aij h ALA 217 Ca -0.01 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1aij h ALA 217 Cb 1.09 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 18.56 1aij h ALA 217 CO 0.09 0.66 -0.36 0.52 0.00 0.00 0.00 179.25 180.16 1aij h MET 218 N 1.19 -0.97 -0.21 0.00 2.86 -0.65 -2.24 114.93 114.92 1aij h MET 218 Ca 0.28 0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.99 1aij h MET 218 Cb 0.14 0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1aij h MET 218 CO -0.03 -0.63 0.12 1.25 1.06 0.00 0.00 176.91 178.68 1aij h HIS 219 N -1.21 0.27 -0.21 -0.22 -0.00 -0.75 0.04 115.15 113.07 1aij h HIS 219 Ca -0.10 -0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.29 1aij h HIS 219 Cb 0.79 -0.09 -0.03 0.00 -0.00 0.00 0.00 27.41 28.08 1aij h HIS 219 CO -0.00 0.22 0.05 0.78 -0.00 0.00 0.00 177.93 178.98 1aij h GLY 220 N 0.24 0.24 1.14 5.26 0.00 -1.05 -1.12 103.07 107.79 1aij h GLY 220 Ca 0.07 -0.02 -0.05 0.00 0.00 0.00 0.00 47.33 47.33 1aij h GLY 220 CO -0.01 0.00 0.25 0.00 0.00 0.00 0.00 176.54 176.78 1aij h ALA 221 N 1.15 1.09 -0.35 3.60 0.00 -1.28 -1.77 119.26 121.70 1aij h ALA 221 Ca 0.09 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 1aij h ALA 221 Cb 0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1aij h ALA 221 CO -0.12 0.63 0.10 1.15 0.00 0.00 0.00 179.25 181.01 1aij h THR 222 N 1.05 1.22 -0.45 0.00 2.02 -0.39 0.22 112.91 116.58 1aij h THR 222 Ca 0.24 -0.72 -0.11 0.00 0.77 0.00 0.00 66.41 66.58 1aij h THR 222 Cb 0.26 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 1aij h THR 222 CO -0.01 0.25 -0.15 0.40 0.37 0.00 0.00 175.52 176.37 1aij h ILE 223 N 0.42 1.27 0.00 3.11 1.08 -1.08 -0.14 117.51 122.16 1aij h ILE 223 Ca 0.11 -1.27 -0.09 0.00 -0.39 0.00 0.00 64.86 63.22 1aij h ILE 223 Cb 0.28 1.08 -0.01 0.00 -3.07 0.00 0.00 36.82 35.10 1aij h ILE 223 CO -0.00 0.43 -0.43 -0.07 -0.69 0.00 0.00 178.15 177.40 1aij h LEU 224 N 0.77 0.00 -0.73 1.44 3.38 -1.15 0.87 115.31 119.88 1aij h LEU 224 Ca 0.12 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.00 1aij h LEU 224 Cb 0.68 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 1aij h LEU 224 CO 0.05 0.43 0.00 0.00 0.09 0.00 0.00 178.44 179.01 1aij h ALA 225 N 1.57 0.93 -0.63 1.53 0.00 0.46 -3.01 119.26 120.12 1aij h ALA 225 Ca -0.00 -0.30 -0.18 0.00 0.00 0.00 0.00 54.91 54.43 1aij h ALA 225 Cb 0.91 -0.22 -0.11 0.00 0.00 0.00 0.00 17.79 18.38 1aij h ALA 225 CO 0.06 0.64 0.19 1.33 0.00 0.00 0.00 179.25 181.47 1aij n VAL 226 N -4.19 2.80 0.20 0.00 0.24 -0.16 -4.50 118.33 112.73 1aij n VAL 226 Ca 0.03 -1.80 0.08 0.00 -2.04 0.00 0.00 64.34 60.61 1aij n VAL 226 Cb 0.33 -0.34 0.38 0.00 -1.47 0.00 0.00 33.84 32.75 1aij n VAL 226 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1aij h SER 227 N 2.38 0.00 0.00 -1.34 4.64 -0.68 -0.43 113.55 118.12 1aij h SER 227 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1aij h SER 227 Cb 2.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.22 1aij h SER 227 CO 0.62 0.29 0.08 -2.11 -0.87 0.00 0.00 176.83 174.85 1aij n ARG 228 N -3.43 0.04 -0.63 4.77 1.85 -1.26 0.00 116.66 118.00 1aij n ARG 228 Ca 0.00 0.49 0.06 0.00 -1.00 0.00 0.00 57.85 57.41 1aij n ARG 228 Cb 0.48 -1.72 0.18 0.00 -1.05 0.00 0.00 32.46 30.35 1aij n ARG 228 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1aij n PHE 229 N -1.69 0.00 -3.55 2.89 3.72 -0.99 -4.98 117.46 112.87 1aij n PHE 229 Ca -0.00 -1.30 -0.23 0.00 -0.05 0.00 0.00 57.45 55.86 1aij n PHE 229 Cb 0.09 -0.22 0.08 0.00 -0.94 0.00 0.00 39.48 38.48 1aij n PHE 229 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1aij n GLY 230 N -0.97 -0.48 0.37 1.37 0.00 0.10 -4.51 105.19 101.07 1aij n GLY 230 Ca 0.17 0.22 0.01 0.00 0.00 0.00 0.00 46.02 46.42 1aij n GLY 230 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1aij h GLY 231 N -2.57 1.31 1.94 -0.02 0.00 -1.21 -2.86 103.07 99.66 1aij h GLY 231 Ca -0.55 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 46.33 1aij h GLY 231 CO 0.54 0.39 0.03 1.05 0.00 0.00 0.00 176.54 178.55 1aij h GLU 232 N 1.15 0.00 -3.74 4.80 9.09 -1.82 -3.29 114.58 120.76 1aij h GLU 232 Ca 0.36 0.00 -0.72 0.00 0.05 0.00 0.00 59.36 59.05 1aij h GLU 232 Cb 0.01 0.00 -0.07 0.00 -1.65 0.00 0.00 28.75 27.04 1aij h GLU 232 CO -0.11 0.00 2.89 0.54 0.05 0.00 0.00 179.01 182.38 1aij n ARG 233 N -2.84 3.18 -0.12 1.06 1.74 -1.08 -4.73 116.66 113.87 1aij n ARG 233 Ca -0.03 -2.84 -0.08 0.00 -0.77 0.00 0.00 57.85 54.13 1aij n ARG 233 Cb 0.09 -3.13 0.07 0.00 -1.02 0.00 0.00 32.46 28.46 1aij n ARG 233 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1aij h GLU 234 N 5.80 0.86 -0.70 5.56 5.08 -1.86 -2.24 114.58 127.09 1aij h GLU 234 Ca 0.55 -0.34 -0.01 0.00 -1.00 0.00 0.00 59.36 58.56 1aij h GLU 234 Cb 0.60 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.77 1aij h GLU 234 CO 1.80 0.97 0.38 -0.07 -1.00 0.00 0.00 179.01 181.09 1aij h LEU 235 N 0.75 0.87 -0.69 1.33 3.38 -1.93 0.39 115.31 119.41 1aij h LEU 235 Ca 0.11 -0.10 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 1aij h LEU 235 Cb 0.72 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1aij h LEU 235 CO 0.05 0.72 -0.62 -0.08 0.09 0.00 0.00 178.44 178.60 1aij h GLU 236 N 0.96 0.00 0.00 1.13 4.57 -1.91 -1.65 114.58 117.67 1aij h GLU 236 Ca 0.24 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.36 1aij h GLU 236 Cb 0.04 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.62 1aij h GLU 236 CO -0.04 0.62 -0.32 1.96 -1.18 0.00 0.00 179.01 180.06 1aij h GLN 237 N 0.00 0.00 -0.04 1.92 1.08 -0.80 0.31 115.11 117.58 1aij h GLN 237 Ca -0.01 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 1aij h GLN 237 Cb 1.15 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.58 1aij h GLN 237 CO 0.08 0.32 -0.03 0.82 -0.95 0.00 0.00 178.83 179.07 1aij h ILE 238 N 0.00 1.37 -0.30 2.54 2.04 -0.46 -2.92 117.51 119.78 1aij h ILE 238 Ca -0.00 -1.15 -0.07 0.00 1.00 0.00 0.00 64.86 64.64 1aij h ILE 238 Cb 0.64 2.05 -0.02 0.00 -0.74 0.00 0.00 36.82 38.76 1aij h ILE 238 CO 0.04 0.31 -0.13 0.00 0.00 0.00 0.00 178.15 178.38 1aij h ALA 239 N 0.56 1.23 -1.54 1.87 0.00 -1.05 -3.40 119.26 116.91 1aij h ALA 239 Ca 0.01 -0.27 -0.22 0.00 0.00 0.00 0.00 54.91 54.42 1aij h ALA 239 Cb 0.52 -0.14 -0.26 0.00 0.00 0.00 0.00 17.79 17.91 1aij h ALA 239 CO 0.01 0.50 -0.57 0.34 0.00 0.00 0.00 179.25 179.53 1aij s ASP 240 N -6.77 -0.01 -0.01 0.00 2.15 0.11 -5.09 116.67 107.04 1aij s ASP 240 Ca -0.07 -1.07 -0.36 0.00 0.43 0.00 0.00 52.55 51.48 1aij s ASP 240 Cb 0.15 1.19 -0.14 0.00 -0.30 0.00 0.00 42.92 43.81 1aij s ASP 240 CO 0.78 -0.24 1.62 -1.14 -0.17 0.00 0.00 175.17 176.02 1aij n ARG 241 N 4.50 1.68 -3.47 4.34 0.63 -1.10 -4.31 116.66 118.93 1aij n ARG 241 Ca 0.09 0.61 -0.23 0.00 -0.92 0.00 0.00 57.85 57.41 1aij n ARG 241 Cb 0.50 -2.35 0.01 0.00 0.45 0.00 0.00 32.46 31.08 1aij n ARG 241 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1aij n GLY 242 N 3.59 2.64 0.27 5.14 0.00 -1.26 -5.00 105.19 110.56 1aij n GLY 242 Ca 0.21 -2.28 0.14 0.00 0.00 0.00 0.00 46.02 44.09 1aij n GLY 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aij h THR 243 N 0.56 0.39 0.15 2.61 1.03 -1.95 -1.97 112.91 113.74 1aij h THR 243 Ca -0.30 -0.59 -0.01 0.00 -0.01 0.00 0.00 66.41 65.49 1aij h THR 243 Cb 1.15 1.43 0.00 0.00 -1.07 0.00 0.00 68.15 69.66 1aij h THR 243 CO 0.47 0.10 -0.07 0.00 -0.01 0.00 0.00 175.52 176.01 1aij h ALA 244 N 1.89 -0.20 -0.38 0.00 0.00 -1.89 0.64 119.26 119.32 1aij h ALA 244 Ca -0.00 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1aij h ALA 244 Cb 0.42 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1aij h ALA 244 CO 0.01 -0.59 -0.00 0.00 0.00 0.00 0.00 179.25 178.67 1aij h ALA 245 N 0.60 1.29 -0.34 0.00 0.00 -1.78 -1.13 119.26 117.90 1aij h ALA 245 Ca -0.02 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 1aij h ALA 245 Cb 0.19 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1aij h ALA 245 CO 0.03 0.48 -0.21 0.93 0.00 0.00 0.00 179.25 180.48 1aij h GLU 246 N 0.57 0.75 -0.18 0.00 5.08 -1.02 -1.87 114.58 117.91 1aij h GLU 246 Ca 0.12 -0.35 -0.16 0.00 -1.00 0.00 0.00 59.36 57.97 1aij h GLU 246 Cb 0.37 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1aij h GLU 246 CO 0.01 0.96 -0.56 0.00 -1.00 0.00 0.00 179.01 178.43 1aij h ARG 247 N 0.53 0.55 -0.20 2.33 3.08 -0.68 -1.00 114.38 118.99 1aij h ARG 247 Ca 0.07 -0.35 -0.00 0.00 0.07 0.00 0.00 59.98 59.77 1aij h ARG 247 Cb 0.77 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.85 1aij h ARG 247 CO 0.06 0.96 0.12 0.00 -1.07 0.00 0.00 179.97 180.04 1aij h ALA 248 N 0.96 0.25 0.13 0.04 0.00 -1.18 -0.92 119.26 118.55 1aij h ALA 248 Ca 0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1aij h ALA 248 Cb 1.11 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1aij h ALA 248 CO 0.11 -0.24 -0.06 0.00 0.00 0.00 0.00 179.25 179.05 1aij h ALA 249 N 1.03 -0.18 0.00 0.00 0.00 -1.21 -2.97 119.26 115.93 1aij h ALA 249 Ca 0.07 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1aij h ALA 249 Cb 0.02 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1aij h ALA 249 CO -0.01 -0.55 -0.15 -0.07 0.00 0.00 0.00 179.25 178.47 1aij h LEU 250 N -0.28 0.00 -0.13 0.00 3.38 -1.15 -0.63 115.31 116.50 1aij h LEU 250 Ca -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1aij h LEU 250 Cb 0.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1aij h LEU 250 CO 0.03 0.15 0.06 0.15 0.09 0.00 0.00 178.44 178.92 1aij h PHE 251 N 0.00 0.19 -0.23 1.13 3.04 -1.01 -1.30 116.94 118.77 1aij h PHE 251 Ca -0.00 -0.01 -0.20 0.00 3.98 0.00 0.00 57.97 61.74 1aij h PHE 251 Cb 0.45 -0.06 0.00 0.00 2.56 0.00 0.00 35.95 38.91 1aij h PHE 251 CO 0.00 0.25 -0.63 -1.49 -2.02 0.00 0.00 178.31 174.41 1aij h TRP 252 N 0.08 1.07 -0.55 0.41 4.06 -1.35 -0.95 115.95 118.72 1aij h TRP 252 Ca 0.05 -0.42 0.04 0.00 2.06 0.00 0.00 58.89 60.61 1aij h TRP 252 Cb 0.13 -0.19 -0.04 0.00 -1.00 0.00 0.00 29.16 28.06 1aij h TRP 252 CO -0.03 1.25 0.31 -0.09 -3.56 0.00 0.00 178.44 176.33 1aij h ARG 253 N 0.59 0.59 -0.09 0.49 2.43 -1.08 0.18 114.38 117.49 1aij h ARG 253 Ca -0.02 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 58.98 1aij h ARG 253 Cb 1.25 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.66 1aij h ARG 253 CO 0.14 0.39 -0.55 -1.49 -1.51 0.00 0.00 179.97 176.95 1aij h TRP 254 N 0.61 0.32 -0.04 2.20 6.55 -1.18 0.57 115.95 124.98 1aij h TRP 254 Ca 0.23 -0.11 -0.12 0.00 0.95 0.00 0.00 58.89 59.84 1aij h TRP 254 Cb 0.09 -0.06 0.01 0.00 -0.86 0.00 0.00 29.16 28.34 1aij h TRP 254 CO -0.08 0.75 -0.45 1.15 -1.05 0.00 0.00 178.44 178.76 1aij h THR 255 N 0.20 1.43 0.00 1.49 2.02 -0.68 -3.41 112.91 113.95 1aij h THR 255 Ca 0.00 -1.90 0.00 0.00 0.77 0.00 0.00 66.41 65.28 1aij h THR 255 Cb 1.03 2.45 0.00 0.00 -1.74 0.00 0.00 68.15 69.89 1aij h THR 255 CO 0.09 0.55 -0.19 1.15 0.37 0.00 0.00 175.52 177.49 1aij n MET 256 N -4.32 0.78 0.00 6.66 0.00 0.58 -5.03 117.12 115.79 1aij n MET 256 Ca -0.09 -1.38 0.00 0.00 0.00 0.00 0.00 57.70 56.23 1aij n MET 256 Cb 0.58 -0.84 0.00 0.00 0.00 0.00 0.00 33.22 32.97 1aij n MET 256 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1aij n GLY 257 N -0.45 2.75 3.27 3.17 0.00 0.19 -4.96 105.19 109.16 1aij n GLY 257 Ca 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.92 1aij n GLY 257 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1aij s PHE 258 N -1.07 1.35 0.31 1.61 -0.71 -1.26 -4.84 117.98 113.37 1aij s PHE 258 Ca 0.00 -1.15 -0.12 0.00 -1.04 0.00 0.00 56.93 54.62 1aij s PHE 258 Cb 0.00 -0.77 0.01 0.00 -1.21 0.00 0.00 43.02 41.06 1aij s PHE 258 CO 0.00 -0.34 0.58 0.54 -1.34 0.00 0.00 175.22 174.66 1aij s ASN 259 N -3.23 0.18 0.20 1.98 4.22 -1.26 -3.14 114.94 113.88 1aij s ASN 259 Ca 0.32 -1.09 0.01 0.00 -2.14 0.00 0.00 52.86 49.97 1aij s ASN 259 Cb 0.07 0.68 0.01 0.00 1.28 0.00 0.00 41.25 43.30 1aij s ASN 259 CO 0.10 -1.33 0.12 0.00 -2.04 0.00 0.00 177.10 173.94 1aij n ALA 260 N -0.47 0.28 -2.52 3.54 0.00 -1.26 -5.02 120.51 115.05 1aij n ALA 260 Ca -0.03 -0.82 -0.25 0.00 0.00 0.00 0.00 53.44 52.34 1aij n ALA 260 Cb 0.61 0.36 -0.09 0.00 0.00 0.00 0.00 19.45 20.33 1aij n ALA 260 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1aij s THR 261 N -1.14 2.42 0.34 0.00 -4.23 -1.26 -4.76 115.64 107.01 1aij s THR 261 Ca 0.09 -1.92 0.02 0.00 -1.18 0.00 0.00 61.69 58.70 1aij s THR 261 Cb -0.01 -2.88 0.25 0.00 1.34 0.00 0.00 72.50 71.20 1aij s THR 261 CO 0.06 -0.11 1.99 -0.03 -0.54 0.00 0.00 174.62 175.98 1aij h MET 262 N 1.72 0.83 0.01 3.99 4.05 -1.91 -0.80 114.93 122.82 1aij h MET 262 Ca -0.43 -0.06 -0.02 0.00 -0.28 0.00 0.00 59.70 58.91 1aij h MET 262 Cb 1.25 -0.18 0.00 0.00 -0.80 0.00 0.00 31.60 31.87 1aij h MET 262 CO 0.70 0.57 -0.08 1.49 0.23 0.00 0.00 176.91 179.83 1aij h GLU 263 N 0.84 0.03 -0.56 0.39 4.81 -1.93 -3.37 114.58 114.81 1aij h GLU 263 Ca 0.22 -0.05 0.09 0.00 -0.13 0.00 0.00 59.36 59.49 1aij h GLU 263 Cb -0.04 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.32 1aij h GLU 263 CO -0.04 0.98 0.38 0.78 -0.73 0.00 0.00 179.01 180.38 1aij h GLY 264 N -0.89 0.51 2.00 1.92 0.00 -1.88 -1.09 103.07 103.64 1aij h GLY 264 Ca -0.01 -0.15 -0.02 0.00 0.00 0.00 0.00 47.33 47.14 1aij h GLY 264 CO 0.02 0.10 -0.09 1.19 0.00 0.00 0.00 176.54 177.75 1aij h ILE 265 N 0.37 0.64 0.00 2.60 6.09 -1.31 -0.87 117.51 125.03 1aij h ILE 265 Ca 0.26 -0.39 -0.07 0.00 -1.37 0.00 0.00 64.86 63.29 1aij h ILE 265 Cb 0.52 1.24 -0.01 0.00 0.47 0.00 0.00 36.82 39.04 1aij h ILE 265 CO -0.07 0.09 -0.33 0.45 -3.07 0.00 0.00 178.15 175.23 1aij h HIS 266 N 0.00 0.00 -0.15 2.19 3.86 -1.39 -0.89 115.15 118.78 1aij h HIS 266 Ca -0.00 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 59.02 1aij h HIS 266 Cb 0.23 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.71 1aij h HIS 266 CO 0.00 0.33 -0.63 0.00 0.86 0.00 0.00 177.93 178.48 1aij h ARG 267 N 0.00 0.69 -0.55 2.45 3.08 -1.18 -1.39 114.38 117.47 1aij h ARG 267 Ca -0.00 -0.54 0.04 0.00 0.07 0.00 0.00 59.98 59.54 1aij h ARG 267 Cb 1.16 0.11 -0.04 0.00 0.08 0.00 0.00 29.97 31.28 1aij h ARG 267 CO 0.04 1.16 0.31 -1.49 -1.07 0.00 0.00 179.97 178.92 1aij h TRP 268 N 0.37 0.58 0.61 3.04 4.06 -1.21 -2.77 115.95 120.63 1aij h TRP 268 Ca -0.04 0.02 -0.02 0.00 2.06 0.00 0.00 58.89 60.91 1aij h TRP 268 Cb 1.26 -0.18 -0.00 0.00 -1.00 0.00 0.00 29.16 29.24 1aij h TRP 268 CO 0.10 0.30 -0.37 0.00 -3.56 0.00 0.00 178.44 174.91 1aij h ALA 269 N 1.27 -0.94 -0.71 1.49 0.00 -1.07 -0.78 119.26 118.52 1aij h ALA 269 Ca 0.24 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1aij h ALA 269 Cb 0.09 0.45 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1aij h ALA 269 CO -0.13 -1.04 0.46 0.97 0.00 0.00 0.00 179.25 179.51 1aij h ILE 270 N -0.92 1.15 -0.23 0.00 2.10 -1.24 -2.27 117.51 116.11 1aij h ILE 270 Ca -0.08 -0.32 -0.14 0.00 1.08 0.00 0.00 64.86 65.41 1aij h ILE 270 Cb 0.74 0.14 -0.01 0.00 -1.09 0.00 0.00 36.82 36.60 1aij h ILE 270 CO 0.08 0.17 -0.43 -0.50 -1.08 0.00 0.00 178.15 176.39 1aij h TRP 271 N 0.93 0.68 -0.67 2.19 4.06 -1.48 0.13 115.95 121.80 1aij h TRP 271 Ca 0.27 -0.21 -0.01 0.00 2.06 0.00 0.00 58.89 61.00 1aij h TRP 271 Cb -0.06 -0.14 -0.03 0.00 -1.00 0.00 0.00 29.16 27.92 1aij h TRP 271 CO -0.03 0.90 0.37 1.98 -3.56 0.00 0.00 178.44 178.10 1aij h MET 272 N 0.46 0.94 0.07 0.49 4.05 -0.69 -1.14 114.93 119.10 1aij h MET 272 Ca 0.03 -0.11 -0.00 0.00 -0.28 0.00 0.00 59.70 59.34 1aij h MET 272 Cb 0.94 -0.18 0.00 0.00 -0.80 0.00 0.00 31.60 31.56 1aij h MET 272 CO 0.08 0.70 -0.03 0.00 0.23 0.00 0.00 176.91 177.89 1aij h ALA 273 N 1.18 -0.09 -0.99 0.39 0.00 -1.35 -3.33 119.26 115.07 1aij h ALA 273 Ca 0.24 -0.29 0.16 0.00 0.00 0.00 0.00 54.91 55.02 1aij h ALA 273 Cb 0.04 0.04 -0.09 0.00 0.00 0.00 0.00 17.79 17.77 1aij h ALA 273 CO -0.04 -0.18 0.62 0.28 0.00 0.00 0.00 179.25 179.93 1aij h VAL 274 N -0.84 0.79 0.00 0.00 2.07 -0.95 -0.01 116.25 117.32 1aij h VAL 274 Ca -0.01 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1aij h VAL 274 Cb 0.62 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1aij h VAL 274 CO 0.02 0.15 0.00 0.18 0.02 0.00 0.00 177.57 177.94 1aij n LEU 275 N -4.68 0.48 0.27 2.57 4.77 -0.44 -2.27 117.00 117.71 1aij n LEU 275 Ca 0.21 0.65 -0.16 0.00 -0.03 0.00 0.00 56.01 56.68 1aij n LEU 275 Cb 0.50 -0.61 -0.08 0.00 -2.33 0.00 0.00 43.42 40.89 1aij n LEU 275 CO 0.25 -0.59 0.67 0.58 -1.33 0.00 0.00 177.39 176.96 1aij h VAL 276 N 0.00 0.52 0.00 4.08 2.07 -1.11 -1.55 116.25 120.27 1aij h VAL 276 Ca 0.00 -0.12 -0.19 0.00 0.82 0.00 0.00 66.70 67.21 1aij h VAL 276 Cb 0.24 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1aij h VAL 276 CO 0.00 0.02 -1.02 0.71 0.02 0.00 0.00 177.57 177.31 1aij h THR 277 N -0.71 1.23 0.22 2.57 1.35 -1.70 -2.24 112.91 113.63 1aij h THR 277 Ca -0.07 -2.84 -0.01 0.00 -0.55 0.00 0.00 66.41 62.94 1aij h THR 277 Cb 0.53 2.58 0.00 0.00 -1.73 0.00 0.00 68.15 69.53 1aij h THR 277 CO 0.11 0.70 -0.11 0.25 -0.25 0.00 0.00 175.52 176.22 1aij h LEU 278 N 0.00 -0.25 -0.36 3.87 6.46 -1.46 0.23 115.31 123.80 1aij h LEU 278 Ca -0.07 -0.10 -0.15 0.00 -0.12 0.00 0.00 57.88 57.45 1aij h LEU 278 Cb 1.68 0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 41.67 1aij h LEU 278 CO 0.10 -0.06 -0.37 0.71 -0.62 0.00 0.00 178.44 178.20 1aij h THR 279 N -0.43 1.28 -0.61 1.05 1.35 -1.37 -3.11 112.91 111.07 1aij h THR 279 Ca -0.03 -1.54 0.10 0.00 -0.55 0.00 0.00 66.41 64.39 1aij h THR 279 Cb 0.33 1.43 -0.08 0.00 -1.73 0.00 0.00 68.15 68.11 1aij h THR 279 CO 0.05 0.51 0.18 1.23 -0.25 0.00 0.00 175.52 177.24 1aij h GLY 280 N 0.69 0.82 1.04 5.82 0.00 -1.33 -1.51 103.07 108.61 1aij h GLY 280 Ca 0.06 -0.08 -0.05 0.00 0.00 0.00 0.00 47.33 47.25 1aij h GLY 280 CO 0.09 -0.07 0.22 -1.33 0.00 0.00 0.00 176.54 175.45 1aij h GLY 281 N 0.34 1.15 0.95 4.60 0.00 -0.49 -2.27 103.07 107.34 1aij h GLY 281 Ca 0.31 -0.67 -0.05 0.00 0.00 0.00 0.00 47.33 46.92 1aij h GLY 281 CO -0.35 0.63 0.09 -2.22 0.00 0.00 0.00 176.54 174.69 1aij h ILE 282 N 1.00 1.24 -0.60 2.60 2.04 -1.34 -0.75 117.51 121.70 1aij h ILE 282 Ca 0.22 -0.84 0.05 0.00 1.00 0.00 0.00 64.86 65.29 1aij h ILE 282 Cb 0.29 0.96 -0.05 0.00 -0.74 0.00 0.00 36.82 37.28 1aij h ILE 282 CO -0.01 0.29 0.33 1.23 0.00 0.00 0.00 178.15 179.99 1aij h GLY 283 N 0.57 0.86 1.04 5.37 0.00 -1.03 -0.88 103.07 109.00 1aij h GLY 283 Ca 0.13 -0.23 -0.17 0.00 0.00 0.00 0.00 47.33 47.07 1aij h GLY 283 CO 0.00 0.15 -0.51 -2.22 0.00 0.00 0.00 176.54 173.96 1aij h ILE 284 N 0.62 1.30 -0.88 2.60 1.08 -1.26 -2.81 117.51 118.16 1aij h ILE 284 Ca 0.26 -1.72 0.00 0.00 -0.39 0.00 0.00 64.86 63.01 1aij h ILE 284 Cb 0.14 1.81 -0.04 0.00 -3.07 0.00 0.00 36.82 35.66 1aij h ILE 284 CO -0.16 0.55 0.56 0.25 -0.69 0.00 0.00 178.15 178.65 1aij h LEU 285 N 0.46 1.03 -1.01 1.44 5.85 -0.81 -1.16 115.31 121.12 1aij h LEU 285 Ca -0.00 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 1aij h LEU 285 Cb 1.12 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.89 1aij h LEU 285 CO 0.11 0.77 -0.11 -0.07 -0.34 0.00 0.00 178.44 178.80 1aij h LEU 286 N 1.20 0.00 -9.04 2.25 3.38 -1.17 -3.39 115.31 108.55 1aij h LEU 286 Ca 0.32 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.72 1aij h LEU 286 Cb -0.10 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.61 1aij h LEU 286 CO -0.06 0.11 0.93 -0.44 0.09 0.00 0.00 178.44 179.07 1aij s SER 287 N -6.00 6.80 0.00 -0.43 0.01 -0.44 -1.18 113.70 112.46 1aij s SER 287 Ca 0.02 1.40 0.00 0.00 1.31 0.00 0.00 55.95 58.68 1aij s SER 287 Cb 0.09 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.78 1aij s SER 287 CO 0.61 -0.93 0.00 0.61 0.41 0.00 0.00 173.24 173.94 1aij n GLY 288 N 3.99 2.83 0.07 3.44 0.00 0.66 -4.78 105.19 111.40 1aij n GLY 288 Ca 0.14 -0.51 -0.14 0.00 0.00 0.00 0.00 46.02 45.50 1aij n GLY 288 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1aij h THR 289 N 0.00 1.76 0.00 2.61 1.35 -1.76 -3.43 112.91 113.44 1aij h THR 289 Ca 0.00 -2.35 -0.28 0.00 -0.55 0.00 0.00 66.41 63.23 1aij h THR 289 Cb 0.00 3.36 -0.05 0.00 -1.73 0.00 0.00 68.15 69.73 1aij h THR 289 CO 0.00 0.61 -1.98 0.52 -0.25 0.00 0.00 175.52 174.41 1aij n VAL 290 N -4.59 0.98 -4.08 6.82 0.31 -0.91 -4.98 118.33 111.88 1aij n VAL 290 Ca -0.11 -0.32 -0.32 0.00 -0.01 0.00 0.00 64.34 63.58 1aij n VAL 290 Cb 0.50 -1.39 -0.16 0.00 -0.91 0.00 0.00 33.84 31.88 1aij n VAL 290 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1aij s VAL 291 N -2.33 1.96 -0.18 2.52 1.01 -0.33 -4.97 120.40 118.08 1aij s VAL 291 Ca -0.24 -1.00 0.17 0.00 0.00 0.00 0.00 61.98 60.91 1aij s VAL 291 Cb 0.08 -1.85 0.02 0.00 0.00 0.00 0.00 36.38 34.63 1aij s VAL 291 CO 0.36 0.41 1.23 0.44 0.00 0.00 0.00 175.10 177.53 1aij h ASP 292 N 7.94 0.00 -2.49 3.32 3.32 -1.86 0.19 116.42 126.83 1aij h ASP 292 Ca -0.39 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.48 1aij h ASP 292 Cb 1.12 0.00 -0.31 0.00 0.22 0.00 0.00 39.33 40.36 1aij h ASP 292 CO 0.58 0.43 -0.49 0.21 -1.72 0.00 0.00 179.24 178.25 1aij s ASN 293 N -6.12 0.30 0.19 6.45 3.84 -1.26 -4.14 114.94 114.21 1aij s ASN 293 Ca 0.02 0.50 0.08 0.00 0.21 0.00 0.00 52.86 53.67 1aij s ASN 293 Cb 0.08 0.93 0.06 0.00 -0.55 0.00 0.00 41.25 41.77 1aij s ASN 293 CO 0.76 -0.26 1.44 -0.50 -2.79 0.00 0.00 177.10 175.75 1aij h TRP 294 N 8.24 0.04 -0.06 0.43 4.06 -1.24 -2.06 115.95 125.35 1aij h TRP 294 Ca -0.16 -0.02 0.01 0.00 2.06 0.00 0.00 58.89 60.78 1aij h TRP 294 Cb 1.13 -0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.27 1aij h TRP 294 CO 0.26 0.83 0.00 -0.92 -3.56 0.00 0.00 178.44 175.05 1aij h TYR 295 N 0.01 -0.00 0.29 0.49 3.20 -1.75 -0.33 116.97 118.89 1aij h TYR 295 Ca -0.01 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 1aij h TYR 295 Cb 1.44 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.70 1aij h TYR 295 CO 0.00 -0.00 -0.24 0.28 -1.64 0.00 0.00 178.16 176.56 1aij h VAL 296 N 0.02 0.49 -0.79 1.81 2.07 -1.87 -2.26 116.25 115.73 1aij h VAL 296 Ca 0.03 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.72 1aij h VAL 296 Cb 0.03 0.49 -0.11 0.00 -1.52 0.00 0.00 31.29 30.18 1aij h VAL 296 CO -0.04 0.00 0.28 -0.25 0.02 0.00 0.00 177.57 177.57 1aij h TRP 297 N -0.54 0.45 -0.85 1.57 7.01 -1.30 -0.26 115.95 122.04 1aij h TRP 297 Ca -0.02 0.04 0.12 0.00 2.11 0.00 0.00 58.89 61.15 1aij h TRP 297 Cb 0.48 -0.08 -0.06 0.00 -2.10 0.00 0.00 29.16 27.40 1aij h TRP 297 CO -0.14 -0.03 0.55 0.78 -2.79 0.00 0.00 178.44 176.81 1aij h GLY 298 N 0.36 1.12 2.00 2.65 0.00 -0.47 -1.74 103.07 106.99 1aij h GLY 298 Ca 0.46 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.49 1aij h GLY 298 CO -0.49 0.13 -0.02 1.46 0.00 0.00 0.00 176.54 177.62 1aij h GLN 299 N 0.71 0.00 -2.03 4.80 1.08 -0.68 -3.19 115.11 115.79 1aij h GLN 299 Ca 0.41 0.00 -0.55 0.00 -1.45 0.00 0.00 58.65 57.06 1aij h GLN 299 Cb 0.60 0.00 -0.41 0.00 -0.05 0.00 0.00 27.48 27.62 1aij h GLN 299 CO -0.17 0.02 -0.81 0.27 -0.95 0.00 0.00 178.83 177.19 1aij n ASN 300 N -3.12 3.57 0.00 1.46 0.23 -0.66 -5.14 115.26 111.59 1aij n ASN 300 Ca 0.00 -3.49 0.00 0.00 -0.53 0.00 0.00 54.58 50.56 1aij n ASN 300 Cb 0.30 -0.56 0.00 0.00 -2.08 0.00 0.00 39.78 37.44 1aij n ASN 300 CO 0.00 0.00 0.00 1.57 -0.93 0.00 0.00 177.26 177.90