#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oej n LYS 8 N 0.00 0.57 -1.89 1.61 4.76 -1.26 -4.99 118.16 116.97 1oej n LYS 8 Ca 0.00 0.25 -0.35 0.00 -2.87 0.00 0.00 58.31 55.34 1oej n LYS 8 Cb 0.00 -2.29 0.04 0.00 -1.84 0.00 0.00 35.03 30.94 1oej n LYS 8 CO 0.00 0.00 0.00 -2.14 -1.37 0.00 0.00 177.40 173.89 1oej s PRO 9 N -3.40 2.83 0.18 1.97 0.02 -1.26 -4.97 135.00 130.37 1oej s PRO 9 Ca 0.75 1.70 -0.30 0.00 0.02 0.00 0.00 61.00 63.17 1oej s PRO 9 Cb -0.35 -1.93 -0.08 0.00 0.02 0.00 0.00 34.50 32.17 1oej s PRO 9 CO 0.49 -1.28 1.07 -0.51 -0.33 0.00 0.00 177.00 176.43 1oej s LEU 10 N -4.38 4.51 1.16 -5.54 1.43 -1.26 -5.06 118.68 109.53 1oej s LEU 10 Ca 0.74 2.05 -0.18 0.00 -1.03 0.00 0.00 54.13 55.71 1oej s LEU 10 Cb -0.27 -3.60 0.27 0.00 0.03 0.00 0.00 46.19 42.61 1oej s LEU 10 CO 0.36 -0.17 1.12 0.42 0.23 0.00 0.00 176.35 178.31 1oej s THR 11 N -0.32 1.69 0.04 5.49 -4.23 -1.26 -4.80 115.64 112.26 1oej s THR 11 Ca 0.48 0.00 -0.25 0.00 -1.18 0.00 0.00 61.69 60.74 1oej s THR 11 Cb -0.28 -2.51 -0.17 0.00 1.34 0.00 0.00 72.50 70.87 1oej s THR 11 CO 0.34 0.00 1.50 -0.08 -0.54 0.00 0.00 174.62 175.85 1oej h GLU 12 N -2.42 -0.20 -0.76 3.99 4.81 -2.00 -1.09 114.58 116.91 1oej h GLU 12 Ca -0.47 0.01 0.12 0.00 -0.13 0.00 0.00 59.36 58.89 1oej h GLU 12 Cb 1.30 0.05 -0.08 0.00 0.63 0.00 0.00 28.75 30.64 1oej h GLU 12 CO 0.39 0.02 0.37 0.28 -0.73 0.00 0.00 179.01 179.34 1oej h VAL 13 N -0.40 0.79 -0.37 0.32 2.07 -1.97 -2.61 116.25 114.07 1oej h VAL 13 Ca -0.02 -0.20 -0.11 0.00 0.82 0.00 0.00 66.70 67.19 1oej h VAL 13 Cb 0.31 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 1oej h VAL 13 CO 0.03 0.11 -0.22 -0.33 0.02 0.00 0.00 177.57 177.19 1oej h GLU 14 N 0.59 0.72 -0.34 1.57 5.08 -1.77 -0.67 114.58 119.76 1oej h GLU 14 Ca 0.39 -0.28 -0.12 0.00 -1.00 0.00 0.00 59.36 58.35 1oej h GLU 14 Cb 0.49 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1oej h GLU 14 CO -0.32 0.88 -0.27 0.37 -1.00 0.00 0.00 179.01 178.67 1oej h GLN 15 N 0.63 0.78 -0.52 2.33 4.15 -0.89 -1.49 115.11 120.10 1oej h GLN 15 Ca 0.09 -0.39 -0.04 0.00 0.77 0.00 0.00 58.65 59.08 1oej h GLN 15 Cb 0.71 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.38 1oej h GLN 15 CO 0.05 1.02 0.16 0.87 -1.93 0.00 0.00 178.83 179.00 1oej h LYS 16 N 0.56 0.81 -0.94 1.69 1.57 -1.35 -2.82 116.57 116.10 1oej h LYS 16 Ca 0.06 -0.18 0.02 0.00 -1.87 0.00 0.00 60.65 58.68 1oej h LYS 16 Cb 0.84 -0.12 -0.05 0.00 0.08 0.00 0.00 32.23 32.99 1oej h LYS 16 CO 0.07 0.75 0.62 0.00 -0.57 0.00 0.00 179.45 180.32 1oej h ALA 17 N 1.02 1.35 0.00 3.86 0.00 -0.69 0.21 119.26 125.02 1oej h ALA 17 Ca 0.17 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1oej h ALA 17 Cb 0.28 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1oej h ALA 17 CO -0.01 0.59 -0.10 0.00 0.00 0.00 0.00 179.25 179.73 1oej h ALA 18 N 1.43 1.22 -0.59 0.00 0.00 -1.06 -0.18 119.26 120.08 1oej h ALA 18 Ca 0.35 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 1oej h ALA 18 Cb -0.10 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1oej h ALA 18 CO -0.09 0.13 0.05 0.09 0.00 0.00 0.00 179.25 179.43 1oej n ASN 19 N -3.53 5.52 -0.12 0.00 4.13 -0.07 -4.89 115.26 116.29 1oej n ASN 19 Ca -0.02 -3.00 -0.01 0.00 1.68 0.00 0.00 54.58 53.23 1oej n ASN 19 Cb 0.24 -0.69 -0.00 0.00 -1.54 0.00 0.00 39.78 37.78 1oej n ASN 19 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1oej n GLY 20 N 0.43 0.44 3.00 7.41 0.00 -0.08 -4.85 105.19 111.54 1oej n GLY 20 Ca 0.30 -0.98 -0.31 0.00 0.00 0.00 0.00 46.02 45.03 1oej n GLY 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oej s VAL 21 N -2.06 1.80 0.11 1.61 1.01 -0.44 -0.25 120.40 122.19 1oej s VAL 21 Ca 0.00 -1.37 -0.25 0.00 0.00 0.00 0.00 61.98 60.37 1oej s VAL 21 Cb 0.00 -1.98 0.07 0.00 0.00 0.00 0.00 36.38 34.47 1oej s VAL 21 CO 0.00 -0.04 0.61 0.72 0.00 0.00 0.00 175.10 176.39 1oej s PHE 22 N 1.28 -0.56 0.10 5.22 -0.12 -1.26 -2.29 117.98 120.35 1oej s PHE 22 Ca -0.07 0.50 -0.16 0.00 -0.05 0.00 0.00 56.93 57.16 1oej s PHE 22 Cb -0.19 0.52 -0.07 0.00 -0.63 0.00 0.00 43.02 42.65 1oej s PHE 22 CO -0.06 -0.79 0.53 -0.51 -0.05 0.00 0.00 175.22 174.34 1oej s ASP 23 N -2.39 6.88 0.33 1.98 1.01 -1.26 -4.98 116.67 118.24 1oej s ASP 23 Ca -0.02 1.10 0.08 0.00 0.71 0.00 0.00 52.55 54.42 1oej s ASP 23 Cb -0.01 -2.30 0.79 0.00 1.01 0.00 0.00 42.92 42.42 1oej s ASP 23 CO -0.08 0.19 1.82 0.44 0.21 0.00 0.00 175.17 177.75 1oej h ASP 24 N 4.00 0.71 0.31 0.27 5.19 -2.01 -0.72 116.42 124.16 1oej h ASP 24 Ca -0.49 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 55.98 1oej h ASP 24 Cb 1.20 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.64 1oej h ASP 24 CO 0.64 0.31 0.00 0.00 -3.12 0.00 0.00 179.24 177.07 1oej n ALA 25 N -2.39 1.33 0.95 3.45 0.00 -1.26 -2.05 120.51 120.53 1oej n ALA 25 Ca 0.20 0.09 0.10 0.00 0.00 0.00 0.00 53.44 53.84 1oej n ALA 25 Cb 0.53 -1.27 -0.01 0.00 0.00 0.00 0.00 19.45 18.70 1oej n ALA 25 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1oej n ASN 26 N -2.00 1.91 -4.72 0.00 3.02 -0.28 -4.90 115.26 108.29 1oej n ASN 26 Ca 0.01 -1.46 -0.42 0.00 -0.03 0.00 0.00 54.58 52.68 1oej n ASN 26 Cb 0.11 0.51 -0.03 0.00 -0.61 0.00 0.00 39.78 39.76 1oej n ASN 26 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1oej s VAL 27 N -2.41 3.67 0.17 2.41 1.01 -0.87 -4.79 120.40 119.59 1oej s VAL 27 Ca 0.17 1.28 0.08 0.00 0.00 0.00 0.00 61.98 63.51 1oej s VAL 27 Cb 0.17 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 1oej s VAL 27 CO 0.56 0.15 -0.16 -1.10 0.00 0.00 0.00 175.10 174.55 1oej s GLN 28 N 0.48 1.25 0.74 2.72 -0.21 0.05 -5.02 119.66 119.67 1oej s GLN 28 Ca 0.57 -1.46 -0.14 0.00 0.02 0.00 0.00 55.36 54.36 1oej s GLN 28 Cb -0.32 -1.15 0.04 0.00 1.00 0.00 0.00 33.01 32.58 1oej s GLN 28 CO 0.33 0.21 1.15 -0.80 -2.12 0.00 0.00 175.29 174.06 1oej s ASN 29 N -2.92 4.35 0.14 5.90 0.01 -1.26 -4.32 114.94 116.84 1oej s ASN 29 Ca 0.17 2.15 0.02 0.00 -0.71 0.00 0.00 52.86 54.49 1oej s ASN 29 Cb -0.03 -2.56 -0.04 0.00 0.41 0.00 0.00 41.25 39.02 1oej s ASN 29 CO 0.06 -2.15 -0.02 -0.13 -1.51 0.00 0.00 177.10 173.35 1oej s ARG 30 N -4.20 1.00 0.13 -0.60 0.52 -1.26 -4.18 118.95 110.36 1oej s ARG 30 Ca 0.69 -1.45 0.05 0.00 -0.52 0.00 0.00 55.73 54.50 1oej s ARG 30 Cb -0.24 -0.23 -0.04 0.00 0.52 0.00 0.00 34.95 34.96 1oej s ARG 30 CO 0.47 -0.09 0.06 0.95 0.02 0.00 0.00 175.30 176.71 1oej s THR 31 N -3.65 4.19 0.45 0.02 -4.23 -1.26 -5.01 115.64 106.16 1oej s THR 31 Ca 0.19 -1.08 0.27 0.00 -1.18 0.00 0.00 61.69 59.89 1oej s THR 31 Cb 0.06 -3.07 0.47 0.00 1.34 0.00 0.00 72.50 71.29 1oej s THR 31 CO 0.01 -0.01 1.75 0.25 -0.54 0.00 0.00 174.62 176.08 1oej h LEU 32 N 2.91 0.26 -0.69 4.79 5.85 -2.00 -2.20 115.31 124.23 1oej h LEU 32 Ca -0.47 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.31 1oej h LEU 32 Cb 1.18 0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1oej h LEU 32 CO 0.62 0.01 0.00 -1.54 -0.34 0.00 0.00 178.44 177.19 1oej n SER 33 N -4.48 0.42 0.25 1.25 3.41 -1.26 -1.00 113.62 112.20 1oej n SER 33 Ca 0.28 0.64 0.18 0.00 -0.26 0.00 0.00 58.87 59.71 1oej n SER 33 Cb 1.12 -0.71 0.87 0.00 -0.26 0.00 0.00 64.21 65.22 1oej n SER 33 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1oej h ASP 34 N 0.00 0.00 -0.23 4.04 5.19 -1.70 -2.45 116.42 121.27 1oej h ASP 34 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1oej h ASP 34 Cb 0.18 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.69 1oej h ASP 34 CO 0.00 0.00 0.00 0.79 -3.12 0.00 0.00 179.24 176.91 1oej n TRP 35 N -3.40 0.42 -1.62 4.55 8.01 -0.18 -0.81 117.44 124.41 1oej n TRP 35 Ca 0.01 -0.61 -0.42 0.00 -1.31 0.00 0.00 57.50 55.17 1oej n TRP 35 Cb 0.35 -0.10 0.01 0.00 -2.01 0.00 0.00 31.31 29.56 1oej n TRP 35 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1oej n ASP 36 N -0.06 1.45 0.00 -0.99 8.00 -0.93 -4.59 116.55 119.43 1oej n ASP 36 Ca 0.11 1.06 0.00 0.00 0.71 0.00 0.00 54.79 56.67 1oej n ASP 36 Cb 0.49 -1.37 0.00 0.00 -0.02 0.00 0.00 41.12 40.23 1oej n ASP 36 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1oej n GLY 37 N 1.13 0.98 3.34 0.44 0.00 -0.48 -4.92 105.19 105.68 1oej n GLY 37 Ca 0.09 -1.99 -0.33 0.00 0.00 0.00 0.00 46.02 43.79 1oej n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oej s VAL 38 N -1.19 2.84 -0.05 1.61 1.01 -1.26 -0.90 120.40 122.46 1oej s VAL 38 Ca 0.00 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.28 1oej s VAL 38 Cb 0.00 -2.17 -0.00 0.00 0.00 0.00 0.00 36.38 34.21 1oej s VAL 38 CO 0.00 0.53 -0.18 0.26 0.00 0.00 0.00 175.10 175.72 1oej s TRP 39 N 0.31 1.81 -0.11 5.22 0.52 0.01 -0.16 118.94 126.54 1oej s TRP 39 Ca -0.12 -0.58 -0.14 0.00 0.02 0.00 0.00 56.10 55.28 1oej s TRP 39 Cb -0.16 -1.23 -0.05 0.00 -1.15 0.00 0.00 33.47 30.88 1oej s TRP 39 CO 0.06 -0.22 0.34 1.14 0.02 0.00 0.00 176.95 178.29 1oej s GLN 40 N 0.18 4.12 0.29 4.98 -2.07 0.21 -1.65 119.66 125.72 1oej s GLN 40 Ca -0.08 0.21 -0.30 0.00 -1.82 0.00 0.00 55.36 53.38 1oej s GLN 40 Cb -0.13 -3.36 -0.12 0.00 -1.09 0.00 0.00 33.01 28.31 1oej s GLN 40 CO 0.03 0.38 1.45 0.45 -1.32 0.00 0.00 175.29 176.28 1oej n SER 41 N 3.04 3.18 0.02 12.60 2.88 -0.26 -1.58 113.62 133.50 1oej n SER 41 Ca -0.12 1.17 0.13 0.00 -1.33 0.00 0.00 58.87 58.72 1oej n SER 41 Cb 0.52 -1.51 0.45 0.00 -0.75 0.00 0.00 64.21 62.93 1oej n SER 41 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1oej n VAL 42 N 1.50 0.13 -0.22 2.46 0.24 -0.37 -4.32 118.33 117.75 1oej n VAL 42 Ca 0.08 -0.07 0.03 0.00 -2.04 0.00 0.00 64.34 62.34 1oej n VAL 42 Cb 0.35 -0.30 0.13 0.00 -1.47 0.00 0.00 33.84 32.55 1oej n VAL 42 CO 0.00 0.00 0.00 0.22 -2.14 0.00 0.00 176.83 174.91 1oej h TYR 43 N 0.00 0.06 -0.36 6.34 3.20 -1.81 -0.89 116.97 123.51 1oej h TYR 43 Ca 0.00 0.05 -0.00 0.00 3.14 0.00 0.00 58.73 61.91 1oej h TYR 43 Cb 0.56 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.89 1oej h TYR 43 CO 0.00 -0.15 0.21 -1.00 -1.64 0.00 0.00 178.16 175.59 1oej h PRO 44 N 0.16 0.49 -0.76 1.82 0.13 -1.93 -1.19 132.00 130.71 1oej h PRO 44 Ca 0.36 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 65.43 1oej h PRO 44 Cb 0.60 -0.11 -0.04 0.00 0.13 0.00 0.00 31.00 31.59 1oej h PRO 44 CO -0.53 0.35 0.38 -0.07 -0.23 0.00 0.00 178.00 177.90 1oej h LEU 45 N 0.50 0.97 -0.06 1.56 3.38 -1.45 -1.28 115.31 118.92 1oej h LEU 45 Ca 0.13 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1oej h LEU 45 Cb -0.01 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.49 1oej h LEU 45 CO -0.02 0.81 -0.01 0.25 0.09 0.00 0.00 178.44 179.56 1oej h LEU 46 N 1.07 0.12 -1.48 1.67 6.46 -0.84 -0.95 115.31 121.36 1oej h LEU 46 Ca 0.26 -0.33 0.04 0.00 -0.12 0.00 0.00 57.88 57.74 1oej h LEU 46 Cb 0.08 -0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 39.94 1oej h LEU 46 CO -0.04 0.42 0.40 1.56 -0.62 0.00 0.00 178.44 180.17 1oej h GLN 47 N -0.19 0.65 -0.00 1.25 4.20 -1.06 -1.94 115.11 118.01 1oej h GLN 47 Ca 0.02 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1oej h GLN 47 Cb 0.36 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.00 1oej h GLN 47 CO 0.00 0.43 -0.13 -1.13 -0.67 0.00 0.00 178.83 177.33 1oej n SER 48 N -4.47 0.19 0.00 1.46 3.41 -0.50 -4.90 113.62 108.81 1oej n SER 48 Ca 0.08 0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 1oej n SER 48 Cb 0.18 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 1oej n SER 48 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1oej n GLY 49 N 1.44 0.72 0.26 5.00 0.00 -0.73 -4.95 105.19 106.93 1oej n GLY 49 Ca 0.09 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.22 1oej n GLY 49 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1oej h LYS 50 N 4.19 0.00 -0.00 1.61 1.63 -1.40 -1.89 116.57 120.71 1oej h LYS 50 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1oej h LYS 50 Cb 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 1oej h LYS 50 CO 0.00 0.13 -0.16 1.28 -3.45 0.00 0.00 179.45 177.24 1oej n LEU 51 N -3.69 0.58 -0.34 5.20 4.77 -1.01 -4.46 117.00 118.05 1oej n LEU 51 Ca -0.02 -0.03 0.16 0.00 -0.03 0.00 0.00 56.01 56.09 1oej n LEU 51 Cb 0.24 -0.19 0.38 0.00 -2.33 0.00 0.00 43.42 41.52 1oej n LEU 51 CO 0.31 0.11 1.19 0.44 -1.33 0.00 0.00 177.39 178.11 1oej h ASP 52 N 0.66 0.69 0.03 -1.43 5.19 -1.65 0.22 116.42 120.13 1oej h ASP 52 Ca 0.00 0.10 -0.02 0.00 -0.62 0.00 0.00 57.03 56.49 1oej h ASP 52 Cb 0.41 -0.02 -0.01 0.00 0.18 0.00 0.00 39.33 39.90 1oej h ASP 52 CO 0.00 0.20 -0.06 -0.65 -3.12 0.00 0.00 179.24 175.62 1oej h PRO 53 N 0.65 0.08 0.03 3.56 0.11 -1.81 0.25 132.00 134.86 1oej h PRO 53 Ca 0.59 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.71 1oej h PRO 53 Cb 1.08 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.15 1oej h PRO 53 CO -0.38 0.14 -0.15 0.28 -0.21 0.00 0.00 178.00 177.68 1oej h VAL 54 N 0.08 0.64 -0.07 3.15 2.07 -0.88 -2.20 116.25 119.04 1oej h VAL 54 Ca 0.02 0.00 -0.20 0.00 0.82 0.00 0.00 66.70 67.33 1oej h VAL 54 Cb 0.15 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 1oej h VAL 54 CO 0.01 0.00 -0.80 -0.26 0.02 0.00 0.00 177.57 176.54 1oej h PHE 55 N -0.27 0.68 -0.34 1.57 0.04 -1.08 -1.54 116.94 116.00 1oej h PHE 55 Ca 0.04 -0.32 0.07 0.00 2.80 0.00 0.00 57.97 60.57 1oej h PHE 55 Cb 0.31 -0.10 -0.08 0.00 2.20 0.00 0.00 35.95 38.29 1oej h PHE 55 CO -0.19 1.11 -0.20 0.37 -0.60 0.00 0.00 178.31 178.80 1oej h GLN 56 N 0.32 -0.15 -0.04 1.51 4.15 -0.58 0.11 115.11 120.42 1oej h GLN 56 Ca -0.05 0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.38 1oej h GLN 56 Cb 1.41 0.03 -0.00 0.00 0.21 0.00 0.00 27.48 29.13 1oej h GLN 56 CO 0.14 -0.10 0.02 -0.22 -1.93 0.00 0.00 178.83 176.75 1oej h LYS 57 N -0.16 0.06 -0.40 1.69 3.64 -1.25 -1.11 116.57 119.03 1oej h LYS 57 Ca 0.17 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.58 1oej h LYS 57 Cb 0.42 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.20 1oej h LYS 57 CO -0.43 0.12 0.20 0.87 -2.27 0.00 0.00 179.45 177.93 1oej h LYS 58 N -0.01 0.39 -0.37 1.90 1.57 -1.12 -2.03 116.57 116.89 1oej h LYS 58 Ca 0.02 -0.02 -0.12 0.00 -1.87 0.00 0.00 60.65 58.65 1oej h LYS 58 Cb 0.08 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1oej h LYS 58 CO -0.00 0.26 -0.25 0.00 -0.57 0.00 0.00 179.45 178.88 1oej h ALA 59 N 1.22 0.86 -0.90 3.86 0.00 -0.75 -1.39 119.26 122.17 1oej h ALA 59 Ca 0.17 -0.38 0.04 0.00 0.00 0.00 0.00 54.91 54.74 1oej h ALA 59 Cb 0.09 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 1oej h ALA 59 CO -0.13 0.63 0.58 -0.44 0.00 0.00 0.00 179.25 179.89 1oej h ASP 60 N 0.65 0.94 0.93 0.00 3.32 -0.93 -3.08 116.42 118.25 1oej h ASP 60 Ca 0.08 -0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.93 1oej h ASP 60 Cb 0.76 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.08 1oej h ASP 60 CO 0.06 0.64 -0.96 0.00 -1.72 0.00 0.00 179.24 177.26 1oej h ALA 61 N 1.39 0.42 -2.22 3.45 0.00 -1.04 -3.41 119.26 117.85 1oej h ALA 61 Ca 0.37 -0.86 -0.76 0.00 0.00 0.00 0.00 54.91 53.66 1oej h ALA 61 Cb 0.06 -0.14 -0.25 0.00 0.00 0.00 0.00 17.79 17.45 1oej h ALA 61 CO -0.14 1.17 -0.21 0.34 0.00 0.00 0.00 179.25 180.41 1oej s ASP 62 N -6.75 6.18 0.00 0.00 -1.08 -0.55 -4.92 116.67 109.55 1oej s ASP 62 Ca 0.00 -1.89 0.16 0.00 -0.52 0.00 0.00 52.55 50.30 1oej s ASP 62 Cb 0.10 -2.19 0.80 0.00 -1.46 0.00 0.00 42.92 40.17 1oej s ASP 62 CO 0.82 -0.81 1.45 0.29 0.52 0.00 0.00 175.17 177.44 1oej n LYS 63 N 5.09 0.22 0.00 4.34 4.01 -1.26 -1.72 118.16 128.85 1oej n LYS 63 Ca -0.11 0.14 0.12 0.00 -0.51 0.00 0.00 58.31 57.95 1oej n LYS 63 Cb 0.41 -1.50 0.16 0.00 -0.51 0.00 0.00 35.03 33.59 1oej n LYS 63 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 1oej n THR 64 N -1.29 0.00 -4.51 -0.18 -2.24 -1.26 -4.96 114.28 99.84 1oej n THR 64 Ca 0.07 -0.27 -0.22 0.00 -2.27 0.00 0.00 64.05 61.36 1oej n THR 64 Cb 0.13 1.02 -0.14 0.00 -2.10 0.00 0.00 70.33 69.24 1oej n THR 64 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1oej s LYS 65 N -2.34 1.10 0.52 -0.78 -0.14 -0.70 -5.14 119.74 112.26 1oej s LYS 65 Ca 0.24 -0.72 0.02 0.00 -1.36 0.00 0.00 55.97 54.15 1oej s LYS 65 Cb 0.19 -1.11 0.03 0.00 -1.68 0.00 0.00 37.83 35.25 1oej s LYS 65 CO 0.48 0.29 0.74 0.95 -0.76 0.00 0.00 175.35 177.05 1oej s THR 66 N -0.68 2.92 0.22 2.17 -4.23 -1.26 -4.75 115.64 110.02 1oej s THR 66 Ca 0.04 -0.66 -0.08 0.00 -1.18 0.00 0.00 61.69 59.81 1oej s THR 66 Cb -0.07 -3.08 0.16 0.00 1.34 0.00 0.00 72.50 70.85 1oej s THR 66 CO 0.01 -0.06 1.77 0.15 -0.54 0.00 0.00 174.62 175.96 1oej h PHE 67 N 0.17 0.58 -0.27 3.99 3.57 -1.91 -1.89 116.94 121.19 1oej h PHE 67 Ca -0.43 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 60.96 1oej h PHE 67 Cb 1.29 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.86 1oej h PHE 67 CO 0.39 0.21 -0.42 0.00 -2.23 0.00 0.00 178.31 176.26 1oej h ALA 68 N 1.41 0.77 -0.56 2.41 0.00 -1.96 0.21 119.26 121.55 1oej h ALA 68 Ca 0.33 -0.45 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1oej h ALA 68 Cb 0.35 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1oej h ALA 68 CO -0.26 0.66 0.28 0.93 0.00 0.00 0.00 179.25 180.85 1oej h GLU 69 N 0.53 0.79 0.05 0.00 5.08 -1.81 -0.58 114.58 118.63 1oej h GLU 69 Ca 0.04 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1oej h GLU 69 Cb 0.94 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1oej h GLU 69 CO 0.09 0.63 -0.02 0.82 -1.00 0.00 0.00 179.01 179.53 1oej h ILE 70 N 0.75 1.14 -0.49 3.13 2.04 -1.06 -2.58 117.51 120.44 1oej h ILE 70 Ca 0.19 -0.62 -0.02 0.00 1.00 0.00 0.00 64.86 65.41 1oej h ILE 70 Cb 0.09 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 1oej h ILE 70 CO -0.03 0.16 0.23 0.50 0.00 0.00 0.00 178.15 179.01 1oej h LYS 71 N -0.34 0.72 -0.87 2.37 3.64 -0.84 -2.41 116.57 118.83 1oej h LYS 71 Ca -0.01 -0.11 0.04 0.00 -1.27 0.00 0.00 60.65 59.30 1oej h LYS 71 Cb 0.30 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 31.94 1oej h LYS 71 CO 0.01 0.61 0.56 -0.44 -2.27 0.00 0.00 179.45 177.91 1oej h ASP 72 N 0.65 0.92 -0.38 4.20 3.32 -1.15 0.56 116.42 124.55 1oej h ASP 72 Ca 0.17 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1oej h ASP 72 Cb 0.13 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 1oej h ASP 72 CO -0.02 0.63 0.18 0.22 -1.72 0.00 0.00 179.24 178.53 1oej h TYR 73 N 1.08 0.55 -0.14 4.55 3.20 -1.16 0.30 116.97 125.35 1oej h TYR 73 Ca 0.35 -0.03 -0.10 0.00 3.14 0.00 0.00 58.73 62.09 1oej h TYR 73 Cb 0.03 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.12 1oej h TYR 73 CO -0.02 0.46 -0.37 1.88 -1.64 0.00 0.00 178.16 178.47 1oej h TYR 74 N 0.47 0.33 -0.22 -3.82 0.05 -1.02 -1.08 116.97 111.68 1oej h TYR 74 Ca 0.13 -0.08 -0.00 0.00 0.05 0.00 0.00 58.73 58.82 1oej h TYR 74 Cb 0.12 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 37.78 1oej h TYR 74 CO -0.01 0.62 0.12 1.25 -1.05 0.00 0.00 178.16 179.10 1oej h HIS 75 N 0.25 0.30 -0.64 4.88 2.76 0.62 0.27 115.15 123.58 1oej h HIS 75 Ca 0.03 -0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 58.12 1oej h HIS 75 Cb 0.77 -0.10 -0.03 0.00 1.55 0.00 0.00 27.41 29.61 1oej h HIS 75 CO 0.02 0.25 0.10 0.87 -1.30 0.00 0.00 177.93 177.87 1oej h LYS 76 N 0.25 1.05 -0.42 5.26 1.57 -0.92 -2.30 116.57 121.07 1oej h LYS 76 Ca 0.08 -0.27 -0.12 0.00 -1.87 0.00 0.00 60.65 58.46 1oej h LYS 76 Cb 0.05 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 1oej h LYS 76 CO -0.01 0.96 -0.21 0.78 -0.57 0.00 0.00 179.45 180.39 1oej h GLY 77 N 1.04 0.95 1.00 3.86 0.00 -0.82 -3.29 103.07 105.83 1oej h GLY 77 Ca 0.20 -0.87 0.00 0.00 0.00 0.00 0.00 47.33 46.66 1oej h GLY 77 CO 0.01 0.79 -0.76 -0.97 0.00 0.00 0.00 176.54 175.61 1oej h TYR 78 N 0.70 0.00 -1.88 5.60 0.05 -0.43 0.31 116.97 121.32 1oej h TYR 78 Ca 0.09 0.00 -0.65 0.00 0.05 0.00 0.00 58.73 58.22 1oej h TYR 78 Cb 0.78 0.00 0.03 0.00 1.01 0.00 0.00 36.73 38.55 1oej h TYR 78 CO 0.06 0.00 0.91 0.00 -1.05 0.00 0.00 178.16 178.07 1oej n ALA 79 N -1.85 0.40 -3.57 3.88 0.00 -0.87 -4.42 120.51 114.07 1oej n ALA 79 Ca 0.03 0.37 -0.07 0.00 0.00 0.00 0.00 53.44 53.76 1oej n ALA 79 Cb 0.45 -2.34 -0.03 0.00 0.00 0.00 0.00 19.45 17.53 1oej n ALA 79 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1oej s THR 80 N 2.91 0.00 -2.12 0.00 -1.32 -1.26 -4.62 115.64 109.23 1oej s THR 80 Ca 0.91 0.00 0.20 0.00 -1.21 0.00 0.00 61.69 61.59 1oej s THR 80 Cb -0.84 -1.00 0.36 0.00 -1.51 0.00 0.00 72.50 69.52 1oej s THR 80 CO 0.53 0.00 1.31 -0.90 -2.21 0.00 0.00 174.62 173.35 1oej n ASP 81 N 0.21 3.21 -4.56 8.08 5.68 -1.26 -4.78 116.55 123.13 1oej n ASP 81 Ca -0.06 -1.93 -0.41 0.00 -0.50 0.00 0.00 54.79 51.90 1oej n ASP 81 Cb 0.59 -0.22 -0.03 0.00 -1.14 0.00 0.00 41.12 40.33 1oej n ASP 81 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1oej s ILE 82 N -1.35 3.91 0.27 2.12 1.01 -1.26 -4.11 121.20 121.79 1oej s ILE 82 Ca 0.33 -0.81 0.24 0.00 0.00 0.00 0.00 60.65 60.41 1oej s ILE 82 Cb 0.20 -5.03 0.23 0.00 0.01 0.00 0.00 42.46 37.87 1oej s ILE 82 CO 0.27 -1.91 1.91 -0.33 0.00 0.00 0.00 174.94 174.88 1oej h GLU 83 N 9.73 0.00 -3.16 2.79 3.07 -1.54 -3.41 114.58 122.06 1oej h GLU 83 Ca 0.21 0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 58.91 1oej h GLU 83 Cb 1.00 0.00 -0.25 0.00 -0.84 0.00 0.00 28.75 28.66 1oej h GLU 83 CO 1.42 0.22 -0.43 -1.64 -1.40 0.00 0.00 179.01 177.18 1oej s MET 84 N -3.89 0.32 -0.04 2.33 -1.94 -1.22 -1.10 119.30 113.76 1oej s MET 84 Ca -0.01 0.26 0.05 0.00 -1.71 0.00 0.00 55.69 54.28 1oej s MET 84 Cb 0.12 0.15 -0.00 0.00 2.01 0.00 0.00 34.83 37.10 1oej s MET 84 CO 0.63 -0.05 -0.18 0.42 -0.01 0.00 0.00 175.02 175.83 1oej s ILE 85 N -0.05 1.46 -0.08 2.53 1.01 -0.66 -1.38 121.20 124.03 1oej s ILE 85 Ca -0.02 -0.74 0.04 0.00 0.00 0.00 0.00 60.65 59.94 1oej s ILE 85 Cb -0.02 -1.25 -0.01 0.00 0.01 0.00 0.00 42.46 41.19 1oej s ILE 85 CO 0.01 0.42 -0.21 -0.83 0.00 0.00 0.00 174.94 174.33 1oej s GLY 86 N -0.03 1.39 -0.06 6.18 0.00 -0.70 -0.81 107.32 113.29 1oej s GLY 86 Ca -0.02 -0.99 0.01 0.00 0.00 0.00 0.00 44.72 43.72 1oej s GLY 86 CO 0.02 -0.53 -0.08 -0.42 0.00 0.00 0.00 173.10 172.09 1oej s ILE 87 N -0.09 0.85 -0.28 0.90 1.01 -0.08 -0.12 121.20 123.39 1oej s ILE 87 Ca -0.05 -0.29 -0.25 0.00 0.00 0.00 0.00 60.65 60.06 1oej s ILE 87 Cb -0.14 -0.82 0.12 0.00 0.01 0.00 0.00 42.46 41.63 1oej s ILE 87 CO 0.04 0.30 1.03 -0.70 0.00 0.00 0.00 174.94 175.61 1oej s GLU 88 N 0.88 0.51 -1.70 2.79 2.12 -0.15 -1.38 118.70 121.78 1oej s GLU 88 Ca -0.11 0.59 -0.16 0.00 0.36 0.00 0.00 54.97 55.65 1oej s GLU 88 Cb -0.15 0.25 0.15 0.00 0.26 0.00 0.00 34.13 34.64 1oej s GLU 88 CO 0.01 -0.06 0.65 -0.25 -0.54 0.00 0.00 175.26 175.07 1oej n ASP 89 N 2.18 -2.36 0.00 -1.70 8.00 -1.26 -0.03 116.55 121.38 1oej n ASP 89 Ca -0.12 -1.08 0.00 0.00 0.71 0.00 0.00 54.79 54.30 1oej n ASP 89 Cb 0.56 -2.48 0.00 0.00 -0.02 0.00 0.00 41.12 39.18 1oej n ASP 89 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1oej n GLY 90 N -1.49 0.58 3.41 0.44 0.00 -1.26 -5.01 105.19 101.86 1oej n GLY 90 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 1oej n GLY 90 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oej s ILE 91 N -2.45 3.16 -0.18 -0.61 1.01 0.96 -2.54 121.20 120.55 1oej s ILE 91 Ca 0.00 -0.64 -0.06 0.00 0.00 0.00 0.00 60.65 59.96 1oej s ILE 91 Cb 0.00 -2.31 -0.03 0.00 0.01 0.00 0.00 42.46 40.13 1oej s ILE 91 CO 0.00 0.54 0.01 -0.69 0.00 0.00 0.00 174.94 174.80 1oej s VAL 92 N 0.11 4.26 -0.13 2.92 1.01 -0.76 -0.97 120.40 126.84 1oej s VAL 92 Ca -0.05 -0.22 -0.02 0.00 0.00 0.00 0.00 61.98 61.69 1oej s VAL 92 Cb -0.15 -2.91 -0.03 0.00 0.00 0.00 0.00 36.38 33.30 1oej s VAL 92 CO 0.04 0.45 -0.06 -0.70 0.00 0.00 0.00 175.10 174.84 1oej s GLU 93 N 0.61 3.36 -0.14 2.72 2.12 0.82 -1.88 118.70 126.31 1oej s GLU 93 Ca 0.00 -0.55 -0.01 0.00 0.36 0.00 0.00 54.97 54.77 1oej s GLU 93 Cb -0.14 -2.78 -0.02 0.00 0.26 0.00 0.00 34.13 31.46 1oej s GLU 93 CO 0.02 0.36 -0.11 -0.06 -0.54 0.00 0.00 175.26 174.93 1oej s PHE 94 N 0.02 2.85 -0.30 5.30 0.08 0.13 -1.72 117.98 124.34 1oej s PHE 94 Ca -0.01 -0.62 -0.01 0.00 0.12 0.00 0.00 56.93 56.41 1oej s PHE 94 Cb -0.14 -1.87 0.06 0.00 -0.57 0.00 0.00 43.02 40.49 1oej s PHE 94 CO 0.03 -0.21 0.00 -1.01 -0.10 0.00 0.00 175.22 173.93 1oej s HIS 95 N 0.42 3.29 0.56 0.36 3.76 -0.48 -1.41 115.29 121.80 1oej s HIS 95 Ca -0.09 -1.97 0.09 0.00 -0.15 0.00 0.00 55.06 52.94 1oej s HIS 95 Cb -0.16 -2.18 0.07 0.00 1.11 0.00 0.00 32.58 31.43 1oej s HIS 95 CO 0.05 -0.82 0.71 1.03 -0.85 0.00 0.00 174.74 174.85 1oej s ARG 96 N 1.23 2.32 -1.00 1.40 0.52 -0.03 -1.41 118.95 121.97 1oej s ARG 96 Ca -0.04 -1.70 -0.15 0.00 -0.52 0.00 0.00 55.73 53.32 1oej s ARG 96 Cb -0.20 -2.54 -0.31 0.00 0.52 0.00 0.00 34.95 32.42 1oej s ARG 96 CO -0.02 -0.79 2.29 -1.71 0.02 0.00 0.00 175.30 175.09 1oej n ASN 97 N -2.13 -1.01 0.00 0.23 5.15 -1.26 -1.04 115.26 115.20 1oej n ASN 97 Ca 0.12 -0.36 0.00 0.00 -0.60 0.00 0.00 54.58 53.74 1oej n ASN 97 Cb 0.62 -0.63 0.00 0.00 -0.53 0.00 0.00 39.78 39.24 1oej n ASN 97 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1oej n ASN 98 N 6.80 0.00 -4.59 1.20 3.02 -1.26 -4.97 115.26 115.45 1oej n ASN 98 Ca 0.67 0.00 -0.34 0.00 -0.03 0.00 0.00 54.58 54.88 1oej n ASN 98 Cb 0.11 -0.44 -0.11 0.00 -0.61 0.00 0.00 39.78 38.73 1oej n ASN 98 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1oej s GLU 99 N 0.00 2.98 -0.08 3.52 -6.30 -0.21 -5.11 118.70 113.49 1oej s GLU 99 Ca 0.00 -0.50 0.04 0.00 -2.50 0.00 0.00 54.97 52.01 1oej s GLU 99 Cb 0.00 -2.70 -0.01 0.00 0.00 0.00 0.00 34.13 31.42 1oej s GLU 99 CO 0.00 0.60 -0.21 0.99 0.02 0.00 0.00 175.26 176.66 1oej s THR 100 N -0.62 2.35 0.24 -1.70 2.01 -1.26 -0.85 115.64 115.81 1oej s THR 100 Ca 0.10 -0.94 0.11 0.00 0.31 0.00 0.00 61.69 61.27 1oej s THR 100 Cb -0.12 -1.90 -0.05 0.00 0.01 0.00 0.00 72.50 70.44 1oej s THR 100 CO 0.02 0.56 -0.20 0.42 -0.69 0.00 0.00 174.62 174.73 1oej s THR 101 N 0.02 2.32 0.01 -0.82 -4.23 -0.50 -4.96 115.64 107.48 1oej s THR 101 Ca -0.08 -2.25 -0.22 0.00 -1.18 0.00 0.00 61.69 57.97 1oej s THR 101 Cb -0.15 -2.19 0.05 0.00 1.34 0.00 0.00 72.50 71.54 1oej s THR 101 CO 0.05 -0.33 0.48 -0.94 -0.54 0.00 0.00 174.62 173.34 1oej s SER 102 N -3.20 -0.39 0.02 3.99 1.04 -1.26 0.22 113.70 114.12 1oej s SER 102 Ca 0.26 0.24 -0.13 0.00 0.48 0.00 0.00 55.95 56.79 1oej s SER 102 Cb -0.05 0.44 0.02 0.00 0.10 0.00 0.00 66.02 66.53 1oej s SER 102 CO 0.12 -0.61 0.29 0.00 0.98 0.00 0.00 173.24 174.02 1oej s LYS 104 N -2.11 3.31 0.20 0.00 2.47 -1.26 -1.83 119.74 120.52 1oej s LYS 104 Ca -0.08 -1.07 -0.30 0.00 -1.56 0.00 0.00 55.97 52.96 1oej s LYS 104 Cb -0.03 -4.54 -0.08 0.00 -1.46 0.00 0.00 37.83 31.72 1oej s LYS 104 CO -0.01 -1.88 1.04 0.71 0.16 0.00 0.00 175.35 175.37 1oej s TYR 105 N 3.94 3.72 -0.05 4.03 2.02 -1.05 -4.64 117.35 125.32 1oej s TYR 105 Ca 0.29 1.73 -0.17 0.00 -0.37 0.00 0.00 57.07 58.55 1oej s TYR 105 Cb -0.11 -3.17 -0.05 0.00 -0.40 0.00 0.00 41.96 38.23 1oej s TYR 105 CO 0.03 -0.20 0.47 -0.51 -1.57 0.00 0.00 175.55 173.76 1oej s ASP 106 N -0.49 6.78 0.17 2.29 1.01 0.10 -4.88 116.67 121.66 1oej s ASP 106 Ca 0.46 0.93 -0.30 0.00 0.71 0.00 0.00 52.55 54.34 1oej s ASP 106 Cb -0.28 -2.29 -0.09 0.00 1.01 0.00 0.00 42.92 41.28 1oej s ASP 106 CO 0.35 0.15 1.35 -0.47 0.21 0.00 0.00 175.17 176.76 1oej s TYR 107 N -0.19 3.23 -0.12 4.23 5.04 -1.26 -0.50 117.35 127.77 1oej s TYR 107 Ca 0.26 1.10 0.17 0.00 -2.44 0.00 0.00 57.07 56.15 1oej s TYR 107 Cb -0.16 -3.65 0.27 0.00 0.35 0.00 0.00 41.96 38.76 1oej s TYR 107 CO 0.13 -2.15 1.14 -3.47 -1.34 0.00 0.00 175.55 169.86 1oej n ASP 108 N 3.11 2.37 0.00 4.32 2.03 0.15 -4.91 116.55 123.62 1oej n ASP 108 Ca 0.08 -2.98 0.00 0.00 0.52 0.00 0.00 54.79 52.41 1oej n ASP 108 Cb 0.42 -0.39 0.00 0.00 -0.72 0.00 0.00 41.12 40.43 1oej n ASP 108 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1oej n GLY 109 N -1.32 -1.80 3.26 0.27 0.00 -1.23 -4.80 105.19 99.57 1oej n GLY 109 Ca 0.15 -1.72 -0.14 0.00 0.00 0.00 0.00 46.02 44.31 1oej n GLY 109 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1oej s TYR 110 N 0.00 1.30 -0.02 1.61 -0.85 -1.26 -0.73 117.35 117.40 1oej s TYR 110 Ca 0.00 -1.09 0.01 0.00 -0.52 0.00 0.00 57.07 55.47 1oej s TYR 110 Cb 0.00 -0.74 0.01 0.00 0.38 0.00 0.00 41.96 41.61 1oej s TYR 110 CO 0.00 -0.28 -0.03 0.15 -1.52 0.00 0.00 175.55 173.87 1oej s LYS 111 N -3.97 0.40 -0.20 -3.49 -0.14 0.01 -4.96 119.74 107.40 1oej s LYS 111 Ca 0.29 -0.08 -0.19 0.00 -1.36 0.00 0.00 55.97 54.63 1oej s LYS 111 Cb 0.07 -0.45 -0.03 0.00 -1.68 0.00 0.00 37.83 35.73 1oej s LYS 111 CO 0.07 -0.00 0.53 0.42 -0.76 0.00 0.00 175.35 175.61 1oej s ILE 112 N 0.38 5.10 -0.01 2.17 1.01 -1.26 -0.79 121.20 127.81 1oej s ILE 112 Ca -0.04 0.99 0.02 0.00 0.00 0.00 0.00 60.65 61.62 1oej s ILE 112 Cb -0.07 -3.86 -0.03 0.00 0.01 0.00 0.00 42.46 38.51 1oej s ILE 112 CO -0.01 0.17 -0.05 -0.76 0.00 0.00 0.00 174.94 174.30 1oej s LEU 113 N 1.63 3.26 -0.18 2.97 1.43 0.33 -4.99 118.68 123.14 1oej s LEU 113 Ca 0.25 -0.09 -0.01 0.00 -1.03 0.00 0.00 54.13 53.24 1oej s LEU 113 Cb -0.15 -1.85 -0.00 0.00 0.03 0.00 0.00 46.19 44.21 1oej s LEU 113 CO 0.10 0.29 -0.12 -0.89 0.23 0.00 0.00 176.35 175.96 1oej s THR 114 N -1.00 2.84 0.64 5.49 2.01 -1.26 -1.45 115.64 122.91 1oej s THR 114 Ca 0.17 -0.69 -0.07 0.00 0.31 0.00 0.00 61.69 61.41 1oej s THR 114 Cb -0.11 -2.23 0.02 0.00 0.01 0.00 0.00 72.50 70.19 1oej s THR 114 CO 0.08 0.49 0.96 -0.31 -0.69 0.00 0.00 174.62 175.14 1oej s TYR 115 N 1.08 3.17 0.27 4.92 2.02 -0.09 -4.93 117.35 123.80 1oej s TYR 115 Ca 0.00 0.65 -0.02 0.00 -0.37 0.00 0.00 57.07 57.32 1oej s TYR 115 Cb -0.15 -2.90 0.37 0.00 -0.40 0.00 0.00 41.96 38.89 1oej s TYR 115 CO -0.03 -1.03 1.86 0.87 -1.57 0.00 0.00 175.55 175.65 1oej h LYS 116 N -0.35 0.96 -1.17 -0.62 1.57 -2.00 0.26 116.57 115.21 1oej h LYS 116 Ca -0.45 -0.15 0.33 0.00 -1.87 0.00 0.00 60.65 58.51 1oej h LYS 116 Cb 1.27 -0.17 -0.06 0.00 0.08 0.00 0.00 32.23 33.36 1oej h LYS 116 CO 0.61 0.77 0.82 0.66 -0.57 0.00 0.00 179.45 181.75 1oej h SER 117 N 0.94 0.08 0.00 0.86 4.64 -2.05 -3.45 113.55 114.57 1oej h SER 117 Ca 0.22 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1oej h SER 117 Cb 0.17 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1oej h SER 117 CO -0.02 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.56 1oej n GLY 118 N -1.72 0.20 3.74 -0.77 0.00 0.90 -5.07 105.19 102.49 1oej n GLY 118 Ca 0.26 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.93 1oej n GLY 118 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oej s LYS 119 N -0.99 2.56 0.32 1.61 -0.14 -1.26 -4.72 119.74 117.13 1oej s LYS 119 Ca 0.00 1.66 0.10 0.00 -1.36 0.00 0.00 55.97 56.37 1oej s LYS 119 Cb 0.00 -1.90 -0.06 0.00 -1.68 0.00 0.00 37.83 34.19 1oej s LYS 119 CO 0.00 -1.49 -0.12 0.15 -0.76 0.00 0.00 175.35 173.13 1oej s LYS 120 N -3.81 1.75 0.21 1.68 1.02 0.66 -0.91 119.74 120.33 1oej s LYS 120 Ca 0.73 -1.87 -0.17 0.00 0.02 0.00 0.00 55.97 54.68 1oej s LYS 120 Cb -0.27 -1.65 0.02 0.00 -0.52 0.00 0.00 37.83 35.41 1oej s LYS 120 CO 0.41 0.18 0.52 0.20 -0.92 0.00 0.00 175.35 175.74 1oej s GLY 121 N -3.56 0.01 -0.07 -3.33 0.00 -0.52 -4.25 107.32 95.60 1oej s GLY 121 Ca 0.31 -0.34 0.02 0.00 0.00 0.00 0.00 44.72 44.71 1oej s GLY 121 CO 0.15 -0.32 -0.12 0.14 0.00 0.00 0.00 173.10 172.95 1oej s VAL 122 N -3.90 1.16 -0.16 1.40 1.01 -1.26 -0.51 120.40 118.15 1oej s VAL 122 Ca 0.11 -0.49 -0.16 0.00 0.00 0.00 0.00 61.98 61.44 1oej s VAL 122 Cb -0.01 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 1oej s VAL 122 CO -0.00 0.36 0.39 -0.13 0.00 0.00 0.00 175.10 175.72 1oej s ARG 123 N 0.69 4.26 -0.30 2.72 1.81 0.03 -4.55 118.95 123.62 1oej s ARG 123 Ca -0.14 0.25 -0.11 0.00 -1.72 0.00 0.00 55.73 54.01 1oej s ARG 123 Cb -0.16 -3.46 -0.04 0.00 -0.45 0.00 0.00 34.95 30.84 1oej s ARG 123 CO 0.03 0.13 0.20 0.71 -0.68 0.00 0.00 175.30 175.69 1oej s TYR 124 N 0.77 3.22 -0.18 -0.53 2.02 0.99 -0.81 117.35 122.83 1oej s TYR 124 Ca 0.21 -0.03 -0.09 0.00 -0.37 0.00 0.00 57.07 56.78 1oej s TYR 124 Cb -0.14 -2.40 -0.05 0.00 -0.40 0.00 0.00 41.96 38.97 1oej s TYR 124 CO 0.07 -0.24 0.13 -0.51 -1.57 0.00 0.00 175.55 173.43 1oej s LEU 125 N 1.74 4.23 0.16 -1.29 1.02 0.09 -0.66 118.68 123.97 1oej s LEU 125 Ca 0.07 0.28 0.07 0.00 0.02 0.00 0.00 54.13 54.57 1oej s LEU 125 Cb -0.16 -2.08 -0.04 0.00 0.02 0.00 0.00 46.19 43.93 1oej s LEU 125 CO 0.10 0.24 -0.14 -0.36 0.02 0.00 0.00 176.35 176.21 1oej s PHE 126 N -0.02 1.53 -0.01 0.29 0.08 -0.42 0.31 117.98 119.73 1oej s PHE 126 Ca 0.10 -0.58 0.02 0.00 0.12 0.00 0.00 56.93 56.58 1oej s PHE 126 Cb -0.11 -0.76 0.00 0.00 -0.57 0.00 0.00 43.02 41.58 1oej s PHE 126 CO -0.00 0.22 -0.06 -2.00 -0.10 0.00 0.00 175.22 173.28 1oej s GLU 127 N -3.16 0.60 -0.33 0.44 2.12 0.34 -1.89 118.70 116.83 1oej s GLU 127 Ca 0.15 -0.21 -0.16 0.00 0.36 0.00 0.00 54.97 55.11 1oej s GLU 127 Cb -0.03 -0.59 -0.01 0.00 0.26 0.00 0.00 34.13 33.76 1oej s GLU 127 CO 0.04 0.10 0.40 0.00 -0.54 0.00 0.00 175.26 175.26 1oej n LYS 129 N 5.47 2.43 -2.63 0.00 5.02 -1.26 -4.81 118.16 122.37 1oej n LYS 129 Ca -0.08 -1.95 -0.43 0.00 -2.02 0.00 0.00 58.31 53.83 1oej n LYS 129 Cb 0.49 -1.29 -0.02 0.00 -0.02 0.00 0.00 35.03 34.19 1oej n LYS 129 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1oej s ASP 130 N -1.01 6.57 0.54 4.39 -1.08 -1.26 -4.93 116.67 119.88 1oej s ASP 130 Ca 0.24 0.32 0.27 0.00 -0.52 0.00 0.00 52.55 52.87 1oej s ASP 130 Cb 0.13 -2.53 1.56 0.00 -1.46 0.00 0.00 42.92 40.62 1oej s ASP 130 CO 0.18 -1.28 2.14 1.55 0.52 0.00 0.00 175.17 178.27 1oej h PRO 131 N 9.28 0.00 0.00 4.34 0.13 -2.03 -2.14 132.00 141.58 1oej h PRO 131 Ca -0.24 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.83 1oej h PRO 131 Cb 1.06 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.18 1oej h PRO 131 CO 1.13 0.08 -0.29 0.93 -0.23 0.00 0.00 178.00 179.62 1oej h GLU 132 N 0.00 0.00 -7.04 0.86 4.39 -2.00 -3.47 114.58 107.31 1oej h GLU 132 Ca -0.00 0.00 -0.52 0.00 0.34 0.00 0.00 59.36 59.18 1oej h GLU 132 Cb 0.21 0.00 0.09 0.00 -0.10 0.00 0.00 28.75 28.95 1oej h GLU 132 CO 0.01 0.29 0.50 0.45 -1.16 0.00 0.00 179.01 179.09 1oej s SER 133 N -6.27 5.74 0.00 1.42 0.15 -0.81 -4.95 113.70 108.98 1oej s SER 133 Ca 0.02 2.39 0.18 0.00 0.70 0.00 0.00 55.95 59.24 1oej s SER 133 Cb 0.09 -2.61 0.14 0.00 -1.71 0.00 0.00 66.02 61.94 1oej s SER 133 CO 0.67 -1.22 1.08 0.29 1.20 0.00 0.00 173.24 175.26 1oej n LYS 134 N -0.92 1.55 -1.23 5.44 4.76 -1.26 -5.01 118.16 121.48 1oej n LYS 134 Ca 0.10 -1.59 -0.35 0.00 -2.87 0.00 0.00 58.31 53.60 1oej n LYS 134 Cb 0.48 -1.35 0.11 0.00 -1.84 0.00 0.00 35.03 32.43 1oej n LYS 134 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1oej n ALA 135 N 1.03 -0.18 -1.68 7.82 0.00 -1.26 -4.94 120.51 121.30 1oej n ALA 135 Ca 0.11 -0.27 -0.44 0.00 0.00 0.00 0.00 53.44 52.84 1oej n ALA 135 Cb 0.46 -2.17 -0.02 0.00 0.00 0.00 0.00 19.45 17.72 1oej n ALA 135 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1oej n PRO 136 N -2.52 2.06 -0.05 0.00 -0.02 -1.26 -4.90 135.00 128.31 1oej n PRO 136 Ca 0.13 0.73 -0.01 0.00 -2.02 0.00 0.00 63.50 62.33 1oej n PRO 136 Cb 0.50 -2.34 0.25 0.00 -0.02 0.00 0.00 33.50 31.89 1oej n PRO 136 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1oej h LYS 137 N 3.42 0.64 -5.03 -0.52 3.64 -1.80 -3.40 116.57 113.52 1oej h LYS 137 Ca -0.45 -0.14 -0.45 0.00 -1.27 0.00 0.00 60.65 58.33 1oej h LYS 137 Cb 1.28 -0.09 -0.29 0.00 -0.41 0.00 0.00 32.23 32.72 1oej h LYS 137 CO 0.69 0.64 -0.80 0.71 -2.27 0.00 0.00 179.45 178.42 1oej s TYR 138 N -5.03 1.11 0.04 1.91 2.02 -0.10 -1.21 117.35 116.10 1oej s TYR 138 Ca -0.08 -0.23 0.03 0.00 -0.37 0.00 0.00 57.07 56.41 1oej s TYR 138 Cb 0.15 -0.73 -0.02 0.00 -0.40 0.00 0.00 41.96 40.96 1oej s TYR 138 CO 0.78 -0.04 -0.09 0.96 -1.57 0.00 0.00 175.55 175.59 1oej s ILE 139 N -0.19 0.63 -0.05 2.71 -4.36 -0.79 -1.45 121.20 117.69 1oej s ILE 139 Ca 0.03 -1.08 0.02 0.00 -0.26 0.00 0.00 60.65 59.36 1oej s ILE 139 Cb -0.06 -0.67 0.01 0.00 1.25 0.00 0.00 42.46 42.99 1oej s ILE 139 CO -0.00 -0.33 -0.10 -1.10 0.24 0.00 0.00 174.94 173.65 1oej s GLN 140 N -1.54 1.29 -0.13 0.37 -0.21 -0.25 -1.31 119.66 117.89 1oej s GLN 140 Ca -0.08 -0.31 -0.09 0.00 0.02 0.00 0.00 55.36 54.90 1oej s GLN 140 Cb -0.10 -1.14 -0.04 0.00 1.00 0.00 0.00 33.01 32.73 1oej s GLN 140 CO 0.01 0.03 0.17 -0.06 -2.12 0.00 0.00 175.29 173.32 1oej s PHE 141 N 0.59 3.56 -0.07 0.91 0.08 0.17 -1.27 117.98 121.95 1oej s PHE 141 Ca -0.11 0.54 -0.01 0.00 0.12 0.00 0.00 56.93 57.47 1oej s PHE 141 Cb -0.14 -2.04 0.03 0.00 -0.57 0.00 0.00 43.02 40.30 1oej s PHE 141 CO 0.02 0.61 -0.01 0.45 -0.10 0.00 0.00 175.22 176.18 1oej s SER 142 N -0.65 1.44 -0.03 1.36 0.15 0.00 -0.01 113.70 115.96 1oej s SER 142 Ca 0.14 -0.10 0.12 0.00 0.70 0.00 0.00 55.95 56.82 1oej s SER 142 Cb -0.12 -0.45 0.22 0.00 -1.71 0.00 0.00 66.02 63.95 1oej s SER 142 CO 0.04 -0.16 1.10 -0.90 1.20 0.00 0.00 173.24 174.52 1oej n ASP 143 N 4.87 -0.08 -1.58 5.45 5.75 -1.26 -0.66 116.55 129.03 1oej n ASP 143 Ca -0.12 -2.01 -0.20 0.00 -0.01 0.00 0.00 54.79 52.45 1oej n ASP 143 Cb 0.50 0.04 -0.09 0.00 -1.03 0.00 0.00 41.12 40.54 1oej n ASP 143 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1oej n HIS 144 N 0.10 -0.02 -4.98 2.11 8.25 -1.26 -4.92 115.22 114.50 1oej n HIS 144 Ca -0.12 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.07 1oej n HIS 144 Cb 0.90 -3.44 -0.15 0.00 1.12 0.00 0.00 29.99 28.41 1oej n HIS 144 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1oej s ILE 145 N -2.73 1.61 -0.01 1.59 1.01 -1.26 -3.30 121.20 118.11 1oej s ILE 145 Ca 0.00 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 59.77 1oej s ILE 145 Cb 0.00 -1.34 0.01 0.00 0.01 0.00 0.00 42.46 41.14 1oej s ILE 145 CO 0.00 0.44 0.91 2.30 0.00 0.00 0.00 174.94 178.59 1oej n ILE 146 N 2.53 0.83 -3.57 2.92 -5.35 -1.26 -4.82 119.36 110.64 1oej n ILE 146 Ca -0.15 -0.85 -0.10 0.00 -0.27 0.00 0.00 62.75 61.38 1oej n ILE 146 Cb 0.53 0.57 -0.02 0.00 -1.74 0.00 0.00 39.64 38.98 1oej n ILE 146 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1oej s ALA 147 N -0.87 -1.47 0.01 -1.28 0.00 -1.26 -0.77 121.76 116.11 1oej s ALA 147 Ca 0.01 0.22 -0.38 0.00 0.00 0.00 0.00 51.96 51.82 1oej s ALA 147 Cb 0.01 0.87 -0.17 0.00 0.00 0.00 0.00 23.12 23.83 1oej s ALA 147 CO 0.00 -0.86 1.40 -2.30 0.00 0.00 0.00 175.76 174.00 1oej n PRO 148 N -0.41 1.06 0.00 0.00 -0.02 -1.26 -4.93 135.00 129.44 1oej n PRO 148 Ca -0.12 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 1oej n PRO 148 Cb 0.63 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 1oej n PRO 148 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1oej n ARG 149 N 3.00 0.00 -1.68 -0.52 0.63 -1.26 -5.13 116.66 111.69 1oej n ARG 149 Ca 0.20 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 56.70 1oej n ARG 149 Cb 0.17 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 33.05 1oej n ARG 149 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1oej n LYS 150 N -0.01 2.69 -2.30 -0.14 4.76 -1.26 -4.80 118.16 117.09 1oej n LYS 150 Ca 0.00 0.98 -0.39 0.00 -2.87 0.00 0.00 58.31 56.03 1oej n LYS 150 Cb 0.00 -2.87 -0.02 0.00 -1.84 0.00 0.00 35.03 30.30 1oej n LYS 150 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1oej s SER 151 N 3.03 6.64 -0.02 4.39 0.15 0.01 -4.96 113.70 122.94 1oej s SER 151 Ca 0.84 2.37 0.18 0.00 0.70 0.00 0.00 55.95 60.04 1oej s SER 151 Cb -0.51 -2.62 -0.27 0.00 -1.71 0.00 0.00 66.02 60.91 1oej s SER 151 CO 0.40 -0.59 0.44 -1.54 1.20 0.00 0.00 173.24 173.15 1oej n SER 152 N 0.29 0.90 -3.54 5.45 3.41 -1.26 -4.94 113.62 113.92 1oej n SER 152 Ca 0.03 -0.13 -0.11 0.00 -0.26 0.00 0.00 58.87 58.40 1oej n SER 152 Cb 0.46 1.70 -0.04 0.00 -0.26 0.00 0.00 64.21 66.06 1oej n SER 152 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 1oej s HIS 153 N -3.16 -0.42 0.07 7.33 -3.43 -1.26 -4.33 115.29 110.09 1oej s HIS 153 Ca -0.05 0.59 -0.06 0.00 -0.80 0.00 0.00 55.06 54.75 1oej s HIS 153 Cb 0.12 0.47 -0.01 0.00 -1.43 0.00 0.00 32.58 31.72 1oej s HIS 153 CO 0.74 -0.46 0.11 -0.59 -2.00 0.00 0.00 174.74 172.54 1oej s PHE 154 N -1.77 0.26 -0.10 0.38 -0.12 -0.70 -4.72 117.98 111.22 1oej s PHE 154 Ca -0.01 -0.70 -0.02 0.00 -0.05 0.00 0.00 56.93 56.14 1oej s PHE 154 Cb -0.01 -0.17 -0.03 0.00 -0.63 0.00 0.00 43.02 42.18 1oej s PHE 154 CO -0.00 -0.46 0.00 -1.01 -0.05 0.00 0.00 175.22 173.70 1oej s HIS 155 N -3.60 3.15 -0.04 3.49 3.76 0.16 -0.66 115.29 121.55 1oej s HIS 155 Ca 0.03 0.12 0.02 0.00 -0.15 0.00 0.00 55.06 55.09 1oej s HIS 155 Cb 0.04 -1.83 0.01 0.00 1.11 0.00 0.00 32.58 31.92 1oej s HIS 155 CO -0.09 0.38 -0.09 -1.50 -0.85 0.00 0.00 174.74 172.59 1oej s ILE 156 N -0.64 0.81 -0.15 0.60 2.07 -0.27 -0.82 121.20 122.81 1oej s ILE 156 Ca 0.10 -0.33 -0.04 0.00 -1.41 0.00 0.00 60.65 58.98 1oej s ILE 156 Cb -0.12 -0.76 -0.03 0.00 0.13 0.00 0.00 42.46 41.69 1oej s ILE 156 CO 0.02 0.27 -0.02 -0.36 -1.91 0.00 0.00 174.94 172.94 1oej s PHE 157 N 0.52 3.07 -0.02 3.50 0.08 -0.40 -3.52 117.98 121.21 1oej s PHE 157 Ca -0.09 -0.16 0.03 0.00 0.12 0.00 0.00 56.93 56.83 1oej s PHE 157 Cb -0.12 -1.94 -0.00 0.00 -0.57 0.00 0.00 43.02 40.38 1oej s PHE 157 CO 0.01 0.08 -0.10 -1.64 -0.10 0.00 0.00 175.22 173.47 1oej s MET 158 N 0.15 1.00 0.08 0.44 -1.94 -1.26 -1.09 119.30 116.68 1oej s MET 158 Ca -0.00 -0.36 -0.26 0.00 -1.71 0.00 0.00 55.69 53.35 1oej s MET 158 Cb -0.13 -0.94 0.09 0.00 2.01 0.00 0.00 34.83 35.86 1oej s MET 158 CO 0.02 0.17 1.15 0.20 -0.01 0.00 0.00 175.02 176.56 1oej s GLY 159 N 0.01 -0.16 0.00 -0.03 0.00 -0.53 -5.03 107.32 101.58 1oej s GLY 159 Ca -0.00 0.13 0.00 0.00 0.00 0.00 0.00 44.72 44.84 1oej s GLY 159 CO 0.00 2.02 0.56 0.70 0.00 0.00 0.00 173.10 176.38 1oej n ASN 160 N -0.84 1.06 -0.04 1.64 3.02 -1.26 -0.92 115.26 117.92 1oej n ASN 160 Ca -0.04 -1.24 -0.03 0.00 -0.03 0.00 0.00 54.58 53.25 1oej n ASN 160 Cb 0.60 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.77 1oej n ASN 160 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1oej n ASP 161 N -0.12 0.92 -3.55 6.41 8.00 -1.26 -4.87 116.55 122.08 1oej n ASP 161 Ca 0.00 0.42 -0.11 0.00 0.71 0.00 0.00 54.79 55.81 1oej n ASP 161 Cb 0.12 -0.68 -0.04 0.00 -0.02 0.00 0.00 41.12 40.50 1oej n ASP 161 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1oej s SER 162 N -4.67 -0.37 0.32 -2.24 1.04 -1.26 -5.01 113.70 101.51 1oej s SER 162 Ca -0.08 -0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.18 1oej s SER 162 Cb 0.01 0.52 0.54 0.00 0.10 0.00 0.00 66.02 67.19 1oej s SER 162 CO 0.12 -0.89 1.98 1.56 0.98 0.00 0.00 173.24 177.00 1oej h GLN 163 N 2.25 0.95 -0.85 4.02 1.08 -1.97 -3.03 115.11 117.57 1oej h GLN 163 Ca -0.34 -0.06 -0.03 0.00 -1.45 0.00 0.00 58.65 56.77 1oej h GLN 163 Cb 1.27 -0.21 -0.04 0.00 -0.05 0.00 0.00 27.48 28.45 1oej h GLN 163 CO 0.43 0.64 0.40 0.37 -0.95 0.00 0.00 178.83 179.72 1oej h GLN 164 N 0.98 1.23 -0.92 1.46 5.75 -1.99 -1.31 115.11 120.30 1oej h GLN 164 Ca 0.26 -0.18 0.10 0.00 -0.15 0.00 0.00 58.65 58.67 1oej h GLN 164 Cb -0.09 -0.22 -0.08 0.00 1.07 0.00 0.00 27.48 28.16 1oej h GLN 164 CO -0.05 0.94 0.56 1.03 -2.65 0.00 0.00 178.83 178.66 1oej h SER 165 N 1.21 0.84 0.26 -0.69 0.87 -1.92 -0.31 113.55 113.81 1oej h SER 165 Ca 0.29 0.04 -0.15 0.00 -1.23 0.00 0.00 61.79 60.74 1oej h SER 165 Cb 0.12 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 1oej h SER 165 CO -0.04 0.48 -0.57 -0.07 -0.53 0.00 0.00 176.83 176.10 1oej h LEU 166 N 0.95 0.36 -0.82 2.23 3.38 -1.37 -3.01 115.31 117.04 1oej h LEU 166 Ca 0.44 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 58.15 1oej h LEU 166 Cb 0.36 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1oej h LEU 166 CO -0.23 0.86 0.18 -0.07 0.09 0.00 0.00 178.44 179.27 1oej h LEU 167 N 0.25 1.00 -2.03 1.67 3.38 -0.40 -2.55 115.31 116.64 1oej h LEU 167 Ca -0.00 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 1oej h LEU 167 Cb 1.08 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 1oej h LEU 167 CO 0.09 0.95 -0.03 0.78 0.09 0.00 0.00 178.44 180.33 1oej h ASN 168 N 1.02 0.00 -2.95 -0.43 2.35 -0.96 -3.44 115.58 111.17 1oej h ASN 168 Ca 0.22 0.00 -0.54 0.00 -0.55 0.00 0.00 56.30 55.43 1oej h ASN 168 Cb 0.33 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.71 1oej h ASN 168 CO -0.00 0.03 0.78 -0.70 -1.65 0.00 0.00 177.43 175.89 1oej s GLU 169 N -3.90 4.30 0.00 0.81 2.56 -0.96 -4.88 118.70 116.63 1oej s GLU 169 Ca -0.01 1.99 0.00 0.00 0.00 0.00 0.00 54.97 56.95 1oej s GLU 169 Cb 0.11 -3.46 0.00 0.00 2.00 0.00 0.00 34.13 32.78 1oej s GLU 169 CO 0.51 -0.51 0.00 -1.33 -0.56 0.00 0.00 175.26 173.36 1oej n MET 170 N 4.84 1.85 -0.01 4.30 2.81 -1.26 -4.92 117.12 124.73 1oej n MET 170 Ca 0.12 0.00 0.05 0.00 -1.81 0.00 0.00 57.70 56.07 1oej n MET 170 Cb 0.43 -0.15 -0.09 0.00 -0.71 0.00 0.00 33.22 32.70 1oej n MET 170 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 1oej n GLU 171 N -0.24 0.49 -4.37 0.03 0.28 -1.26 -4.93 120.64 110.64 1oej n GLU 171 Ca 0.00 -0.10 -0.33 0.00 -0.16 0.00 0.00 57.16 56.57 1oej n GLU 171 Cb 0.00 -1.29 -0.16 0.00 1.43 0.00 0.00 31.44 31.42 1oej n GLU 171 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 1oej s ASN 172 N -3.47 3.22 -0.44 -1.84 2.47 -1.26 -2.67 114.94 110.94 1oej s ASN 172 Ca -0.05 -0.60 0.07 0.00 0.42 0.00 0.00 52.86 52.70 1oej s ASN 172 Cb 0.07 -1.48 0.22 0.00 -1.45 0.00 0.00 41.25 38.62 1oej s ASN 172 CO 0.50 0.04 0.62 -2.67 -3.72 0.00 0.00 177.10 171.88 1oej n TRP 173 N 4.35 -1.82 -1.43 0.43 4.27 0.11 -4.92 117.44 118.43 1oej n TRP 173 Ca -0.20 -2.69 -0.48 0.00 -3.89 0.00 0.00 57.50 50.24 1oej n TRP 173 Cb 0.51 0.57 -0.03 0.00 -1.36 0.00 0.00 31.31 31.00 1oej n TRP 173 CO 0.00 0.00 0.00 -2.30 -2.29 0.00 0.00 177.69 173.10 1oej n PRO 174 N 1.95 0.15 -4.44 -2.67 -0.02 -1.14 -4.44 135.00 124.40 1oej n PRO 174 Ca 0.19 0.05 -0.22 0.00 -2.02 0.00 0.00 63.50 61.50 1oej n PRO 174 Cb 0.55 -1.12 -0.16 0.00 -0.02 0.00 0.00 33.50 32.76 1oej n PRO 174 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1oej s THR 175 N -0.95 0.88 -0.06 3.45 2.01 -1.26 -1.11 115.64 118.60 1oej s THR 175 Ca 0.65 -0.38 0.03 0.00 0.31 0.00 0.00 61.69 62.30 1oej s THR 175 Cb -0.92 -0.80 0.01 0.00 0.01 0.00 0.00 72.50 70.79 1oej s THR 175 CO 0.56 0.28 -0.15 -0.31 -0.69 0.00 0.00 174.62 174.32 1oej s TYR 176 N 0.42 1.61 0.26 4.92 2.02 0.17 -1.24 117.35 125.51 1oej s TYR 176 Ca -0.08 -0.56 0.10 0.00 -0.37 0.00 0.00 57.07 56.16 1oej s TYR 176 Cb -0.12 -1.14 -0.05 0.00 -0.40 0.00 0.00 41.96 40.25 1oej s TYR 176 CO 0.01 -0.25 -0.15 0.71 -1.57 0.00 0.00 175.55 174.30 1oej s TYR 177 N 0.44 2.06 0.19 2.71 2.02 -0.62 -1.73 117.35 122.43 1oej s TYR 177 Ca -0.12 -0.47 -0.33 0.00 -0.37 0.00 0.00 57.07 55.78 1oej s TYR 177 Cb -0.15 -0.97 -0.14 0.00 -0.40 0.00 0.00 41.96 40.30 1oej s TYR 177 CO 0.04 0.53 1.52 -2.30 -1.57 0.00 0.00 175.55 173.78 1oej n PRO 178 N -0.55 2.11 -0.22 -1.71 -0.02 -1.26 -0.62 135.00 132.73 1oej n PRO 178 Ca -0.06 0.76 0.18 0.00 -2.02 0.00 0.00 63.50 62.36 1oej n PRO 178 Cb 0.61 -2.49 0.51 0.00 -0.02 0.00 0.00 33.50 32.11 1oej n PRO 178 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1oej h TYR 179 N 5.37 0.52 0.00 6.00 3.20 -0.84 -1.60 116.97 129.62 1oej h TYR 179 Ca -0.45 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.41 1oej h TYR 179 Cb 1.26 -0.16 -0.00 0.00 1.54 0.00 0.00 36.73 39.37 1oej h TYR 179 CO 0.60 0.15 -0.10 -0.56 -1.64 0.00 0.00 178.16 176.61 1oej h GLN 180 N 0.40 0.00 -6.82 1.82 -0.00 -1.88 -3.44 115.11 105.19 1oej h GLN 180 Ca 0.45 0.00 -0.52 0.00 -0.00 0.00 0.00 58.65 58.57 1oej h GLN 180 Cb 1.11 0.00 0.06 0.00 -0.00 0.00 0.00 27.48 28.65 1oej h GLN 180 CO -0.16 0.10 0.68 -0.51 -0.00 0.00 0.00 178.83 178.94 1oej s LEU 181 N -6.64 4.41 0.95 0.06 1.43 -0.60 -5.00 118.68 113.29 1oej s LEU 181 Ca -0.01 2.66 -0.11 0.00 -1.03 0.00 0.00 54.13 55.64 1oej s LEU 181 Cb 0.11 -3.64 0.16 0.00 0.03 0.00 0.00 46.19 42.85 1oej s LEU 181 CO 0.57 -0.59 1.10 -0.94 0.23 0.00 0.00 176.35 176.72 1oej s SER 182 N -0.14 2.81 0.20 2.29 1.04 -1.26 -4.84 113.70 113.79 1oej s SER 182 Ca 0.53 1.79 -0.09 0.00 0.48 0.00 0.00 55.95 58.65 1oej s SER 182 Cb -0.40 -2.39 0.13 0.00 0.10 0.00 0.00 66.02 63.46 1oej s SER 182 CO 0.49 -3.11 1.78 0.77 0.98 0.00 0.00 173.24 174.15 1oej h SER 183 N -1.87 0.98 -0.89 7.02 4.64 -1.96 -1.57 113.55 119.90 1oej h SER 183 Ca -0.49 -0.15 0.08 0.00 -0.47 0.00 0.00 61.79 60.76 1oej h SER 183 Cb 1.28 -0.25 -0.07 0.00 -0.31 0.00 0.00 62.40 63.05 1oej h SER 183 CO 0.48 0.86 0.55 -0.33 -0.87 0.00 0.00 176.83 177.52 1oej h GLU 184 N 1.04 0.92 -0.31 4.77 3.07 -1.96 -2.17 114.58 119.94 1oej h GLU 184 Ca 0.25 -0.06 -0.13 0.00 -0.50 0.00 0.00 59.36 58.93 1oej h GLU 184 Cb 0.15 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 27.85 1oej h GLU 184 CO -0.03 0.61 -0.33 1.49 -1.40 0.00 0.00 179.01 179.34 1oej h GLU 185 N 0.94 0.69 -0.05 2.33 4.57 -1.80 -1.12 114.58 120.14 1oej h GLU 185 Ca 0.41 -0.32 0.02 0.00 -1.18 0.00 0.00 59.36 58.29 1oej h GLU 185 Cb 0.29 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.85 1oej h GLU 185 CO -0.21 0.93 -0.07 0.28 -1.18 0.00 0.00 179.01 178.76 1oej h VAL 186 N 0.58 0.81 -0.50 0.32 2.07 -1.04 0.49 116.25 118.98 1oej h VAL 186 Ca 0.06 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.62 1oej h VAL 186 Cb 0.85 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 31.39 1oej h VAL 186 CO 0.07 0.00 0.26 0.58 0.02 0.00 0.00 177.57 178.50 1oej h VAL 187 N -0.10 0.97 -0.53 2.57 2.07 -1.13 0.13 116.25 120.23 1oej h VAL 187 Ca 0.05 -0.17 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 1oej h VAL 187 Cb 0.16 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 1oej h VAL 187 CO -0.11 0.09 0.19 -0.08 0.02 0.00 0.00 177.57 177.68 1oej h GLU 188 N 0.50 0.78 -0.32 1.57 4.57 -0.93 0.20 114.58 120.95 1oej h GLU 188 Ca 0.22 -0.13 -0.04 0.00 -1.18 0.00 0.00 59.36 58.23 1oej h GLU 188 Cb 0.12 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.56 1oej h GLU 188 CO -0.15 0.66 0.05 0.93 -1.18 0.00 0.00 179.01 179.32 1oej h GLU 189 N 0.77 0.54 -0.63 1.92 4.39 0.33 -2.75 114.58 119.15 1oej h GLU 189 Ca 0.18 -0.15 -0.03 0.00 0.34 0.00 0.00 59.36 59.70 1oej h GLU 189 Cb 0.19 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.75 1oej h GLU 189 CO -0.01 0.63 0.27 0.52 -1.16 0.00 0.00 179.01 179.26 1oej h MET 190 N 0.36 0.90 -0.09 2.33 2.86 -0.16 -1.95 114.93 119.19 1oej h MET 190 Ca 0.10 -0.13 0.03 0.00 -2.06 0.00 0.00 59.70 57.63 1oej h MET 190 Cb 0.36 -0.16 -0.00 0.00 0.06 0.00 0.00 31.60 31.85 1oej h MET 190 CO 0.01 0.72 0.09 1.98 1.06 0.00 0.00 176.91 180.76 1oej h MET 191 N 0.89 0.00 0.00 1.72 -1.53 -0.34 -3.42 114.93 112.26 1oej h MET 191 Ca 0.22 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.48 1oej h MET 191 Cb 0.14 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.19 1oej h MET 191 CO -0.02 0.00 0.00 0.43 0.14 0.00 0.00 176.91 177.46 1oej n SER 192 N -4.01 0.00 0.00 1.39 7.64 -0.74 -5.09 113.62 112.81 1oej n SER 192 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.87 1oej n SER 192 Cb 0.19 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 1oej n SER 192 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44