#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 2.81 -4.21 1.67 4.13 -1.26 -4.99 115.26 113.41 3dej n ASN 35 Ca 0.00 -1.87 -0.14 0.00 1.68 0.00 0.00 54.58 54.25 3dej n ASN 35 Cb 0.00 -0.05 -0.10 0.00 -1.54 0.00 0.00 39.78 38.09 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 -1.63 1.62 0.84 6.41 1.04 -1.26 -1.45 113.70 119.27 3dej s SER 36 Ca 0.26 -0.91 -0.12 0.00 0.48 0.00 0.00 55.95 55.66 3dej s SER 36 Cb 0.18 -0.00 0.10 0.00 0.10 0.00 0.00 66.02 66.40 3dej s SER 36 CO 0.26 -0.29 1.17 -0.31 0.98 0.00 0.00 173.24 175.05 3dej s TYR 37 N -2.86 1.79 -0.74 5.02 2.02 -0.06 -4.81 117.35 117.71 3dej s TYR 37 Ca 0.11 1.71 -0.23 0.00 -0.37 0.00 0.00 57.07 58.30 3dej s TYR 37 Cb -0.00 -3.39 0.07 0.00 -0.40 0.00 0.00 41.96 38.24 3dej s TYR 37 CO 0.00 -2.74 1.07 0.21 -1.57 0.00 0.00 175.55 172.52 3dej s LYS 38 N -4.39 3.24 -0.13 -0.62 2.20 -1.26 -4.88 119.74 113.89 3dej s LYS 38 Ca 0.70 -0.94 0.15 0.00 -0.36 0.00 0.00 55.97 55.52 3dej s LYS 38 Cb -0.25 -4.42 0.67 0.00 -1.51 0.00 0.00 37.83 32.32 3dej s LYS 38 CO 0.53 -1.88 1.56 -1.33 -0.36 0.00 0.00 175.35 173.87 3dej n MET 39 N 7.81 3.76 -0.43 4.03 2.81 -1.26 -4.44 117.12 129.39 3dej n MET 39 Ca 0.04 -2.63 0.08 0.00 -1.81 0.00 0.00 57.70 53.39 3dej n MET 39 Cb 0.47 -1.94 0.25 0.00 -0.71 0.00 0.00 33.22 31.29 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 0.86 3.86 -4.53 7.83 3.85 -1.26 -4.91 116.55 122.25 3dej n ASP 40 Ca 0.24 -2.85 -0.29 0.00 -0.71 0.00 0.00 54.79 51.18 3dej n ASP 40 Cb 0.90 -0.51 0.23 0.00 -1.35 0.00 0.00 41.12 40.39 3dej n ASP 40 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 3dej s TYR 41 N -2.52 1.39 0.28 2.11 1.51 -1.26 -4.91 117.35 113.95 3dej s TYR 41 Ca 0.40 1.36 0.02 0.00 -1.01 0.00 0.00 57.07 57.84 3dej s TYR 41 Cb 0.31 -3.16 0.61 0.00 -0.11 0.00 0.00 41.96 39.61 3dej s TYR 41 CO 0.11 -3.63 1.80 -1.00 -1.11 0.00 0.00 175.55 171.72 3dej h PRO 42 N -2.45 0.83 -6.58 -1.71 0.13 -1.95 -3.43 132.00 116.84 3dej h PRO 42 Ca -0.57 -0.05 -0.69 0.00 -0.87 0.00 0.00 66.00 63.83 3dej h PRO 42 Cb 1.32 -0.19 -0.23 0.00 0.13 0.00 0.00 31.00 32.03 3dej h PRO 42 CO 0.48 0.55 -0.81 -1.21 -0.23 0.00 0.00 178.00 176.77 3dej s GLU 43 N -5.93 2.06 0.21 0.86 2.02 -0.96 -5.03 118.70 111.93 3dej s GLU 43 Ca -0.12 -0.98 -0.07 0.00 0.02 0.00 0.00 54.97 53.82 3dej s GLU 43 Cb 0.23 -2.17 0.17 0.00 0.10 0.00 0.00 34.13 32.46 3dej s GLU 43 CO 0.80 0.54 1.70 0.52 0.02 0.00 0.00 175.26 178.85 3dej h MET 44 N 4.62 1.02 0.00 1.61 2.86 -1.83 0.20 114.93 123.42 3dej h MET 44 Ca -0.47 -0.28 0.00 0.00 -2.06 0.00 0.00 59.70 56.89 3dej h MET 44 Cb 1.15 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.70 3dej h MET 44 CO 0.47 0.96 0.00 0.41 1.06 0.00 0.00 176.91 179.81 3dej n GLY 45 N -0.58 0.90 3.61 8.32 0.00 -1.26 -0.70 105.19 115.48 3dej n GLY 45 Ca 0.04 -2.10 -0.34 0.00 0.00 0.00 0.00 46.02 43.62 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 3.29 -0.41 0.99 0.05 -1.25 -1.26 118.68 120.10 3dej s LEU 46 Ca 0.00 0.03 -0.08 0.00 0.05 0.00 0.00 54.13 54.13 3dej s LEU 46 Cb 0.00 -1.73 0.08 0.00 -2.05 0.00 0.00 46.19 42.49 3dej s LEU 46 CO 0.00 0.36 0.23 0.00 -0.55 0.00 0.00 176.35 176.39 3dej s ILE 48 N 1.38 5.01 -0.23 0.00 -1.09 0.41 -0.50 121.20 126.19 3dej s ILE 48 Ca 0.03 0.90 -0.04 0.00 -2.23 0.00 0.00 60.65 59.31 3dej s ILE 48 Cb -0.23 -3.91 -0.01 0.00 -1.58 0.00 0.00 42.46 36.74 3dej s ILE 48 CO 0.01 -0.01 -0.04 -0.63 -1.23 0.00 0.00 174.94 173.04 3dej s ILE 49 N 2.44 3.39 -0.23 2.92 1.01 -0.00 -0.66 121.20 130.07 3dej s ILE 49 Ca 0.23 -0.52 -0.07 0.00 0.00 0.00 0.00 60.65 60.29 3dej s ILE 49 Cb -0.15 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 3dej s ILE 49 CO 0.10 0.40 0.05 -0.63 0.00 0.00 0.00 174.94 174.86 3dej s ILE 50 N 1.47 4.30 -0.38 2.92 1.01 -0.28 -0.47 121.20 129.77 3dej s ILE 50 Ca 0.05 -0.18 0.02 0.00 0.00 0.00 0.00 60.65 60.54 3dej s ILE 50 Cb -0.14 -2.99 0.11 0.00 0.01 0.00 0.00 42.46 39.45 3dej s ILE 50 CO -0.03 0.38 0.14 0.21 0.00 0.00 0.00 174.94 175.63 3dej s ASN 51 N 1.28 4.27 -0.43 3.58 3.04 0.17 -1.34 114.94 125.51 3dej s ASN 51 Ca 0.05 -2.25 -0.16 0.00 0.04 0.00 0.00 52.86 50.53 3dej s ASN 51 Cb -0.15 -1.30 0.03 0.00 -1.54 0.00 0.00 41.25 38.29 3dej s ASN 51 CO 0.03 -0.34 0.37 0.20 -3.04 0.00 0.00 177.10 174.32 3dej s ASN 52 N 0.79 6.15 -0.25 -4.21 -0.87 -0.75 -1.27 114.94 114.53 3dej s ASN 52 Ca 0.13 -0.88 -0.16 0.00 -1.57 0.00 0.00 52.86 50.39 3dej s ASN 52 Cb -0.21 -2.19 -0.12 0.00 -0.02 0.00 0.00 41.25 38.71 3dej s ASN 52 CO -0.10 -0.54 -0.26 1.17 -2.57 0.00 0.00 177.10 174.81 3dej n LYS 53 N 5.36 0.58 -4.72 -0.60 4.81 -1.26 -4.66 118.16 117.67 3dej n LYS 53 Ca -0.10 0.32 -0.31 0.00 -0.87 0.00 0.00 58.31 57.34 3dej n LYS 53 Cb 0.47 -1.53 -0.13 0.00 0.02 0.00 0.00 35.03 33.86 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 -7.18 3.94 0.20 3.14 0.01 -1.26 -1.38 114.94 112.41 3dej s ASN 54 Ca -0.36 -0.33 0.10 0.00 -0.71 0.00 0.00 52.86 51.56 3dej s ASN 54 Cb 0.12 -0.72 -0.04 0.00 0.41 0.00 0.00 41.25 41.01 3dej s ASN 54 CO 0.49 0.28 -0.20 -0.36 -1.51 0.00 0.00 177.10 175.81 3dej s PHE 55 N -0.87 2.06 0.16 2.20 0.40 -1.26 -4.72 117.98 115.94 3dej s PHE 55 Ca 0.14 -0.42 -0.30 0.00 -0.60 0.00 0.00 56.93 55.75 3dej s PHE 55 Cb -0.11 -0.98 -0.08 0.00 0.51 0.00 0.00 43.02 42.36 3dej s PHE 55 CO 0.04 0.47 1.29 -1.01 0.70 0.00 0.00 175.22 176.72 3dej s HIS 56 N -2.15 3.31 0.51 0.36 3.76 0.04 -4.88 115.29 116.24 3dej s HIS 56 Ca 0.21 1.21 0.37 0.00 -0.15 0.00 0.00 55.06 56.70 3dej s HIS 56 Cb -0.06 -3.56 1.52 0.00 1.11 0.00 0.00 32.58 31.60 3dej s HIS 56 CO 0.10 -1.78 1.71 0.87 -0.85 0.00 0.00 174.74 174.79 3dej h LYS 57 N 5.88 0.06 0.00 1.40 1.79 -1.93 0.19 116.57 123.96 3dej h LYS 57 Ca -0.44 -0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.01 3dej h LYS 57 Cb 1.21 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.85 3dej h LYS 57 CO 0.79 0.04 -0.07 0.66 -1.08 0.00 0.00 179.45 179.79 3dej h SER 58 N 0.06 0.00 1.33 0.86 4.64 -1.96 -2.27 113.55 116.22 3dej h SER 58 Ca 0.71 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.03 3dej h SER 58 Cb 2.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.69 3dej h SER 58 CO -0.11 0.07 -0.38 0.71 -0.87 0.00 0.00 176.83 176.25 3dej h THR 59 N 0.00 0.00 0.00 2.95 1.35 -0.95 -3.48 112.91 112.78 3dej h THR 59 Ca -0.00 -0.72 0.00 0.00 -0.55 0.00 0.00 66.41 65.14 3dej h THR 59 Cb 0.18 1.49 0.00 0.00 -1.73 0.00 0.00 68.15 68.09 3dej h THR 59 CO 0.01 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.89 3dej n GLY 60 N 1.24 0.29 3.79 5.82 0.00 -0.86 -4.97 105.19 110.50 3dej n GLY 60 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.82 4.51 0.79 1.61 -1.94 -1.26 -5.04 119.30 117.15 3dej s MET 61 Ca 0.00 1.30 -0.12 0.00 -1.71 0.00 0.00 55.69 55.17 3dej s MET 61 Cb 0.00 -2.69 0.06 0.00 2.01 0.00 0.00 34.83 34.21 3dej s MET 61 CO 0.00 0.21 1.15 0.95 -0.01 0.00 0.00 175.02 177.33 3dej s THR 62 N -1.71 2.42 0.12 2.05 -4.23 -1.26 -4.65 115.64 108.38 3dej s THR 62 Ca 0.52 0.14 -0.30 0.00 -1.18 0.00 0.00 61.69 60.87 3dej s THR 62 Cb -0.17 -3.12 -0.06 0.00 1.34 0.00 0.00 72.50 70.49 3dej s THR 62 CO 0.22 -0.18 0.94 -0.55 -0.54 0.00 0.00 174.62 174.52 3dej s SER 63 N -4.48 7.50 -1.23 3.99 0.15 -1.26 -4.70 113.70 113.67 3dej s SER 63 Ca 0.61 1.79 -0.10 0.00 0.70 0.00 0.00 55.95 58.95 3dej s SER 63 Cb -0.11 -2.58 0.20 0.00 -1.71 0.00 0.00 66.02 61.81 3dej s SER 63 CO 0.50 -0.03 1.67 0.54 1.20 0.00 0.00 173.24 177.12 3dej n ARG 64 N 2.62 3.68 -1.75 5.44 1.74 -0.48 -5.00 116.66 122.92 3dej n ARG 64 Ca 0.01 -3.81 -0.42 0.00 -0.77 0.00 0.00 57.85 52.86 3dej n ARG 64 Cb 0.49 -2.87 -0.03 0.00 -1.02 0.00 0.00 32.46 29.03 3dej n ARG 64 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 3dej s SER 65 N 0.99 6.40 0.00 0.55 0.01 -1.26 -2.23 113.70 118.15 3dej s SER 65 Ca 0.39 2.85 0.00 0.00 1.31 0.00 0.00 55.95 60.50 3dej s SER 65 Cb 0.05 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.68 3dej s SER 65 CO 0.01 -0.96 0.00 0.61 0.41 0.00 0.00 173.24 173.31 3dej n GLY 66 N 3.93 0.72 0.29 3.44 0.00 -1.25 -4.43 105.19 107.88 3dej n GLY 66 Ca 0.16 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.26 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 0.98 -0.02 2.61 1.03 -1.73 -0.67 112.91 115.11 3dej h THR 67 Ca 0.00 -0.05 0.01 0.00 -0.01 0.00 0.00 66.41 66.36 3dej h THR 67 Cb 0.00 0.84 -0.00 0.00 -1.07 0.00 0.00 68.15 67.92 3dej h THR 67 CO 0.00 0.02 0.03 0.44 -0.01 0.00 0.00 175.52 176.00 3dej h ASP 68 N 0.14 0.00 -0.56 0.00 3.32 -1.92 0.38 116.42 117.78 3dej h ASP 68 Ca 0.07 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.07 3dej h ASP 68 Cb 0.13 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 3dej h ASP 68 CO -0.01 0.00 0.15 0.58 -1.72 0.00 0.00 179.24 178.24 3dej h VAL 69 N 0.00 1.24 0.03 -1.35 2.07 -1.48 -0.33 116.25 116.43 3dej h VAL 69 Ca 0.01 -0.86 -0.00 0.00 0.82 0.00 0.00 66.70 66.67 3dej h VAL 69 Cb 0.06 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 3dej h VAL 69 CO -0.00 0.33 -0.01 0.44 0.02 0.00 0.00 177.57 178.34 3dej h ASP 70 N 0.89 -0.03 -0.33 0.57 3.32 -1.03 -2.51 116.42 117.30 3dej h ASP 70 Ca 0.19 -0.53 0.07 0.00 0.02 0.00 0.00 57.03 56.79 3dej h ASP 70 Cb 0.31 0.01 -0.07 0.00 0.22 0.00 0.00 39.33 39.80 3dej h ASP 70 CO -0.00 0.52 -0.11 0.00 -1.72 0.00 0.00 179.24 177.93 3dej h ALA 71 N 0.34 0.18 -0.62 3.45 0.00 -1.38 0.17 119.26 121.40 3dej h ALA 71 Ca -0.00 0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.09 3dej h ALA 71 Cb 0.55 0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.61 3dej h ALA 71 CO 0.01 -0.49 0.41 0.00 0.00 0.00 0.00 179.25 179.18 3dej h ALA 72 N 1.27 1.76 0.03 0.00 0.00 -1.12 0.19 119.26 121.39 3dej h ALA 72 Ca 0.16 -0.02 -0.21 0.00 0.00 0.00 0.00 54.91 54.84 3dej h ALA 72 Cb 0.29 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3dej h ALA 72 CO -0.36 0.15 -0.98 -0.97 0.00 0.00 0.00 179.25 177.09 3dej h ASN 73 N 0.65 0.17 0.64 0.00 -1.24 -0.76 -2.53 115.58 112.51 3dej h ASN 73 Ca 0.26 -0.16 -0.27 0.00 0.71 0.00 0.00 56.30 56.84 3dej h ASN 73 Cb 0.22 -0.06 0.00 0.00 0.73 0.00 0.00 38.32 39.22 3dej h ASN 73 CO -0.08 1.05 -1.25 -0.07 -1.29 0.00 0.00 177.43 175.79 3dej h LEU 74 N 0.05 0.41 -1.32 0.34 3.38 -0.17 -2.10 115.31 115.90 3dej h LEU 74 Ca -0.05 -0.44 -0.05 0.00 0.09 0.00 0.00 57.88 57.43 3dej h LEU 74 Cb 1.67 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 42.27 3dej h LEU 74 CO 0.14 1.35 -0.08 -0.09 0.09 0.00 0.00 178.44 179.85 3dej h ARG 75 N 0.07 0.35 0.21 1.13 2.43 -0.67 -1.29 114.38 116.62 3dej h ARG 75 Ca -0.14 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 58.94 3dej h ARG 75 Cb 1.97 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 31.47 3dej h ARG 75 CO 0.20 0.45 -0.10 1.49 -1.51 0.00 0.00 179.97 180.50 3dej h GLU 76 N 0.34 -0.28 -1.00 0.20 4.57 -1.43 -2.87 114.58 114.11 3dej h GLU 76 Ca 0.07 0.02 0.11 0.00 -1.18 0.00 0.00 59.36 58.38 3dej h GLU 76 Cb 0.36 0.06 -0.08 0.00 -0.16 0.00 0.00 28.75 28.93 3dej h GLU 76 CO 0.02 -0.03 0.63 1.15 -1.18 0.00 0.00 179.01 179.60 3dej h THR 77 N -1.02 0.94 0.09 0.32 2.02 -1.33 -0.12 112.91 113.81 3dej h THR 77 Ca -0.03 -0.35 -0.28 0.00 0.77 0.00 0.00 66.41 66.52 3dej h THR 77 Cb 0.37 -0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.61 3dej h THR 77 CO 0.05 0.19 -1.42 -0.26 0.37 0.00 0.00 175.52 174.44 3dej h PHE 78 N 1.01 0.33 -0.38 3.16 0.04 -1.39 -2.53 116.94 117.19 3dej h PHE 78 Ca 0.49 -0.24 -0.03 0.00 2.80 0.00 0.00 57.97 60.98 3dej h PHE 78 Cb 0.45 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.57 3dej h PHE 78 CO -0.00 1.26 0.09 0.00 -0.60 0.00 0.00 178.31 179.06 3dej h ARG 79 N 0.05 0.56 0.00 1.51 3.08 -1.24 -0.77 114.38 117.56 3dej h ARG 79 Ca -0.19 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 59.76 3dej h ARG 79 Cb 1.97 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.92 3dej h ARG 79 CO 0.15 0.52 0.00 -0.91 -1.07 0.00 0.00 179.97 178.66 3dej h ASN 80 N 0.55 0.00 -0.13 7.04 4.21 -1.05 -2.72 115.58 123.48 3dej h ASN 80 Ca 0.13 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.64 3dej h ASN 80 Cb 0.21 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.41 3dej h ASN 80 CO -0.00 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 176.32 3dej n LEU 81 N -2.63 1.76 -0.10 1.61 4.77 -0.64 -4.93 117.00 116.84 3dej n LEU 81 Ca 0.03 -0.69 0.00 0.00 -0.03 0.00 0.00 56.01 55.32 3dej n LEU 81 Cb 0.36 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 3dej n LEU 81 CO 0.27 0.35 0.00 1.17 -1.33 0.00 0.00 177.39 177.85 3dej n LYS 82 N 0.38 0.00 -3.74 3.23 3.00 -1.02 -4.98 118.16 115.03 3dej n LYS 82 Ca 0.17 0.00 -0.30 0.00 -0.00 0.00 0.00 58.31 58.18 3dej n LYS 82 Cb 0.36 -3.29 -0.04 0.00 0.00 0.00 0.00 35.03 32.06 3dej n LYS 82 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 3dej s TYR 83 N -2.20 3.49 -1.06 5.64 1.51 -0.39 -4.24 117.35 120.10 3dej s TYR 83 Ca 0.00 0.42 -0.21 0.00 -1.01 0.00 0.00 57.07 56.27 3dej s TYR 83 Cb 0.00 -1.90 0.08 0.00 -0.11 0.00 0.00 41.96 40.03 3dej s TYR 83 CO 0.00 0.45 1.43 -2.00 -1.11 0.00 0.00 175.55 174.32 3dej s GLU 84 N -2.83 3.69 -0.06 -0.62 2.12 -0.39 -4.46 118.70 116.16 3dej s GLU 84 Ca 0.39 -1.50 -0.30 0.00 0.36 0.00 0.00 54.97 53.92 3dej s GLU 84 Cb -0.12 -5.27 -0.03 0.00 0.26 0.00 0.00 34.13 28.97 3dej s GLU 84 CO 0.27 -2.09 1.19 0.08 -0.54 0.00 0.00 175.26 174.16 3dej s VAL 85 N 4.14 4.28 -0.22 3.70 1.01 -1.26 -1.15 120.40 130.90 3dej s VAL 85 Ca 0.44 1.60 -0.00 0.00 0.00 0.00 0.00 61.98 64.02 3dej s VAL 85 Cb -0.01 -4.03 0.02 0.00 0.00 0.00 0.00 36.38 32.37 3dej s VAL 85 CO -0.06 -0.00 -0.12 -0.13 0.00 0.00 0.00 175.10 174.79 3dej s ARG 86 N 2.23 2.91 0.07 2.72 0.52 0.35 -4.92 118.95 122.83 3dej s ARG 86 Ca 0.55 -0.91 -0.17 0.00 -0.52 0.00 0.00 55.73 54.68 3dej s ARG 86 Cb -0.24 -2.82 -0.06 0.00 0.52 0.00 0.00 34.95 32.35 3dej s ARG 86 CO 0.22 -0.32 0.53 1.21 0.02 0.00 0.00 175.30 176.96 3dej s ASN 87 N 1.31 6.95 -0.11 0.23 2.47 -1.26 -0.82 114.94 123.70 3dej s ASN 87 Ca 0.02 1.15 -0.04 0.00 0.42 0.00 0.00 52.86 54.41 3dej s ASN 87 Cb -0.15 -2.32 0.05 0.00 -1.45 0.00 0.00 41.25 37.38 3dej s ASN 87 CO -0.08 0.25 0.09 -0.54 -3.72 0.00 0.00 177.10 173.10 3dej s LYS 88 N -1.31 0.01 -0.06 0.43 3.01 0.38 -4.95 119.74 117.25 3dej s LYS 88 Ca 0.30 0.19 -0.04 0.00 -1.01 0.00 0.00 55.97 55.40 3dej s LYS 88 Cb -0.18 -1.10 -0.04 0.00 -1.01 0.00 0.00 37.83 35.50 3dej s LYS 88 CO 0.18 -0.49 0.13 -0.80 0.51 0.00 0.00 175.35 174.87 3dej s ASN 89 N 2.18 6.14 -1.23 2.83 0.01 -1.26 0.43 114.94 124.04 3dej s ASN 89 Ca 0.04 0.34 -0.08 0.00 -0.71 0.00 0.00 52.86 52.45 3dej s ASN 89 Cb -0.14 -1.91 -0.01 0.00 0.41 0.00 0.00 41.25 39.60 3dej s ASN 89 CO -0.06 0.34 0.73 0.47 -1.51 0.00 0.00 177.10 177.06 3dej n ASP 90 N 1.55 -3.14 -4.81 -1.22 10.43 -0.40 -4.93 116.55 114.04 3dej n ASP 90 Ca -0.16 -0.89 -0.36 0.00 2.57 0.00 0.00 54.79 55.95 3dej n ASP 90 Cb 0.54 -3.87 -0.06 0.00 1.84 0.00 0.00 41.12 39.56 3dej n ASP 90 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3dej s LEU 91 N -6.47 4.29 0.68 0.64 1.43 -1.26 -4.86 118.68 113.12 3dej s LEU 91 Ca 0.22 1.52 -0.07 0.00 -1.03 0.00 0.00 54.13 54.77 3dej s LEU 91 Cb -0.06 -3.79 0.05 0.00 0.03 0.00 0.00 46.19 42.41 3dej s LEU 91 CO 0.83 -0.04 0.99 0.42 0.23 0.00 0.00 176.35 178.78 3dej s THR 92 N -1.63 2.60 0.25 5.49 -4.23 -1.26 -0.81 115.64 116.06 3dej s THR 92 Ca 0.47 -0.19 -0.02 0.00 -1.18 0.00 0.00 61.69 60.76 3dej s THR 92 Cb -0.16 -3.11 0.23 0.00 1.34 0.00 0.00 72.50 70.80 3dej s THR 92 CO 0.21 -0.12 1.76 0.08 -0.54 0.00 0.00 174.62 176.01 3dej h ARG 93 N -0.51 0.58 0.35 3.99 0.11 -1.83 -0.48 114.38 116.59 3dej h ARG 93 Ca -0.45 -0.03 -0.02 0.00 0.10 0.00 0.00 59.98 59.58 3dej h ARG 93 Cb 1.30 -0.13 0.00 0.00 1.11 0.00 0.00 29.97 32.25 3dej h ARG 93 CO 0.60 0.38 -0.17 0.93 0.10 0.00 0.00 179.97 181.82 3dej h GLU 94 N 0.60 -0.45 0.00 0.08 3.07 -1.95 -2.90 114.58 113.02 3dej h GLU 94 Ca 0.44 0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 59.32 3dej h GLU 94 Cb 0.60 0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 28.61 3dej h GLU 94 CO -0.35 -0.25 -0.03 0.93 -1.40 0.00 0.00 179.01 177.90 3dej h GLU 95 N -0.55 0.00 -0.01 2.33 5.08 -1.79 -0.35 114.58 119.29 3dej h GLU 95 Ca -0.05 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 3dej h GLU 95 Cb 0.41 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 3dej h GLU 95 CO 0.08 0.03 -0.01 0.82 -1.00 0.00 0.00 179.01 178.94 3dej h ILE 96 N 0.00 1.36 0.75 3.13 2.04 -1.07 -1.62 117.51 122.09 3dej h ILE 96 Ca -0.00 -1.06 -0.04 0.00 1.00 0.00 0.00 64.86 64.77 3dej h ILE 96 Cb 0.06 2.06 0.01 0.00 -0.74 0.00 0.00 36.82 38.21 3dej h ILE 96 CO 0.00 0.28 -0.36 0.58 0.00 0.00 0.00 178.15 178.65 3dej h VAL 97 N -0.42 0.23 -0.67 1.67 2.07 -1.22 -1.88 116.25 116.03 3dej h VAL 97 Ca 0.00 -0.07 0.08 0.00 0.82 0.00 0.00 66.70 67.53 3dej h VAL 97 Cb 0.46 0.25 -0.10 0.00 -1.52 0.00 0.00 31.29 30.38 3dej h VAL 97 CO 0.00 0.01 -0.32 1.21 0.02 0.00 0.00 177.57 178.49 3dej n GLU 98 N -5.50 -0.22 -0.16 1.57 2.13 -0.19 -1.56 120.64 116.71 3dej n GLU 98 Ca -0.14 1.02 -0.08 0.00 0.66 0.00 0.00 57.16 58.61 3dej n GLU 98 Cb 0.41 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.62 3dej n GLU 98 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 3dej h LEU 99 N 0.00 0.63 0.01 4.31 5.85 -0.79 -2.34 115.31 122.98 3dej h LEU 99 Ca 0.18 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 3dej h LEU 99 Cb 0.34 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.21 3dej h LEU 99 CO -0.65 0.62 -0.00 0.24 -0.34 0.00 0.00 178.44 178.31 3dej h MET 100 N 0.61 -0.01 -0.88 1.25 2.86 -0.84 -1.78 114.93 116.13 3dej h MET 100 Ca 0.16 0.00 0.17 0.00 -2.06 0.00 0.00 59.70 57.96 3dej h MET 100 Cb 0.18 0.00 -0.16 0.00 0.06 0.00 0.00 31.60 31.68 3dej h MET 100 CO -0.01 0.24 -0.24 -2.13 1.06 0.00 0.00 176.91 175.82 3dej n ARG 101 N -4.98 -0.10 -0.07 1.72 0.63 -0.60 -0.26 116.66 113.00 3dej n ARG 101 Ca -0.08 1.37 -0.14 0.00 -0.92 0.00 0.00 57.85 58.09 3dej n ARG 101 Cb 0.15 -2.04 -0.06 0.00 0.45 0.00 0.00 32.46 30.95 3dej n ARG 101 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 3dej h ASP 102 N 0.00 0.58 -0.05 6.15 3.45 -1.08 -1.62 116.42 123.84 3dej h ASP 102 Ca 0.40 -0.51 -0.09 0.00 0.43 0.00 0.00 57.03 57.26 3dej h ASP 102 Cb 0.62 -0.16 -0.01 0.00 -0.56 0.00 0.00 39.33 39.21 3dej h ASP 102 CO -0.90 0.98 -0.22 0.58 -1.57 0.00 0.00 179.24 178.11 3dej h VAL 103 N 0.20 1.25 -0.07 -1.35 2.07 -0.66 -2.68 116.25 115.00 3dej h VAL 103 Ca 0.02 -1.18 -0.02 0.00 0.82 0.00 0.00 66.70 66.34 3dej h VAL 103 Cb 0.84 1.30 -0.00 0.00 -1.52 0.00 0.00 31.29 31.92 3dej h VAL 103 CO 0.06 0.38 -0.04 0.77 0.02 0.00 0.00 177.57 178.76 3dej h SER 104 N 0.41 0.16 0.08 0.57 4.64 -0.61 -2.89 113.55 115.92 3dej h SER 104 Ca 0.07 -0.42 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 3dej h SER 104 Cb 0.61 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 3dej h SER 104 CO 0.04 0.54 0.00 0.29 -0.87 0.00 0.00 176.83 176.84 3dej n LYS 105 N -4.77 0.08 -1.12 4.77 4.76 -0.62 -4.73 118.16 116.54 3dej n LYS 105 Ca -0.07 0.21 -0.30 0.00 -2.87 0.00 0.00 58.31 55.27 3dej n LYS 105 Cb 0.26 -1.50 0.24 0.00 -1.84 0.00 0.00 35.03 32.19 3dej n LYS 105 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 3dej s GLU 106 N -2.49 -1.27 -0.45 1.97 2.02 -1.03 -5.01 118.70 112.44 3dej s GLU 106 Ca 0.05 -0.14 -0.08 0.00 0.02 0.00 0.00 54.97 54.82 3dej s GLU 106 Cb 0.03 -1.60 0.11 0.00 0.10 0.00 0.00 34.13 32.78 3dej s GLU 106 CO 0.07 -3.73 0.31 0.34 0.02 0.00 0.00 175.26 172.28 3dej s ASP 107 N -3.99 5.62 0.00 -0.19 2.15 -1.26 -4.92 116.67 114.08 3dej s ASP 107 Ca 0.72 -1.87 0.23 0.00 0.43 0.00 0.00 52.55 52.06 3dej s ASP 107 Cb -0.09 -1.98 0.40 0.00 -0.30 0.00 0.00 42.92 40.95 3dej s ASP 107 CO 0.56 -0.65 1.38 1.41 -0.17 0.00 0.00 175.17 177.70 3dej n HIS 108 N 4.86 0.36 -0.23 -5.34 8.25 -1.26 -4.53 115.22 117.32 3dej n HIS 108 Ca -0.07 -0.18 0.19 0.00 -0.26 0.00 0.00 57.72 57.40 3dej n HIS 108 Cb 0.41 0.00 0.52 0.00 1.12 0.00 0.00 29.99 32.04 3dej n HIS 108 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3dej h SER 109 N 4.40 0.39 -0.14 0.41 4.64 -1.91 0.21 113.55 121.55 3dej h SER 109 Ca 0.00 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 3dej h SER 109 Cb 0.96 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 3dej h SER 109 CO 0.00 0.16 0.00 0.29 -0.87 0.00 0.00 176.83 176.41 3dej n LYS 110 N -4.50 1.62 -4.53 4.77 5.02 -1.26 -4.89 118.16 114.38 3dej n LYS 110 Ca 0.19 -0.93 -0.34 0.00 -2.02 0.00 0.00 58.31 55.21 3dej n LYS 110 Cb 0.68 -1.38 -0.11 0.00 -0.02 0.00 0.00 35.03 34.20 3dej n LYS 110 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3dej s ARG 111 N -1.83 3.09 0.35 1.97 0.52 0.72 -2.27 118.95 121.51 3dej s ARG 111 Ca 0.32 -0.53 0.13 0.00 -0.52 0.00 0.00 55.73 55.13 3dej s ARG 111 Cb 0.17 -2.72 0.63 0.00 0.52 0.00 0.00 34.95 33.55 3dej s ARG 111 CO 0.26 0.52 1.76 0.77 0.02 0.00 0.00 175.30 178.63 3dej h SER 112 N 5.75 0.00 -2.69 0.23 0.02 -0.54 -3.47 113.55 112.85 3dej h SER 112 Ca -0.42 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.47 3dej h SER 112 Cb 1.18 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.72 3dej h SER 112 CO 0.56 0.44 0.17 -1.54 -1.14 0.00 0.00 176.83 175.32 3dej n SER 113 N -3.94 -1.72 -3.76 3.07 3.41 0.12 -4.24 113.62 106.57 3dej n SER 113 Ca -0.02 -2.29 -0.13 0.00 -0.26 0.00 0.00 58.87 56.18 3dej n SER 113 Cb 0.47 2.89 -0.13 0.00 -0.26 0.00 0.00 64.21 67.18 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 -3.59 -0.25 -0.09 7.33 5.36 -0.97 -3.94 117.98 121.83 3dej s PHE 114 Ca 0.14 0.62 0.02 0.00 -0.96 0.00 0.00 56.93 56.75 3dej s PHE 114 Cb -0.03 0.02 0.01 0.00 -0.34 0.00 0.00 43.02 42.68 3dej s PHE 114 CO 0.10 -0.17 -0.16 0.08 -1.46 0.00 0.00 175.22 173.61 3dej s VAL 115 N 0.86 1.47 -0.13 3.12 1.01 -1.00 -0.37 120.40 125.35 3dej s VAL 115 Ca -0.06 -0.65 0.02 0.00 0.00 0.00 0.00 61.98 61.29 3dej s VAL 115 Cb -0.08 -1.33 0.01 0.00 0.00 0.00 0.00 36.38 34.99 3dej s VAL 115 CO -0.05 0.43 -0.19 0.00 0.00 0.00 0.00 175.10 175.29 3dej s VAL 117 N 0.91 3.69 -0.14 0.00 1.01 0.16 -0.50 120.40 125.54 3dej s VAL 117 Ca -0.06 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.50 3dej s VAL 117 Cb -0.15 -2.59 0.00 0.00 0.00 0.00 0.00 36.38 33.65 3dej s VAL 117 CO -0.03 0.52 -0.19 -0.76 0.00 0.00 0.00 175.10 174.64 3dej s LEU 118 N 0.14 2.26 -0.28 3.92 1.43 0.32 -1.13 118.68 125.34 3dej s LEU 118 Ca -0.03 -0.54 0.03 0.00 -1.03 0.00 0.00 54.13 52.57 3dej s LEU 118 Cb -0.14 -1.49 0.07 0.00 0.03 0.00 0.00 46.19 44.66 3dej s LEU 118 CO 0.03 0.09 -0.06 -0.76 0.23 0.00 0.00 176.35 175.88 3dej s LEU 119 N 0.75 3.81 0.11 1.79 1.43 -0.45 -0.63 118.68 125.49 3dej s LEU 119 Ca -0.08 -1.61 -0.26 0.00 -1.03 0.00 0.00 54.13 51.15 3dej s LEU 119 Cb -0.16 -1.57 0.08 0.00 0.03 0.00 0.00 46.19 44.58 3dej s LEU 119 CO 0.00 -0.24 1.08 -0.55 0.23 0.00 0.00 176.35 176.86 3dej s SER 120 N 1.05 -0.10 0.86 2.29 0.15 -1.01 -1.80 113.70 115.14 3dej s SER 120 Ca -0.03 -0.38 -0.11 0.00 0.70 0.00 0.00 55.95 56.13 3dej s SER 120 Cb -0.20 0.39 0.11 0.00 -1.71 0.00 0.00 66.02 64.62 3dej s SER 120 CO -0.06 -0.73 1.16 -1.00 1.20 0.00 0.00 173.24 173.80 3dej s HIS 121 N -2.80 1.81 0.20 3.44 3.76 -1.26 -4.16 115.29 116.28 3dej s HIS 121 Ca 0.15 1.73 -0.23 0.00 -0.15 0.00 0.00 55.06 56.56 3dej s HIS 121 Cb 0.00 -3.35 0.05 0.00 1.11 0.00 0.00 32.58 30.39 3dej s HIS 121 CO 0.01 -2.68 0.85 0.20 -0.85 0.00 0.00 174.74 172.27 3dej s GLY 122 N -2.60 -0.19 0.26 -2.22 0.00 -1.26 -1.38 107.32 99.92 3dej s GLY 122 Ca 0.68 -0.02 0.01 0.00 0.00 0.00 0.00 44.72 45.39 3dej s GLY 122 CO 0.55 -0.02 0.09 -0.54 0.00 0.00 0.00 173.10 173.18 3dej s GLU 123 N -3.56 1.40 -0.39 2.90 2.02 0.30 -4.33 118.70 117.04 3dej s GLU 123 Ca 0.11 -1.76 -0.41 0.00 0.02 0.00 0.00 54.97 52.94 3dej s GLU 123 Cb -0.03 -0.28 -0.16 0.00 0.10 0.00 0.00 34.13 33.76 3dej s GLU 123 CO 0.03 -0.28 1.95 -1.91 0.02 0.00 0.00 175.26 175.07 3dej n GLU 124 N -0.46 0.66 -1.10 1.61 4.07 -1.17 0.19 120.64 124.44 3dej n GLU 124 Ca -0.00 0.21 -0.03 0.00 -0.06 0.00 0.00 57.16 57.28 3dej n GLU 124 Cb 0.66 -1.95 -0.01 0.00 -0.06 0.00 0.00 31.44 30.08 3dej n GLU 124 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3dej n GLY 125 N 5.67 0.58 2.83 8.31 0.00 -1.26 -5.00 105.19 116.31 3dej n GLY 125 Ca 0.39 -0.22 -0.17 0.00 0.00 0.00 0.00 46.02 46.01 3dej n GLY 125 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dej s ILE 126 N -1.84 0.18 0.05 -0.61 1.01 0.13 -1.80 121.20 118.32 3dej s ILE 126 Ca 0.00 0.07 0.03 0.00 0.00 0.00 0.00 60.65 60.74 3dej s ILE 126 Cb 0.00 -0.27 -0.04 0.00 0.01 0.00 0.00 42.46 42.16 3dej s ILE 126 CO 0.00 0.14 0.04 0.27 0.00 0.00 0.00 174.94 175.39 3dej s ILE 127 N 0.94 4.34 -0.05 2.92 -0.00 -0.66 -0.54 121.20 128.15 3dej s ILE 127 Ca -0.10 -0.72 -0.22 0.00 -0.00 0.00 0.00 60.65 59.61 3dej s ILE 127 Cb -0.13 -3.03 -0.04 0.00 -0.00 0.00 0.00 42.46 39.26 3dej s ILE 127 CO -0.02 0.22 0.63 -0.36 -0.00 0.00 0.00 174.94 175.41 3dej s PHE 128 N -1.26 3.61 0.66 1.37 0.08 -0.48 -0.50 117.98 121.45 3dej s PHE 128 Ca 0.25 1.18 -0.11 0.00 0.12 0.00 0.00 56.93 58.37 3dej s PHE 128 Cb -0.12 -2.69 -0.02 0.00 -0.57 0.00 0.00 43.02 39.62 3dej s PHE 128 CO 0.17 0.20 1.05 0.20 -0.10 0.00 0.00 175.22 176.75 3dej s GLY 129 N 0.37 1.65 0.61 4.36 0.00 0.18 -4.70 107.32 109.79 3dej s GLY 129 Ca 0.33 -0.15 0.30 0.00 0.00 0.00 0.00 44.72 45.20 3dej s GLY 129 CO 0.17 0.16 2.01 -0.91 0.00 0.00 0.00 173.10 174.52 3dej h THR 130 N -0.47 0.33 -0.05 0.90 1.35 -1.25 -1.44 112.91 112.28 3dej h THR 130 Ca -0.44 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 3dej h THR 130 Cb 1.21 0.74 0.00 0.00 -1.73 0.00 0.00 68.15 68.37 3dej h THR 130 CO 0.62 0.00 0.00 -0.46 -0.25 0.00 0.00 175.52 175.43 3dej n ASN 131 N -3.58 1.68 0.00 5.36 6.94 -1.26 -0.78 115.26 123.63 3dej n ASN 131 Ca 0.03 -1.45 0.00 0.00 -0.02 0.00 0.00 54.58 53.14 3dej n ASN 131 Cb 0.44 -0.03 0.00 0.00 -2.36 0.00 0.00 39.78 37.83 3dej n ASN 131 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3dej n GLY 132 N 0.12 1.01 3.78 4.83 0.00 -0.54 -4.86 105.19 109.53 3dej n GLY 132 Ca 0.03 -0.97 -0.37 0.00 0.00 0.00 0.00 46.02 44.71 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 -2.00 3.89 -0.04 1.61 0.04 -1.26 0.47 135.00 137.70 3dej s PRO 133 Ca 0.00 1.64 0.02 0.00 0.04 0.00 0.00 61.00 62.70 3dej s PRO 133 Cb 0.00 -2.42 0.02 0.00 0.04 0.00 0.00 34.50 32.14 3dej s PRO 133 CO 0.00 -0.41 -0.07 0.08 0.04 0.00 0.00 177.00 176.64 3dej s VAL 134 N -1.63 0.72 0.07 -0.36 1.01 0.34 -4.79 120.40 115.76 3dej s VAL 134 Ca 0.62 -0.25 -0.31 0.00 0.00 0.00 0.00 61.98 62.04 3dej s VAL 134 Cb -0.25 -0.69 -0.07 0.00 0.00 0.00 0.00 36.38 35.37 3dej s VAL 134 CO 0.31 0.26 1.34 -1.81 0.00 0.00 0.00 175.10 175.19 3dej s ASP 135 N 0.70 6.91 0.48 3.32 -0.00 -1.26 -1.65 116.67 125.16 3dej s ASP 135 Ca -0.11 2.17 0.13 0.00 -0.00 0.00 0.00 52.55 54.74 3dej s ASP 135 Cb -0.14 -2.58 1.11 0.00 -0.00 0.00 0.00 42.92 41.31 3dej s ASP 135 CO 0.01 -0.62 2.11 -0.07 -0.00 0.00 0.00 175.17 176.60 3dej h LEU 136 N 7.23 0.19 -0.57 1.23 3.38 -1.72 -2.30 115.31 122.75 3dej h LEU 136 Ca -0.41 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.56 3dej h LEU 136 Cb 1.20 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.88 3dej h LEU 136 CO 0.86 0.14 0.38 0.50 0.09 0.00 0.00 178.44 180.41 3dej h LYS 137 N 0.23 0.76 -0.60 1.13 1.63 -1.91 -0.84 116.57 116.97 3dej h LYS 137 Ca 0.07 -0.05 0.09 0.00 -0.85 0.00 0.00 60.65 59.92 3dej h LYS 137 Cb 0.01 -0.17 -0.07 0.00 -0.60 0.00 0.00 32.23 31.40 3dej h LYS 137 CO -0.01 0.50 0.21 -0.22 -3.45 0.00 0.00 179.45 176.48 3dej h LYS 138 N 0.78 0.38 -0.10 1.90 3.64 -1.81 0.13 116.57 121.49 3dej h LYS 138 Ca 0.21 -0.02 -0.16 0.00 -1.27 0.00 0.00 60.65 59.41 3dej h LYS 138 Cb -0.09 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.64 3dej h LYS 138 CO -0.05 0.25 -0.62 -0.84 -2.27 0.00 0.00 179.45 175.92 3dej h ILE 139 N 0.39 1.37 0.02 2.00 -0.00 -1.40 -3.22 117.51 116.67 3dej h ILE 139 Ca 0.30 -1.98 -0.24 0.00 -0.00 0.00 0.00 64.86 62.94 3dej h ILE 139 Cb 0.38 1.98 0.01 0.00 -0.00 0.00 0.00 36.82 39.18 3dej h ILE 139 CO -0.31 0.59 -1.00 0.71 -0.00 0.00 0.00 178.15 178.15 3dej h THR 140 N 0.26 1.39 -0.92 0.16 1.35 -0.85 -3.28 112.91 111.04 3dej h THR 140 Ca -0.01 -2.49 0.24 0.00 -0.55 0.00 0.00 66.41 63.60 3dej h THR 140 Cb 1.16 2.48 -0.05 0.00 -1.73 0.00 0.00 68.15 70.01 3dej h THR 140 CO 0.10 0.74 0.63 0.78 -0.25 0.00 0.00 175.52 177.53 3dej h ASN 141 N 0.23 0.18 0.01 5.36 2.35 -0.76 0.91 115.58 123.85 3dej h ASN 141 Ca -0.09 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 3dej h ASN 141 Cb 1.64 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 40.00 3dej h ASN 141 CO 0.17 0.06 0.00 0.49 -1.65 0.00 0.00 177.43 176.51 3dej n PHE 142 N -4.38 0.16 -0.05 1.19 3.72 -1.24 -1.85 117.46 115.02 3dej n PHE 142 Ca 0.20 0.08 0.00 0.00 -0.05 0.00 0.00 57.45 57.68 3dej n PHE 142 Cb 0.87 -0.63 0.00 0.00 -0.94 0.00 0.00 39.48 38.78 3dej n PHE 142 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 3dej n PHE 143 N -1.66 0.00 -2.46 1.38 3.72 0.31 -4.49 117.46 114.25 3dej n PHE 143 Ca -0.00 -0.23 -0.43 0.00 -0.05 0.00 0.00 57.45 56.74 3dej n PHE 143 Cb 0.01 -0.02 -0.02 0.00 -0.94 0.00 0.00 39.48 38.50 3dej n PHE 143 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 3dej s ARG 144 N -0.47 4.30 0.00 -1.08 1.70 -0.77 -4.70 118.95 117.94 3dej s ARG 144 Ca 0.00 1.64 0.00 0.00 -0.47 0.00 0.00 55.73 56.90 3dej s ARG 144 Cb 0.00 -3.64 0.00 0.00 -0.57 0.00 0.00 34.95 30.74 3dej s ARG 144 CO 0.00 -0.56 0.00 0.41 -1.08 0.00 0.00 175.30 174.07 3dej n GLY 145 N 3.45 0.00 0.09 3.88 0.00 -0.78 -0.37 105.19 111.46 3dej n GLY 145 Ca 0.12 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.99 3dej n GLY 145 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3dej h ASP 146 N 0.00 0.21 0.00 1.61 2.03 -1.89 -3.34 116.42 115.03 3dej h ASP 146 Ca 0.00 -0.79 0.00 0.00 -0.73 0.00 0.00 57.03 55.51 3dej h ASP 146 Cb 0.00 -0.06 0.00 0.00 -0.83 0.00 0.00 39.33 38.44 3dej h ASP 146 CO 0.00 0.97 0.00 0.54 -1.03 0.00 0.00 179.24 179.72 3dej n ARG 147 N -4.51 0.75 -3.11 4.15 1.74 0.50 -4.25 116.66 111.94 3dej n ARG 147 Ca -0.10 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.00 3dej n ARG 147 Cb 0.50 -1.06 -0.01 0.00 -1.02 0.00 0.00 32.46 30.88 3dej n ARG 147 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3dej h ARG 149 N 6.70 0.03 0.00 0.00 2.47 -1.74 -3.16 114.38 118.68 3dej h ARG 149 Ca 0.03 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 3dej h ARG 149 Cb 1.19 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.52 3dej h ARG 149 CO 0.06 0.71 0.00 -1.13 0.56 0.00 0.00 179.97 180.17 3dej n SER 150 N -3.74 0.00 -0.29 7.04 3.41 -1.26 -2.40 113.62 116.38 3dej n SER 150 Ca -0.01 0.22 0.05 0.00 -0.26 0.00 0.00 58.87 58.86 3dej n SER 150 Cb 0.67 -0.38 0.01 0.00 -0.26 0.00 0.00 64.21 64.25 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 -1.38 1.42 -4.67 1.04 4.77 -1.20 -3.43 117.00 113.55 3dej n LEU 151 Ca 0.08 -0.85 -0.47 0.00 -0.03 0.00 0.00 56.01 54.74 3dej n LEU 151 Cb 0.20 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.25 3dej n LEU 151 CO 0.18 0.28 1.34 0.41 -1.33 0.00 0.00 177.39 178.27 3dej n THR 152 N 0.04 0.29 -0.99 -5.08 -1.04 -1.01 -0.36 114.28 106.13 3dej n THR 152 Ca 0.05 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 3dej n THR 152 Cb 0.22 -1.70 0.00 0.00 -1.82 0.00 0.00 70.33 67.03 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 3.90 0.54 3.58 3.41 0.00 -1.26 -5.03 105.19 110.32 3dej n GLY 153 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.15 2.26 0.02 1.61 1.02 0.52 -4.90 119.74 120.12 3dej s LYS 154 Ca 0.00 -0.93 -0.30 0.00 0.02 0.00 0.00 55.97 54.75 3dej s LYS 154 Cb 0.00 -2.36 -0.07 0.00 -0.52 0.00 0.00 37.83 34.89 3dej s LYS 154 CO 0.00 0.54 1.55 -1.25 -0.92 0.00 0.00 175.35 175.26 3dej s PRO 155 N -1.94 4.23 -0.55 -1.68 0.04 -1.26 -4.83 135.00 129.01 3dej s PRO 155 Ca 0.20 2.15 -0.12 0.00 0.04 0.00 0.00 61.00 63.28 3dej s PRO 155 Cb -0.11 -3.66 0.14 0.00 0.04 0.00 0.00 34.50 30.91 3dej s PRO 155 CO 0.12 -0.69 0.46 0.15 0.04 0.00 0.00 177.00 177.07 3dej s LYS 156 N 2.80 2.79 -0.09 4.56 3.01 0.10 -2.29 119.74 130.62 3dej s LYS 156 Ca 0.70 -1.88 -0.16 0.00 -1.01 0.00 0.00 55.97 53.61 3dej s LYS 156 Cb -0.35 -4.10 -0.05 0.00 -1.01 0.00 0.00 37.83 32.32 3dej s LYS 156 CO 0.29 -1.25 0.42 -0.51 0.51 0.00 0.00 175.35 174.81 3dej s LEU 157 N 1.20 4.33 -0.18 3.17 1.43 0.50 -0.79 118.68 128.34 3dej s LEU 157 Ca 0.07 0.79 -0.00 0.00 -1.03 0.00 0.00 54.13 53.96 3dej s LEU 157 Cb -0.25 -2.59 0.04 0.00 0.03 0.00 0.00 46.19 43.42 3dej s LEU 157 CO -0.01 0.12 -0.06 -0.36 0.23 0.00 0.00 176.35 176.27 3dej s PHE 158 N 0.08 1.88 -0.26 0.29 0.40 0.11 -0.97 117.98 119.50 3dej s PHE 158 Ca 0.23 -1.24 -0.10 0.00 -0.60 0.00 0.00 56.93 55.22 3dej s PHE 158 Cb -0.15 -1.39 -0.05 0.00 0.51 0.00 0.00 43.02 41.94 3dej s PHE 158 CO 0.10 -0.66 0.16 0.42 0.70 0.00 0.00 175.22 175.95 3dej s ILE 159 N 1.57 5.18 -0.25 0.64 -1.09 0.35 0.31 121.20 127.91 3dej s ILE 159 Ca -0.00 0.12 0.02 0.00 -2.23 0.00 0.00 60.65 58.56 3dej s ILE 159 Cb -0.16 -3.45 0.05 0.00 -1.58 0.00 0.00 42.46 37.33 3dej s ILE 159 CO -0.08 0.29 -0.11 -0.63 -1.23 0.00 0.00 174.94 173.18 3dej s ILE 160 N 1.55 2.24 -0.70 2.92 1.09 0.12 -0.52 121.20 127.90 3dej s ILE 160 Ca 0.07 -1.49 -0.09 0.00 -1.10 0.00 0.00 60.65 58.04 3dej s ILE 160 Cb -0.15 -2.25 0.18 0.00 -1.06 0.00 0.00 42.46 39.18 3dej s ILE 160 CO 0.08 0.06 0.58 -1.58 -0.10 0.00 0.00 174.94 173.99 3dej s GLN 161 N 1.15 3.04 0.00 2.79 2.00 0.20 -1.09 119.66 127.75 3dej s GLN 161 Ca -0.06 -2.43 0.00 0.00 -2.00 0.00 0.00 55.36 50.87 3dej s GLN 161 Cb -0.19 -4.07 0.00 0.00 0.80 0.00 0.00 33.01 29.55 3dej s GLN 161 CO -0.06 -1.23 0.00 0.00 -0.50 0.00 0.00 175.29 173.50 3dej n ALA 162 N 3.84 0.00 -1.83 1.58 0.00 -1.26 -2.39 120.51 120.45 3dej n ALA 162 Ca 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.50 3dej n ALA 162 Cb 0.42 0.00 -0.03 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 -0.58 0.00 1.74 -0.21 -4.71 116.66 112.89 3dej n ARG 164 Ca 0.00 -0.37 0.00 0.00 -0.77 0.00 0.00 57.85 56.71 3dej n ARG 164 Cb 0.00 0.24 0.00 0.00 -1.02 0.00 0.00 32.46 31.68 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 0.67 0.04 -0.13 0.00 -1.20 -1.60 105.19 102.98 3dej n GLY 165 Ca -0.10 -1.80 0.04 0.00 0.00 0.00 0.00 46.02 44.16 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 9.00 0.00 -1.71 2.61 -2.24 -1.12 -3.13 114.28 117.69 3dej n THR 166 Ca 0.00 -0.31 -0.39 0.00 -2.27 0.00 0.00 64.05 61.08 3dej n THR 166 Cb 0.00 1.02 0.03 0.00 -2.10 0.00 0.00 70.33 69.28 3dej n THR 166 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3dej n GLU 167 N -1.02 1.71 -4.86 -0.78 1.02 -0.88 -4.33 120.64 111.49 3dej n GLU 167 Ca 0.02 0.62 -0.33 0.00 -0.02 0.00 0.00 57.16 57.45 3dej n GLU 167 Cb 0.15 -2.44 -0.14 0.00 -0.02 0.00 0.00 31.44 29.00 3dej n GLU 167 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3dej s LEU 168 N -2.46 2.72 -0.30 -4.62 1.02 -1.26 -0.55 118.68 113.22 3dej s LEU 168 Ca 0.67 -0.24 -0.14 0.00 0.02 0.00 0.00 54.13 54.44 3dej s LEU 168 Cb -0.46 -1.57 -0.03 0.00 0.02 0.00 0.00 46.19 44.15 3dej s LEU 168 CO 0.53 0.29 0.30 -0.62 0.02 0.00 0.00 176.35 176.87 3dej s ASP 169 N -0.37 6.14 0.34 2.29 -1.08 -1.26 -4.97 116.67 117.76 3dej s ASP 169 Ca 0.04 -0.03 0.08 0.00 -0.52 0.00 0.00 52.55 52.13 3dej s ASP 169 Cb -0.12 -2.17 0.61 0.00 -1.46 0.00 0.00 42.92 39.78 3dej s ASP 169 CO 0.02 -0.19 1.80 0.00 0.52 0.00 0.00 175.17 177.32 3dej n GLY 171 N -0.49 -2.43 3.22 0.00 0.00 -1.26 -4.60 105.19 99.63 3dej n GLY 171 Ca -0.01 -1.58 -0.13 0.00 0.00 0.00 0.00 46.02 44.30 3dej n GLY 171 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3dej s ILE 172 N -0.99 -0.00 0.65 -0.61 1.10 -1.26 -5.10 121.20 114.98 3dej s ILE 172 Ca 0.00 0.01 -0.16 0.00 -0.51 0.00 0.00 60.65 59.99 3dej s ILE 172 Cb 0.00 -0.47 -0.00 0.00 0.15 0.00 0.00 42.46 42.14 3dej s ILE 172 CO 0.00 0.00 1.14 -1.83 -2.11 0.00 0.00 174.94 172.14 3dej s GLU 173 N 0.24 2.76 0.29 3.50 1.03 -1.26 -5.22 118.70 120.03 3dej s GLU 173 Ca -0.01 1.52 -0.29 0.00 0.03 0.00 0.00 54.97 56.22 3dej s GLU 173 Cb -0.03 -1.93 -0.10 0.00 -0.80 0.00 0.00 34.13 31.27 3dej s GLU 173 CO -0.00 -1.30 1.11 0.95 -1.33 0.00 0.00 175.26 174.68 3dej s THR 174 N -2.14 3.45 0.00 1.83 -4.23 -1.26 -5.34 115.64 107.95 3dej s THR 174 Ca 0.70 1.45 0.00 0.00 -1.18 0.00 0.00 61.69 62.66 3dej s THR 174 Cb -0.23 -3.92 0.00 0.00 1.34 0.00 0.00 72.50 69.69 3dej s THR 174 CO 0.39 0.34 0.00 0.29 -0.54 0.00 0.00 174.62 175.10 3dej n LYS 186 N 1.13 0.00 -4.43 3.99 4.01 -1.26 -5.38 118.16 116.22 3dej n LYS 186 Ca -0.01 0.00 -0.23 0.00 -0.51 0.00 0.00 58.31 57.57 3dej n LYS 186 Cb 0.45 0.00 -0.10 0.00 -0.51 0.00 0.00 35.03 34.87 3dej n LYS 186 CO 0.00 0.00 0.00 0.96 -1.11 0.00 0.00 177.40 177.25 3dej s ILE 187 N 0.00 2.27 0.41 -0.18 -4.36 -1.26 -5.12 121.20 112.96 3dej s ILE 187 Ca 0.00 -2.35 -0.26 0.00 -0.26 0.00 0.00 60.65 57.78 3dej s ILE 187 Cb 0.00 -2.22 -0.09 0.00 1.25 0.00 0.00 42.46 41.40 3dej s ILE 187 CO 0.00 -0.45 1.36 -2.84 0.24 0.00 0.00 174.94 173.25 3dej s PRO 188 N -3.53 3.94 0.48 0.37 0.02 -1.26 -4.90 135.00 130.11 3dej s PRO 188 Ca 0.28 2.28 0.14 0.00 0.02 0.00 0.00 61.00 63.72 3dej s PRO 188 Cb -0.04 -2.78 1.11 0.00 0.02 0.00 0.00 34.50 32.81 3dej s PRO 188 CO 0.13 -0.56 2.07 -0.39 -0.33 0.00 0.00 177.00 177.91 3dej h VAL 189 N 2.52 1.07 -0.05 3.83 -1.51 -1.97 -2.48 116.25 117.66 3dej h VAL 189 Ca -0.50 -0.31 0.00 0.00 -1.23 0.00 0.00 66.70 64.66 3dej h VAL 189 Cb 1.25 1.12 0.00 0.00 -2.13 0.00 0.00 31.29 31.53 3dej h VAL 189 CO 0.63 0.09 0.00 0.47 -1.23 0.00 0.00 177.57 177.53 3dej n ASP 190 N -4.43 0.45 -4.92 4.19 8.00 -1.26 -1.87 116.55 116.71 3dej n ASP 190 Ca -0.02 -2.01 -0.26 0.00 0.71 0.00 0.00 54.79 53.20 3dej n ASP 190 Cb 0.16 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.15 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 -1.80 3.46 -1.57 2.24 0.00 -0.94 -4.25 121.76 118.92 3dej s ALA 191 Ca 0.04 -0.65 -0.03 0.00 0.00 0.00 0.00 51.96 51.32 3dej s ALA 191 Cb 0.02 -2.48 0.00 0.00 0.00 0.00 0.00 23.12 20.67 3dej s ALA 191 CO 0.02 -0.37 0.39 -0.25 0.00 0.00 0.00 175.76 175.55 3dej n ASP 192 N -2.22 -5.89 -4.66 0.00 8.00 0.14 -4.84 116.55 107.09 3dej n ASP 192 Ca 0.00 -0.19 -0.35 0.00 0.71 0.00 0.00 54.79 54.97 3dej n ASP 192 Cb 0.56 -4.77 -0.10 0.00 -0.02 0.00 0.00 41.12 36.79 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 -3.11 3.18 -0.04 1.24 0.08 -1.24 0.03 117.98 118.13 3dej s PHE 193 Ca 0.20 0.12 0.04 0.00 0.12 0.00 0.00 56.93 57.40 3dej s PHE 193 Cb -0.09 -1.88 -0.00 0.00 -0.57 0.00 0.00 43.02 40.48 3dej s PHE 193 CO 0.24 0.35 -0.15 -1.17 -0.10 0.00 0.00 175.22 174.39 3dej s LEU 194 N -0.48 1.91 -0.28 -0.37 2.96 0.03 -0.84 118.68 121.61 3dej s LEU 194 Ca 0.09 -0.31 0.03 0.00 -0.22 0.00 0.00 54.13 53.72 3dej s LEU 194 Cb -0.12 -0.87 0.07 0.00 0.50 0.00 0.00 46.19 45.77 3dej s LEU 194 CO 0.02 0.14 -0.07 -0.31 -1.32 0.00 0.00 176.35 174.81 3dej s TYR 195 N 0.01 3.37 -0.69 5.38 1.51 0.11 0.05 117.35 127.09 3dej s TYR 195 Ca -0.02 -2.44 -0.18 0.00 -1.01 0.00 0.00 57.07 53.41 3dej s TYR 195 Cb -0.10 -2.13 0.12 0.00 -0.11 0.00 0.00 41.96 39.74 3dej s TYR 195 CO 0.01 -0.89 0.80 0.00 -1.11 0.00 0.00 175.55 174.36 3dej s ALA 196 N 1.07 3.49 0.18 3.71 0.00 0.15 -1.07 121.76 129.28 3dej s ALA 196 Ca -0.05 -2.46 -0.24 0.00 0.00 0.00 0.00 51.96 49.21 3dej s ALA 196 Cb -0.20 -3.63 -0.08 0.00 0.00 0.00 0.00 23.12 19.21 3dej s ALA 196 CO -0.05 -2.47 0.76 0.71 0.00 0.00 0.00 175.76 174.71 3dej s TYR 197 N 2.38 3.84 0.08 0.00 2.02 -1.05 -0.70 117.35 123.92 3dej s TYR 197 Ca 0.16 1.57 0.33 0.00 -0.37 0.00 0.00 57.07 58.76 3dej s TYR 197 Cb -0.19 -2.73 1.31 0.00 -0.40 0.00 0.00 41.96 39.95 3dej s TYR 197 CO 0.02 0.47 1.96 0.66 -1.57 0.00 0.00 175.55 177.09 3dej h SER 198 N 4.10 0.00 -5.27 2.29 4.64 -1.41 -2.15 113.55 115.74 3dej h SER 198 Ca -0.47 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.74 3dej h SER 198 Cb 1.20 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.17 3dej h SER 198 CO 0.66 0.01 -0.32 0.42 -0.87 0.00 0.00 176.83 176.72 3dej s THR 199 N -3.65 0.06 0.64 2.95 -4.23 -1.26 -3.76 115.64 106.39 3dej s THR 199 Ca 0.01 -1.40 -0.17 0.00 -1.18 0.00 0.00 61.69 58.95 3dej s THR 199 Cb 0.09 -1.87 -0.01 0.00 1.34 0.00 0.00 72.50 72.05 3dej s THR 199 CO 0.55 -0.28 1.16 0.00 -0.54 0.00 0.00 174.62 175.51 3dej s ALA 200 N -3.97 2.44 0.16 3.99 0.00 -1.05 -4.18 121.76 119.16 3dej s ALA 200 Ca 0.18 0.80 -0.33 0.00 0.00 0.00 0.00 51.96 52.60 3dej s ALA 200 Cb 0.03 -3.40 -0.16 0.00 0.00 0.00 0.00 23.12 19.60 3dej s ALA 200 CO 0.01 -1.30 1.14 -2.30 0.00 0.00 0.00 175.76 173.30 3dej n PRO 201 N -2.08 1.04 0.00 0.00 -0.02 -1.26 -2.05 135.00 130.63 3dej n PRO 201 Ca 0.12 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 3dej n PRO 201 Cb 0.51 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 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 2.00 1.73 3.79 -1.23 0.00 -0.63 -5.02 105.19 105.84 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 -2.34 3.16 0.64 1.61 1.51 -0.87 -2.07 117.35 119.00 3dej s TYR 203 Ca 0.00 0.01 -0.17 0.00 -1.01 0.00 0.00 57.07 55.91 3dej s TYR 203 Cb 0.00 -1.55 -0.01 0.00 -0.11 0.00 0.00 41.96 40.29 3dej s TYR 203 CO 0.00 0.52 1.15 -0.47 -1.11 0.00 0.00 175.55 175.64 3dej s TYR 204 N -1.63 2.46 -0.20 2.71 5.04 0.28 -1.04 117.35 124.97 3dej s TYR 204 Ca 0.30 1.55 -0.01 0.00 -2.44 0.00 0.00 57.07 56.47 3dej s TYR 204 Cb -0.11 -3.32 0.01 0.00 0.35 0.00 0.00 41.96 38.89 3dej s TYR 204 CO 0.23 -1.97 -0.12 0.45 -1.34 0.00 0.00 175.55 172.80 3dej s SER 205 N -2.12 3.74 0.21 4.32 0.15 -1.26 -4.85 113.70 113.88 3dej s SER 205 Ca 0.72 -0.55 -0.30 0.00 0.70 0.00 0.00 55.95 56.52 3dej s SER 205 Cb -0.25 -1.61 -0.08 0.00 -1.71 0.00 0.00 66.02 62.37 3dej s SER 205 CO 0.38 -0.02 0.95 0.26 1.20 0.00 0.00 173.24 176.02 3dej s TRP 206 N 1.38 3.92 0.15 3.44 0.52 -1.26 -5.00 118.94 122.09 3dej s TRP 206 Ca 0.05 1.87 0.06 0.00 0.02 0.00 0.00 56.10 58.11 3dej s TRP 206 Cb -0.14 -3.02 -0.04 0.00 -1.15 0.00 0.00 33.47 29.13 3dej s TRP 206 CO -0.08 0.34 -0.14 1.03 0.02 0.00 0.00 176.95 178.12 3dej s ARG 207 N -0.86 1.12 -0.21 4.98 0.52 -1.26 -2.46 118.95 120.77 3dej s ARG 207 Ca 0.43 -1.36 -0.02 0.00 -0.52 0.00 0.00 55.73 54.26 3dej s ARG 207 Cb -0.26 -0.96 0.00 0.00 0.52 0.00 0.00 34.95 34.25 3dej s ARG 207 CO 0.32 0.18 -0.08 1.21 0.02 0.00 0.00 175.30 176.94 3dej s ASN 208 N -2.74 4.00 0.26 0.23 2.47 -0.92 -4.91 114.94 113.33 3dej s ASN 208 Ca 0.13 -0.50 -0.03 0.00 0.42 0.00 0.00 52.86 52.88 3dej s ASN 208 Cb -0.03 -1.67 0.38 0.00 -1.45 0.00 0.00 41.25 38.48 3dej s ASN 208 CO 0.04 -0.03 1.87 0.28 -3.72 0.00 0.00 177.10 175.54 3dej h SER 209 N 8.06 0.96 0.08 -4.21 0.02 -1.85 -0.87 113.55 115.74 3dej h SER 209 Ca -0.42 0.01 -0.15 0.00 -0.84 0.00 0.00 61.79 60.39 3dej h SER 209 Cb 1.15 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.50 3dej h SER 209 CO 0.61 0.61 -0.74 0.50 -1.14 0.00 0.00 176.83 176.67 3dej h LYS 210 N 1.10 0.17 -0.00 3.45 3.64 -1.92 -3.34 116.57 119.68 3dej h LYS 210 Ca 0.41 -0.29 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 3dej h LYS 210 Cb 0.18 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 3dej h LYS 210 CO -0.18 1.14 -0.76 -0.25 -2.27 0.00 0.00 179.45 177.13 3dej n ASP 211 N -4.26 1.02 0.00 4.20 8.00 -1.18 -4.98 116.55 119.35 3dej n ASP 211 Ca -0.17 -0.88 0.00 0.00 0.71 0.00 0.00 54.79 54.45 3dej n ASP 211 Cb 0.72 0.69 0.00 0.00 -0.02 0.00 0.00 41.12 42.52 3dej n ASP 211 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dej n GLY 212 N 1.48 2.37 3.75 0.44 0.00 -0.34 -4.93 105.19 107.96 3dej n GLY 212 Ca 0.06 -1.98 -0.37 0.00 0.00 0.00 0.00 46.02 43.73 3dej n GLY 212 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dej s SER 213 N 0.00 5.19 0.18 1.61 1.04 -1.26 -2.17 113.70 118.28 3dej s SER 213 Ca 0.00 2.56 -0.14 0.00 0.48 0.00 0.00 55.95 58.85 3dej s SER 213 Cb 0.00 -2.62 0.15 0.00 0.10 0.00 0.00 66.02 63.65 3dej s SER 213 CO 0.00 -1.61 1.72 -0.50 0.98 0.00 0.00 173.24 173.83 3dej h TRP 214 N 1.13 0.14 0.48 5.02 4.06 -1.84 0.64 115.95 125.59 3dej h TRP 214 Ca -0.51 0.03 -0.02 0.00 2.06 0.00 0.00 58.89 60.45 3dej h TRP 214 Cb 1.30 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.47 3dej h TRP 214 CO 0.46 0.01 -0.23 0.35 -3.56 0.00 0.00 178.44 175.47 3dej h PHE 215 N 0.22 -0.59 -0.40 0.49 3.57 -1.89 -2.07 116.94 116.27 3dej h PHE 215 Ca 0.22 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.71 3dej h PHE 215 Cb 0.28 0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.19 3dej h PHE 215 CO -0.21 -0.27 0.27 0.82 -2.23 0.00 0.00 178.31 176.68 3dej h ILE 216 N -0.98 1.09 -0.07 1.41 1.08 -1.92 0.42 117.51 118.54 3dej h ILE 216 Ca -0.07 -0.18 -0.00 0.00 -0.39 0.00 0.00 64.86 64.22 3dej h ILE 216 Cb 0.59 0.52 -0.00 0.00 -3.07 0.00 0.00 36.82 34.85 3dej h ILE 216 CO 0.11 0.10 0.04 -0.61 -0.69 0.00 0.00 178.15 177.09 3dej h GLN 217 N 0.53 0.10 -0.37 2.37 4.15 -0.86 -1.90 115.11 119.13 3dej h GLN 217 Ca 0.15 -0.01 -0.14 0.00 0.77 0.00 0.00 58.65 59.41 3dej h GLN 217 Cb -0.04 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.62 3dej h GLN 217 CO -0.03 0.16 -0.33 0.77 -1.93 0.00 0.00 178.83 177.47 3dej h SER 218 N 0.02 0.92 0.06 -0.69 0.02 -0.65 -2.50 113.55 110.73 3dej h SER 218 Ca 0.03 -0.46 0.03 0.00 -0.84 0.00 0.00 61.79 60.55 3dej h SER 218 Cb 0.09 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.32 3dej h SER 218 CO -0.00 1.19 -0.31 0.25 -1.14 0.00 0.00 176.83 176.81 3dej h LEU 219 N 0.67 -0.92 -0.79 5.07 5.85 -0.11 -0.97 115.31 124.11 3dej h LEU 219 Ca 0.06 0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 3dej h LEU 219 Cb 0.91 0.36 -0.04 0.00 0.37 0.00 0.00 40.66 42.27 3dej h LEU 219 CO 0.08 -0.39 0.34 0.00 -0.34 0.00 0.00 178.44 178.13 3dej h ALA 221 N 1.18 -0.29 0.00 0.00 0.00 -1.26 -0.70 119.26 118.19 3dej h ALA 221 Ca 0.27 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 3dej h ALA 221 Cb 0.19 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3dej h ALA 221 CO -0.03 -0.69 -0.28 1.98 0.00 0.00 0.00 179.25 180.24 3dej h MET 222 N -0.33 0.00 0.03 0.00 -1.53 -0.93 -1.34 114.93 110.83 3dej h MET 222 Ca 0.01 0.00 -0.00 0.00 -3.44 0.00 0.00 59.70 56.27 3dej h MET 222 Cb 0.32 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.37 3dej h MET 222 CO -0.05 0.28 -0.01 -0.07 0.14 0.00 0.00 176.91 177.19 3dej h LEU 223 N 0.00 -0.03 -0.94 3.39 3.38 -0.93 -2.28 115.31 117.90 3dej h LEU 223 Ca -0.00 -0.64 0.21 0.00 0.09 0.00 0.00 57.88 57.54 3dej h LEU 223 Cb 0.73 0.01 -0.12 0.00 0.09 0.00 0.00 40.66 41.37 3dej h LEU 223 CO 0.04 0.65 0.50 0.50 0.09 0.00 0.00 178.44 180.22 3dej h LYS 224 N -0.74 0.54 0.00 1.13 3.64 -0.87 0.41 116.57 120.68 3dej h LYS 224 Ca -0.00 -0.03 -0.15 0.00 -1.27 0.00 0.00 60.65 59.19 3dej h LYS 224 Cb 0.67 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.34 3dej h LYS 224 CO 0.01 0.35 -0.81 0.37 -2.27 0.00 0.00 179.45 177.10 3dej h GLN 225 N 0.55 0.00 0.00 1.90 4.15 -1.31 -3.41 115.11 116.99 3dej h GLN 225 Ca 0.58 0.00 0.00 0.00 0.77 0.00 0.00 58.65 60.00 3dej h GLN 225 Cb 1.03 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.72 3dej h GLN 225 CO -0.46 0.64 0.00 0.66 -1.93 0.00 0.00 178.83 177.74 3dej n TYR 226 N -3.22 0.00 0.20 3.99 4.01 -0.85 -4.84 117.16 116.45 3dej n TYR 226 Ca -0.01 0.00 0.18 0.00 -0.16 0.00 0.00 57.90 57.91 3dej n TYR 226 Cb 0.83 0.00 0.82 0.00 -0.31 0.00 0.00 39.34 40.68 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 1.82 -0.13 -0.72 0.00 -0.38 0.71 119.26 120.56 3dej h ALA 227 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dej h ALA 227 Cb 0.26 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3dej h ALA 227 CO 0.00 -0.34 0.00 -0.40 0.00 0.00 0.00 179.25 178.51 3dej n ASP 228 N -3.76 2.84 -0.00 0.00 5.68 -1.26 -3.79 116.55 116.26 3dej n ASP 228 Ca 0.02 -1.86 -0.04 0.00 -0.50 0.00 0.00 54.79 52.41 3dej n ASP 228 Cb 0.36 -0.08 -0.01 0.00 -1.14 0.00 0.00 41.12 40.25 3dej n ASP 228 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3dej n LYS 229 N 1.16 0.16 -3.88 0.11 5.02 0.14 -4.86 118.16 116.00 3dej n LYS 229 Ca 0.13 0.06 -0.21 0.00 -2.02 0.00 0.00 58.31 56.28 3dej n LYS 229 Cb 0.51 -0.77 -0.02 0.00 -0.02 0.00 0.00 35.03 34.72 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 -7.10 4.08 0.41 -0.35 1.43 -0.58 -5.09 118.68 111.48 3dej s LEU 230 Ca -0.09 -0.10 -0.25 0.00 -1.03 0.00 0.00 54.13 52.67 3dej s LEU 230 Cb 0.02 -2.68 -0.08 0.00 0.03 0.00 0.00 46.19 43.48 3dej s LEU 230 CO 0.13 -0.17 1.18 -0.70 0.23 0.00 0.00 176.35 177.02 3dej s GLU 231 N -4.00 3.99 0.29 1.70 -6.30 -1.26 -4.70 118.70 108.42 3dej s GLU 231 Ca 0.37 1.84 0.05 0.00 -2.50 0.00 0.00 54.97 54.73 3dej s GLU 231 Cb -0.09 -2.62 0.74 0.00 0.00 0.00 0.00 34.13 32.16 3dej s GLU 231 CO 0.28 -0.38 1.72 0.35 0.02 0.00 0.00 175.26 177.25 3dej h PHE 232 N 2.51 0.77 0.00 5.30 3.57 -1.37 0.19 116.94 127.92 3dej h PHE 232 Ca -0.49 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.00 3dej h PHE 232 Cb 1.24 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.77 3dej h PHE 232 CO 0.55 0.02 -0.25 0.52 -2.23 0.00 0.00 178.31 176.92 3dej h MET 233 N 0.49 0.00 0.00 1.11 2.86 -1.92 -1.52 114.93 115.94 3dej h MET 233 Ca 0.57 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 58.00 3dej h MET 233 Cb 1.04 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.67 3dej h MET 233 CO -0.49 0.25 -1.02 0.45 1.06 0.00 0.00 176.91 177.15 3dej h HIS 234 N 0.00 0.00 0.13 -0.22 3.86 -1.03 -2.24 115.15 115.65 3dej h HIS 234 Ca -0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 3dej h HIS 234 Cb 0.51 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.98 3dej h HIS 234 CO 0.00 0.95 -0.06 0.82 0.86 0.00 0.00 177.93 180.50 3dej h ILE 235 N 0.00 0.89 -0.09 2.45 1.08 -0.81 -1.85 117.51 119.18 3dej h ILE 235 Ca -0.04 -0.07 -0.07 0.00 -0.39 0.00 0.00 64.86 64.30 3dej h ILE 235 Cb 1.75 0.93 -0.01 0.00 -3.07 0.00 0.00 36.82 36.42 3dej h ILE 235 CO 0.12 0.02 -0.25 -0.07 -0.69 0.00 0.00 178.15 177.28 3dej h LEU 236 N -0.21 0.14 -0.94 1.44 3.38 -1.26 0.26 115.31 118.12 3dej h LEU 236 Ca -0.02 -0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.83 3dej h LEU 236 Cb 0.16 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3dej h LEU 236 CO 0.03 0.40 -0.11 0.74 0.09 0.00 0.00 178.44 179.59 3dej h THR 237 N 0.13 1.25 -0.45 0.22 2.02 -1.34 0.41 112.91 115.14 3dej h THR 237 Ca 0.02 -1.09 -0.11 0.00 0.77 0.00 0.00 66.41 66.00 3dej h THR 237 Cb 0.52 1.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 3dej h THR 237 CO 0.04 0.37 -0.16 0.03 0.37 0.00 0.00 175.52 176.16 3dej h ARG 238 N 0.60 0.91 -0.32 6.66 2.47 0.14 -2.05 114.38 122.78 3dej h ARG 238 Ca 0.11 -0.37 0.01 0.00 -1.26 0.00 0.00 59.98 58.47 3dej h ARG 238 Cb 0.53 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.79 3dej h ARG 238 CO 0.03 1.02 0.18 0.28 0.56 0.00 0.00 179.97 182.05 3dej h VAL 239 N 0.75 1.03 -0.72 2.04 2.07 -0.11 -1.03 116.25 120.26 3dej h VAL 239 Ca 0.11 -0.13 0.12 0.00 0.82 0.00 0.00 66.70 67.62 3dej h VAL 239 Cb 0.72 0.62 -0.09 0.00 -1.52 0.00 0.00 31.29 31.02 3dej h VAL 239 CO 0.05 0.07 0.30 0.78 0.02 0.00 0.00 177.57 178.79 3dej h ASN 240 N 0.38 0.31 -0.24 0.57 4.21 -0.07 -1.10 115.58 119.63 3dej h ASN 240 Ca 0.13 0.09 -0.04 0.00 1.21 0.00 0.00 56.30 57.69 3dej h ASN 240 Cb 0.01 0.06 -0.01 0.00 -1.12 0.00 0.00 38.32 37.26 3dej h ASN 240 CO -0.07 0.14 -0.00 -0.09 -1.29 0.00 0.00 177.43 176.12 3dej h ARG 241 N 0.47 0.42 -0.03 0.81 2.43 -0.77 -1.47 114.38 116.24 3dej h ARG 241 Ca 0.38 -0.14 0.02 0.00 -0.81 0.00 0.00 59.98 59.44 3dej h ARG 241 Cb 0.54 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 3dej h ARG 241 CO -0.36 0.60 -0.07 -0.22 -1.51 0.00 0.00 179.97 178.41 3dej h LYS 242 N 0.19 -0.11 -0.60 0.20 3.64 -0.77 0.83 116.57 119.96 3dej h LYS 242 Ca 0.07 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.39 3dej h LYS 242 Cb 0.41 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.23 3dej h LYS 242 CO 0.01 -0.07 0.13 0.28 -2.27 0.00 0.00 179.45 177.53 3dej h VAL 243 N -0.11 1.24 0.00 2.00 2.07 -1.17 -0.51 116.25 119.78 3dej h VAL 243 Ca 0.04 -0.91 -0.10 0.00 0.82 0.00 0.00 66.70 66.55 3dej h VAL 243 Cb 0.17 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 3dej h VAL 243 CO -0.10 0.34 -0.49 0.00 0.02 0.00 0.00 177.57 177.34 3dej h ALA 244 N 1.24 0.80 0.00 1.67 0.00 -0.88 -3.28 119.26 118.81 3dej h ALA 244 Ca 0.19 -0.45 -0.22 0.00 0.00 0.00 0.00 54.91 54.43 3dej h ALA 244 Cb 0.35 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 3dej h ALA 244 CO 0.00 0.61 -1.84 0.25 0.00 0.00 0.00 179.25 178.28 3dej n THR 245 N -3.39 0.84 0.45 0.00 -2.24 0.25 -4.66 114.28 105.54 3dej n THR 245 Ca 0.01 -0.43 0.12 0.00 -2.27 0.00 0.00 64.05 61.47 3dej n THR 245 Cb 0.64 -0.83 0.13 0.00 -2.10 0.00 0.00 70.33 68.18 3dej n THR 245 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3dej h GLU 246 N 0.00 0.00 -5.77 -0.78 5.08 -1.28 -3.47 114.58 108.36 3dej h GLU 246 Ca -0.33 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.36 3dej h GLU 246 Cb 1.65 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 30.65 3dej h GLU 246 CO -0.01 0.00 -0.77 -0.06 -1.00 0.00 0.00 179.01 177.17 3dej s PHE 247 N -3.21 2.76 -0.15 4.33 0.08 -1.24 -5.08 117.98 115.47 3dej s PHE 247 Ca 0.05 -0.43 -0.12 0.00 0.12 0.00 0.00 56.93 56.55 3dej s PHE 247 Cb 0.12 -1.74 0.04 0.00 -0.57 0.00 0.00 43.02 40.87 3dej s PHE 247 CO 0.73 -0.04 0.39 -2.00 -0.10 0.00 0.00 175.22 174.21 3dej s GLU 248 N -0.14 0.43 0.31 0.44 2.12 -1.26 -4.74 118.70 115.85 3dej s GLU 248 Ca -0.01 0.61 -0.28 0.00 0.36 0.00 0.00 54.97 55.66 3dej s GLU 248 Cb -0.14 0.14 -0.09 0.00 0.26 0.00 0.00 34.13 34.30 3dej s GLU 248 CO 0.03 -0.09 1.05 -1.54 -0.54 0.00 0.00 175.26 174.18 3dej s SER 249 N 0.60 7.20 -0.03 -1.70 1.04 -0.46 -4.86 113.70 115.49 3dej s SER 249 Ca -0.03 2.13 0.03 0.00 0.48 0.00 0.00 55.95 58.56 3dej s SER 249 Cb -0.05 -2.61 -0.03 0.00 0.10 0.00 0.00 66.02 63.43 3dej s SER 249 CO -0.04 -0.18 -0.09 0.12 0.98 0.00 0.00 173.24 174.03 3dej s PHE 250 N -1.32 2.83 -0.21 5.02 5.36 -1.26 0.81 117.98 129.21 3dej s PHE 250 Ca 0.48 -0.06 -0.27 0.00 -0.96 0.00 0.00 56.93 56.11 3dej s PHE 250 Cb -0.28 -1.64 0.10 0.00 -0.34 0.00 0.00 43.02 40.87 3dej s PHE 250 CO 0.35 0.30 0.90 0.45 -1.46 0.00 0.00 175.22 175.76 3dej s SER 251 N -1.04 -0.53 0.09 6.13 0.15 -1.26 -4.81 113.70 112.43 3dej s SER 251 Ca 0.14 0.85 0.20 0.00 0.70 0.00 0.00 55.95 57.84 3dej s SER 251 Cb -0.11 0.80 0.83 0.00 -1.71 0.00 0.00 66.02 65.83 3dej s SER 251 CO 0.04 -0.30 1.63 0.49 1.20 0.00 0.00 173.24 176.30 3dej n PHE 252 N 1.71 0.32 -3.88 3.44 0.99 -1.26 -4.58 117.46 114.21 3dej n PHE 252 Ca -0.13 0.12 -0.36 0.00 -0.00 0.00 0.00 57.45 57.08 3dej n PHE 252 Cb 0.56 -0.69 -0.13 0.00 -1.00 0.00 0.00 39.48 38.22 3dej n PHE 252 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 3dej s ASP 253 N -3.50 4.75 0.32 4.37 -1.08 -1.26 -5.00 116.67 115.27 3dej s ASP 253 Ca 0.08 -0.28 0.10 0.00 -0.52 0.00 0.00 52.55 51.93 3dej s ASP 253 Cb 0.11 -1.83 0.93 0.00 -1.46 0.00 0.00 42.92 40.67 3dej s ASP 253 CO 0.37 -0.01 1.68 0.00 0.52 0.00 0.00 175.17 177.73 3dej h ALA 254 N 8.04 1.73 -1.02 3.66 0.00 -1.95 -1.19 119.26 128.53 3dej h ALA 254 Ca -0.39 0.18 0.27 0.00 0.00 0.00 0.00 54.91 54.97 3dej h ALA 254 Cb 1.17 0.15 -0.13 0.00 0.00 0.00 0.00 17.79 18.98 3dej h ALA 254 CO 0.59 -0.45 0.61 1.15 0.00 0.00 0.00 179.25 181.15 3dej h THR 255 N 0.38 0.46 -0.24 0.00 2.02 -1.95 -1.90 112.91 111.69 3dej h THR 255 Ca 0.66 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.67 3dej h THR 255 Cb 1.39 -0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 3dej h THR 255 CO -0.57 0.09 0.00 0.49 0.37 0.00 0.00 175.52 175.89 3dej n PHE 256 N -4.89 0.55 -3.95 3.16 3.01 -0.46 -5.02 117.46 109.86 3dej n PHE 256 Ca 0.28 -0.70 -0.35 0.00 1.01 0.00 0.00 57.45 57.69 3dej n PHE 256 Cb 0.84 -0.16 -0.06 0.00 -0.01 0.00 0.00 39.48 40.09 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 -1.92 3.52 -1.39 1.38 2.46 -0.72 -4.22 115.29 114.41 3dej s HIS 257 Ca 0.29 0.43 -0.09 0.00 0.47 0.00 0.00 55.06 56.16 3dej s HIS 257 Cb 0.21 -1.88 0.03 0.00 -0.13 0.00 0.00 32.58 30.81 3dej s HIS 257 CO 0.10 0.67 1.06 0.00 -2.47 0.00 0.00 174.74 174.10 3dej n ALA 258 N 1.65 -1.46 -2.56 1.58 0.00 0.24 -4.93 120.51 115.03 3dej n ALA 258 Ca -0.17 0.23 -0.32 0.00 0.00 0.00 0.00 53.44 53.19 3dej n ALA 258 Cb 0.54 -4.50 -0.05 0.00 0.00 0.00 0.00 19.45 15.44 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 -6.26 3.70 0.45 0.00 -0.14 -1.25 -4.74 119.74 111.50 3dej s LYS 259 Ca 0.48 0.07 0.04 0.00 -1.36 0.00 0.00 55.97 55.21 3dej s LYS 259 Cb -0.23 -2.77 -0.05 0.00 -1.68 0.00 0.00 37.83 33.11 3dej s LYS 259 CO 0.77 0.41 0.01 0.15 -0.76 0.00 0.00 175.35 175.93 3dej s LYS 260 N -2.70 2.07 -0.19 1.68 -0.14 0.25 -1.36 119.74 119.35 3dej s LYS 260 Ca 0.43 -2.23 -0.13 0.00 -1.36 0.00 0.00 55.97 52.68 3dej s LYS 260 Cb -0.12 -1.60 0.06 0.00 -1.68 0.00 0.00 37.83 34.49 3dej s LYS 260 CO 0.23 -0.19 0.49 -1.14 -0.76 0.00 0.00 175.35 173.98 3dej s GLN 261 N -3.79 0.51 -0.12 1.68 0.74 -1.26 -4.05 119.66 113.37 3dej s GLN 261 Ca 0.22 0.82 0.01 0.00 0.05 0.00 0.00 55.36 56.47 3dej s GLN 261 Cb 0.06 0.12 -0.01 0.00 1.10 0.00 0.00 33.01 34.28 3dej s GLN 261 CO 0.11 -0.12 -0.16 -1.50 -0.55 0.00 0.00 175.29 173.07 3dej s ILE 262 N 1.01 2.76 1.11 -2.34 1.10 -1.26 -3.49 121.20 120.09 3dej s ILE 262 Ca -0.06 -0.77 -0.16 0.00 -0.51 0.00 0.00 60.65 59.15 3dej s ILE 262 Cb -0.06 -2.13 0.24 0.00 0.15 0.00 0.00 42.46 40.66 3dej s ILE 262 CO -0.09 0.53 1.11 -2.84 -2.11 0.00 0.00 174.94 171.55 3dej s PRO 263 N 0.36 -0.50 -0.19 3.50 0.02 -1.25 -2.52 135.00 134.42 3dej s PRO 263 Ca -0.13 0.13 -0.05 0.00 0.02 0.00 0.00 61.00 60.97 3dej s PRO 263 Cb -0.17 -1.66 0.07 0.00 0.02 0.00 0.00 34.50 32.76 3dej s PRO 263 CO 0.07 -3.27 0.10 0.00 -0.33 0.00 0.00 177.00 173.57 3dej s ILE 265 N 2.14 4.90 -0.28 0.00 -1.09 -1.26 -2.54 121.20 123.08 3dej s ILE 265 Ca 0.03 1.60 0.02 0.00 -2.23 0.00 0.00 60.65 60.08 3dej s ILE 265 Cb -0.16 -4.12 0.07 0.00 -1.58 0.00 0.00 42.46 36.67 3dej s ILE 265 CO -0.14 0.05 -0.03 -0.69 -1.23 0.00 0.00 174.94 172.90 3dej s VAL 266 N 2.00 1.88 -0.13 2.92 1.01 -0.23 -5.02 120.40 122.82 3dej s VAL 266 Ca 0.38 -1.67 0.00 0.00 0.00 0.00 0.00 61.98 60.69 3dej s VAL 266 Cb -0.17 -2.18 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 3dej s VAL 266 CO 0.13 -0.26 -0.14 -0.55 0.00 0.00 0.00 175.10 174.28 3dej s SER 267 N 1.18 3.87 -0.16 3.32 0.15 -1.26 0.07 113.70 120.88 3dej s SER 267 Ca -0.01 -0.37 0.15 0.00 0.70 0.00 0.00 55.95 56.41 3dej s SER 267 Cb -0.19 -1.59 0.41 0.00 -1.71 0.00 0.00 66.02 62.95 3dej s SER 267 CO -0.08 0.15 1.20 0.23 1.20 0.00 0.00 173.24 175.94 3dej n MET 268 N 3.65 1.19 -2.60 5.44 0.00 -0.02 -5.03 117.12 119.75 3dej n MET 268 Ca -0.18 -2.96 -0.34 0.00 0.00 0.00 0.00 57.70 54.21 3dej n MET 268 Cb 0.53 -1.23 -0.04 0.00 0.00 0.00 0.00 33.22 32.48 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 -2.44 3.92 0.00 4.03 1.43 -1.21 -0.68 118.68 123.73 3dej s LEU 269 Ca 0.37 1.90 0.11 0.00 -1.03 0.00 0.00 54.13 55.47 3dej s LEU 269 Cb 0.37 -4.49 0.13 0.00 0.03 0.00 0.00 46.19 42.23 3dej s LEU 269 CO -0.09 -0.64 0.93 0.35 0.23 0.00 0.00 176.35 177.13 3dej n THR 270 N -0.74 0.21 -3.82 5.49 -2.24 -1.26 -4.86 114.28 107.06 3dej n THR 270 Ca 0.08 -0.60 -0.10 0.00 -2.27 0.00 0.00 64.05 61.15 3dej n THR 270 Cb 0.52 1.07 -0.08 0.00 -2.10 0.00 0.00 70.33 69.75 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 -0.92 0.75 0.31 -0.78 1.02 -1.26 -4.96 119.74 113.90 3dej s LYS 271 Ca 0.15 -0.66 -0.29 0.00 0.02 0.00 0.00 55.97 55.19 3dej s LYS 271 Cb 0.10 0.32 -0.10 0.00 -0.52 0.00 0.00 37.83 37.62 3dej s LYS 271 CO 0.14 -0.23 1.26 -1.21 -0.92 0.00 0.00 175.35 174.39 3dej s GLU 272 N -2.80 4.43 -0.19 1.68 2.02 -0.53 -4.67 118.70 118.64 3dej s GLU 272 Ca -0.03 2.10 0.01 0.00 0.02 0.00 0.00 54.97 57.07 3dej s GLU 272 Cb 0.00 -3.11 0.02 0.00 0.10 0.00 0.00 34.13 31.14 3dej s GLU 272 CO -0.05 -0.10 -0.18 -1.17 0.02 0.00 0.00 175.26 173.78 3dej s LEU 273 N -1.56 2.24 -0.06 1.80 2.96 -1.26 -0.88 118.68 121.92 3dej s LEU 273 Ca 0.48 -0.64 0.05 0.00 -0.22 0.00 0.00 54.13 53.81 3dej s LEU 273 Cb -0.38 -1.51 -0.01 0.00 0.50 0.00 0.00 46.19 44.80 3dej s LEU 273 CO 0.49 -0.01 -0.22 -0.31 -1.32 0.00 0.00 176.35 174.98 3dej s TYR 274 N 1.31 2.17 -1.35 5.38 2.02 -1.26 -0.79 117.35 124.83 3dej s TYR 274 Ca 0.05 -0.67 0.29 0.00 -0.37 0.00 0.00 57.07 56.36 3dej s TYR 274 Cb -0.13 -1.44 1.27 0.00 -0.40 0.00 0.00 41.96 41.25 3dej s TYR 274 CO -0.12 -0.22 1.90 1.19 -1.57 0.00 0.00 175.55 176.73 3dej n PHE 275 N 3.10 0.00 0.00 2.71 3.72 -1.25 -4.65 117.46 121.10 3dej n PHE 275 Ca -0.18 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.22 3dej n PHE 275 Cb 0.52 -0.30 0.00 0.00 -0.94 0.00 0.00 39.48 38.76 3dej n PHE 275 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 3dej n TYR 276 N -1.25 0.00 -0.50 1.38 4.11 -1.26 -4.98 117.16 114.66 3dej n TYR 276 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 58.02 3dej n TYR 276 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.63 3dej n TYR 276 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.86 177.58