#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dej n ASN 35 N 0.00 2.74 -3.90 1.67 4.13 -1.26 -4.88 115.26 113.76 3dej n ASN 35 Ca 0.00 -2.29 -0.10 0.00 1.68 0.00 0.00 54.58 53.87 3dej n ASN 35 Cb 0.00 -0.47 -0.10 0.00 -1.54 0.00 0.00 39.78 37.67 3dej n ASN 35 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 3dej s SER 36 N -0.57 0.10 0.32 6.41 1.04 -1.26 -1.39 113.70 118.35 3dej s SER 36 Ca 0.24 -0.35 -0.29 0.00 0.48 0.00 0.00 55.95 56.03 3dej s SER 36 Cb 0.17 0.20 -0.10 0.00 0.10 0.00 0.00 66.02 66.39 3dej s SER 36 CO 0.10 -0.41 1.40 -0.31 0.98 0.00 0.00 173.24 175.00 3dej s TYR 37 N -1.83 2.90 -0.22 5.02 2.02 -0.00 -4.85 117.35 120.38 3dej s TYR 37 Ca -0.11 1.23 -0.29 0.00 -0.37 0.00 0.00 57.07 57.53 3dej s TYR 37 Cb -0.06 -3.83 -0.04 0.00 -0.40 0.00 0.00 41.96 37.64 3dej s TYR 37 CO -0.01 -2.44 1.87 0.21 -1.57 0.00 0.00 175.55 173.60 3dej s LYS 38 N -1.49 3.54 -0.26 -0.62 2.20 -1.26 -4.82 119.74 117.03 3dej s LYS 38 Ca 0.53 1.81 0.09 0.00 -0.36 0.00 0.00 55.97 58.04 3dej s LYS 38 Cb -0.42 -4.18 0.45 0.00 -1.51 0.00 0.00 37.83 32.16 3dej s LYS 38 CO 0.53 -1.62 1.29 -1.33 -0.36 0.00 0.00 175.35 173.86 3dej n MET 39 N 8.15 2.20 -2.53 4.03 2.81 -1.26 -4.70 117.12 125.82 3dej n MET 39 Ca 0.23 -3.51 -0.09 0.00 -1.81 0.00 0.00 57.70 52.51 3dej n MET 39 Cb 0.45 -1.85 0.04 0.00 -0.71 0.00 0.00 33.22 31.15 3dej n MET 39 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 3dej n ASP 40 N -1.01 2.86 -4.83 7.83 5.68 -1.26 -4.95 116.55 120.86 3dej n ASP 40 Ca 0.30 -2.69 -0.29 0.00 -0.50 0.00 0.00 54.79 51.60 3dej n ASP 40 Cb 0.83 -0.43 0.09 0.00 -1.14 0.00 0.00 41.12 40.48 3dej n ASP 40 CO 0.00 0.00 0.00 -0.31 -1.33 0.00 0.00 177.20 175.56 3dej s TYR 41 N -3.72 2.87 0.08 2.11 1.51 -1.26 -4.99 117.35 113.94 3dej s TYR 41 Ca 0.36 0.97 -0.18 0.00 -1.01 0.00 0.00 57.07 57.21 3dej s TYR 41 Cb 0.36 -3.26 -0.06 0.00 -0.11 0.00 0.00 41.96 38.89 3dej s TYR 41 CO -0.01 -1.81 1.31 -1.35 -1.11 0.00 0.00 175.55 172.58 3dej h PRO 42 N -1.10 -0.18 -6.65 -1.71 0.11 -1.92 -3.43 132.00 117.12 3dej h PRO 42 Ca -0.47 0.01 -0.44 0.00 0.11 0.00 0.00 66.00 65.21 3dej h PRO 42 Cb 1.29 0.04 0.03 0.00 0.11 0.00 0.00 31.00 32.48 3dej h PRO 42 CO 0.62 -0.12 -0.14 -1.21 -0.21 0.00 0.00 178.00 176.94 3dej s GLU 43 N -4.46 2.58 0.05 1.05 2.02 -0.90 -5.04 118.70 114.00 3dej s GLU 43 Ca -0.08 -1.13 0.16 0.00 0.02 0.00 0.00 54.97 53.94 3dej s GLU 43 Cb 0.05 -2.63 -0.15 0.00 0.10 0.00 0.00 34.13 31.51 3dej s GLU 43 CO 0.34 -0.58 0.83 0.52 0.02 0.00 0.00 175.26 176.39 3dej h MET 44 N 0.31 0.00 0.00 1.61 2.86 -1.84 -2.81 114.93 115.05 3dej h MET 44 Ca -0.39 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.25 3dej h MET 44 Cb 1.29 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.95 3dej h MET 44 CO 0.46 0.35 0.00 0.41 1.06 0.00 0.00 176.91 179.19 3dej n GLY 45 N 1.42 3.03 3.76 8.32 0.00 -1.26 -1.67 105.19 118.79 3dej n GLY 45 Ca -0.10 -1.70 -0.40 0.00 0.00 0.00 0.00 46.02 43.82 3dej n GLY 45 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3dej s LEU 46 N 0.00 4.44 -0.69 0.99 0.05 -1.26 -2.86 118.68 119.35 3dej s LEU 46 Ca 0.00 2.31 0.01 0.00 0.05 0.00 0.00 54.13 56.50 3dej s LEU 46 Cb 0.00 -3.75 0.17 0.00 -2.05 0.00 0.00 46.19 40.56 3dej s LEU 46 CO 0.00 -0.31 0.50 0.00 -0.55 0.00 0.00 176.35 175.99 3dej s ILE 48 N -0.74 2.90 -0.22 0.00 1.09 -0.53 -2.69 121.20 121.01 3dej s ILE 48 Ca 0.21 0.78 -0.01 0.00 -1.10 0.00 0.00 60.65 60.53 3dej s ILE 48 Cb -0.15 -3.50 0.06 0.00 -1.06 0.00 0.00 42.46 37.82 3dej s ILE 48 CO -0.08 0.13 -0.02 -0.63 -0.10 0.00 0.00 174.94 174.25 3dej s ILE 49 N -0.18 1.11 -0.12 2.92 1.01 -0.30 -1.53 121.20 124.11 3dej s ILE 49 Ca 0.56 -0.95 -0.18 0.00 0.00 0.00 0.00 60.65 60.08 3dej s ILE 49 Cb -0.39 -1.48 -0.04 0.00 0.01 0.00 0.00 42.46 40.56 3dej s ILE 49 CO 0.43 -0.15 0.49 -0.63 0.00 0.00 0.00 174.94 175.08 3dej s ILE 50 N 1.59 5.17 -0.31 2.92 1.01 -0.66 -1.08 121.20 129.84 3dej s ILE 50 Ca -0.04 0.97 -0.01 0.00 0.00 0.00 0.00 60.65 61.57 3dej s ILE 50 Cb -0.18 -3.83 0.10 0.00 0.01 0.00 0.00 42.46 38.56 3dej s ILE 50 CO -0.07 0.31 0.11 0.21 0.00 0.00 0.00 174.94 175.49 3dej s ASN 51 N 0.69 3.91 -0.16 3.58 3.04 -1.04 -2.15 114.94 122.81 3dej s ASN 51 Ca 0.26 -1.58 -0.18 0.00 0.04 0.00 0.00 52.86 51.40 3dej s ASN 51 Cb -0.15 -0.75 -0.04 0.00 -1.54 0.00 0.00 41.25 38.77 3dej s ASN 51 CO 0.11 -0.42 0.47 0.20 -3.04 0.00 0.00 177.10 174.42 3dej s ASN 52 N 1.70 6.58 -0.04 -4.21 -0.87 -0.75 -0.27 114.94 117.07 3dej s ASN 52 Ca 0.10 0.69 -0.00 0.00 -1.57 0.00 0.00 52.86 52.08 3dej s ASN 52 Cb -0.17 -2.27 -0.03 0.00 -0.02 0.00 0.00 41.25 38.76 3dej s ASN 52 CO -0.27 -0.07 -0.05 1.17 -2.57 0.00 0.00 177.10 175.31 3dej n LYS 53 N 4.22 0.11 -4.82 -0.60 4.81 -1.26 -4.62 118.16 115.99 3dej n LYS 53 Ca -0.07 0.03 -0.30 0.00 -0.87 0.00 0.00 58.31 57.11 3dej n LYS 53 Cb 0.51 -0.96 -0.17 0.00 0.02 0.00 0.00 35.03 34.44 3dej n LYS 53 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 3dej s ASN 54 N -4.73 2.64 0.06 3.14 0.01 -1.26 -0.50 114.94 114.29 3dej s ASN 54 Ca -0.06 -0.47 0.07 0.00 -0.71 0.00 0.00 52.86 51.69 3dej s ASN 54 Cb 0.02 -1.20 -0.03 0.00 0.41 0.00 0.00 41.25 40.44 3dej s ASN 54 CO 0.09 0.09 -0.16 -0.36 -1.51 0.00 0.00 177.10 175.25 3dej s PHE 55 N 0.63 2.60 1.02 2.20 0.40 -1.26 -4.80 117.98 118.76 3dej s PHE 55 Ca -0.13 -0.23 -0.12 0.00 -0.60 0.00 0.00 56.93 55.84 3dej s PHE 55 Cb -0.16 -1.45 0.17 0.00 0.51 0.00 0.00 43.02 42.09 3dej s PHE 55 CO 0.04 0.30 0.90 0.72 0.70 0.00 0.00 175.22 177.87 3dej n HIS 56 N 1.35 -0.35 0.26 0.36 8.25 -1.13 -4.86 115.22 119.10 3dej n HIS 56 Ca -0.16 0.18 0.13 0.00 -0.26 0.00 0.00 57.72 57.61 3dej n HIS 56 Cb 0.52 -1.84 0.73 0.00 1.12 0.00 0.00 29.99 30.53 3dej n HIS 56 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 3dej h LYS 57 N -2.12 0.00 0.00 -0.41 2.10 -1.95 -2.70 116.57 111.49 3dej h LYS 57 Ca -0.50 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.15 3dej h LYS 57 Cb 1.30 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.63 3dej h LYS 57 CO 0.42 0.11 -0.03 0.77 -2.00 0.00 0.00 179.45 178.73 3dej h SER 58 N 0.00 0.00 0.03 7.07 0.02 -1.94 -2.96 113.55 115.77 3dej h SER 58 Ca -0.00 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.66 3dej h SER 58 Cb 0.32 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.83 3dej h SER 58 CO 0.01 0.03 -1.57 0.35 -1.14 0.00 0.00 176.83 174.51 3dej n THR 59 N -3.56 1.59 0.00 -2.27 -2.24 -1.02 -5.02 114.28 101.76 3dej n THR 59 Ca -0.03 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 3dej n THR 59 Cb 0.12 -1.95 0.00 0.00 -2.10 0.00 0.00 70.33 66.41 3dej n THR 59 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dej n GLY 60 N 1.55 2.08 3.78 3.38 0.00 -1.12 -5.05 105.19 109.82 3dej n GLY 60 Ca -0.35 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.31 3dej n GLY 60 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3dej s MET 61 N -0.67 4.34 1.14 1.61 -1.94 -1.26 -5.03 119.30 117.49 3dej s MET 61 Ca 0.00 1.42 -0.15 0.00 -1.71 0.00 0.00 55.69 55.25 3dej s MET 61 Cb 0.00 -2.62 0.26 0.00 2.01 0.00 0.00 34.83 34.48 3dej s MET 61 CO 0.00 0.03 1.05 0.95 -0.01 0.00 0.00 175.02 177.04 3dej s THR 62 N -1.68 1.85 0.26 2.05 -4.23 -1.26 -4.69 115.64 107.96 3dej s THR 62 Ca 0.55 0.00 -0.30 0.00 -1.18 0.00 0.00 61.69 60.76 3dej s THR 62 Cb -0.20 -2.30 -0.09 0.00 1.34 0.00 0.00 72.50 71.25 3dej s THR 62 CO 0.25 0.00 1.03 -0.44 -0.54 0.00 0.00 174.62 174.92 3dej s SER 63 N -3.17 7.43 -1.07 3.99 0.01 -1.26 -4.73 113.70 114.89 3dej s SER 63 Ca 0.68 2.13 -0.15 0.00 1.31 0.00 0.00 55.95 59.92 3dej s SER 63 Cb -0.19 -2.62 0.17 0.00 0.21 0.00 0.00 66.02 63.59 3dej s SER 63 CO 0.60 -0.02 1.25 -0.13 0.41 0.00 0.00 173.24 175.35 3dej s ARG 64 N -1.34 3.89 0.47 12.44 0.52 0.35 -5.02 118.95 130.26 3dej s ARG 64 Ca 0.43 -2.33 -0.19 0.00 -0.52 0.00 0.00 55.73 53.13 3dej s ARG 64 Cb -0.29 -4.92 -0.09 0.00 0.52 0.00 0.00 34.95 30.16 3dej s ARG 64 CO 0.37 -1.69 0.97 -1.54 0.02 0.00 0.00 175.30 173.43 3dej s SER 65 N 2.95 6.77 0.00 0.23 1.04 -1.26 -3.80 113.70 119.63 3dej s SER 65 Ca 0.36 1.63 0.00 0.00 0.48 0.00 0.00 55.95 58.42 3dej s SER 65 Cb -0.05 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.55 3dej s SER 65 CO -0.05 -0.48 0.00 0.61 0.98 0.00 0.00 173.24 174.30 3dej n GLY 66 N -1.13 0.97 0.13 7.32 0.00 -1.26 -4.45 105.19 106.78 3dej n GLY 66 Ca 0.07 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.21 3dej n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dej h THR 67 N 0.00 0.00 -0.15 2.61 1.03 -1.88 -2.98 112.91 111.54 3dej h THR 67 Ca 0.00 -0.67 -0.16 0.00 -0.01 0.00 0.00 66.41 65.57 3dej h THR 67 Cb 0.00 1.57 -0.01 0.00 -1.07 0.00 0.00 68.15 68.64 3dej h THR 67 CO 0.00 0.00 -0.56 0.44 -0.01 0.00 0.00 175.52 175.39 3dej h ASP 68 N 0.00 0.53 -0.98 0.00 3.32 -1.90 -1.81 116.42 115.58 3dej h ASP 68 Ca 0.00 -0.28 0.07 0.00 0.02 0.00 0.00 57.03 56.84 3dej h ASP 68 Cb 0.84 -0.15 -0.07 0.00 0.22 0.00 0.00 39.33 40.17 3dej h ASP 68 CO 0.00 0.98 0.64 0.58 -1.72 0.00 0.00 179.24 179.71 3dej h VAL 69 N 0.36 1.07 0.19 -1.35 2.07 -1.92 -2.26 116.25 114.41 3dej h VAL 69 Ca 0.00 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 3dej h VAL 69 Cb 1.09 -0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.70 3dej h VAL 69 CO 0.10 0.21 -0.09 0.44 0.02 0.00 0.00 177.57 178.25 3dej h ASP 70 N 1.13 -0.21 -0.69 0.57 3.32 -1.57 -1.35 116.42 117.63 3dej h ASP 70 Ca 0.43 -0.29 0.13 0.00 0.02 0.00 0.00 57.03 57.32 3dej h ASP 70 Cb 0.19 0.06 -0.09 0.00 0.22 0.00 0.00 39.33 39.71 3dej h ASP 70 CO -0.17 0.33 0.21 0.00 -1.72 0.00 0.00 179.24 177.89 3dej h ALA 71 N -0.49 0.90 0.44 3.45 0.00 -1.33 0.39 119.26 122.62 3dej h ALA 71 Ca -0.03 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3dej h ALA 71 Cb 0.49 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3dej h ALA 71 CO 0.04 -0.27 -0.21 0.00 0.00 0.00 0.00 179.25 178.82 3dej h ALA 72 N 1.53 -0.59 -0.44 0.00 0.00 -1.50 -1.22 119.26 117.04 3dej h ALA 72 Ca 0.37 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 55.20 3dej h ALA 72 Cb 0.57 0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.53 3dej h ALA 72 CO -0.42 -0.78 0.07 -0.97 0.00 0.00 0.00 179.25 177.15 3dej h ASN 73 N -0.69 -0.03 0.18 0.00 -0.73 0.00 -1.88 115.58 112.43 3dej h ASN 73 Ca -0.06 0.08 -0.00 0.00 1.87 0.00 0.00 56.30 58.19 3dej h ASN 73 Cb 0.50 0.12 -0.01 0.00 0.27 0.00 0.00 38.32 39.20 3dej h ASN 73 CO 0.10 0.02 -0.14 -0.07 -0.37 0.00 0.00 177.43 176.96 3dej h LEU 74 N 0.20 -0.37 -0.87 0.34 3.38 -0.31 -2.35 115.31 115.32 3dej h LEU 74 Ca 0.22 0.03 0.22 0.00 0.09 0.00 0.00 57.88 58.44 3dej h LEU 74 Cb 0.28 0.12 -0.16 0.00 0.09 0.00 0.00 40.66 41.00 3dej h LEU 74 CO -0.30 -0.23 0.01 -0.09 0.09 0.00 0.00 178.44 177.93 3dej h ARG 75 N -0.34 0.07 -0.05 1.13 2.43 -0.42 0.81 114.38 118.01 3dej h ARG 75 Ca -0.01 -0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 3dej h ARG 75 Cb 0.30 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 3dej h ARG 75 CO -0.02 0.04 -0.11 1.49 -1.51 0.00 0.00 179.97 179.87 3dej h GLU 76 N 0.07 0.16 0.00 0.20 4.22 -1.34 -1.80 114.58 116.08 3dej h GLU 76 Ca 0.50 -0.11 -0.03 0.00 0.08 0.00 0.00 59.36 59.81 3dej h GLU 76 Cb 0.95 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.21 3dej h GLU 76 CO -0.79 0.70 -0.13 1.79 -2.18 0.00 0.00 179.01 178.40 3dej h THR 77 N -0.36 0.83 0.15 0.32 1.35 -0.46 0.15 112.91 114.89 3dej h THR 77 Ca -0.00 -0.49 -0.35 0.00 -0.55 0.00 0.00 66.41 65.01 3dej h THR 77 Cb 0.70 1.29 -0.00 0.00 -1.73 0.00 0.00 68.15 68.41 3dej h THR 77 CO 0.02 0.13 -1.84 -0.26 -0.25 0.00 0.00 175.52 173.32 3dej h PHE 78 N 0.00 0.58 -0.92 4.73 0.04 -0.99 -3.29 116.94 117.09 3dej h PHE 78 Ca -0.00 -0.43 0.12 0.00 2.80 0.00 0.00 57.97 60.47 3dej h PHE 78 Cb 0.28 -0.02 -0.07 0.00 2.20 0.00 0.00 35.95 38.33 3dej h PHE 78 CO 0.00 1.68 0.59 -0.09 -0.60 0.00 0.00 178.31 179.89 3dej h ARG 79 N 0.09 0.81 0.00 1.51 2.43 -1.04 -0.13 114.38 118.05 3dej h ARG 79 Ca -0.37 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.75 3dej h ARG 79 Cb 2.07 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 31.43 3dej h ARG 79 CO 0.14 0.54 0.00 -0.97 -1.51 0.00 0.00 179.97 178.16 3dej h ASN 80 N 0.83 0.00 -0.48 -3.80 -0.73 -0.79 -1.73 115.58 108.89 3dej h ASN 80 Ca 0.45 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.62 3dej h ASN 80 Cb 0.57 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.16 3dej h ASN 80 CO -0.22 0.00 0.00 0.18 -0.37 0.00 0.00 177.43 177.02 3dej n LEU 81 N -2.95 3.44 0.00 0.34 4.77 -0.09 -4.95 117.00 117.56 3dej n LEU 81 Ca -0.02 -1.74 0.00 0.00 -0.03 0.00 0.00 56.01 54.22 3dej n LEU 81 Cb 0.11 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 3dej n LEU 81 CO 0.20 0.81 0.00 0.29 -1.33 0.00 0.00 177.39 177.35 3dej n LYS 82 N 1.31 0.00 -3.26 3.23 5.02 -0.65 -4.98 118.16 118.84 3dej n LYS 82 Ca 0.19 0.17 -0.38 0.00 -2.02 0.00 0.00 58.31 56.27 3dej n LYS 82 Cb 0.56 -3.50 -0.06 0.00 -0.02 0.00 0.00 35.03 32.01 3dej n LYS 82 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3dej s TYR 83 N -2.00 3.76 -1.33 2.13 1.51 -1.02 -3.99 117.35 116.41 3dej s TYR 83 Ca 0.00 1.26 -0.17 0.00 -1.01 0.00 0.00 57.07 57.15 3dej s TYR 83 Cb 0.00 -2.50 0.07 0.00 -0.11 0.00 0.00 41.96 39.42 3dej s TYR 83 CO 0.00 0.53 1.83 -1.91 -1.11 0.00 0.00 175.55 174.89 3dej n GLU 84 N 1.44 3.14 -2.08 -0.62 2.13 -1.14 -4.33 120.64 119.19 3dej n GLU 84 Ca -0.08 -3.17 -0.37 0.00 0.66 0.00 0.00 57.16 54.19 3dej n GLU 84 Cb 0.51 -3.43 0.01 0.00 0.27 0.00 0.00 31.44 28.80 3dej n GLU 84 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 3dej s VAL 85 N 3.88 2.72 -0.02 6.31 1.01 -1.26 -1.97 120.40 131.08 3dej s VAL 85 Ca 0.52 0.53 0.00 0.00 0.00 0.00 0.00 61.98 63.03 3dej s VAL 85 Cb 0.06 -3.26 0.02 0.00 0.00 0.00 0.00 36.38 33.20 3dej s VAL 85 CO 0.04 -0.02 0.01 -0.13 0.00 0.00 0.00 175.10 174.99 3dej s ARG 86 N -2.88 0.12 -0.18 2.72 0.52 -1.10 -4.88 118.95 113.28 3dej s ARG 86 Ca 0.68 0.07 -0.04 0.00 -0.52 0.00 0.00 55.73 55.93 3dej s ARG 86 Cb -0.32 -0.27 -0.02 0.00 0.52 0.00 0.00 34.95 34.85 3dej s ARG 86 CO 0.38 -0.09 -0.03 -0.80 0.02 0.00 0.00 175.30 174.78 3dej s ASN 87 N 0.69 4.70 0.25 0.23 -0.87 -1.26 -1.15 114.94 117.52 3dej s ASN 87 Ca -0.06 -0.21 0.08 0.00 -1.57 0.00 0.00 52.86 51.10 3dej s ASN 87 Cb -0.09 -1.78 -0.04 0.00 -0.02 0.00 0.00 41.25 39.31 3dej s ASN 87 CO -0.02 0.10 0.07 -0.54 -2.57 0.00 0.00 177.10 174.15 3dej s LYS 88 N 0.78 2.56 0.00 -0.60 3.01 -0.25 -4.99 119.74 120.26 3dej s LYS 88 Ca -0.01 -1.23 -0.03 0.00 -1.01 0.00 0.00 55.97 53.69 3dej s LYS 88 Cb -0.14 -2.35 -0.01 0.00 -1.01 0.00 0.00 37.83 34.32 3dej s LYS 88 CO 0.02 0.39 0.06 -0.80 0.51 0.00 0.00 175.35 175.53 3dej s ASN 89 N -3.64 0.09 -1.49 2.83 0.01 -1.26 -2.50 114.94 108.98 3dej s ASN 89 Ca 0.31 -0.24 -0.03 0.00 -0.71 0.00 0.00 52.86 52.20 3dej s ASN 89 Cb -0.07 0.15 0.00 0.00 0.41 0.00 0.00 41.25 41.74 3dej s ASN 89 CO 0.22 -0.26 0.14 0.47 -1.51 0.00 0.00 177.10 176.15 3dej n ASP 90 N 1.88 0.27 -4.85 -1.22 9.92 0.62 -4.91 116.55 118.26 3dej n ASP 90 Ca -0.21 -1.23 -0.32 0.00 -0.53 0.00 0.00 54.79 52.51 3dej n ASP 90 Cb 0.56 -1.89 -0.05 0.00 -0.64 0.00 0.00 41.12 39.11 3dej n ASP 90 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 3dej s LEU 91 N -7.31 3.88 0.82 0.64 1.43 -1.26 -4.83 118.68 112.05 3dej s LEU 91 Ca 0.04 1.35 -0.12 0.00 -1.03 0.00 0.00 54.13 54.37 3dej s LEU 91 Cb -0.02 -4.21 0.10 0.00 0.03 0.00 0.00 46.19 42.08 3dej s LEU 91 CO 0.98 -0.37 1.18 0.42 0.23 0.00 0.00 176.35 178.79 3dej s THR 92 N -2.27 2.03 0.19 5.49 -4.23 -1.26 -1.00 115.64 114.58 3dej s THR 92 Ca 0.55 -0.03 -0.11 0.00 -1.18 0.00 0.00 61.69 60.93 3dej s THR 92 Cb -0.10 -3.00 0.12 0.00 1.34 0.00 0.00 72.50 70.86 3dej s THR 92 CO 0.24 0.00 1.79 0.08 -0.54 0.00 0.00 174.62 176.19 3dej h ARG 93 N -1.09 0.98 -0.37 3.99 0.11 -1.86 -1.42 114.38 114.72 3dej h ARG 93 Ca -0.46 -0.14 -0.12 0.00 0.10 0.00 0.00 59.98 59.37 3dej h ARG 93 Cb 1.31 -0.18 -0.01 0.00 1.11 0.00 0.00 29.97 32.20 3dej h ARG 93 CO 0.61 0.77 -0.26 0.93 0.10 0.00 0.00 179.97 182.13 3dej h GLU 94 N 0.95 0.75 -0.54 0.08 3.07 -1.95 -2.82 114.58 114.11 3dej h GLU 94 Ca 0.24 -0.32 -0.08 0.00 -0.50 0.00 0.00 59.36 58.70 3dej h GLU 94 Cb 0.10 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 27.97 3dej h GLU 94 CO -0.03 0.93 0.00 0.93 -1.40 0.00 0.00 179.01 179.44 3dej h GLU 95 N 0.65 0.92 0.11 2.33 5.08 -1.85 0.41 114.58 122.23 3dej h GLU 95 Ca 0.08 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.17 3dej h GLU 95 Cb 0.77 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.92 3dej h GLU 95 CO 0.06 0.91 -0.05 0.82 -1.00 0.00 0.00 179.01 179.75 3dej h ILE 96 N 0.85 0.97 -0.37 3.13 2.04 -1.23 0.42 117.51 123.33 3dej h ILE 96 Ca 0.16 -0.30 0.06 0.00 1.00 0.00 0.00 64.86 65.78 3dej h ILE 96 Cb 0.50 1.16 -0.06 0.00 -0.74 0.00 0.00 36.82 37.69 3dej h ILE 96 CO 0.02 0.07 0.02 0.58 0.00 0.00 0.00 178.15 178.84 3dej h VAL 97 N -0.29 0.74 -0.40 1.67 2.07 -1.37 -0.14 116.25 118.54 3dej h VAL 97 Ca -0.02 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.49 3dej h VAL 97 Cb 0.23 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 3dej h VAL 97 CO 0.02 0.02 0.22 -0.33 0.02 0.00 0.00 177.57 177.53 3dej h GLU 98 N 0.12 0.43 0.56 1.57 5.08 -0.61 0.20 114.58 121.94 3dej h GLU 98 Ca 0.18 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 3dej h GLU 98 Cb 0.24 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 3dej h GLU 98 CO -0.29 0.29 -0.48 1.25 -1.00 0.00 0.00 179.01 178.79 3dej h LEU 99 N 0.45 -1.28 0.13 1.33 5.85 0.29 -1.86 115.31 120.23 3dej h LEU 99 Ca 0.16 0.10 0.02 0.00 0.84 0.00 0.00 57.88 59.00 3dej h LEU 99 Cb 0.04 0.41 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 3dej h LEU 99 CO -0.09 -0.66 -0.39 0.24 -0.34 0.00 0.00 178.44 177.20 3dej h MET 100 N -1.02 -0.61 -0.95 1.25 2.86 -0.84 0.57 114.93 116.19 3dej h MET 100 Ca -0.07 0.04 0.30 0.00 -2.06 0.00 0.00 59.70 57.91 3dej h MET 100 Cb 0.86 0.14 -0.16 0.00 0.06 0.00 0.00 31.60 32.51 3dej h MET 100 CO -0.02 -0.40 0.36 -0.09 1.06 0.00 0.00 176.91 177.82 3dej h ARG 101 N -0.63 0.18 0.20 1.72 2.43 -0.59 0.11 114.38 117.79 3dej h ARG 101 Ca 0.02 -0.01 -0.31 0.00 -0.81 0.00 0.00 59.98 58.87 3dej h ARG 101 Cb 0.65 -0.04 0.03 0.00 -0.42 0.00 0.00 29.97 30.20 3dej h ARG 101 CO -0.22 0.12 -1.33 -0.44 -1.51 0.00 0.00 179.97 176.58 3dej h ASP 102 N 0.18 0.83 -0.46 -3.80 3.45 -0.66 -2.77 116.42 113.19 3dej h ASP 102 Ca 0.66 -0.89 -0.03 0.00 0.43 0.00 0.00 57.03 57.21 3dej h ASP 102 Cb 1.49 -0.27 -0.02 0.00 -0.56 0.00 0.00 39.33 39.97 3dej h ASP 102 CO -0.70 1.65 0.21 0.58 -1.57 0.00 0.00 179.24 179.41 3dej h VAL 103 N 0.14 1.19 0.00 -1.35 2.07 0.03 -1.28 116.25 117.04 3dej h VAL 103 Ca -0.22 -0.58 -0.04 0.00 0.82 0.00 0.00 66.70 66.68 3dej h VAL 103 Cb 2.03 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 3dej h VAL 103 CO 0.25 0.23 -0.19 0.77 0.02 0.00 0.00 177.57 178.65 3dej h SER 104 N 0.72 0.00 1.78 0.57 4.64 -0.90 -3.00 113.55 117.36 3dej h SER 104 Ca 0.18 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.48 3dej h SER 104 Cb 0.14 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 3dej h SER 104 CO -0.02 0.19 -0.08 0.11 -0.87 0.00 0.00 176.83 176.16 3dej h LYS 105 N 0.00 0.00 0.00 4.77 1.79 -0.95 -3.44 116.57 118.73 3dej h LYS 105 Ca -0.00 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.31 3dej h LYS 105 Cb 0.87 0.00 0.09 0.00 -1.58 0.00 0.00 32.23 31.61 3dej h LYS 105 CO 0.02 0.08 -0.07 0.39 -1.08 0.00 0.00 179.45 178.80 3dej n GLU 106 N -3.13 -3.16 -4.05 3.15 1.02 -0.86 -5.02 120.64 108.58 3dej n GLU 106 Ca 0.03 -0.64 -0.33 0.00 -0.02 0.00 0.00 57.16 56.21 3dej n GLU 106 Cb 0.53 -0.81 -0.15 0.00 -0.02 0.00 0.00 31.44 30.99 3dej n GLU 106 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3dej s ASP 107 N -2.49 4.25 -0.15 1.62 2.15 -1.26 -4.92 116.67 115.87 3dej s ASP 107 Ca 0.29 -1.22 0.16 0.00 0.43 0.00 0.00 52.55 52.22 3dej s ASP 107 Cb -0.05 -1.56 0.67 0.00 -0.30 0.00 0.00 42.92 41.68 3dej s ASP 107 CO 0.24 -0.16 1.58 1.41 -0.17 0.00 0.00 175.17 178.08 3dej n HIS 108 N 4.50 1.43 -0.32 -5.34 8.25 -1.26 -4.58 115.22 117.90 3dej n HIS 108 Ca -0.15 -0.69 0.11 0.00 -0.26 0.00 0.00 57.72 56.72 3dej n HIS 108 Cb 0.44 -0.31 0.28 0.00 1.12 0.00 0.00 29.99 31.52 3dej n HIS 108 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 3dej h SER 109 N 3.39 0.61 1.57 0.41 0.02 -1.95 0.14 113.55 117.74 3dej h SER 109 Ca 0.00 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 3dej h SER 109 Cb 1.52 0.01 0.00 0.00 0.14 0.00 0.00 62.40 64.07 3dej h SER 109 CO 0.28 0.21 -0.20 0.11 -1.14 0.00 0.00 176.83 176.08 3dej h LYS 110 N 0.65 0.00 -6.18 3.45 1.79 -1.92 -3.46 116.57 110.90 3dej h LYS 110 Ca 0.53 0.00 -0.58 0.00 -2.18 0.00 0.00 60.65 58.42 3dej h LYS 110 Cb 0.83 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.43 3dej h LYS 110 CO -0.40 0.00 -0.05 1.03 -1.08 0.00 0.00 179.45 178.95 3dej s ARG 111 N -3.19 4.20 0.15 3.15 0.52 0.04 -2.12 118.95 121.70 3dej s ARG 111 Ca 0.07 0.70 0.07 0.00 -0.52 0.00 0.00 55.73 56.05 3dej s ARG 111 Cb 0.09 -3.26 -0.09 0.00 0.52 0.00 0.00 34.95 32.21 3dej s ARG 111 CO 0.67 0.59 1.35 1.03 0.02 0.00 0.00 175.30 178.96 3dej h SER 112 N 4.78 0.02 -0.22 0.23 0.87 -1.43 -3.46 113.55 114.35 3dej h SER 112 Ca -0.49 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 3dej h SER 112 Cb 1.21 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 3dej h SER 112 CO 0.64 0.93 0.00 -1.54 -0.53 0.00 0.00 176.83 176.34 3dej n SER 113 N -3.46 0.00 -3.69 6.23 3.41 -0.67 -4.56 113.62 110.88 3dej n SER 113 Ca -0.01 -0.20 -0.13 0.00 -0.26 0.00 0.00 58.87 58.27 3dej n SER 113 Cb 0.87 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.73 3dej n SER 113 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3dej s PHE 114 N -3.93 -0.62 -0.03 7.33 5.36 -1.14 -4.31 117.98 120.63 3dej s PHE 114 Ca 0.00 1.49 0.01 0.00 -0.96 0.00 0.00 56.93 57.47 3dej s PHE 114 Cb 0.00 0.23 0.02 0.00 -0.34 0.00 0.00 43.02 42.93 3dej s PHE 114 CO 0.00 -0.30 -0.03 0.08 -1.46 0.00 0.00 175.22 173.50 3dej s VAL 115 N 0.43 0.40 -0.12 3.12 1.01 -1.16 -0.38 120.40 123.70 3dej s VAL 115 Ca -0.01 -0.08 -0.03 0.00 0.00 0.00 0.00 61.98 61.86 3dej s VAL 115 Cb -0.04 -0.43 0.05 0.00 0.00 0.00 0.00 36.38 35.96 3dej s VAL 115 CO -0.01 0.18 0.06 0.00 0.00 0.00 0.00 175.10 175.32 3dej s VAL 117 N 2.09 4.25 -0.19 0.00 1.01 -0.58 -1.57 120.40 125.41 3dej s VAL 117 Ca 0.03 -0.22 -0.05 0.00 0.00 0.00 0.00 61.98 61.74 3dej s VAL 117 Cb -0.14 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.30 3dej s VAL 117 CO -0.06 0.44 -0.00 -0.76 0.00 0.00 0.00 175.10 174.71 3dej s LEU 118 N 0.74 3.29 -0.22 3.92 1.43 0.23 -1.66 118.68 126.41 3dej s LEU 118 Ca 0.01 -0.17 0.01 0.00 -1.03 0.00 0.00 54.13 52.95 3dej s LEU 118 Cb -0.14 -1.83 0.05 0.00 0.03 0.00 0.00 46.19 44.31 3dej s LEU 118 CO 0.02 0.09 -0.09 -0.76 0.23 0.00 0.00 176.35 175.84 3dej s LEU 119 N 0.85 2.64 0.00 1.79 1.43 -0.91 0.08 118.68 124.56 3dej s LEU 119 Ca 0.01 -1.10 -0.06 0.00 -1.03 0.00 0.00 54.13 51.94 3dej s LEU 119 Cb -0.14 -1.29 0.02 0.00 0.03 0.00 0.00 46.19 44.81 3dej s LEU 119 CO 0.02 -0.18 0.31 -0.24 0.23 0.00 0.00 176.35 176.48 3dej n SER 120 N 4.62 -0.46 -4.79 2.29 2.88 -0.88 -1.81 113.62 115.47 3dej n SER 120 Ca -0.14 -1.22 -0.39 0.00 -1.33 0.00 0.00 58.87 55.80 3dej n SER 120 Cb 0.45 0.74 -0.06 0.00 -0.75 0.00 0.00 64.21 64.59 3dej n SER 120 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 3dej s HIS 121 N -4.47 3.74 0.07 0.66 3.76 -1.26 -4.20 115.29 113.59 3dej s HIS 121 Ca 0.07 1.22 -0.11 0.00 -0.15 0.00 0.00 55.06 56.09 3dej s HIS 121 Cb -0.01 -2.54 0.01 0.00 1.11 0.00 0.00 32.58 31.15 3dej s HIS 121 CO 0.01 0.47 0.25 0.20 -0.85 0.00 0.00 174.74 174.83 3dej s GLY 122 N -0.65 -0.03 0.19 -2.22 0.00 -1.26 0.94 107.32 104.28 3dej s GLY 122 Ca 0.30 -0.28 0.01 0.00 0.00 0.00 0.00 44.72 44.75 3dej s GLY 122 CO 0.18 -0.48 0.10 1.18 0.00 0.00 0.00 173.10 174.08 3dej n GLU 123 N 0.29 1.32 -1.83 2.90 1.02 -1.05 -4.23 120.64 119.07 3dej n GLU 123 Ca -0.17 -1.21 -0.42 0.00 -0.02 0.00 0.00 57.16 55.33 3dej n GLU 123 Cb 0.61 0.19 -0.03 0.00 -0.02 0.00 0.00 31.44 32.19 3dej n GLU 123 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 3dej s GLU 124 N -2.73 3.90 -0.03 3.49 2.56 -1.07 -1.79 118.70 123.03 3dej s GLU 124 Ca 0.07 2.21 0.00 0.00 0.00 0.00 0.00 54.97 57.26 3dej s GLU 124 Cb -0.01 -4.13 0.00 0.00 2.00 0.00 0.00 34.13 31.99 3dej s GLU 124 CO 0.05 -1.20 0.00 0.41 -0.56 0.00 0.00 175.26 173.96 3dej n GLY 125 N 4.68 0.41 2.97 -1.50 0.00 -1.26 -5.02 105.19 105.46 3dej n GLY 125 Ca 0.21 -0.05 -0.12 0.00 0.00 0.00 0.00 46.02 46.05 3dej n GLY 125 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3dej s ILE 126 N -1.81 0.26 0.16 -0.61 -4.36 -0.74 -1.33 121.20 112.77 3dej s ILE 126 Ca 0.00 -0.56 0.09 0.00 -0.26 0.00 0.00 60.65 59.92 3dej s ILE 126 Cb 0.00 -0.30 -0.04 0.00 1.25 0.00 0.00 42.46 43.36 3dej s ILE 126 CO 0.00 -0.20 -0.13 0.27 0.24 0.00 0.00 174.94 175.12 3dej s ILE 127 N -0.76 3.03 -0.17 8.37 -0.00 -0.83 -2.51 121.20 128.33 3dej s ILE 127 Ca -0.06 -1.63 -0.15 0.00 -0.00 0.00 0.00 60.65 58.81 3dej s ILE 127 Cb -0.06 -2.46 -0.04 0.00 -0.00 0.00 0.00 42.46 39.90 3dej s ILE 127 CO -0.00 -0.04 0.33 -0.36 -0.00 0.00 0.00 174.94 174.87 3dej s PHE 128 N -1.53 3.44 0.81 1.37 0.08 0.27 -1.03 117.98 121.38 3dej s PHE 128 Ca 0.22 0.61 -0.14 0.00 0.12 0.00 0.00 56.93 57.75 3dej s PHE 128 Cb -0.09 -2.41 0.20 0.00 -0.57 0.00 0.00 43.02 40.15 3dej s PHE 128 CO 0.13 0.16 0.84 0.41 -0.10 0.00 0.00 175.22 176.67 3dej n GLY 129 N 3.55 -2.20 0.18 4.36 0.00 0.13 -4.51 105.19 106.70 3dej n GLY 129 Ca -0.11 -1.56 -0.12 0.00 0.00 0.00 0.00 46.02 44.23 3dej n GLY 129 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3dej h THR 130 N -2.07 1.37 0.14 2.61 1.35 -1.32 -3.34 112.91 111.65 3dej h THR 130 Ca -0.30 -2.21 -0.36 0.00 -0.55 0.00 0.00 66.41 62.99 3dej h THR 130 Cb 0.88 2.18 -0.01 0.00 -1.73 0.00 0.00 68.15 69.47 3dej h THR 130 CO 0.20 0.67 -1.96 -0.55 -0.25 0.00 0.00 175.52 173.63 3dej h ASN 131 N 0.29 0.45 -1.47 5.36 -1.07 -1.91 -3.00 115.58 114.22 3dej h ASN 131 Ca -0.05 -0.95 -0.01 0.00 0.07 0.00 0.00 56.30 55.36 3dej h ASN 131 Cb 1.40 -0.15 -0.00 0.00 -2.07 0.00 0.00 38.32 37.50 3dej h ASN 131 CO 0.14 1.85 0.00 0.61 0.07 0.00 0.00 177.43 180.10 3dej n GLY 132 N 1.97 2.52 3.88 9.14 0.00 -1.26 -4.64 105.19 116.81 3dej n GLY 132 Ca -0.31 -1.22 -0.30 0.00 0.00 0.00 0.00 46.02 44.18 3dej n GLY 132 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3dej s PRO 133 N -2.04 3.79 -0.04 1.61 0.04 -1.26 0.19 135.00 137.29 3dej s PRO 133 Ca 0.02 0.42 0.01 0.00 0.04 0.00 0.00 61.00 61.49 3dej s PRO 133 Cb -0.00 -2.45 0.02 0.00 0.04 0.00 0.00 34.50 32.11 3dej s PRO 133 CO 0.01 0.05 -0.05 0.08 0.04 0.00 0.00 177.00 177.13 3dej s VAL 134 N -2.24 0.55 0.01 -0.36 1.01 -0.20 -4.83 120.40 114.34 3dej s VAL 134 Ca 0.50 -0.15 -0.30 0.00 0.00 0.00 0.00 61.98 62.03 3dej s VAL 134 Cb -0.10 -0.55 -0.07 0.00 0.00 0.00 0.00 36.38 35.66 3dej s VAL 134 CO 0.29 0.22 1.58 -1.81 0.00 0.00 0.00 175.10 175.37 3dej s ASP 135 N 0.75 6.69 0.33 3.32 -0.00 -1.26 -1.97 116.67 124.53 3dej s ASP 135 Ca -0.10 2.31 0.13 0.00 -0.00 0.00 0.00 52.55 54.88 3dej s ASP 135 Cb -0.13 -2.55 1.00 0.00 -0.00 0.00 0.00 42.92 41.23 3dej s ASP 135 CO 0.00 -0.85 1.70 -0.07 -0.00 0.00 0.00 175.17 175.95 3dej h LEU 136 N 8.95 0.59 -1.74 1.23 3.38 -1.56 0.20 115.31 126.37 3dej h LEU 136 Ca -0.40 0.16 0.04 0.00 0.09 0.00 0.00 57.88 57.77 3dej h LEU 136 Cb 1.19 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 42.00 3dej h LEU 136 CO 0.93 -0.01 0.25 0.50 0.09 0.00 0.00 178.44 180.19 3dej h LYS 137 N 0.45 0.33 -0.64 1.13 1.63 -1.91 0.21 116.57 117.77 3dej h LYS 137 Ca 0.69 -0.02 -0.09 0.00 -0.85 0.00 0.00 60.65 60.38 3dej h LYS 137 Cb 1.47 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 33.00 3dej h LYS 137 CO -0.53 0.22 0.05 -0.22 -3.45 0.00 0.00 179.45 175.52 3dej h LYS 138 N 0.34 1.09 0.08 1.90 1.63 -0.97 -2.42 116.57 118.21 3dej h LYS 138 Ca 0.15 -0.32 -0.30 0.00 -0.85 0.00 0.00 60.65 59.33 3dej h LYS 138 Cb 0.18 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.68 3dej h LYS 138 CO -0.03 1.03 -1.60 0.97 -3.45 0.00 0.00 179.45 176.36 3dej h ILE 139 N 1.00 1.04 0.00 2.00 2.10 -1.11 -3.30 117.51 119.24 3dej h ILE 139 Ca 0.19 -2.75 -0.05 0.00 1.08 0.00 0.00 64.86 63.32 3dej h ILE 139 Cb 0.51 2.64 -0.01 0.00 -1.09 0.00 0.00 36.82 38.87 3dej h ILE 139 CO 0.02 0.76 -0.23 0.71 -1.08 0.00 0.00 178.15 178.32 3dej h THR 140 N 0.05 0.52 0.00 2.19 1.35 -0.74 -3.17 112.91 113.10 3dej h THR 140 Ca -0.26 -1.23 -0.03 0.00 -0.55 0.00 0.00 66.41 64.34 3dej h THR 140 Cb 2.00 1.86 -0.00 0.00 -1.73 0.00 0.00 68.15 70.28 3dej h THR 140 CO 0.13 0.23 -0.14 0.78 -0.25 0.00 0.00 175.52 176.27 3dej h ASN 141 N 0.00 0.00 0.26 5.36 2.35 -1.51 -2.77 115.58 119.27 3dej h ASN 141 Ca -0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 3dej h ASN 141 Cb 0.84 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.21 3dej h ASN 141 CO 0.03 0.14 -0.07 -0.26 -1.65 0.00 0.00 177.43 175.62 3dej h PHE 142 N 0.00 0.00 -0.22 1.19 0.04 -1.67 -2.63 116.94 113.66 3dej h PHE 142 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3dej h PHE 142 Cb 0.64 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.79 3dej h PHE 142 CO 0.00 0.07 0.00 1.19 -0.60 0.00 0.00 178.31 178.97 3dej n PHE 143 N -3.62 0.27 -1.82 -0.55 3.72 -1.05 -4.15 117.46 110.27 3dej n PHE 143 Ca -0.02 -0.19 -0.42 0.00 -0.05 0.00 0.00 57.45 56.77 3dej n PHE 143 Cb 0.18 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.69 3dej n PHE 143 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3dej s ARG 144 N -1.29 4.16 0.00 -1.08 0.52 -0.99 -4.51 118.95 115.76 3dej s ARG 144 Ca 0.26 2.43 0.00 0.00 -0.52 0.00 0.00 55.73 57.90 3dej s ARG 144 Cb 0.16 -4.04 0.00 0.00 0.52 0.00 0.00 34.95 31.59 3dej s ARG 144 CO 0.23 -0.90 0.00 0.41 0.02 0.00 0.00 175.30 175.06 3dej n GLY 145 N 4.34 0.00 0.00 -3.53 0.00 -1.19 0.62 105.19 105.43 3dej n GLY 145 Ca 0.19 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.27 3dej n GLY 145 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dej n ASP 146 N -2.42 0.00 0.00 1.61 5.75 -1.26 -2.88 116.55 117.34 3dej n ASP 146 Ca 0.00 -0.65 0.00 0.00 -0.01 0.00 0.00 54.79 54.13 3dej n ASP 146 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 3dej n ASP 146 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 3dej n ARG 147 N -0.89 2.52 -3.46 0.11 0.63 0.20 -4.84 116.66 110.93 3dej n ARG 147 Ca 0.10 0.00 -0.26 0.00 -0.92 0.00 0.00 57.85 56.77 3dej n ARG 147 Cb 0.05 -0.75 -0.09 0.00 0.45 0.00 0.00 32.46 32.12 3dej n ARG 147 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3dej h ARG 149 N 4.76 0.22 0.00 0.00 3.08 -1.88 -0.56 114.38 120.00 3dej h ARG 149 Ca 0.17 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.21 3dej h ARG 149 Cb 0.80 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.80 3dej h ARG 149 CO 0.59 0.15 0.00 -1.13 -1.07 0.00 0.00 179.97 178.51 3dej n SER 150 N -4.45 0.26 -0.25 7.04 3.41 -1.26 -2.41 113.62 115.96 3dej n SER 150 Ca 0.09 0.57 0.03 0.00 -0.26 0.00 0.00 58.87 59.30 3dej n SER 150 Cb 0.44 -0.62 0.02 0.00 -0.26 0.00 0.00 64.21 63.79 3dej n SER 150 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3dej n LEU 151 N -1.79 1.49 -4.62 1.04 4.77 -0.23 -4.12 117.00 113.52 3dej n LEU 151 Ca 0.02 -0.97 -0.50 0.00 -0.03 0.00 0.00 56.01 54.53 3dej n LEU 151 Cb 0.16 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.20 3dej n LEU 151 CO 0.14 0.31 1.03 0.41 -1.33 0.00 0.00 177.39 177.94 3dej n THR 152 N 0.29 0.01 -0.15 -5.08 -1.04 -1.01 -1.37 114.28 105.93 3dej n THR 152 Ca 0.04 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 3dej n THR 152 Cb 0.16 -1.12 0.00 0.00 -1.82 0.00 0.00 70.33 67.56 3dej n THR 152 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3dej n GLY 153 N 2.91 1.74 3.56 3.41 0.00 -1.26 -5.02 105.19 110.52 3dej n GLY 153 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 3dej n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dej s LYS 154 N -0.34 2.64 -0.07 1.61 1.02 -0.47 -4.98 119.74 119.16 3dej s LYS 154 Ca 0.00 -0.62 -0.30 0.00 0.02 0.00 0.00 55.97 55.07 3dej s LYS 154 Cb 0.00 -2.52 -0.06 0.00 -0.52 0.00 0.00 37.83 34.73 3dej s LYS 154 CO 0.00 0.64 1.78 -1.25 -0.92 0.00 0.00 175.35 175.60 3dej s PRO 155 N -0.95 4.02 -0.51 -1.68 0.04 -1.26 -4.87 135.00 129.80 3dej s PRO 155 Ca 0.13 2.21 -0.15 0.00 0.04 0.00 0.00 61.00 63.23 3dej s PRO 155 Cb -0.11 -4.07 0.11 0.00 0.04 0.00 0.00 34.50 30.47 3dej s PRO 155 CO 0.03 -1.05 0.45 0.15 0.04 0.00 0.00 177.00 176.62 3dej s LYS 156 N 4.44 2.92 -0.17 4.56 3.01 0.49 -2.88 119.74 132.11 3dej s LYS 156 Ca 0.79 -1.62 -0.16 0.00 -1.01 0.00 0.00 55.97 53.97 3dej s LYS 156 Cb -0.34 -4.20 -0.04 0.00 -1.01 0.00 0.00 37.83 32.24 3dej s LYS 156 CO 0.33 -1.23 0.41 -0.51 0.51 0.00 0.00 175.35 174.87 3dej s LEU 157 N 1.58 4.20 -0.17 3.17 1.43 0.48 -2.17 118.68 127.20 3dej s LEU 157 Ca 0.04 0.61 0.01 0.00 -1.03 0.00 0.00 54.13 53.75 3dej s LEU 157 Cb -0.28 -2.56 0.01 0.00 0.03 0.00 0.00 46.19 43.39 3dej s LEU 157 CO 0.03 -0.04 -0.18 -0.36 0.23 0.00 0.00 176.35 176.03 3dej s PHE 158 N 1.03 2.77 -0.27 0.29 0.40 -0.09 -0.66 117.98 121.46 3dej s PHE 158 Ca 0.21 -1.43 -0.03 0.00 -0.60 0.00 0.00 56.93 55.09 3dej s PHE 158 Cb -0.15 -1.91 0.03 0.00 0.51 0.00 0.00 43.02 41.50 3dej s PHE 158 CO 0.08 -0.69 -0.02 0.42 0.70 0.00 0.00 175.22 175.71 3dej s ILE 159 N 1.14 3.11 -0.31 0.64 1.01 -0.61 -1.23 121.20 124.95 3dej s ILE 159 Ca 0.01 -1.05 -0.07 0.00 0.00 0.00 0.00 60.65 59.54 3dej s ILE 159 Cb -0.14 -2.64 0.02 0.00 0.01 0.00 0.00 42.46 39.71 3dej s ILE 159 CO -0.08 0.10 0.09 -0.63 0.00 0.00 0.00 174.94 174.43 3dej s ILE 160 N 1.34 3.96 -0.71 2.92 1.09 -0.88 -0.60 121.20 128.32 3dej s ILE 160 Ca -0.01 -0.80 -0.05 0.00 -1.10 0.00 0.00 60.65 58.69 3dej s ILE 160 Cb -0.17 -3.10 0.18 0.00 -1.06 0.00 0.00 42.46 38.31 3dej s ILE 160 CO -0.02 -0.00 0.56 -1.58 -0.10 0.00 0.00 174.94 173.80 3dej s GLN 161 N 1.48 2.91 0.00 2.79 2.00 0.11 -1.59 119.66 127.37 3dej s GLN 161 Ca 0.02 -2.62 0.00 0.00 -2.00 0.00 0.00 55.36 50.75 3dej s GLN 161 Cb -0.18 -3.93 0.00 0.00 0.80 0.00 0.00 33.01 29.71 3dej s GLN 161 CO 0.03 -1.21 0.00 0.00 -0.50 0.00 0.00 175.29 173.61 3dej n ALA 162 N 3.43 0.00 -0.97 1.58 0.00 -1.26 -2.06 120.51 121.23 3dej n ALA 162 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 3dej n ALA 162 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.85 3dej n ALA 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3dej n ARG 164 N 0.00 0.00 0.00 0.00 1.74 -0.02 -4.60 116.66 113.78 3dej n ARG 164 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3dej n ARG 164 Cb 0.00 -0.06 0.00 0.00 -1.02 0.00 0.00 32.46 31.38 3dej n ARG 164 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dej n GLY 165 N 0.00 -0.98 0.36 -0.13 0.00 -0.36 -2.60 105.19 101.48 3dej n GLY 165 Ca 0.00 -1.22 0.08 0.00 0.00 0.00 0.00 46.02 44.88 3dej n GLY 165 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3dej n THR 166 N -0.67 0.17 -2.51 2.61 -2.24 -1.22 -0.46 114.28 109.96 3dej n THR 166 Ca 0.00 -0.24 -0.41 0.00 -2.27 0.00 0.00 64.05 61.14 3dej n THR 166 Cb 0.00 0.13 -0.04 0.00 -2.10 0.00 0.00 70.33 68.32 3dej n THR 166 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3dej s GLU 167 N -1.83 4.60 -0.13 -0.78 0.41 -0.89 -4.61 118.70 115.47 3dej s GLU 167 Ca 0.26 1.72 -0.03 0.00 -0.41 0.00 0.00 54.97 56.52 3dej s GLU 167 Cb 0.14 -3.27 -0.03 0.00 -1.78 0.00 0.00 34.13 29.18 3dej s GLU 167 CO 0.21 0.08 -0.04 -0.51 -0.49 0.00 0.00 175.26 174.51 3dej s LEU 168 N -0.44 3.29 -0.31 1.80 1.43 -1.26 -0.13 118.68 123.06 3dej s LEU 168 Ca 0.49 -0.07 -0.26 0.00 -1.03 0.00 0.00 54.13 53.26 3dej s LEU 168 Cb -0.30 -1.77 0.01 0.00 0.03 0.00 0.00 46.19 44.16 3dej s LEU 168 CO 0.35 0.23 0.91 -0.62 0.23 0.00 0.00 176.35 177.45 3dej s ASP 169 N -0.03 6.78 0.28 2.29 -1.08 -1.26 -4.94 116.67 118.71 3dej s ASP 169 Ca 0.01 0.83 0.07 0.00 -0.52 0.00 0.00 52.55 52.94 3dej s ASP 169 Cb -0.13 -2.46 0.39 0.00 -1.46 0.00 0.00 42.92 39.25 3dej s ASP 169 CO 0.03 -0.72 1.64 0.00 0.52 0.00 0.00 175.17 176.64 3dej n GLY 171 N 0.05 -1.51 2.01 0.00 0.00 -1.26 -4.62 105.19 99.86 3dej n GLY 171 Ca -0.02 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.49 3dej n GLY 171 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3dej n ILE 172 N -1.56 0.00 0.00 -0.61 0.00 -1.26 -5.10 119.36 110.83 3dej n ILE 172 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 62.75 62.75 3dej n ILE 172 Cb 0.02 -0.48 0.00 0.00 0.00 0.00 0.00 39.64 39.18 3dej n ILE 172 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 176.55 178.12 3dej n HIS 185 N -3.06 0.00 -4.27 9.51 -0.00 -1.26 -5.27 115.22 110.87 3dej n HIS 185 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.72 57.53 3dej n HIS 185 Cb 0.00 -0.02 -0.11 0.00 -0.00 0.00 0.00 29.99 29.86 3dej n HIS 185 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.34 176.49 3dej s LYS 186 N -0.16 1.11 0.11 1.57 1.02 -1.26 -5.16 119.74 116.97 3dej s LYS 186 Ca 0.00 -1.31 0.03 0.00 0.02 0.00 0.00 55.97 54.71 3dej s LYS 186 Cb 0.00 -1.02 -0.04 0.00 -0.52 0.00 0.00 37.83 36.25 3dej s LYS 186 CO 0.00 0.20 -0.09 0.96 -0.92 0.00 0.00 175.35 175.49 3dej s ILE 187 N -2.20 0.94 0.28 2.17 -4.36 -1.26 -5.13 121.20 111.64 3dej s ILE 187 Ca 0.12 -1.76 -0.29 0.00 -0.26 0.00 0.00 60.65 58.45 3dej s ILE 187 Cb -0.05 -1.50 -0.10 0.00 1.25 0.00 0.00 42.46 42.07 3dej s ILE 187 CO 0.04 -0.65 1.37 -2.84 0.24 0.00 0.00 174.94 173.11 3dej s PRO 188 N -3.13 4.31 0.51 0.37 0.02 -1.26 -4.88 135.00 130.94 3dej s PRO 188 Ca 0.08 2.25 0.35 0.00 0.02 0.00 0.00 61.00 63.70 3dej s PRO 188 Cb -0.01 -3.10 1.81 0.00 0.02 0.00 0.00 34.50 33.23 3dej s PRO 188 CO -0.01 -0.31 2.06 -0.39 -0.33 0.00 0.00 177.00 178.02 3dej h VAL 189 N 3.34 0.00 -0.01 3.83 -1.51 -1.99 -1.78 116.25 118.13 3dej h VAL 189 Ca -0.47 -0.07 0.00 0.00 -1.23 0.00 0.00 66.70 64.93 3dej h VAL 189 Cb 1.22 0.88 0.00 0.00 -2.13 0.00 0.00 31.29 31.26 3dej h VAL 189 CO 0.72 0.00 -0.45 0.47 -1.23 0.00 0.00 177.57 177.09 3dej n ASP 190 N -2.75 1.18 -4.77 4.19 8.00 -1.26 -3.19 116.55 117.95 3dej n ASP 190 Ca -0.02 -0.94 -0.33 0.00 0.71 0.00 0.00 54.79 54.21 3dej n ASP 190 Cb 0.09 0.35 0.06 0.00 -0.02 0.00 0.00 41.12 41.60 3dej n ASP 190 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dej s ALA 191 N -2.65 2.39 -0.76 2.24 0.00 -0.67 -4.09 121.76 118.22 3dej s ALA 191 Ca 0.18 0.49 -0.01 0.00 0.00 0.00 0.00 51.96 52.63 3dej s ALA 191 Cb 0.18 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.99 3dej s ALA 191 CO 0.61 -1.43 0.10 -0.25 0.00 0.00 0.00 175.76 174.79 3dej n ASP 192 N -2.72 -3.34 -4.34 0.00 8.00 -0.30 -4.87 116.55 108.98 3dej n ASP 192 Ca 0.10 -0.05 -0.32 0.00 0.71 0.00 0.00 54.79 55.23 3dej n ASP 192 Cb 0.52 -2.48 -0.15 0.00 -0.02 0.00 0.00 41.12 38.99 3dej n ASP 192 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3dej s PHE 193 N -2.60 2.56 -0.06 1.24 0.08 -1.25 -0.38 117.98 117.58 3dej s PHE 193 Ca 0.05 -0.53 0.04 0.00 0.12 0.00 0.00 56.93 56.60 3dej s PHE 193 Cb -0.02 -1.64 0.00 0.00 -0.57 0.00 0.00 43.02 40.79 3dej s PHE 193 CO 0.06 -0.09 -0.16 -1.17 -0.10 0.00 0.00 175.22 173.76 3dej s LEU 194 N -0.27 1.84 -0.26 -0.37 0.20 -0.92 0.23 118.68 119.13 3dej s LEU 194 Ca 0.00 -0.35 0.03 0.00 0.69 0.00 0.00 54.13 54.50 3dej s LEU 194 Cb -0.13 -0.95 0.06 0.00 -0.43 0.00 0.00 46.19 44.74 3dej s LEU 194 CO 0.03 0.11 -0.11 -0.31 -0.29 0.00 0.00 176.35 175.78 3dej s TYR 195 N 0.28 3.21 -0.80 5.38 1.51 0.86 -0.91 117.35 126.88 3dej s TYR 195 Ca -0.09 -2.27 -0.13 0.00 -1.01 0.00 0.00 57.07 53.57 3dej s TYR 195 Cb -0.13 -1.91 0.21 0.00 -0.11 0.00 0.00 41.96 40.01 3dej s TYR 195 CO 0.03 -0.87 0.73 0.00 -1.11 0.00 0.00 175.55 174.33 3dej s ALA 196 N 1.12 4.02 0.33 3.71 0.00 -0.36 -0.22 121.76 130.37 3dej s ALA 196 Ca -0.08 -3.29 -0.24 0.00 0.00 0.00 0.00 51.96 48.35 3dej s ALA 196 Cb -0.20 -3.42 -0.10 0.00 0.00 0.00 0.00 23.12 19.40 3dej s ALA 196 CO -0.05 -2.25 0.91 0.71 0.00 0.00 0.00 175.76 175.07 3dej s TYR 197 N 0.18 3.58 0.21 0.00 2.02 -0.69 -2.08 117.35 120.57 3dej s TYR 197 Ca 0.17 1.67 -0.05 0.00 -0.37 0.00 0.00 57.07 58.49 3dej s TYR 197 Cb -0.12 -2.85 0.17 0.00 -0.40 0.00 0.00 41.96 38.76 3dej s TYR 197 CO -0.08 0.15 1.62 0.66 -1.57 0.00 0.00 175.55 176.32 3dej h SER 198 N 2.87 0.80 -4.00 2.29 4.64 -1.59 -2.44 113.55 116.11 3dej h SER 198 Ca -0.47 -0.30 -0.36 0.00 -0.47 0.00 0.00 61.79 60.19 3dej h SER 198 Cb 1.19 -0.22 -0.14 0.00 -0.31 0.00 0.00 62.40 62.91 3dej h SER 198 CO 0.64 1.01 -0.65 -0.89 -0.87 0.00 0.00 176.83 176.06 3dej s THR 199 N -4.58 0.95 0.90 2.95 2.01 -1.26 -3.29 115.64 113.32 3dej s THR 199 Ca -0.09 -2.02 -0.11 0.00 0.31 0.00 0.00 61.69 59.77 3dej s THR 199 Cb 0.13 -2.33 0.11 0.00 0.01 0.00 0.00 72.50 70.42 3dej s THR 199 CO 0.84 -0.32 1.03 0.00 -0.69 0.00 0.00 174.62 175.47 3dej n ALA 200 N -0.40 -0.95 -1.70 7.40 0.00 -0.43 -4.19 120.51 120.23 3dej n ALA 200 Ca -0.05 -0.51 -0.43 0.00 0.00 0.00 0.00 53.44 52.45 3dej n ALA 200 Cb 0.64 -2.14 -0.03 0.00 0.00 0.00 0.00 19.45 17.92 3dej n ALA 200 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3dej n PRO 201 N -3.55 2.56 -0.06 0.00 -0.02 -1.26 -2.52 135.00 130.15 3dej n PRO 201 Ca 0.11 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.52 3dej n PRO 201 Cb 0.52 -2.74 0.00 0.00 -0.02 0.00 0.00 33.50 31.26 3dej n PRO 201 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dej n GLY 202 N 3.72 1.49 3.92 -1.23 0.00 -1.14 -4.98 105.19 106.99 3dej n GLY 202 Ca 0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.90 3dej n GLY 202 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dej s TYR 203 N -2.59 3.48 0.52 1.61 1.51 -1.05 -2.10 117.35 118.74 3dej s TYR 203 Ca 0.00 0.37 -0.21 0.00 -1.01 0.00 0.00 57.07 56.21 3dej s TYR 203 Cb 0.00 -1.87 -0.06 0.00 -0.11 0.00 0.00 41.96 39.92 3dej s TYR 203 CO 0.00 0.38 1.20 -0.47 -1.11 0.00 0.00 175.55 175.56 3dej s TYR 204 N -1.84 2.63 -0.23 2.71 5.04 0.81 -0.84 117.35 125.63 3dej s TYR 204 Ca 0.39 1.50 -0.06 0.00 -2.44 0.00 0.00 57.07 56.46 3dej s TYR 204 Cb -0.11 -3.46 -0.02 0.00 0.35 0.00 0.00 41.96 38.72 3dej s TYR 204 CO 0.29 -1.91 0.02 0.45 -1.34 0.00 0.00 175.55 173.05 3dej s SER 205 N -1.41 4.77 -0.43 4.32 0.15 -1.26 -4.86 113.70 114.99 3dej s SER 205 Ca 0.69 -0.28 -0.28 0.00 0.70 0.00 0.00 55.95 56.78 3dej s SER 205 Cb -0.30 -1.84 0.02 0.00 -1.71 0.00 0.00 66.02 62.19 3dej s SER 205 CO 0.35 -0.02 1.06 0.26 1.20 0.00 0.00 173.24 176.09 3dej s TRP 206 N 1.52 2.93 0.02 3.44 0.52 -1.26 -5.03 118.94 121.08 3dej s TRP 206 Ca 0.06 0.76 0.04 0.00 0.02 0.00 0.00 56.10 56.99 3dej s TRP 206 Cb -0.15 -4.11 -0.03 0.00 -1.15 0.00 0.00 33.47 28.03 3dej s TRP 206 CO 0.01 -1.08 -0.09 0.50 0.02 0.00 0.00 176.95 176.30 3dej s ARG 207 N 4.05 2.43 -0.05 4.98 3.52 -1.26 -2.49 118.95 130.13 3dej s ARG 207 Ca 0.44 -0.80 0.06 0.00 -0.13 0.00 0.00 55.73 55.30 3dej s ARG 207 Cb -0.09 -2.43 -0.01 0.00 -1.56 0.00 0.00 34.95 30.86 3dej s ARG 207 CO 0.26 0.58 -0.23 1.21 -0.81 0.00 0.00 175.30 176.31 3dej s ASN 208 N -1.51 2.81 0.00 -2.12 3.04 -1.26 -4.89 114.94 111.01 3dej s ASN 208 Ca 0.17 -0.46 0.05 0.00 0.04 0.00 0.00 52.86 52.66 3dej s ASN 208 Cb -0.11 -0.75 0.29 0.00 -1.54 0.00 0.00 41.25 39.15 3dej s ASN 208 CO 0.08 0.22 0.67 -1.20 -3.04 0.00 0.00 177.10 173.83 3dej n SER 209 N 2.97 0.00 -0.09 -4.21 7.64 -1.26 -3.86 113.62 114.82 3dej n SER 209 Ca -0.17 -0.49 0.00 0.00 1.01 0.00 0.00 58.87 59.22 3dej n SER 209 Cb 0.52 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.73 3dej n SER 209 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3dej n LYS 210 N -0.74 0.59 -2.14 1.43 4.76 -1.26 -4.27 118.16 116.53 3dej n LYS 210 Ca 0.04 -0.86 -0.41 0.00 -2.87 0.00 0.00 58.31 54.21 3dej n LYS 210 Cb 0.02 -0.63 -0.03 0.00 -1.84 0.00 0.00 35.03 32.55 3dej n LYS 210 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 3dej s SER 213 N -0.47 6.80 0.22 4.39 1.04 -1.25 -5.14 113.70 119.29 3dej s SER 213 Ca 0.02 2.56 -0.08 0.00 0.48 0.00 0.00 55.95 58.92 3dej s SER 213 Cb 0.01 -2.63 0.28 0.00 0.10 0.00 0.00 66.02 63.79 3dej s SER 213 CO 0.00 -0.57 1.82 -0.50 0.98 0.00 0.00 173.24 174.98 3dej h TRP 214 N 4.68 0.80 0.31 5.02 4.06 -1.87 -2.41 115.95 126.55 3dej h TRP 214 Ca -0.46 0.03 -0.02 0.00 2.06 0.00 0.00 58.89 60.50 3dej h TRP 214 Cb 1.22 -0.25 0.00 0.00 -1.00 0.00 0.00 29.16 29.13 3dej h TRP 214 CO 0.60 0.39 -0.15 0.35 -3.56 0.00 0.00 178.44 176.06 3dej h PHE 215 N 0.79 -0.39 -0.52 0.49 3.57 -1.90 -2.56 116.94 116.43 3dej h PHE 215 Ca 0.33 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.78 3dej h PHE 215 Cb 0.19 0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 3dej h PHE 215 CO -0.06 -0.07 0.15 0.82 -2.23 0.00 0.00 178.31 176.92 3dej h ILE 216 N -0.74 1.21 0.47 1.41 1.08 -1.96 0.90 117.51 119.87 3dej h ILE 216 Ca -0.04 -0.73 -0.02 0.00 -0.39 0.00 0.00 64.86 63.69 3dej h ILE 216 Cb 0.50 0.66 -0.02 0.00 -3.07 0.00 0.00 36.82 34.89 3dej h ILE 216 CO 0.07 0.27 -0.43 -0.61 -0.69 0.00 0.00 178.15 176.76 3dej h GLN 217 N 0.75 -0.86 -0.10 2.37 4.15 -1.47 -1.56 115.11 118.39 3dej h GLN 217 Ca 0.17 0.06 -0.05 0.00 0.77 0.00 0.00 58.65 59.60 3dej h GLN 217 Cb 0.24 0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.11 3dej h GLN 217 CO -0.01 -0.57 -0.16 0.77 -1.93 0.00 0.00 178.83 176.93 3dej h SER 218 N -0.89 0.15 0.16 -0.69 0.02 -1.01 0.13 113.55 111.43 3dej h SER 218 Ca -0.06 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.85 3dej h SER 218 Cb 0.76 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.26 3dej h SER 218 CO -0.03 0.33 -0.08 0.25 -1.14 0.00 0.00 176.83 176.16 3dej h LEU 219 N 0.15 -0.19 -0.97 5.07 5.85 -0.80 -0.02 115.31 124.40 3dej h LEU 219 Ca 0.03 -0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.54 3dej h LEU 219 Cb 0.38 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 3dej h LEU 219 CO 0.02 0.06 0.24 0.00 -0.34 0.00 0.00 178.44 178.43 3dej h ALA 221 N 1.30 0.13 0.00 0.00 0.00 -0.72 -2.99 119.26 116.99 3dej h ALA 221 Ca 0.22 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 3dej h ALA 221 Cb 0.22 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3dej h ALA 221 CO -0.02 -0.17 -0.59 0.52 0.00 0.00 0.00 179.25 178.99 3dej h MET 222 N -0.11 0.00 0.69 0.00 2.07 -0.81 -2.81 114.93 113.96 3dej h MET 222 Ca 0.03 0.00 -0.03 0.00 -2.07 0.00 0.00 59.70 57.62 3dej h MET 222 Cb 0.37 0.00 0.01 0.00 -1.87 0.00 0.00 31.60 30.10 3dej h MET 222 CO 0.01 0.59 -0.33 -0.07 1.07 0.00 0.00 176.91 178.18 3dej h LEU 223 N 0.00 -0.78 -0.26 1.22 3.38 -0.87 -1.85 115.31 116.15 3dej h LEU 223 Ca -0.01 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.00 3dej h LEU 223 Cb 1.23 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 42.15 3dej h LEU 223 CO 0.08 -0.48 0.04 0.07 0.09 0.00 0.00 178.44 178.24 3dej h LYS 224 N -1.05 0.13 0.00 1.13 2.10 -1.57 0.79 116.57 118.11 3dej h LYS 224 Ca -0.09 -0.01 -0.00 0.00 -2.00 0.00 0.00 60.65 58.55 3dej h LYS 224 Cb 0.74 -0.03 -0.00 0.00 -0.90 0.00 0.00 32.23 32.04 3dej h LYS 224 CO 0.15 0.09 -0.01 0.37 -2.00 0.00 0.00 179.45 178.05 3dej h GLN 225 N 0.14 0.00 0.00 0.07 4.15 -1.48 -3.34 115.11 114.65 3dej h GLN 225 Ca 0.12 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.54 3dej h GLN 225 Cb 0.13 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.82 3dej h GLN 225 CO -0.17 0.01 -0.21 0.66 -1.93 0.00 0.00 178.83 177.20 3dej n TYR 226 N -3.15 0.00 -0.50 3.99 4.01 -0.70 -4.86 117.16 115.96 3dej n TYR 226 Ca -0.02 0.00 0.41 0.00 -0.16 0.00 0.00 57.90 58.13 3dej n TYR 226 Cb 0.16 0.00 0.69 0.00 -0.31 0.00 0.00 39.34 39.88 3dej n TYR 226 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3dej h ALA 227 N 0.00 2.96 -0.58 -0.72 0.00 0.47 0.56 119.26 121.96 3dej h ALA 227 Ca 0.00 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3dej h ALA 227 Cb 0.00 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3dej h ALA 227 CO 0.00 -1.61 0.02 -0.40 0.00 0.00 0.00 179.25 177.26 3dej n ASP 228 N -4.60 5.65 0.00 0.00 5.75 -1.26 -4.11 116.55 117.98 3dej n ASP 228 Ca 0.40 -2.96 0.00 0.00 -0.01 0.00 0.00 54.79 52.21 3dej n ASP 228 Cb 1.59 -0.69 0.00 0.00 -1.03 0.00 0.00 41.12 40.99 3dej n ASP 228 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3dej n LYS 229 N 0.53 0.00 -4.95 0.11 5.02 0.17 -5.03 118.16 114.01 3dej n LYS 229 Ca 0.29 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 56.26 3dej n LYS 229 Cb 1.21 -0.41 -0.14 0.00 -0.02 0.00 0.00 35.03 35.67 3dej n LYS 229 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3dej s LEU 230 N -1.28 2.39 0.33 -0.35 1.43 0.59 -5.11 118.68 116.68 3dej s LEU 230 Ca 0.00 -0.42 -0.29 0.00 -1.03 0.00 0.00 54.13 52.39 3dej s LEU 230 Cb 0.00 -1.43 -0.11 0.00 0.03 0.00 0.00 46.19 44.68 3dej s LEU 230 CO 0.00 0.30 1.53 -0.70 0.23 0.00 0.00 176.35 177.70 3dej s GLU 231 N -1.00 4.13 0.53 1.70 -6.30 -1.26 -4.69 118.70 111.82 3dej s GLU 231 Ca 0.12 2.54 0.34 0.00 -2.50 0.00 0.00 54.97 55.48 3dej s GLU 231 Cb -0.10 -3.01 1.51 0.00 0.00 0.00 0.00 34.13 32.53 3dej s GLU 231 CO 0.02 -0.56 1.83 0.35 0.02 0.00 0.00 175.26 176.92 3dej h PHE 232 N 4.02 0.04 -0.08 5.30 3.57 -1.13 0.13 116.94 128.79 3dej h PHE 232 Ca -0.49 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 60.96 3dej h PHE 232 Cb 1.23 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.96 3dej h PHE 232 CO 0.56 0.00 -0.15 0.52 -2.23 0.00 0.00 178.31 177.02 3dej h MET 233 N 0.02 0.24 -0.09 1.11 2.86 -1.91 -2.04 114.93 115.13 3dej h MET 233 Ca 0.53 -0.15 -0.00 0.00 -2.06 0.00 0.00 59.70 58.01 3dej h MET 233 Cb 2.06 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 33.73 3dej h MET 233 CO -0.02 0.74 0.05 0.45 1.06 0.00 0.00 176.91 179.19 3dej h HIS 234 N -0.23 0.11 0.50 -0.22 3.86 -1.36 0.21 115.15 118.02 3dej h HIS 234 Ca 0.00 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.19 3dej h HIS 234 Cb 0.73 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 29.17 3dej h HIS 234 CO 0.11 0.07 -0.24 0.82 0.86 0.00 0.00 177.93 179.55 3dej h ILE 235 N 0.12 0.46 -0.51 2.45 2.04 -1.39 -2.70 117.51 117.98 3dej h ILE 235 Ca 0.03 -0.25 0.04 0.00 1.00 0.00 0.00 64.86 65.68 3dej h ILE 235 Cb -0.00 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 3dej h ILE 235 CO -0.01 0.04 0.34 -0.07 0.00 0.00 0.00 178.15 178.46 3dej h LEU 236 N -0.84 0.47 -0.63 1.44 3.38 -0.37 0.61 115.31 119.37 3dej h LEU 236 Ca -0.07 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 3dej h LEU 236 Cb 0.59 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 3dej h LEU 236 CO 0.11 0.32 0.32 0.74 0.09 0.00 0.00 178.44 180.02 3dej h THR 237 N 0.54 1.21 -0.22 0.22 2.02 -0.71 0.30 112.91 116.27 3dej h THR 237 Ca 0.21 -0.55 -0.11 0.00 0.77 0.00 0.00 66.41 66.73 3dej h THR 237 Cb 0.17 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 3dej h THR 237 CO -0.06 0.23 -0.34 0.03 0.37 0.00 0.00 175.52 175.76 3dej h ARG 238 N 0.86 0.46 0.00 6.66 3.08 -0.19 -1.46 114.38 123.79 3dej h ARG 238 Ca 0.22 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 3dej h ARG 238 Cb 0.08 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.11 3dej h ARG 238 CO -0.03 0.74 -0.10 0.28 -1.07 0.00 0.00 179.97 179.79 3dej h VAL 239 N 0.39 0.70 0.24 2.04 2.07 0.59 -1.33 116.25 120.96 3dej h VAL 239 Ca 0.05 -0.40 -0.34 0.00 0.82 0.00 0.00 66.70 66.82 3dej h VAL 239 Cb 0.78 1.25 0.03 0.00 -1.52 0.00 0.00 31.29 31.83 3dej h VAL 239 CO 0.06 0.10 -1.51 0.78 0.02 0.00 0.00 177.57 177.02 3dej h ASN 240 N 0.00 0.79 -0.43 0.57 4.21 -0.12 -2.52 115.58 118.09 3dej h ASN 240 Ca -0.00 -0.89 -0.08 0.00 1.21 0.00 0.00 56.30 56.54 3dej h ASN 240 Cb 0.24 -0.26 -0.01 0.00 -1.12 0.00 0.00 38.32 37.16 3dej h ASN 240 CO 0.01 1.70 -0.04 -0.09 -1.29 0.00 0.00 177.43 177.73 3dej h ARG 241 N 0.14 0.78 -0.29 0.81 2.43 -1.09 -1.10 114.38 116.05 3dej h ARG 241 Ca -0.26 -0.27 -0.01 0.00 -0.81 0.00 0.00 59.98 58.63 3dej h ARG 241 Cb 2.15 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 31.63 3dej h ARG 241 CO 0.26 0.87 0.14 -0.22 -1.51 0.00 0.00 179.97 179.51 3dej h LYS 242 N 0.61 0.41 0.00 0.20 3.64 -1.35 0.10 116.57 120.18 3dej h LYS 242 Ca 0.12 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 3dej h LYS 242 Cb 0.55 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.29 3dej h LYS 242 CO 0.03 0.39 -0.08 0.28 -2.27 0.00 0.00 179.45 177.81 3dej h VAL 243 N 0.33 0.27 0.04 2.00 2.07 -1.39 -2.18 116.25 117.39 3dej h VAL 243 Ca 0.10 -0.54 -0.24 0.00 0.82 0.00 0.00 66.70 66.84 3dej h VAL 243 Cb 0.11 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 3dej h VAL 243 CO -0.01 0.07 -1.27 0.00 0.02 0.00 0.00 177.57 176.38 3dej h ALA 244 N 1.92 0.25 -0.34 1.67 0.00 -0.69 -3.38 119.26 118.69 3dej h ALA 244 Ca -0.00 -1.15 0.00 0.00 0.00 0.00 0.00 54.91 53.76 3dej h ALA 244 Cb 0.41 0.62 0.00 0.00 0.00 0.00 0.00 17.79 18.83 3dej h ALA 244 CO 0.01 0.74 0.00 0.25 0.00 0.00 0.00 179.25 180.25 3dej n THR 245 N -4.23 0.63 -0.06 0.00 -2.24 0.31 -4.39 114.28 104.31 3dej n THR 245 Ca -0.29 -0.82 0.00 0.00 -2.27 0.00 0.00 64.05 60.68 3dej n THR 245 Cb 0.75 0.81 0.00 0.00 -2.10 0.00 0.00 70.33 69.80 3dej n THR 245 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3dej n GLU 246 N 1.01 3.13 -4.42 -0.78 1.02 -0.82 -5.03 120.64 114.76 3dej n GLU 246 Ca 0.15 -0.18 -0.21 0.00 -0.02 0.00 0.00 57.16 56.89 3dej n GLU 246 Cb 0.48 -0.64 -0.10 0.00 -0.02 0.00 0.00 31.44 31.16 3dej n GLU 246 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 3dej s PHE 247 N -0.50 2.01 -0.30 -0.32 0.08 -1.26 -5.05 117.98 112.65 3dej s PHE 247 Ca 0.00 -0.48 -0.19 0.00 0.12 0.00 0.00 56.93 56.38 3dej s PHE 247 Cb 0.00 -0.94 0.21 0.00 -0.57 0.00 0.00 43.02 41.72 3dej s PHE 247 CO 0.00 0.51 1.33 -2.00 -0.10 0.00 0.00 175.22 174.97 3dej s GLU 248 N -3.59 0.03 0.75 0.44 2.12 -1.26 -4.90 118.70 112.29 3dej s GLU 248 Ca 0.27 0.05 -0.11 0.00 0.36 0.00 0.00 54.97 55.54 3dej s GLU 248 Cb -0.02 0.01 0.05 0.00 0.26 0.00 0.00 34.13 34.43 3dej s GLU 248 CO 0.11 -0.01 1.09 -1.54 -0.54 0.00 0.00 175.26 174.38 3dej s SER 249 N 0.71 4.64 -0.05 -1.70 1.04 -0.72 -4.87 113.70 112.74 3dej s SER 249 Ca -0.03 1.83 -0.01 0.00 0.48 0.00 0.00 55.95 58.22 3dej s SER 249 Cb -0.03 -2.52 0.03 0.00 0.10 0.00 0.00 66.02 63.59 3dej s SER 249 CO -0.12 -1.95 0.01 0.12 0.98 0.00 0.00 173.24 172.29 3dej s PHE 250 N -2.84 0.43 0.05 5.02 5.36 -1.26 -1.79 117.98 122.94 3dej s PHE 250 Ca 0.62 -0.03 -0.04 0.00 -0.96 0.00 0.00 56.93 56.52 3dej s PHE 250 Cb -0.17 -0.58 -0.02 0.00 -0.34 0.00 0.00 43.02 41.90 3dej s PHE 250 CO 0.54 -0.22 0.05 0.45 -1.46 0.00 0.00 175.22 174.58 3dej s SER 251 N 1.57 0.29 -0.59 6.13 0.15 -1.26 -4.90 113.70 115.09 3dej s SER 251 Ca -0.02 -0.71 -0.02 0.00 0.70 0.00 0.00 55.95 55.90 3dej s SER 251 Cb -0.13 0.22 0.33 0.00 -1.71 0.00 0.00 66.02 64.73 3dej s SER 251 CO -0.03 -0.55 2.12 0.49 1.20 0.00 0.00 173.24 176.47 3dej n PHE 252 N 0.52 2.59 -3.15 3.44 3.01 -1.26 -4.65 117.46 117.95 3dej n PHE 252 Ca -0.17 -2.52 0.04 0.00 1.01 0.00 0.00 57.45 55.80 3dej n PHE 252 Cb 0.59 -1.28 -0.00 0.00 -0.01 0.00 0.00 39.48 38.78 3dej n PHE 252 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 3dej s ASP 253 N -0.95 -1.58 0.52 4.37 2.15 -1.26 -5.06 116.67 114.85 3dej s ASP 253 Ca 0.54 0.26 0.34 0.00 0.43 0.00 0.00 52.55 54.11 3dej s ASP 253 Cb 0.42 2.03 1.49 0.00 -0.30 0.00 0.00 42.92 46.56 3dej s ASP 253 CO -0.10 -0.29 1.81 0.00 -0.17 0.00 0.00 175.17 176.42 3dej h ALA 254 N 7.98 2.97 -0.28 3.66 0.00 -1.92 0.53 119.26 132.19 3dej h ALA 254 Ca -0.03 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 54.93 3dej h ALA 254 Cb 1.19 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 3dej h ALA 254 CO 0.15 -1.30 0.37 1.15 0.00 0.00 0.00 179.25 179.62 3dej h THR 255 N 0.05 0.33 0.00 0.00 2.02 -1.97 -2.75 112.91 110.59 3dej h THR 255 Ca 0.55 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.73 3dej h THR 255 Cb 2.08 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 69.19 3dej h THR 255 CO -0.04 0.00 0.00 0.49 0.37 0.00 0.00 175.52 176.34 3dej n PHE 256 N -3.58 0.00 -3.47 3.16 3.01 0.18 -5.03 117.46 111.72 3dej n PHE 256 Ca 0.04 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.13 3dej n PHE 256 Cb 0.51 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.92 3dej n PHE 256 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 3dej s HIS 257 N -0.04 3.70 -0.80 1.38 2.46 -1.04 -4.31 115.29 116.64 3dej s HIS 257 Ca 0.00 1.00 -0.01 0.00 0.47 0.00 0.00 55.06 56.52 3dej s HIS 257 Cb 0.00 -2.30 0.00 0.00 -0.13 0.00 0.00 32.58 30.15 3dej s HIS 257 CO 0.00 0.59 0.07 0.00 -2.47 0.00 0.00 174.74 172.93 3dej n ALA 258 N 1.53 -0.32 -1.96 1.58 0.00 -0.74 -4.92 120.51 115.68 3dej n ALA 258 Ca -0.12 0.09 -0.31 0.00 0.00 0.00 0.00 53.44 53.10 3dej n ALA 258 Cb 0.52 -1.48 -0.03 0.00 0.00 0.00 0.00 19.45 18.46 3dej n ALA 258 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3dej s LYS 259 N -4.63 3.84 0.31 0.00 -0.14 -1.26 -4.75 119.74 113.12 3dej s LYS 259 Ca 0.03 0.76 0.09 0.00 -1.36 0.00 0.00 55.97 55.50 3dej s LYS 259 Cb -0.02 -2.21 -0.06 0.00 -1.68 0.00 0.00 37.83 33.86 3dej s LYS 259 CO 0.04 -0.24 -0.11 0.15 -0.76 0.00 0.00 175.35 174.44 3dej s LYS 260 N -4.16 1.71 -0.03 1.68 -0.14 -0.35 -1.76 119.74 116.69 3dej s LYS 260 Ca 0.56 -1.86 -0.02 0.00 -1.36 0.00 0.00 55.97 53.29 3dej s LYS 260 Cb -0.10 -1.56 0.01 0.00 -1.68 0.00 0.00 37.83 34.50 3dej s LYS 260 CO 0.35 0.15 0.07 -1.14 -0.76 0.00 0.00 175.35 174.01 3dej s GLN 261 N -3.62 0.07 -0.09 1.68 0.74 -1.26 -4.06 119.66 113.12 3dej s GLN 261 Ca 0.31 0.11 0.03 0.00 0.05 0.00 0.00 55.36 55.86 3dej s GLN 261 Cb 0.01 0.01 0.01 0.00 1.10 0.00 0.00 33.01 34.14 3dej s GLN 261 CO 0.15 -0.03 -0.17 -1.50 -0.55 0.00 0.00 175.29 173.19 3dej s ILE 262 N 0.15 1.56 0.82 -2.34 -1.16 -1.26 -4.09 121.20 114.88 3dej s ILE 262 Ca -0.01 -0.72 -0.11 0.00 -0.51 0.00 0.00 60.65 59.30 3dej s ILE 262 Cb -0.02 -1.39 0.08 0.00 0.61 0.00 0.00 42.46 41.75 3dej s ILE 262 CO -0.00 0.45 1.09 -2.84 -2.81 0.00 0.00 174.94 170.83 3dej s PRO 263 N 0.62 1.90 -0.28 3.50 0.02 -1.21 -1.32 135.00 138.24 3dej s PRO 263 Ca -0.14 0.93 -0.02 0.00 0.02 0.00 0.00 61.00 61.79 3dej s PRO 263 Cb -0.16 -1.87 0.09 0.00 0.02 0.00 0.00 34.50 32.57 3dej s PRO 263 CO 0.04 -1.82 0.09 0.00 -0.33 0.00 0.00 177.00 174.98 3dej s ILE 265 N 1.75 4.79 -0.30 0.00 1.01 -1.26 -1.70 121.20 125.48 3dej s ILE 265 Ca 0.07 1.98 0.02 0.00 0.00 0.00 0.00 60.65 62.73 3dej s ILE 265 Cb -0.17 -4.29 0.08 0.00 0.01 0.00 0.00 42.46 38.09 3dej s ILE 265 CO -0.23 0.00 -0.03 -0.69 0.00 0.00 0.00 174.94 174.00 3dej s VAL 266 N 2.08 2.37 -0.19 2.92 1.01 0.70 -5.01 120.40 124.27 3dej s VAL 266 Ca 0.47 -1.87 -0.01 0.00 0.00 0.00 0.00 61.98 60.56 3dej s VAL 266 Cb -0.18 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.68 3dej s VAL 266 CO 0.16 -0.27 -0.12 -0.55 0.00 0.00 0.00 175.10 174.33 3dej s SER 267 N 1.09 3.80 -0.28 3.32 0.15 -1.26 -0.10 113.70 120.42 3dej s SER 267 Ca -0.01 -0.49 0.12 0.00 0.70 0.00 0.00 55.95 56.27 3dej s SER 267 Cb -0.20 -1.62 0.63 0.00 -1.71 0.00 0.00 66.02 63.12 3dej s SER 267 CO -0.05 0.01 1.62 0.23 1.20 0.00 0.00 173.24 176.25 3dej n MET 268 N 4.56 3.02 -2.22 5.44 0.00 0.13 -5.01 117.12 123.05 3dej n MET 268 Ca -0.19 -3.04 -0.38 0.00 0.00 0.00 0.00 57.70 54.09 3dej n MET 268 Cb 0.51 -2.02 -0.01 0.00 0.00 0.00 0.00 33.22 31.70 3dej n MET 268 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 3dej s LEU 269 N -3.02 4.14 -0.01 4.03 1.43 -1.20 -1.15 118.68 122.90 3dej s LEU 269 Ca 0.49 2.41 0.18 0.00 -1.03 0.00 0.00 54.13 56.18 3dej s LEU 269 Cb 0.41 -4.06 -0.23 0.00 0.03 0.00 0.00 46.19 42.33 3dej s LEU 269 CO 0.09 -0.80 0.61 0.35 0.23 0.00 0.00 176.35 176.83 3dej n THR 270 N -0.10 0.00 -4.11 5.49 -2.24 -1.26 -4.86 114.28 107.20 3dej n THR 270 Ca 0.05 -0.21 -0.08 0.00 -2.27 0.00 0.00 64.05 61.54 3dej n THR 270 Cb 0.46 0.64 -0.10 0.00 -2.10 0.00 0.00 70.33 69.23 3dej n THR 270 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3dej s LYS 271 N -2.90 0.68 0.46 -0.78 1.02 -1.26 -4.96 119.74 112.00 3dej s LYS 271 Ca 0.01 -1.26 -0.23 0.00 0.02 0.00 0.00 55.97 54.51 3dej s LYS 271 Cb 0.13 0.14 -0.07 0.00 -0.52 0.00 0.00 37.83 37.51 3dej s LYS 271 CO 0.74 -0.11 1.24 -1.21 -0.92 0.00 0.00 175.35 175.09 3dej s GLU 272 N -3.92 3.67 -0.21 1.68 2.02 -0.49 -4.71 118.70 116.75 3dej s GLU 272 Ca 0.10 1.96 -0.00 0.00 0.02 0.00 0.00 54.97 57.04 3dej s GLU 272 Cb 0.07 -2.46 0.02 0.00 0.10 0.00 0.00 34.13 31.86 3dej s GLU 272 CO -0.08 -0.67 -0.13 -1.17 0.02 0.00 0.00 175.26 173.23 3dej s LEU 273 N -2.99 2.62 -0.18 1.80 2.96 -1.26 -0.82 118.68 120.80 3dej s LEU 273 Ca 0.64 -0.70 0.01 0.00 -0.22 0.00 0.00 54.13 53.85 3dej s LEU 273 Cb -0.33 -1.58 0.03 0.00 0.50 0.00 0.00 46.19 44.81 3dej s LEU 273 CO 0.41 -0.05 -0.15 -0.31 -1.32 0.00 0.00 176.35 174.93 3dej s TYR 274 N 1.32 2.56 0.43 5.38 2.02 -1.26 -0.41 117.35 127.38 3dej s TYR 274 Ca 0.03 -1.56 0.33 0.00 -0.37 0.00 0.00 57.07 55.50 3dej s TYR 274 Cb -0.15 -1.76 1.72 0.00 -0.40 0.00 0.00 41.96 41.37 3dej s TYR 274 CO -0.09 -0.76 2.15 0.74 -1.57 0.00 0.00 175.55 176.02 3dej h PHE 275 N 7.97 0.00 -0.01 2.71 0.04 -1.85 -3.46 116.94 122.33 3dej h PHE 275 Ca -0.37 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.40 3dej h PHE 275 Cb 1.12 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.27 3dej h PHE 275 CO 0.49 0.06 0.00 2.48 -0.60 0.00 0.00 178.31 180.74