#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dei n ASP 34 N 0.00 4.64 -0.00 -1.43 4.64 -1.26 -4.54 116.55 118.59 3dei n ASP 34 Ca 0.00 -2.93 0.05 0.00 -1.38 0.00 0.00 54.79 50.53 3dei n ASP 34 Cb 0.00 -1.65 -0.08 0.00 -1.04 0.00 0.00 41.12 38.35 3dei n ASP 34 CO 0.00 0.00 0.00 0.59 -0.82 0.00 0.00 177.20 176.97 3dei n ASN 35 N 6.42 2.39 -4.40 1.67 5.03 -1.26 -5.03 115.26 120.09 3dei n ASN 35 Ca 0.47 -0.06 -0.26 0.00 0.87 0.00 0.00 54.58 55.60 3dei n ASN 35 Cb 0.41 1.44 -0.12 0.00 -1.02 0.00 0.00 39.78 40.50 3dei n ASN 35 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 3dei s SER 36 N -3.11 3.23 0.72 6.41 1.04 -1.26 -1.15 113.70 119.57 3dei s SER 36 Ca -0.03 -0.86 -0.15 0.00 0.48 0.00 0.00 55.95 55.39 3dei s SER 36 Cb 0.07 -0.23 0.03 0.00 0.10 0.00 0.00 66.02 65.99 3dei s SER 36 CO 0.44 0.08 1.17 -0.31 0.98 0.00 0.00 173.24 175.60 3dei s TYR 37 N -1.76 2.23 -0.20 5.02 2.02 -0.66 -4.88 117.35 119.12 3dei s TYR 37 Ca 0.19 1.59 -0.27 0.00 -0.37 0.00 0.00 57.07 58.22 3dei s TYR 37 Cb -0.07 -3.35 -0.00 0.00 -0.40 0.00 0.00 41.96 38.13 3dei s TYR 37 CO 0.09 -2.29 0.92 0.21 -1.57 0.00 0.00 175.55 172.90 3dei s LYS 38 N -4.03 4.27 0.00 -0.62 2.20 -1.26 -4.88 119.74 115.42 3dei s LYS 38 Ca 0.71 1.14 0.06 0.00 -0.36 0.00 0.00 55.97 57.52 3dei s LYS 38 Cb -0.26 -3.61 0.11 0.00 -1.51 0.00 0.00 37.83 32.56 3dei s LYS 38 CO 0.45 -0.48 0.92 -1.33 -0.36 0.00 0.00 175.35 174.56 3dei n MET 39 N 5.77 1.47 -0.51 4.03 2.81 -1.26 -4.65 117.12 124.79 3dei n MET 39 Ca 0.08 -1.35 0.09 0.00 -1.81 0.00 0.00 57.70 54.71 3dei n MET 39 Cb 0.48 -1.13 0.31 0.00 -0.71 0.00 0.00 33.22 32.17 3dei n MET 39 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 3dei n ASP 40 N 0.17 4.31 -4.45 7.83 5.68 -1.26 -4.73 116.55 124.10 3dei n ASP 40 Ca 0.05 -2.41 -0.33 0.00 -0.50 0.00 0.00 54.79 51.60 3dei n ASP 40 Cb 0.25 -0.51 0.11 0.00 -1.14 0.00 0.00 41.12 39.83 3dei n ASP 40 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 3dei n TYR 41 N 0.88 -1.14 0.22 2.11 4.02 -1.26 -4.85 117.16 117.14 3dei n TYR 41 Ca 0.23 0.27 0.17 0.00 -0.01 0.00 0.00 57.90 58.55 3dei n TYR 41 Cb 0.80 -1.83 0.84 0.00 -0.02 0.00 0.00 39.34 39.13 3dei n TYR 41 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 3dei h PRO 42 N -1.36 0.00 -5.75 -0.72 0.13 -1.92 -3.42 132.00 118.96 3dei h PRO 42 Ca -0.44 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.20 3dei h PRO 42 Cb 1.29 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.26 3dei h PRO 42 CO 0.36 0.00 -0.76 -1.21 -0.23 0.00 0.00 178.00 176.17 3dei s GLU 43 N -4.65 1.31 0.01 0.86 2.02 -0.25 -5.04 118.70 112.96 3dei s GLU 43 Ca -0.05 -1.50 -0.19 0.00 0.02 0.00 0.00 54.97 53.24 3dei s GLU 43 Cb 0.15 -1.24 -0.22 0.00 0.10 0.00 0.00 34.13 32.92 3dei s GLU 43 CO 0.55 0.23 1.12 0.52 0.02 0.00 0.00 175.26 177.71 3dei h MET 44 N 2.88 0.43 0.00 1.61 2.86 -1.81 0.20 114.93 121.10 3dei h MET 44 Ca -0.40 -0.43 0.00 0.00 -2.06 0.00 0.00 59.70 56.81 3dei h MET 44 Cb 1.22 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.99 3dei h MET 44 CO 0.57 1.09 0.00 0.41 1.06 0.00 0.00 176.91 180.04 3dei n GLY 45 N 0.99 2.61 3.86 8.32 0.00 -1.26 -0.61 105.19 119.10 3dei n GLY 45 Ca -0.10 -1.85 -0.33 0.00 0.00 0.00 0.00 46.02 43.74 3dei n GLY 45 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3dei s LEU 46 N 0.00 4.21 -0.29 0.99 0.05 -1.26 -1.34 118.68 121.04 3dei s LEU 46 Ca 0.00 1.05 0.02 0.00 0.05 0.00 0.00 54.13 55.25 3dei s LEU 46 Cb 0.00 -3.62 0.07 0.00 -2.05 0.00 0.00 46.19 40.59 3dei s LEU 46 CO 0.00 -0.04 -0.05 0.00 -0.55 0.00 0.00 176.35 175.71 3dei s ILE 48 N 1.07 5.14 -0.39 0.00 -1.09 -0.52 -1.21 121.20 124.20 3dei s ILE 48 Ca -0.04 -0.23 -0.11 0.00 -2.23 0.00 0.00 60.65 58.04 3dei s ILE 48 Cb -0.20 -3.94 0.04 0.00 -1.58 0.00 0.00 42.46 36.79 3dei s ILE 48 CO -0.05 -0.28 0.24 -0.63 -1.23 0.00 0.00 174.94 172.99 3dei s ILE 49 N 2.03 4.56 -0.19 2.92 1.01 -0.21 -1.21 121.20 130.11 3dei s ILE 49 Ca 0.11 -1.00 -0.21 0.00 0.00 0.00 0.00 60.65 59.55 3dei s ILE 49 Cb -0.17 -3.62 -0.02 0.00 0.01 0.00 0.00 42.46 38.66 3dei s ILE 49 CO 0.12 -0.33 0.64 -0.63 0.00 0.00 0.00 174.94 174.74 3dei s ILE 50 N 1.53 5.02 -0.46 2.92 1.09 -0.97 0.34 121.20 130.67 3dei s ILE 50 Ca 0.02 1.20 0.03 0.00 -1.10 0.00 0.00 60.65 60.81 3dei s ILE 50 Cb -0.20 -3.95 0.13 0.00 -1.06 0.00 0.00 42.46 37.37 3dei s ILE 50 CO 0.06 0.11 0.22 0.21 -0.10 0.00 0.00 174.94 175.43 3dei s ASN 51 N 1.19 4.14 -0.41 3.58 3.84 0.28 -1.28 114.94 126.27 3dei s ASN 51 Ca 0.29 -2.70 -0.19 0.00 0.21 0.00 0.00 52.86 50.47 3dei s ASN 51 Cb -0.16 -1.40 0.02 0.00 -0.55 0.00 0.00 41.25 39.16 3dei s ASN 51 CO 0.10 -0.27 0.53 0.20 -2.79 0.00 0.00 177.10 174.87 3dei s ASN 52 N 0.18 6.27 -0.18 -4.21 -0.87 -0.87 -1.25 114.94 114.00 3dei s ASN 52 Ca 0.16 -0.42 -0.13 0.00 -1.57 0.00 0.00 52.86 50.91 3dei s ASN 52 Cb -0.24 -2.27 -0.07 0.00 -0.02 0.00 0.00 41.25 38.65 3dei s ASN 52 CO -0.02 -0.64 -0.28 1.17 -2.57 0.00 0.00 177.10 174.75 3dei n LYS 53 N 5.89 0.45 -4.51 -0.60 4.81 -1.26 -4.61 118.16 118.32 3dei n LYS 53 Ca -0.05 0.19 -0.34 0.00 -0.87 0.00 0.00 58.31 57.25 3dei n LYS 53 Cb 0.48 -1.27 -0.12 0.00 0.02 0.00 0.00 35.03 34.14 3dei n LYS 53 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 3dei s ASN 54 N -6.51 4.68 0.00 3.14 0.01 -1.26 -1.57 114.94 113.43 3dei s ASN 54 Ca -0.28 -0.11 0.05 0.00 -0.71 0.00 0.00 52.86 51.81 3dei s ASN 54 Cb 0.08 -1.57 -0.03 0.00 0.41 0.00 0.00 41.25 40.14 3dei s ASN 54 CO 0.37 0.24 -0.12 -0.36 -1.51 0.00 0.00 177.10 175.71 3dei s PHE 55 N -0.05 2.73 0.52 2.20 0.40 -1.26 -4.76 117.98 117.76 3dei s PHE 55 Ca 0.01 -0.14 -0.22 0.00 -0.60 0.00 0.00 56.93 55.98 3dei s PHE 55 Cb -0.13 -1.57 -0.06 0.00 0.51 0.00 0.00 43.02 41.77 3dei s PHE 55 CO 0.03 0.29 1.25 0.72 0.70 0.00 0.00 175.22 178.21 3dei n HIS 56 N 1.74 1.95 0.30 0.36 8.25 0.08 -4.84 115.22 123.07 3dei n HIS 56 Ca -0.16 0.45 0.18 0.00 -0.26 0.00 0.00 57.72 57.94 3dei n HIS 56 Cb 0.52 -2.32 0.99 0.00 1.12 0.00 0.00 29.99 30.30 3dei n HIS 56 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 3dei h LYS 57 N 1.41 0.00 0.72 -0.41 1.79 -1.92 -2.43 116.57 115.73 3dei h LYS 57 Ca -0.49 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 57.94 3dei h LYS 57 Cb 1.31 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.97 3dei h LYS 57 CO 0.57 0.00 -0.35 0.77 -1.08 0.00 0.00 179.45 179.36 3dei h SER 58 N 0.00 -0.82 -1.44 0.86 0.02 -1.94 -3.08 113.55 107.15 3dei h SER 58 Ca 0.00 0.01 0.46 0.00 -0.84 0.00 0.00 61.79 61.43 3dei h SER 58 Cb 0.21 0.21 -0.11 0.00 0.14 0.00 0.00 62.40 62.85 3dei h SER 58 CO 0.00 -0.45 0.98 0.35 -1.14 0.00 0.00 176.83 176.57 3dei n THR 59 N -5.42 -0.15 -0.09 -2.27 -2.24 -0.91 -4.76 114.28 98.44 3dei n THR 59 Ca -0.12 1.53 0.00 0.00 -2.27 0.00 0.00 64.05 63.18 3dei n THR 59 Cb 0.39 -2.51 0.00 0.00 -2.10 0.00 0.00 70.33 66.10 3dei n THR 59 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dei n GLY 60 N -1.60 2.66 3.74 3.38 0.00 -1.16 -5.01 105.19 107.19 3dei n GLY 60 Ca 0.38 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.10 3dei n GLY 60 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3dei s MET 61 N -0.01 1.59 0.29 1.61 -1.94 -1.26 -5.06 119.30 114.52 3dei s MET 61 Ca 0.00 0.92 0.07 0.00 -1.71 0.00 0.00 55.69 54.97 3dei s MET 61 Cb 0.00 -1.84 -0.03 0.00 2.01 0.00 0.00 34.83 34.97 3dei s MET 61 CO 0.00 -2.04 0.26 0.95 -0.01 0.00 0.00 175.02 174.18 3dei s THR 62 N -2.93 4.13 0.08 2.05 -4.23 -1.26 -4.76 115.64 108.72 3dei s THR 62 Ca 0.63 -1.34 -0.31 0.00 -1.18 0.00 0.00 61.69 59.49 3dei s THR 62 Cb -0.18 -3.35 -0.07 0.00 1.34 0.00 0.00 72.50 70.24 3dei s THR 62 CO 0.57 -0.27 1.34 -0.44 -0.54 0.00 0.00 174.62 175.28 3dei s SER 63 N -3.93 6.90 -1.26 3.99 0.01 -1.26 -4.69 113.70 113.45 3dei s SER 63 Ca 0.37 2.20 -0.11 0.00 1.31 0.00 0.00 55.95 59.72 3dei s SER 63 Cb -0.07 -2.58 0.17 0.00 0.21 0.00 0.00 66.02 63.74 3dei s SER 63 CO 0.26 -0.62 1.73 0.54 0.41 0.00 0.00 173.24 175.56 3dei n ARG 64 N 4.23 3.52 -1.73 12.44 1.74 -0.61 -4.97 116.66 131.28 3dei n ARG 64 Ca 0.11 -3.62 -0.42 0.00 -0.77 0.00 0.00 57.85 53.15 3dei n ARG 64 Cb 0.44 -2.98 -0.00 0.00 -1.02 0.00 0.00 32.46 28.90 3dei n ARG 64 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3dei n SER 65 N 4.56 3.15 0.00 0.55 7.64 -1.26 -2.39 113.62 125.87 3dei n SER 65 Ca 0.39 1.21 0.00 0.00 1.01 0.00 0.00 58.87 61.48 3dei n SER 65 Cb 0.39 -1.54 0.00 0.00 -1.01 0.00 0.00 64.21 62.05 3dei n SER 65 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dei n GLY 66 N 0.65 3.22 0.39 0.23 0.00 -1.24 -4.52 105.19 103.92 3dei n GLY 66 Ca 0.03 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.22 3dei n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dei h THR 67 N 0.00 0.76 -0.84 2.61 1.03 -1.77 -0.07 112.91 114.63 3dei h THR 67 Ca 0.00 -0.14 0.10 0.00 -0.01 0.00 0.00 66.41 66.36 3dei h THR 67 Cb 0.00 0.31 -0.06 0.00 -1.07 0.00 0.00 68.15 67.33 3dei h THR 67 CO 0.00 0.07 0.55 0.44 -0.01 0.00 0.00 175.52 176.57 3dei h ASP 68 N 0.41 0.71 -0.96 0.00 3.32 -1.92 -0.42 116.42 117.56 3dei h ASP 68 Ca 0.40 0.02 0.13 0.00 0.02 0.00 0.00 57.03 57.60 3dei h ASP 68 Cb 0.96 -0.13 -0.08 0.00 0.22 0.00 0.00 39.33 40.30 3dei h ASP 68 CO -0.13 0.42 0.61 0.58 -1.72 0.00 0.00 179.24 178.99 3dei h VAL 69 N 0.79 0.90 0.23 -1.35 2.07 -1.36 0.11 116.25 117.64 3dei h VAL 69 Ca 0.39 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.59 3dei h VAL 69 Cb 0.47 -0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 3dei h VAL 69 CO -0.16 0.17 -0.11 0.44 0.02 0.00 0.00 177.57 177.92 3dei h ASP 70 N 0.90 -0.27 -0.25 0.57 3.32 -1.19 -1.41 116.42 118.09 3dei h ASP 70 Ca 0.48 -0.21 0.05 0.00 0.02 0.00 0.00 57.03 57.37 3dei h ASP 70 Cb 0.55 0.07 -0.05 0.00 0.22 0.00 0.00 39.33 40.12 3dei h ASP 70 CO -0.24 0.09 -0.06 0.00 -1.72 0.00 0.00 179.24 177.30 3dei h ALA 71 N 0.01 0.16 -0.52 3.45 0.00 -1.09 0.67 119.26 121.95 3dei h ALA 71 Ca -0.03 0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.04 3dei h ALA 71 Cb 0.46 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 3dei h ALA 71 CO 0.05 -0.47 0.22 0.00 0.00 0.00 0.00 179.25 179.06 3dei h ALA 72 N 1.25 0.65 0.00 0.00 0.00 -1.06 1.28 119.26 121.38 3dei h ALA 72 Ca 0.12 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3dei h ALA 72 Cb 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3dei h ALA 72 CO -0.26 -0.15 0.00 -0.97 0.00 0.00 0.00 179.25 177.87 3dei h ASN 73 N 0.43 0.00 0.20 0.00 -1.24 -0.07 -0.35 115.58 114.55 3dei h ASN 73 Ca 0.24 0.00 -0.35 0.00 0.71 0.00 0.00 56.30 56.90 3dei h ASN 73 Cb 0.21 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.22 3dei h ASN 73 CO -0.21 0.00 -2.03 0.18 -1.29 0.00 0.00 177.43 174.08 3dei n LEU 74 N -3.03 1.83 0.05 0.34 4.77 0.22 -2.74 117.00 118.44 3dei n LEU 74 Ca 0.00 0.19 -0.02 0.00 -0.03 0.00 0.00 56.01 56.15 3dei n LEU 74 Cb 0.27 -0.49 0.23 0.00 -2.33 0.00 0.00 43.42 41.10 3dei n LEU 74 CO 0.26 0.68 0.73 -0.09 -1.33 0.00 0.00 177.39 177.64 3dei h ARG 75 N 0.03 0.39 -0.03 3.23 2.43 0.17 -2.15 114.38 118.45 3dei h ARG 75 Ca -0.42 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 58.59 3dei h ARG 75 Cb 2.03 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 31.56 3dei h ARG 75 CO 0.05 0.64 -0.01 1.49 -1.51 0.00 0.00 179.97 180.63 3dei h GLU 76 N 0.35 0.06 -0.35 0.20 4.57 -1.18 -3.00 114.58 115.24 3dei h GLU 76 Ca 0.05 -0.03 -0.14 0.00 -1.18 0.00 0.00 59.36 58.06 3dei h GLU 76 Cb 0.67 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.25 3dei h GLU 76 CO 0.05 0.45 -0.35 1.15 -1.18 0.00 0.00 179.01 179.13 3dei h THR 77 N -0.32 1.28 0.00 0.32 2.02 -1.45 -2.41 112.91 112.35 3dei h THR 77 Ca 0.01 -1.52 -0.18 0.00 0.77 0.00 0.00 66.41 65.48 3dei h THR 77 Cb 0.43 1.46 -0.02 0.00 -1.74 0.00 0.00 68.15 68.28 3dei h THR 77 CO 0.00 0.50 -0.85 -0.26 0.37 0.00 0.00 175.52 175.29 3dei h PHE 78 N 0.64 0.11 -0.39 3.16 0.04 -1.52 -2.38 116.94 116.60 3dei h PHE 78 Ca 0.05 -0.06 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 3dei h PHE 78 Cb 0.93 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 39.06 3dei h PHE 78 CO 0.07 0.88 0.18 -0.09 -0.60 0.00 0.00 178.31 178.75 3dei h ARG 79 N 0.04 0.56 -0.82 1.51 2.43 -1.58 -0.83 114.38 115.69 3dei h ARG 79 Ca -0.02 -0.09 0.18 0.00 -0.81 0.00 0.00 59.98 59.24 3dei h ARG 79 Cb 1.48 -0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 30.88 3dei h ARG 79 CO 0.12 0.50 0.55 -0.91 -1.51 0.00 0.00 179.97 178.72 3dei h ASN 80 N 0.49 0.38 0.21 -3.80 4.21 -1.33 0.84 115.58 116.58 3dei h ASN 80 Ca 0.13 0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.67 3dei h ASN 80 Cb 0.13 -0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.29 3dei h ASN 80 CO -0.02 0.18 -0.04 0.18 -1.29 0.00 0.00 177.43 176.44 3dei n LEU 81 N -4.48 0.41 -0.44 1.61 4.77 -0.90 -4.95 117.00 113.02 3dei n LEU 81 Ca 0.17 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 3dei n LEU 81 Cb 0.62 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 3dei n LEU 81 CO 0.32 0.07 0.00 0.29 -1.33 0.00 0.00 177.39 176.74 3dei n LYS 82 N -0.84 0.00 -4.02 3.23 4.01 0.29 -4.96 118.16 115.87 3dei n LYS 82 Ca 0.18 0.00 -0.31 0.00 -0.51 0.00 0.00 58.31 57.67 3dei n LYS 82 Cb 0.23 -2.14 -0.06 0.00 -0.51 0.00 0.00 35.03 32.55 3dei n LYS 82 CO 0.00 0.00 0.00 0.71 -1.11 0.00 0.00 177.40 177.00 3dei s TYR 83 N -2.85 3.32 -1.25 2.13 1.51 -0.37 -4.10 117.35 115.74 3dei s TYR 83 Ca 0.00 0.17 -0.20 0.00 -1.01 0.00 0.00 57.07 56.03 3dei s TYR 83 Cb 0.00 -1.69 0.00 0.00 -0.11 0.00 0.00 41.96 40.16 3dei s TYR 83 CO 0.00 0.55 1.84 -1.91 -1.11 0.00 0.00 175.55 174.93 3dei n GLU 84 N 0.60 2.52 -2.11 -0.62 2.13 -0.45 -4.46 120.64 118.26 3dei n GLU 84 Ca -0.09 -2.89 -0.43 0.00 0.66 0.00 0.00 57.16 54.42 3dei n GLU 84 Cb 0.52 -3.56 -0.03 0.00 0.27 0.00 0.00 31.44 28.65 3dei n GLU 84 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 3dei s VAL 85 N 6.78 3.73 -0.26 6.31 1.01 -1.26 -2.34 120.40 134.37 3dei s VAL 85 Ca 0.59 0.87 0.00 0.00 0.00 0.00 0.00 61.98 63.45 3dei s VAL 85 Cb 0.03 -3.61 0.04 0.00 0.00 0.00 0.00 36.38 32.84 3dei s VAL 85 CO 0.09 -0.13 -0.07 -0.13 0.00 0.00 0.00 175.10 174.86 3dei s ARG 86 N 4.11 2.54 0.13 2.72 0.52 -0.35 -4.95 118.95 123.68 3dei s ARG 86 Ca 0.70 -1.17 -0.28 0.00 -0.52 0.00 0.00 55.73 54.46 3dei s ARG 86 Cb -0.29 -2.97 -0.07 0.00 0.52 0.00 0.00 34.95 32.14 3dei s ARG 86 CO 0.27 -0.50 0.89 1.21 0.02 0.00 0.00 175.30 177.19 3dei s ASN 87 N 1.23 7.45 -0.08 0.23 2.47 -1.26 -1.04 114.94 123.94 3dei s ASN 87 Ca -0.04 1.73 0.01 0.00 0.42 0.00 0.00 52.86 54.98 3dei s ASN 87 Cb -0.18 -2.55 0.02 0.00 -1.45 0.00 0.00 41.25 37.08 3dei s ASN 87 CO -0.05 0.04 -0.09 -0.75 -3.72 0.00 0.00 177.10 172.53 3dei s LYS 88 N -0.43 1.54 0.04 0.43 2.47 0.15 -4.94 119.74 119.00 3dei s LYS 88 Ca 0.42 -0.31 0.02 0.00 -1.56 0.00 0.00 55.97 54.54 3dei s LYS 88 Cb -0.23 -1.43 -0.04 0.00 -1.46 0.00 0.00 37.83 34.67 3dei s LYS 88 CO 0.28 -0.11 0.04 -0.80 0.16 0.00 0.00 175.35 174.92 3dei s ASN 89 N 1.14 5.31 -0.66 1.43 0.01 -1.26 0.99 114.94 121.90 3dei s ASN 89 Ca -0.06 -0.02 -0.17 0.00 -0.71 0.00 0.00 52.86 51.90 3dei s ASN 89 Cb -0.14 -1.40 0.03 0.00 0.41 0.00 0.00 41.25 40.14 3dei s ASN 89 CO -0.02 0.22 0.62 0.47 -1.51 0.00 0.00 177.10 176.89 3dei n ASP 90 N 0.90 -5.01 -4.85 -1.22 10.43 -0.38 -4.90 116.55 111.52 3dei n ASP 90 Ca -0.12 -0.62 -0.37 0.00 2.57 0.00 0.00 54.79 56.25 3dei n ASP 90 Cb 0.52 -1.57 -0.06 0.00 1.84 0.00 0.00 41.12 41.85 3dei n ASP 90 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3dei s LEU 91 N -3.85 4.38 0.82 0.64 1.43 -1.26 -4.92 118.68 115.91 3dei s LEU 91 Ca 0.17 0.52 -0.11 0.00 -1.03 0.00 0.00 54.13 53.68 3dei s LEU 91 Cb -0.02 -2.17 0.08 0.00 0.03 0.00 0.00 46.19 44.11 3dei s LEU 91 CO 0.88 0.36 1.09 0.42 0.23 0.00 0.00 176.35 179.33 3dei s THR 92 N -0.81 3.07 0.27 5.49 -4.23 -1.26 -0.11 115.64 118.07 3dei s THR 92 Ca 0.16 0.35 -0.00 0.00 -1.18 0.00 0.00 61.69 61.01 3dei s THR 92 Cb -0.13 -2.98 0.26 0.00 1.34 0.00 0.00 72.50 70.99 3dei s THR 92 CO 0.05 -0.45 1.81 0.08 -0.54 0.00 0.00 174.62 175.57 3dei h ARG 93 N -1.20 0.84 -0.40 3.99 0.11 -1.84 -0.58 114.38 115.31 3dei h ARG 93 Ca -0.47 -0.05 -0.02 0.00 0.10 0.00 0.00 59.98 59.54 3dei h ARG 93 Cb 1.26 -0.19 -0.02 0.00 1.11 0.00 0.00 29.97 32.13 3dei h ARG 93 CO 0.57 0.56 0.18 0.93 0.10 0.00 0.00 179.97 182.30 3dei h GLU 94 N 0.87 0.58 -0.36 0.08 3.07 -1.94 -3.04 114.58 113.83 3dei h GLU 94 Ca 0.47 -0.10 -0.07 0.00 -0.50 0.00 0.00 59.36 59.17 3dei h GLU 94 Cb 0.51 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.30 3dei h GLU 94 CO -0.28 0.53 -0.05 0.93 -1.40 0.00 0.00 179.01 178.74 3dei h GLU 95 N 0.50 0.60 0.36 2.33 5.08 -1.55 -2.49 114.58 119.41 3dei h GLU 95 Ca 0.13 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3dei h GLU 95 Cb 0.15 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 3dei h GLU 95 CO -0.01 0.66 -0.38 0.82 -1.00 0.00 0.00 179.01 179.09 3dei h ILE 96 N 0.56 0.22 0.38 3.13 1.08 -1.10 -1.46 117.51 120.32 3dei h ILE 96 Ca 0.11 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.57 3dei h ILE 96 Cb 0.44 0.22 -0.03 0.00 -3.07 0.00 0.00 36.82 34.38 3dei h ILE 96 CO 0.02 0.00 -0.51 0.58 -0.69 0.00 0.00 178.15 177.55 3dei h VAL 97 N -0.77 0.00 -0.71 1.67 2.07 -1.41 -2.00 116.25 115.10 3dei h VAL 97 Ca -0.02 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.57 3dei h VAL 97 Cb 0.70 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.38 3dei h VAL 97 CO -0.08 0.00 -0.38 1.21 0.02 0.00 0.00 177.57 178.34 3dei n GLU 98 N -5.50 -0.27 -0.25 1.57 2.13 -0.95 -1.24 120.64 116.13 3dei n GLU 98 Ca -0.11 1.07 -0.04 0.00 0.66 0.00 0.00 57.16 58.74 3dei n GLU 98 Cb 0.45 -1.58 0.13 0.00 0.27 0.00 0.00 31.44 30.71 3dei n GLU 98 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 3dei h LEU 99 N 0.00 0.99 0.10 4.31 5.85 -0.74 -1.53 115.31 124.29 3dei h LEU 99 Ca 0.15 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 3dei h LEU 99 Cb 0.32 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.10 3dei h LEU 99 CO -0.67 0.86 -0.05 0.24 -0.34 0.00 0.00 178.44 178.48 3dei h MET 100 N 1.07 -0.12 -0.90 1.25 2.86 -0.73 -1.38 114.93 116.98 3dei h MET 100 Ca 0.25 0.01 0.10 0.00 -2.06 0.00 0.00 59.70 58.00 3dei h MET 100 Cb 0.16 0.03 -0.12 0.00 0.06 0.00 0.00 31.60 31.73 3dei h MET 100 CO -0.03 0.38 -0.47 -2.13 1.06 0.00 0.00 176.91 175.72 3dei n ARG 101 N -4.88 -0.34 -0.27 1.72 0.63 -0.37 0.03 116.66 113.19 3dei n ARG 101 Ca -0.08 1.36 -0.03 0.00 -0.92 0.00 0.00 57.85 58.18 3dei n ARG 101 Cb 0.28 -2.01 0.09 0.00 0.45 0.00 0.00 32.46 31.27 3dei n ARG 101 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 3dei h ASP 102 N 0.00 0.78 1.21 6.15 3.45 -1.20 -1.84 116.42 124.97 3dei h ASP 102 Ca 0.20 -0.00 -0.05 0.00 0.43 0.00 0.00 57.03 57.61 3dei h ASP 102 Cb 0.42 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 39.01 3dei h ASP 102 CO -0.86 0.54 -0.22 0.58 -1.57 0.00 0.00 179.24 177.72 3dei h VAL 103 N 0.92 0.46 0.01 -1.35 2.07 0.02 -2.88 116.25 115.51 3dei h VAL 103 Ca 0.30 -1.24 -0.20 0.00 0.82 0.00 0.00 66.70 66.37 3dei h VAL 103 Cb 0.01 1.90 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 3dei h VAL 103 CO -0.11 0.21 -0.95 0.77 0.02 0.00 0.00 177.57 177.52 3dei h SER 104 N 0.00 0.08 1.05 0.57 4.64 0.28 -2.99 113.55 117.18 3dei h SER 104 Ca -0.00 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 3dei h SER 104 Cb 0.88 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 3dei h SER 104 CO 0.03 0.98 0.00 0.29 -0.87 0.00 0.00 176.83 177.26 3dei n LYS 105 N -3.48 0.08 -1.10 4.77 4.76 -0.76 -4.85 118.16 117.57 3dei n LYS 105 Ca -0.02 0.11 -0.34 0.00 -2.87 0.00 0.00 58.31 55.20 3dei n LYS 105 Cb 0.88 -1.60 0.12 0.00 -1.84 0.00 0.00 35.03 32.60 3dei n LYS 105 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3dei n GLU 106 N -1.74 0.17 -2.94 1.97 1.02 -1.10 -4.95 120.64 113.07 3dei n GLU 106 Ca 0.06 0.13 -0.43 0.00 -0.02 0.00 0.00 57.16 56.90 3dei n GLU 106 Cb 0.34 -2.39 -0.05 0.00 -0.02 0.00 0.00 31.44 29.33 3dei n GLU 106 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3dei s ASP 107 N -2.08 6.26 -0.23 1.62 2.15 -1.26 -4.89 116.67 118.24 3dei s ASP 107 Ca 0.72 -0.72 0.11 0.00 0.43 0.00 0.00 52.55 53.10 3dei s ASP 107 Cb -0.29 -2.38 0.72 0.00 -0.30 0.00 0.00 42.92 40.66 3dei s ASP 107 CO 0.52 -1.18 1.63 1.41 -0.17 0.00 0.00 175.17 177.37 3dei n HIS 108 N 7.11 1.94 -0.13 -5.34 8.25 -1.26 -4.51 115.22 121.27 3dei n HIS 108 Ca -0.03 -0.74 0.07 0.00 -0.26 0.00 0.00 57.72 56.76 3dei n HIS 108 Cb 0.46 -0.51 0.39 0.00 1.12 0.00 0.00 29.99 31.45 3dei n HIS 108 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 3dei h SER 109 N 3.30 0.58 -0.59 0.41 0.02 -1.91 -2.36 113.55 112.99 3dei h SER 109 Ca 0.05 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 3dei h SER 109 Cb 1.90 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 64.30 3dei h SER 109 CO 0.49 0.38 0.03 0.29 -1.14 0.00 0.00 176.83 176.88 3dei n LYS 110 N -4.47 4.81 -4.96 3.45 4.76 -1.26 -4.93 118.16 115.56 3dei n LYS 110 Ca 0.09 -3.17 -0.30 0.00 -2.87 0.00 0.00 58.31 52.06 3dei n LYS 110 Cb 0.22 -2.27 -0.15 0.00 -1.84 0.00 0.00 35.03 30.99 3dei n LYS 110 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3dei s ARG 111 N -2.80 1.81 0.33 1.97 0.52 -0.89 -1.09 118.95 118.80 3dei s ARG 111 Ca 0.55 -1.06 0.15 0.00 -0.52 0.00 0.00 55.73 54.85 3dei s ARG 111 Cb 0.42 -1.94 0.53 0.00 0.52 0.00 0.00 34.95 34.48 3dei s ARG 111 CO 0.16 0.51 1.68 0.77 0.02 0.00 0.00 175.30 178.43 3dei h SER 112 N 4.93 0.00 -5.51 0.23 0.02 -0.26 -3.47 113.55 109.49 3dei h SER 112 Ca -0.45 0.00 0.21 0.00 -0.84 0.00 0.00 61.79 60.71 3dei h SER 112 Cb 1.14 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.63 3dei h SER 112 CO 0.44 0.48 0.65 -0.94 -1.14 0.00 0.00 176.83 176.33 3dei s SER 113 N -6.62 -0.02 -0.05 3.07 1.04 0.22 -4.34 113.70 107.00 3dei s SER 113 Ca -0.00 -0.52 0.02 0.00 0.48 0.00 0.00 55.95 55.92 3dei s SER 113 Cb 0.12 0.41 0.02 0.00 0.10 0.00 0.00 66.02 66.66 3dei s SER 113 CO 0.72 -0.80 -0.08 0.12 0.98 0.00 0.00 173.24 174.17 3dei s PHE 114 N -2.28 1.09 -0.07 5.02 5.36 -0.79 -4.03 117.98 122.28 3dei s PHE 114 Ca 0.22 -0.37 0.04 0.00 -0.96 0.00 0.00 56.93 55.86 3dei s PHE 114 Cb -0.02 -0.86 -0.01 0.00 -0.34 0.00 0.00 43.02 41.79 3dei s PHE 114 CO 0.03 -0.23 -0.21 0.08 -1.46 0.00 0.00 175.22 173.44 3dei s VAL 115 N 0.77 2.43 -0.14 3.12 1.01 -0.98 0.69 120.40 127.31 3dei s VAL 115 Ca -0.13 -0.92 -0.01 0.00 0.00 0.00 0.00 61.98 60.91 3dei s VAL 115 Cb -0.15 -1.93 0.04 0.00 0.00 0.00 0.00 36.38 34.34 3dei s VAL 115 CO 0.02 0.57 -0.03 0.00 0.00 0.00 0.00 175.10 175.65 3dei s VAL 117 N 1.76 4.96 -0.14 0.00 1.01 -0.35 -1.92 120.40 125.72 3dei s VAL 117 Ca 0.02 0.53 -0.02 0.00 0.00 0.00 0.00 61.98 62.52 3dei s VAL 117 Cb -0.14 -3.66 0.04 0.00 0.00 0.00 0.00 36.38 32.62 3dei s VAL 117 CO -0.07 0.10 0.01 -0.76 0.00 0.00 0.00 175.10 174.38 3dei s LEU 118 N -2.38 0.96 -0.35 3.92 1.43 -0.44 -2.28 118.68 119.54 3dei s LEU 118 Ca 0.41 -0.47 -0.07 0.00 -1.03 0.00 0.00 54.13 52.97 3dei s LEU 118 Cb -0.13 -0.56 0.04 0.00 0.03 0.00 0.00 46.19 45.56 3dei s LEU 118 CO 0.20 -0.24 0.12 -0.76 0.23 0.00 0.00 176.35 175.91 3dei s LEU 119 N 1.88 4.40 0.00 1.79 1.43 -0.40 -1.60 118.68 126.18 3dei s LEU 119 Ca 0.02 -1.12 -0.20 0.00 -1.03 0.00 0.00 54.13 51.81 3dei s LEU 119 Cb -0.15 -1.90 0.07 0.00 0.03 0.00 0.00 46.19 44.25 3dei s LEU 119 CO -0.07 -0.34 0.95 -0.24 0.23 0.00 0.00 176.35 176.89 3dei n SER 120 N 4.85 -1.74 -4.75 2.29 2.88 -1.10 -2.05 113.62 114.00 3dei n SER 120 Ca -0.12 -1.96 -0.34 0.00 -1.33 0.00 0.00 58.87 55.11 3dei n SER 120 Cb 0.45 2.83 0.06 0.00 -0.75 0.00 0.00 64.21 66.80 3dei n SER 120 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 3dei s HIS 121 N -2.31 2.32 0.26 0.66 3.76 -1.26 -4.31 115.29 114.40 3dei s HIS 121 Ca 0.21 1.56 -0.12 0.00 -0.15 0.00 0.00 55.06 56.56 3dei s HIS 121 Cb -0.03 -3.39 -0.00 0.00 1.11 0.00 0.00 32.58 30.26 3dei s HIS 121 CO 0.06 -2.22 0.48 0.20 -0.85 0.00 0.00 174.74 172.41 3dei s GLY 122 N -2.02 0.62 0.10 -2.22 0.00 -1.26 -1.14 107.32 101.41 3dei s GLY 122 Ca 0.73 -0.94 -0.09 0.00 0.00 0.00 0.00 44.72 44.42 3dei s GLY 122 CO 0.40 -0.67 0.21 -0.54 0.00 0.00 0.00 173.10 172.50 3dei s GLU 123 N -3.92 0.91 -0.30 2.90 2.02 -0.28 -4.51 118.70 115.52 3dei s GLU 123 Ca 0.23 -1.00 -0.41 0.00 0.02 0.00 0.00 54.97 53.81 3dei s GLU 123 Cb -0.01 0.35 -0.17 0.00 0.10 0.00 0.00 34.13 34.41 3dei s GLU 123 CO 0.10 -0.30 1.69 -1.91 0.02 0.00 0.00 175.26 174.86 3dei n GLU 124 N -0.10 0.91 -0.74 1.61 4.07 -1.19 0.78 120.64 125.98 3dei n GLU 124 Ca -0.14 0.33 0.00 0.00 -0.06 0.00 0.00 57.16 57.30 3dei n GLU 124 Cb 0.63 -1.98 0.00 0.00 -0.06 0.00 0.00 31.44 30.03 3dei n GLU 124 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3dei n GLY 125 N 4.05 0.65 3.20 8.31 0.00 -1.26 -4.97 105.19 115.16 3dei n GLY 125 Ca 0.27 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.99 3dei n GLY 125 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dei s ILE 126 N -2.69 1.80 -0.07 -0.61 1.01 0.23 -1.04 121.20 119.84 3dei s ILE 126 Ca 0.00 -0.91 0.05 0.00 0.00 0.00 0.00 60.65 59.79 3dei s ILE 126 Cb 0.00 -1.55 -0.01 0.00 0.01 0.00 0.00 42.46 40.91 3dei s ILE 126 CO 0.00 0.51 -0.22 0.27 0.00 0.00 0.00 174.94 175.49 3dei s ILE 127 N 0.07 2.28 0.21 2.92 -4.36 -0.44 -1.13 121.20 120.75 3dei s ILE 127 Ca -0.08 -0.98 -0.30 0.00 -0.26 0.00 0.00 60.65 59.03 3dei s ILE 127 Cb -0.14 -1.86 -0.08 0.00 1.25 0.00 0.00 42.46 41.63 3dei s ILE 127 CO 0.04 0.57 1.01 -0.36 0.24 0.00 0.00 174.94 176.44 3dei s PHE 128 N -0.10 3.79 0.60 1.37 0.08 -0.29 -1.23 117.98 122.19 3dei s PHE 128 Ca -0.05 1.78 -0.03 0.00 0.12 0.00 0.00 56.93 58.76 3dei s PHE 128 Cb -0.14 -3.12 0.04 0.00 -0.57 0.00 0.00 43.02 39.22 3dei s PHE 128 CO 0.04 -0.03 0.86 0.20 -0.10 0.00 0.00 175.22 176.20 3dei s GLY 129 N -0.64 1.72 0.64 4.36 0.00 0.21 -4.66 107.32 108.96 3dei s GLY 129 Ca 0.45 -1.07 0.31 0.00 0.00 0.00 0.00 44.72 44.41 3dei s GLY 129 CO 0.34 -0.76 2.00 -0.91 0.00 0.00 0.00 173.10 173.77 3dei h THR 130 N -0.16 0.15 -0.00 0.90 1.35 -0.79 -1.77 112.91 112.58 3dei h THR 130 Ca -0.44 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 3dei h THR 130 Cb 1.29 0.73 0.00 0.00 -1.73 0.00 0.00 68.15 68.44 3dei h THR 130 CO 0.57 0.00 -0.07 -0.46 -0.25 0.00 0.00 175.52 175.31 3dei n ASN 131 N -3.21 1.09 0.00 5.36 6.94 -1.26 -0.74 115.26 123.44 3dei n ASN 131 Ca 0.00 -1.05 0.00 0.00 -0.02 0.00 0.00 54.58 53.52 3dei n ASN 131 Cb 0.38 0.30 0.00 0.00 -2.36 0.00 0.00 39.78 38.11 3dei n ASN 131 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3dei n GLY 132 N 0.56 0.58 3.82 4.83 0.00 -0.67 -4.63 105.19 109.67 3dei n GLY 132 Ca 0.03 -1.21 -0.31 0.00 0.00 0.00 0.00 46.02 44.53 3dei n GLY 132 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3dei s PRO 133 N -2.00 2.68 -0.08 1.61 0.04 -1.26 0.66 135.00 136.65 3dei s PRO 133 Ca 0.00 0.82 -0.06 0.00 0.04 0.00 0.00 61.00 61.80 3dei s PRO 133 Cb 0.00 -1.97 0.03 0.00 0.04 0.00 0.00 34.50 32.60 3dei s PRO 133 CO 0.00 -1.25 0.21 0.08 0.04 0.00 0.00 177.00 176.08 3dei s VAL 134 N -3.10 -0.01 -0.10 -0.36 1.01 -0.36 -4.74 120.40 112.73 3dei s VAL 134 Ca 0.59 0.05 -0.30 0.00 0.00 0.00 0.00 61.98 62.33 3dei s VAL 134 Cb -0.14 -0.31 -0.02 0.00 0.00 0.00 0.00 36.38 35.91 3dei s VAL 134 CO 0.55 0.02 1.16 -1.81 0.00 0.00 0.00 175.10 175.02 3dei s ASP 135 N 0.50 7.07 0.62 3.32 -0.00 -1.26 -1.33 116.67 125.59 3dei s ASP 135 Ca -0.03 1.70 0.35 0.00 -0.00 0.00 0.00 52.55 54.57 3dei s ASP 135 Cb -0.05 -2.55 2.02 0.00 -0.00 0.00 0.00 42.92 42.34 3dei s ASP 135 CO -0.03 -0.60 2.28 -0.07 -0.00 0.00 0.00 175.17 176.75 3dei h LEU 136 N 8.55 0.00 -0.14 1.23 3.38 -1.45 -1.27 115.31 125.60 3dei h LEU 136 Ca -0.31 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.62 3dei h LEU 136 Cb 1.14 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.89 3dei h LEU 136 CO 0.90 0.00 -0.08 0.50 0.09 0.00 0.00 178.44 179.86 3dei h LYS 137 N 0.00 0.30 -0.47 1.13 1.63 -1.91 -1.44 116.57 115.82 3dei h LYS 137 Ca 0.01 -0.14 0.14 0.00 -0.85 0.00 0.00 60.65 59.81 3dei h LYS 137 Cb 0.06 -0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.66 3dei h LYS 137 CO -0.00 0.64 0.52 -0.22 -3.45 0.00 0.00 179.45 176.94 3dei h LYS 138 N -0.04 0.00 0.00 1.90 1.63 -1.63 -1.48 116.57 116.96 3dei h LYS 138 Ca 0.03 0.00 -0.38 0.00 -0.85 0.00 0.00 60.65 59.45 3dei h LYS 138 Cb 0.55 0.00 -0.07 0.00 -0.60 0.00 0.00 32.23 32.11 3dei h LYS 138 CO 0.02 0.00 -2.44 0.44 -3.45 0.00 0.00 179.45 174.02 3dei n ILE 139 N -3.65 1.46 -0.12 2.00 -6.64 -1.09 -4.46 119.36 106.85 3dei n ILE 139 Ca 0.09 -0.66 -0.13 0.00 -1.77 0.00 0.00 62.75 60.28 3dei n ILE 139 Cb 0.71 -1.12 -0.02 0.00 -1.44 0.00 0.00 39.64 37.76 3dei n ILE 139 CO 0.00 0.00 0.00 0.71 -1.77 0.00 0.00 176.55 175.49 3dei h THR 140 N 0.00 1.27 -1.04 7.28 1.35 -1.06 -3.27 112.91 117.45 3dei h THR 140 Ca -0.57 -1.51 0.30 0.00 -0.55 0.00 0.00 66.41 64.08 3dei h THR 140 Cb 2.01 1.35 -0.04 0.00 -1.73 0.00 0.00 68.15 69.74 3dei h THR 140 CO -0.05 0.51 0.78 0.78 -0.25 0.00 0.00 175.52 177.28 3dei h ASN 141 N 0.74 0.00 0.00 5.36 4.21 -1.49 0.21 115.58 124.61 3dei h ASN 141 Ca 0.07 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.58 3dei h ASN 141 Cb 0.93 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.13 3dei h ASN 141 CO 0.09 0.00 0.08 0.49 -1.29 0.00 0.00 177.43 176.80 3dei n PHE 142 N -4.13 0.42 -0.15 1.19 3.72 -1.23 -2.21 117.46 115.07 3dei n PHE 142 Ca 0.22 0.22 0.00 0.00 -0.05 0.00 0.00 57.45 57.84 3dei n PHE 142 Cb 1.13 -0.79 0.00 0.00 -0.94 0.00 0.00 39.48 38.88 3dei n PHE 142 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 3dei n PHE 143 N -1.93 0.00 -2.63 1.38 3.72 0.75 -4.44 117.46 114.31 3dei n PHE 143 Ca -0.01 -0.39 -0.42 0.00 -0.05 0.00 0.00 57.45 56.59 3dei n PHE 143 Cb 0.10 -0.04 -0.03 0.00 -0.94 0.00 0.00 39.48 38.57 3dei n PHE 143 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 3dei s ARG 144 N -0.77 4.57 0.00 -1.08 1.70 -0.94 -4.61 118.95 117.82 3dei s ARG 144 Ca 0.00 1.54 0.00 0.00 -0.47 0.00 0.00 55.73 56.80 3dei s ARG 144 Cb 0.00 -3.40 0.00 0.00 -0.57 0.00 0.00 34.95 30.98 3dei s ARG 144 CO 0.00 -0.02 0.00 0.41 -1.08 0.00 0.00 175.30 174.61 3dei n GLY 145 N 2.71 0.00 0.18 3.88 0.00 -0.88 0.70 105.19 111.79 3dei n GLY 145 Ca 0.05 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.92 3dei n GLY 145 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3dei h ASP 146 N 0.00 0.69 -0.56 1.61 2.03 -1.90 -3.34 116.42 114.96 3dei h ASP 146 Ca 0.00 -0.52 0.00 0.00 -0.73 0.00 0.00 57.03 55.78 3dei h ASP 146 Cb 0.00 -0.21 0.00 0.00 -0.83 0.00 0.00 39.33 38.29 3dei h ASP 146 CO 0.00 1.31 0.00 0.54 -1.03 0.00 0.00 179.24 180.06 3dei n ARG 147 N -3.82 2.50 -2.76 4.15 1.74 0.22 -4.35 116.66 114.33 3dei n ARG 147 Ca -0.07 -2.08 -0.09 0.00 -0.77 0.00 0.00 57.85 54.83 3dei n ARG 147 Cb 0.81 -1.51 0.06 0.00 -1.02 0.00 0.00 32.46 30.80 3dei n ARG 147 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3dei h ARG 149 N 3.67 0.00 0.00 0.00 -0.00 -1.76 0.27 114.38 116.57 3dei h ARG 149 Ca -0.12 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.36 3dei h ARG 149 Cb 1.05 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.02 3dei h ARG 149 CO 0.27 0.00 0.00 0.66 0.00 0.00 0.00 179.97 180.90 3dei h SER 150 N 0.00 0.00 -0.01 7.04 4.64 -1.92 -3.07 113.55 120.24 3dei h SER 150 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dei h SER 150 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 3dei h SER 150 CO 0.00 0.00 -0.24 0.18 -0.87 0.00 0.00 176.83 175.90 3dei n LEU 151 N -3.07 1.15 -4.64 5.97 4.77 0.85 -3.85 117.00 118.16 3dei n LEU 151 Ca 0.01 -0.74 -0.51 0.00 -0.03 0.00 0.00 56.01 54.74 3dei n LEU 151 Cb 0.34 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.37 3dei n LEU 151 CO 0.28 0.23 1.11 0.41 -1.33 0.00 0.00 177.39 178.10 3dei n THR 152 N -0.35 0.11 -0.97 -5.08 -1.04 -0.59 -1.08 114.28 105.28 3dei n THR 152 Ca 0.04 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 3dei n THR 152 Cb 0.21 -1.19 0.00 0.00 -1.82 0.00 0.00 70.33 67.52 3dei n THR 152 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3dei n GLY 153 N 3.24 0.54 3.71 3.41 0.00 -1.26 -5.02 105.19 109.82 3dei n GLY 153 Ca 0.20 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.96 3dei n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dei s LYS 154 N -0.32 2.59 -0.03 1.61 1.02 -0.24 -4.95 119.74 119.43 3dei s LYS 154 Ca 0.00 -1.03 -0.30 0.00 0.02 0.00 0.00 55.97 54.66 3dei s LYS 154 Cb 0.00 -2.46 -0.05 0.00 -0.52 0.00 0.00 37.83 34.80 3dei s LYS 154 CO 0.00 0.46 1.37 -1.25 -0.92 0.00 0.00 175.35 175.01 3dei s PRO 155 N -3.03 4.28 -0.32 -1.68 0.04 -1.26 -4.84 135.00 128.19 3dei s PRO 155 Ca 0.29 1.91 -0.15 0.00 0.04 0.00 0.00 61.00 63.08 3dei s PRO 155 Cb -0.09 -3.61 -0.02 0.00 0.04 0.00 0.00 34.50 30.81 3dei s PRO 155 CO 0.20 -0.58 0.37 0.15 0.04 0.00 0.00 177.00 177.18 3dei s LYS 156 N 2.56 3.73 -0.15 4.56 3.01 0.20 -1.89 119.74 131.76 3dei s LYS 156 Ca 0.62 -0.25 -0.03 0.00 -1.01 0.00 0.00 55.97 55.30 3dei s LYS 156 Cb -0.30 -3.75 -0.03 0.00 -1.01 0.00 0.00 37.83 32.75 3dei s LYS 156 CO 0.25 -0.44 -0.04 -0.51 0.51 0.00 0.00 175.35 175.12 3dei s LEU 157 N 2.05 3.26 -0.25 3.17 1.43 0.22 -0.28 118.68 128.28 3dei s LEU 157 Ca 0.13 -0.11 0.01 0.00 -1.03 0.00 0.00 54.13 53.13 3dei s LEU 157 Cb -0.16 -1.78 0.07 0.00 0.03 0.00 0.00 46.19 44.34 3dei s LEU 157 CO 0.11 0.19 -0.03 -0.36 0.23 0.00 0.00 176.35 176.49 3dei s PHE 158 N 0.25 2.46 -0.30 0.29 0.40 0.22 -0.78 117.98 120.52 3dei s PHE 158 Ca -0.03 -1.86 -0.19 0.00 -0.60 0.00 0.00 56.93 54.26 3dei s PHE 158 Cb -0.14 -1.70 -0.01 0.00 0.51 0.00 0.00 43.02 41.68 3dei s PHE 158 CO 0.03 -0.80 0.55 0.42 0.70 0.00 0.00 175.22 176.12 3dei s ILE 159 N 1.37 5.01 -0.32 0.64 -1.09 -0.81 -0.01 121.20 125.99 3dei s ILE 159 Ca -0.03 0.71 0.03 0.00 -2.23 0.00 0.00 60.65 59.12 3dei s ILE 159 Cb -0.19 -3.93 0.09 0.00 -1.58 0.00 0.00 42.46 36.85 3dei s ILE 159 CO -0.08 -0.08 0.01 -0.63 -1.23 0.00 0.00 174.94 172.93 3dei s ILE 160 N 2.44 2.37 -0.90 2.92 1.01 0.78 -1.33 121.20 128.49 3dei s ILE 160 Ca 0.22 -2.05 -0.13 0.00 0.00 0.00 0.00 60.65 58.68 3dei s ILE 160 Cb -0.15 -2.61 0.23 0.00 0.01 0.00 0.00 42.46 39.93 3dei s ILE 160 CO 0.11 -0.41 0.87 -1.58 0.00 0.00 0.00 174.94 173.94 3dei s GLN 161 N 1.00 3.75 0.00 2.79 2.00 -0.63 -1.21 119.66 127.35 3dei s GLN 161 Ca 0.04 -2.61 0.00 0.00 -2.00 0.00 0.00 55.36 50.79 3dei s GLN 161 Cb -0.20 -4.49 0.00 0.00 0.80 0.00 0.00 33.01 29.13 3dei s GLN 161 CO -0.06 -1.30 0.00 0.00 -0.50 0.00 0.00 175.29 173.42 3dei n ALA 162 N 3.81 0.00 -1.78 1.58 0.00 -1.26 -2.73 120.51 120.13 3dei n ALA 162 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.61 3dei n ALA 162 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 3dei n ALA 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3dei n ARG 164 N 0.00 0.00 -2.27 0.00 1.74 -0.13 -4.68 116.66 111.32 3dei n ARG 164 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3dei n ARG 164 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 3dei n ARG 164 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dei n GLY 165 N 0.00 -0.13 0.15 -0.13 0.00 -1.07 -1.68 105.19 102.33 3dei n GLY 165 Ca 0.00 -1.49 0.05 0.00 0.00 0.00 0.00 46.02 44.58 3dei n GLY 165 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3dei n THR 166 N 9.00 1.13 -2.14 2.61 -2.24 -1.06 -3.10 114.28 118.49 3dei n THR 166 Ca 0.00 -1.31 -0.33 0.00 -2.27 0.00 0.00 64.05 60.14 3dei n THR 166 Cb 0.00 0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.41 3dei n THR 166 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3dei s GLU 167 N -1.62 3.45 -0.07 -0.78 2.02 -0.86 -4.65 118.70 116.19 3dei s GLU 167 Ca 0.16 1.18 0.04 0.00 0.02 0.00 0.00 54.97 56.37 3dei s GLU 167 Cb 0.14 -2.05 -0.02 0.00 0.10 0.00 0.00 34.13 32.30 3dei s GLU 167 CO 0.01 -0.71 -0.19 -0.51 0.02 0.00 0.00 175.26 173.89 3dei s LEU 168 N -4.35 2.44 -0.25 1.80 1.02 -1.26 -1.31 118.68 116.77 3dei s LEU 168 Ca 0.63 -0.36 -0.25 0.00 0.02 0.00 0.00 54.13 54.17 3dei s LEU 168 Cb -0.15 -1.49 -0.00 0.00 0.02 0.00 0.00 46.19 44.57 3dei s LEU 168 CO 0.35 0.26 0.87 -0.62 0.02 0.00 0.00 176.35 177.23 3dei s ASP 169 N -0.25 6.86 0.39 2.29 -1.08 -1.26 -4.94 116.67 118.68 3dei s ASP 169 Ca 0.00 1.05 0.21 0.00 -0.52 0.00 0.00 52.55 53.29 3dei s ASP 169 Cb -0.13 -2.45 0.71 0.00 -1.46 0.00 0.00 42.92 39.59 3dei s ASP 169 CO 0.03 -0.56 1.74 0.00 0.52 0.00 0.00 175.17 176.90 3dei n GLY 171 N 0.31 -2.04 3.14 0.00 0.00 -1.26 -4.71 105.19 100.63 3dei n GLY 171 Ca 0.00 -1.42 -0.12 0.00 0.00 0.00 0.00 46.02 44.48 3dei n GLY 171 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3dei s ILE 172 N -2.19 0.04 -0.85 -0.61 -1.16 -1.26 -5.10 121.20 110.08 3dei s ILE 172 Ca 0.00 -0.31 0.01 0.00 -0.51 0.00 0.00 60.65 59.84 3dei s ILE 172 Cb 0.00 -0.41 0.27 0.00 0.61 0.00 0.00 42.46 42.92 3dei s ILE 172 CO 0.00 -0.17 1.02 -1.84 -2.81 0.00 0.00 174.94 171.14 3dei n GLU 173 N 2.16 3.25 0.03 3.50 -0.00 -1.26 -5.20 120.64 123.13 3dei n GLU 173 Ca -0.18 -4.60 0.00 0.00 -0.00 0.00 0.00 57.16 52.39 3dei n GLU 173 Cb 0.57 -2.38 0.00 0.00 -0.00 0.00 0.00 31.44 29.63 3dei n GLU 173 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.13 174.74 3dei n HIS 185 N 1.27 0.00 -3.95 -1.84 -0.00 -1.26 -5.33 115.22 104.11 3dei n HIS 185 Ca 0.27 0.00 -0.10 0.00 -0.00 0.00 0.00 57.72 57.89 3dei n HIS 185 Cb 0.37 0.00 -0.12 0.00 -0.00 0.00 0.00 29.99 30.24 3dei n HIS 185 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.34 176.49 3dei s LYS 186 N -0.99 0.22 0.18 -1.40 1.02 -1.26 -5.17 119.74 112.35 3dei s LYS 186 Ca 0.00 -0.41 0.07 0.00 0.02 0.00 0.00 55.97 55.65 3dei s LYS 186 Cb 0.00 0.04 -0.05 0.00 -0.52 0.00 0.00 37.83 37.31 3dei s LYS 186 CO 0.00 -0.02 -0.13 0.96 -0.92 0.00 0.00 175.35 175.23 3dei s ILE 187 N -0.95 1.56 0.49 2.17 -4.36 -1.26 -5.14 121.20 113.72 3dei s ILE 187 Ca -0.10 -2.12 -0.23 0.00 -0.26 0.00 0.00 60.65 57.94 3dei s ILE 187 Cb -0.07 -1.94 -0.07 0.00 1.25 0.00 0.00 42.46 41.64 3dei s ILE 187 CO -0.01 -0.61 1.29 -2.84 0.24 0.00 0.00 174.94 173.02 3dei s PRO 188 N -3.55 3.51 0.29 0.37 0.02 -1.26 -4.92 135.00 129.47 3dei s PRO 188 Ca 0.19 2.09 0.10 0.00 0.02 0.00 0.00 61.00 63.41 3dei s PRO 188 Cb -0.00 -2.42 0.43 0.00 0.02 0.00 0.00 34.50 32.53 3dei s PRO 188 CO 0.05 -0.84 1.66 -0.39 -0.33 0.00 0.00 177.00 177.14 3dei h VAL 189 N 1.82 1.40 -0.10 3.83 -1.51 -1.96 -3.08 116.25 116.65 3dei h VAL 189 Ca -0.50 -1.91 0.00 0.00 -1.23 0.00 0.00 66.70 63.06 3dei h VAL 189 Cb 1.27 2.02 0.00 0.00 -2.13 0.00 0.00 31.29 32.46 3dei h VAL 189 CO 0.59 0.55 0.00 0.47 -1.23 0.00 0.00 177.57 177.95 3dei n ASP 190 N -3.88 1.33 -4.93 4.19 8.00 -1.26 -2.06 116.55 117.94 3dei n ASP 190 Ca -0.01 -2.09 -0.25 0.00 0.71 0.00 0.00 54.79 53.14 3dei n ASP 190 Cb 0.57 -0.37 0.02 0.00 -0.02 0.00 0.00 41.12 41.32 3dei n ASP 190 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dei s ALA 191 N -1.47 3.50 -2.01 2.24 0.00 -1.17 -4.31 121.76 118.54 3dei s ALA 191 Ca 0.08 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.19 3dei s ALA 191 Cb 0.06 -2.41 0.00 0.00 0.00 0.00 0.00 23.12 20.77 3dei s ALA 191 CO 0.03 -0.62 0.00 -0.25 0.00 0.00 0.00 175.76 174.92 3dei n ASP 192 N -2.37 -5.20 -4.83 0.00 8.00 -0.02 -4.82 116.55 107.30 3dei n ASP 192 Ca 0.03 0.41 -0.38 0.00 0.71 0.00 0.00 54.79 55.57 3dei n ASP 192 Cb 0.58 -4.58 -0.06 0.00 -0.02 0.00 0.00 41.12 37.03 3dei n ASP 192 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3dei s PHE 193 N -2.70 3.66 0.03 1.24 0.08 -1.24 0.62 117.98 119.68 3dei s PHE 193 Ca 0.00 0.83 0.05 0.00 0.12 0.00 0.00 56.93 57.93 3dei s PHE 193 Cb 0.00 -2.21 -0.02 0.00 -0.57 0.00 0.00 43.02 40.22 3dei s PHE 193 CO 0.00 0.61 -0.15 -1.17 -0.10 0.00 0.00 175.22 174.41 3dei s LEU 194 N -0.86 2.14 -0.19 -0.37 2.96 0.61 -1.17 118.68 121.81 3dei s LEU 194 Ca 0.21 -0.43 0.00 0.00 -0.22 0.00 0.00 54.13 53.69 3dei s LEU 194 Cb -0.15 -0.68 0.04 0.00 0.50 0.00 0.00 46.19 45.90 3dei s LEU 194 CO 0.10 0.08 -0.09 -0.31 -1.32 0.00 0.00 176.35 174.80 3dei s TYR 195 N -0.75 2.22 -0.58 5.38 1.51 0.56 -0.61 117.35 125.09 3dei s TYR 195 Ca 0.03 -1.45 -0.16 0.00 -1.01 0.00 0.00 57.07 54.48 3dei s TYR 195 Cb -0.08 -1.55 0.13 0.00 -0.11 0.00 0.00 41.96 40.35 3dei s TYR 195 CO 0.01 -0.71 0.56 0.00 -1.11 0.00 0.00 175.55 174.31 3dei s ALA 196 N 1.46 3.64 0.30 3.71 0.00 0.99 -0.41 121.76 131.44 3dei s ALA 196 Ca -0.00 -2.54 -0.22 0.00 0.00 0.00 0.00 51.96 49.19 3dei s ALA 196 Cb -0.16 -3.35 -0.09 0.00 0.00 0.00 0.00 23.12 19.52 3dei s ALA 196 CO -0.08 -2.11 0.85 0.71 0.00 0.00 0.00 175.76 175.12 3dei s TYR 197 N 1.71 3.60 -0.08 0.00 2.02 -1.02 -0.16 117.35 123.41 3dei s TYR 197 Ca 0.06 1.56 0.21 0.00 -0.37 0.00 0.00 57.07 58.54 3dei s TYR 197 Cb -0.27 -2.77 0.53 0.00 -0.40 0.00 0.00 41.96 39.05 3dei s TYR 197 CO 0.03 0.21 1.66 0.66 -1.57 0.00 0.00 175.55 176.53 3dei h SER 198 N 3.02 0.00 -5.59 2.29 4.64 -1.45 -2.31 113.55 114.15 3dei h SER 198 Ca -0.48 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 60.56 3dei h SER 198 Cb 1.19 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.17 3dei h SER 198 CO 0.65 0.27 -0.32 0.42 -0.87 0.00 0.00 176.83 176.97 3dei s THR 199 N -3.32 0.00 0.61 2.95 -4.23 -1.26 -3.82 115.64 106.57 3dei s THR 199 Ca 0.03 -1.73 -0.13 0.00 -1.18 0.00 0.00 61.69 58.67 3dei s THR 199 Cb 0.08 -2.53 -0.03 0.00 1.34 0.00 0.00 72.50 71.36 3dei s THR 199 CO 0.68 0.00 1.04 0.00 -0.54 0.00 0.00 174.62 175.79 3dei s ALA 200 N -3.44 2.87 0.33 3.99 0.00 -1.04 -4.03 121.76 120.44 3dei s ALA 200 Ca 0.33 0.15 -0.27 0.00 0.00 0.00 0.00 51.96 52.18 3dei s ALA 200 Cb 0.01 -3.16 -0.13 0.00 0.00 0.00 0.00 23.12 19.85 3dei s ALA 200 CO 0.19 -0.79 0.99 -2.30 0.00 0.00 0.00 175.76 173.85 3dei n PRO 201 N -2.42 1.33 0.00 0.00 -0.02 -1.26 -2.13 135.00 130.49 3dei n PRO 201 Ca 0.07 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 3dei n PRO 201 Cb 0.54 -1.89 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 3dei n PRO 201 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dei n GLY 202 N 1.23 2.39 3.88 -1.23 0.00 -0.67 -4.99 105.19 105.80 3dei n GLY 202 Ca 0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 3dei n GLY 202 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dei s TYR 203 N -2.42 3.38 0.77 1.61 1.51 -0.91 -2.02 117.35 119.26 3dei s TYR 203 Ca 0.00 0.11 -0.11 0.00 -1.01 0.00 0.00 57.07 56.07 3dei s TYR 203 Cb 0.00 -1.65 0.05 0.00 -0.11 0.00 0.00 41.96 40.25 3dei s TYR 203 CO 0.00 0.53 1.09 -0.47 -1.11 0.00 0.00 175.55 175.59 3dei s TYR 204 N -1.64 2.66 -0.11 2.71 5.04 -0.43 -0.95 117.35 124.62 3dei s TYR 204 Ca 0.33 1.52 0.01 0.00 -2.44 0.00 0.00 57.07 56.49 3dei s TYR 204 Cb -0.11 -3.02 0.02 0.00 0.35 0.00 0.00 41.96 39.19 3dei s TYR 204 CO 0.26 -1.73 -0.14 0.45 -1.34 0.00 0.00 175.55 173.06 3dei s SER 205 N -3.46 2.39 0.24 4.32 0.15 -1.26 -4.82 113.70 111.24 3dei s SER 205 Ca 0.61 -0.41 -0.22 0.00 0.70 0.00 0.00 55.95 56.62 3dei s SER 205 Cb -0.17 -1.05 -0.09 0.00 -1.71 0.00 0.00 66.02 63.01 3dei s SER 205 CO 0.56 -0.02 0.79 0.26 1.20 0.00 0.00 173.24 176.03 3dei s TRP 206 N 1.17 3.71 0.01 3.44 0.52 -1.26 -5.03 118.94 121.51 3dei s TRP 206 Ca -0.03 1.54 -0.01 0.00 0.02 0.00 0.00 56.10 57.62 3dei s TRP 206 Cb -0.14 -2.73 -0.01 0.00 -1.15 0.00 0.00 33.47 29.44 3dei s TRP 206 CO -0.04 0.34 0.01 0.50 0.02 0.00 0.00 176.95 177.78 3dei s ARG 207 N -1.82 0.22 -0.24 4.98 3.52 -1.26 -2.99 118.95 121.35 3dei s ARG 207 Ca 0.43 -0.33 -0.05 0.00 -0.13 0.00 0.00 55.73 55.65 3dei s ARG 207 Cb -0.18 0.08 -0.01 0.00 -1.56 0.00 0.00 34.95 33.28 3dei s ARG 207 CO 0.23 -0.04 0.01 1.21 -0.81 0.00 0.00 175.30 175.90 3dei s ASN 208 N -0.86 4.70 0.48 -2.12 2.47 -0.59 -4.92 114.94 114.12 3dei s ASN 208 Ca -0.09 -0.41 0.15 0.00 0.42 0.00 0.00 52.86 52.93 3dei s ASN 208 Cb -0.06 -1.82 1.16 0.00 -1.45 0.00 0.00 41.25 39.08 3dei s ASN 208 CO -0.00 -0.06 2.09 0.28 -3.72 0.00 0.00 177.10 175.69 3dei h SER 209 N 8.17 0.16 0.00 -4.21 0.02 -1.85 -0.66 113.55 115.18 3dei h SER 209 Ca -0.38 -0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.54 3dei h SER 209 Cb 1.16 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 63.66 3dei h SER 209 CO 0.59 0.11 -0.37 0.11 -1.14 0.00 0.00 176.83 176.13 3dei h LYS 210 N 0.18 0.00 0.00 3.45 1.57 -1.91 -3.28 116.57 116.58 3dei h LYS 210 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 3dei h LYS 210 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.49 3dei h LYS 210 CO -0.02 0.18 -0.19 -0.44 -0.57 0.00 0.00 179.45 178.41 3dei h ASP 211 N -1.00 0.00 -5.00 0.86 3.32 -1.92 -3.48 116.42 109.20 3dei h ASP 211 Ca -0.04 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.00 3dei h ASP 211 Cb 0.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 3dei h ASP 211 CO -0.02 0.01 0.00 0.61 -1.72 0.00 0.00 179.24 178.11 3dei n GLY 212 N 1.16 2.08 3.77 2.75 0.00 -0.26 -4.89 105.19 109.80 3dei n GLY 212 Ca 0.04 -2.08 -0.41 0.00 0.00 0.00 0.00 46.02 43.56 3dei n GLY 212 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dei s SER 213 N 0.00 6.59 0.18 1.61 1.04 -1.26 -1.53 113.70 120.33 3dei s SER 213 Ca 0.00 2.83 -0.17 0.00 0.48 0.00 0.00 55.95 59.09 3dei s SER 213 Cb 0.00 -2.65 0.13 0.00 0.10 0.00 0.00 66.02 63.59 3dei s SER 213 CO 0.00 -0.68 1.64 -0.50 0.98 0.00 0.00 173.24 174.68 3dei h TRP 214 N 3.42 -0.38 0.43 5.02 6.55 -1.90 0.18 115.95 129.28 3dei h TRP 214 Ca -0.49 0.04 -0.01 0.00 0.95 0.00 0.00 58.89 59.38 3dei h TRP 214 Cb 1.23 0.24 -0.01 0.00 -0.86 0.00 0.00 29.16 29.76 3dei h TRP 214 CO 0.55 -0.25 -0.27 0.35 -1.05 0.00 0.00 178.44 177.77 3dei h PHE 215 N -0.06 -0.72 -0.38 0.49 3.57 -1.89 -0.48 116.94 117.48 3dei h PHE 215 Ca 0.22 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.63 3dei h PHE 215 Cb 0.39 0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.37 3dei h PHE 215 CO -0.43 -0.42 -0.08 0.82 -2.23 0.00 0.00 178.31 175.97 3dei h ILE 216 N -0.68 1.24 -1.00 1.41 2.04 -1.89 0.31 117.51 118.95 3dei h ILE 216 Ca -0.05 -1.05 0.05 0.00 1.00 0.00 0.00 64.86 64.82 3dei h ILE 216 Cb 0.56 1.04 -0.06 0.00 -0.74 0.00 0.00 36.82 37.62 3dei h ILE 216 CO 0.04 0.35 0.65 -0.61 0.00 0.00 0.00 178.15 178.59 3dei h GLN 217 N 0.59 1.18 0.21 2.37 4.15 -0.48 -1.65 115.11 121.49 3dei h GLN 217 Ca 0.11 -0.07 -0.33 0.00 0.77 0.00 0.00 58.65 59.13 3dei h GLN 217 Cb 0.50 -0.27 0.03 0.00 0.21 0.00 0.00 27.48 27.95 3dei h GLN 217 CO 0.03 0.78 -1.47 0.77 -1.93 0.00 0.00 178.83 177.01 3dei h SER 218 N 1.22 0.71 0.12 -0.69 0.02 0.23 -2.27 113.55 112.88 3dei h SER 218 Ca 0.41 -0.80 -0.01 0.00 -0.84 0.00 0.00 61.79 60.56 3dei h SER 218 Cb 0.08 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.39 3dei h SER 218 CO -0.14 1.63 -0.06 0.25 -1.14 0.00 0.00 176.83 177.37 3dei h LEU 219 N 0.12 -0.13 -0.39 5.07 5.85 -0.36 0.46 115.31 125.93 3dei h LEU 219 Ca -0.24 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.33 3dei h LEU 219 Cb 2.12 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 43.16 3dei h LEU 219 CO 0.24 0.04 0.15 0.00 -0.34 0.00 0.00 178.44 178.54 3dei h ALA 221 N 1.00 1.03 0.00 0.00 0.00 -1.29 -2.59 119.26 117.40 3dei h ALA 221 Ca 0.13 0.10 -0.20 0.00 0.00 0.00 0.00 54.91 54.94 3dei h ALA 221 Cb 0.20 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3dei h ALA 221 CO -0.01 -0.16 -1.09 1.98 0.00 0.00 0.00 179.25 179.97 3dei h MET 222 N 0.49 0.00 0.63 0.00 -1.53 -0.64 -3.14 114.93 110.74 3dei h MET 222 Ca 0.39 0.00 -0.03 0.00 -3.44 0.00 0.00 59.70 56.62 3dei h MET 222 Cb 0.54 0.00 0.01 0.00 -0.55 0.00 0.00 31.60 31.60 3dei h MET 222 CO -0.36 0.69 -0.30 -0.07 0.14 0.00 0.00 176.91 177.01 3dei h LEU 223 N 0.00 -0.72 -2.76 3.39 3.38 -0.85 -2.33 115.31 115.43 3dei h LEU 223 Ca -0.08 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3dei h LEU 223 Cb 1.71 0.19 -0.00 0.00 0.09 0.00 0.00 40.66 42.64 3dei h LEU 223 CO 0.09 -0.35 -0.00 0.07 0.09 0.00 0.00 178.44 178.34 3dei h LYS 224 N -1.13 0.00 0.00 1.13 5.09 -1.59 0.74 116.57 120.81 3dei h LYS 224 Ca -0.09 0.00 -0.17 0.00 0.09 0.00 0.00 60.65 60.48 3dei h LYS 224 Cb 0.69 0.00 -0.03 0.00 0.10 0.00 0.00 32.23 32.99 3dei h LYS 224 CO 0.14 0.00 -0.96 0.37 -2.09 0.00 0.00 179.45 176.91 3dei h GLN 225 N 0.00 0.00 0.00 0.07 4.15 -1.55 -3.42 115.11 114.37 3dei h GLN 225 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3dei h GLN 225 Cb 0.02 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.71 3dei h GLN 225 CO 0.00 0.63 0.00 0.66 -1.93 0.00 0.00 178.83 178.19 3dei n TYR 226 N -3.19 0.00 0.21 3.99 4.01 -0.28 -4.83 117.16 117.07 3dei n TYR 226 Ca -0.03 -0.04 0.03 0.00 -0.16 0.00 0.00 57.90 57.70 3dei n TYR 226 Cb 0.86 -0.00 0.12 0.00 -0.31 0.00 0.00 39.34 40.00 3dei n TYR 226 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3dei n ALA 227 N -0.04 1.31 -0.96 -0.72 0.00 0.24 -1.26 120.51 119.08 3dei n ALA 227 Ca 0.00 -0.02 0.06 0.00 0.00 0.00 0.00 53.44 53.48 3dei n ALA 227 Cb 0.30 -1.09 0.09 0.00 0.00 0.00 0.00 19.45 18.75 3dei n ALA 227 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3dei n ASP 228 N -1.42 1.86 0.00 0.00 5.68 -1.26 -3.78 116.55 117.63 3dei n ASP 228 Ca 0.02 -2.62 0.00 0.00 -0.50 0.00 0.00 54.79 51.69 3dei n ASP 228 Cb 0.05 -0.29 0.00 0.00 -1.14 0.00 0.00 41.12 39.75 3dei n ASP 228 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3dei n LYS 229 N -0.99 0.00 -4.07 0.11 5.02 -0.39 -5.00 118.16 112.84 3dei n LYS 229 Ca 0.10 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.17 3dei n LYS 229 Cb 0.56 -0.25 -0.04 0.00 -0.02 0.00 0.00 35.03 35.28 3dei n LYS 229 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3dei s LEU 230 N -4.59 3.83 0.46 -0.35 1.43 -0.60 -5.11 118.68 113.75 3dei s LEU 230 Ca 0.00 -0.25 -0.22 0.00 -1.03 0.00 0.00 54.13 52.63 3dei s LEU 230 Cb 0.00 -2.37 -0.08 0.00 0.03 0.00 0.00 46.19 43.77 3dei s LEU 230 CO 0.00 -0.07 1.10 -0.70 0.23 0.00 0.00 176.35 176.91 3dei s GLU 231 N -3.87 3.82 0.18 1.70 -6.30 -1.26 -4.72 118.70 108.25 3dei s GLU 231 Ca 0.34 1.58 -0.19 0.00 -2.50 0.00 0.00 54.97 54.20 3dei s GLU 231 Cb -0.08 -2.32 0.12 0.00 0.00 0.00 0.00 34.13 31.85 3dei s GLU 231 CO 0.25 -0.45 1.61 0.35 0.02 0.00 0.00 175.26 177.05 3dei h PHE 232 N 1.94 -0.65 -0.82 5.30 3.57 -1.53 0.29 116.94 125.03 3dei h PHE 232 Ca -0.49 0.05 0.20 0.00 3.53 0.00 0.00 57.97 61.26 3dei h PHE 232 Cb 1.23 0.36 -0.05 0.00 2.79 0.00 0.00 35.95 40.28 3dei h PHE 232 CO 0.55 -0.33 0.56 0.52 -2.23 0.00 0.00 178.31 177.38 3dei h MET 233 N -0.15 0.26 0.00 1.11 2.86 -1.93 -0.30 114.93 116.77 3dei h MET 233 Ca 0.21 -0.02 -0.16 0.00 -2.06 0.00 0.00 59.70 57.68 3dei h MET 233 Cb 0.49 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.07 3dei h MET 233 CO -0.56 0.17 -0.78 0.45 1.06 0.00 0.00 176.91 177.26 3dei h HIS 234 N 0.27 0.00 0.05 -0.22 3.86 -0.85 0.07 115.15 118.32 3dei h HIS 234 Ca 0.41 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.62 3dei h HIS 234 Cb 1.20 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.67 3dei h HIS 234 CO -0.00 0.74 -0.02 0.82 0.86 0.00 0.00 177.93 180.33 3dei h ILE 235 N 0.00 1.00 -0.18 2.45 1.08 0.14 -2.39 117.51 119.61 3dei h ILE 235 Ca -0.02 -0.16 -0.11 0.00 -0.39 0.00 0.00 64.86 64.18 3dei h ILE 235 Cb 1.58 1.11 -0.01 0.00 -3.07 0.00 0.00 36.82 36.43 3dei h ILE 235 CO 0.10 0.04 -0.35 -0.07 -0.69 0.00 0.00 178.15 177.18 3dei h LEU 236 N -0.13 0.40 -1.07 1.44 3.38 -1.05 -1.87 115.31 116.40 3dei h LEU 236 Ca -0.01 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 3dei h LEU 236 Cb 0.12 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3dei h LEU 236 CO 0.01 0.72 -0.09 0.74 0.09 0.00 0.00 178.44 179.91 3dei h THR 237 N 0.33 1.23 -0.44 0.22 2.02 -0.96 -0.21 112.91 115.10 3dei h THR 237 Ca 0.04 -1.00 -0.12 0.00 0.77 0.00 0.00 66.41 66.10 3dei h THR 237 Cb 0.78 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 68.25 3dei h THR 237 CO 0.06 0.33 -0.20 0.03 0.37 0.00 0.00 175.52 176.11 3dei h ARG 238 N 0.51 0.87 -0.33 6.66 2.47 -0.87 -2.37 114.38 121.33 3dei h ARG 238 Ca 0.10 -0.35 0.00 0.00 -1.26 0.00 0.00 59.98 58.47 3dei h ARG 238 Cb 0.47 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.74 3dei h ARG 238 CO 0.03 1.00 0.21 0.28 0.56 0.00 0.00 179.97 182.05 3dei h VAL 239 N 0.76 1.08 -0.66 2.04 2.07 -0.89 0.36 116.25 121.01 3dei h VAL 239 Ca 0.11 -0.15 0.14 0.00 0.82 0.00 0.00 66.70 67.62 3dei h VAL 239 Cb 0.74 0.60 -0.11 0.00 -1.52 0.00 0.00 31.29 31.01 3dei h VAL 239 CO 0.06 0.08 0.07 0.78 0.02 0.00 0.00 177.57 178.57 3dei h ASN 240 N 0.44 -0.17 -0.16 0.57 4.21 -0.92 -0.03 115.58 119.51 3dei h ASN 240 Ca 0.12 0.15 -0.06 0.00 1.21 0.00 0.00 56.30 57.73 3dei h ASN 240 Cb -0.05 0.24 -0.00 0.00 -1.12 0.00 0.00 38.32 37.39 3dei h ASN 240 CO -0.03 -0.09 -0.12 -0.09 -1.29 0.00 0.00 177.43 175.82 3dei h ARG 241 N 0.17 0.37 -0.73 0.81 2.43 -0.75 -2.22 114.38 114.45 3dei h ARG 241 Ca 0.36 -0.18 0.07 0.00 -0.81 0.00 0.00 59.98 59.42 3dei h ARG 241 Cb 0.59 -0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.08 3dei h ARG 241 CO -0.52 0.71 0.42 -0.22 -1.51 0.00 0.00 179.97 178.85 3dei h LYS 242 N 0.02 0.72 0.00 0.20 3.64 0.18 -1.50 116.57 119.84 3dei h LYS 242 Ca 0.03 -0.04 -0.14 0.00 -1.27 0.00 0.00 60.65 59.23 3dei h LYS 242 Cb 0.62 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.26 3dei h LYS 242 CO 0.03 0.48 -0.65 0.28 -2.27 0.00 0.00 179.45 177.32 3dei h VAL 243 N 0.75 1.44 0.00 2.00 2.07 -0.95 -1.90 116.25 119.65 3dei h VAL 243 Ca 0.34 -2.25 -0.10 0.00 0.82 0.00 0.00 66.70 65.51 3dei h VAL 243 Cb 0.23 2.22 -0.02 0.00 -1.52 0.00 0.00 31.29 32.21 3dei h VAL 243 CO -0.20 0.64 -0.89 0.00 0.02 0.00 0.00 177.57 177.13 3dei h ALA 244 N 1.35 0.67 0.00 1.67 0.00 -1.07 -3.31 119.26 118.57 3dei h ALA 244 Ca -0.01 -0.46 -0.19 0.00 0.00 0.00 0.00 54.91 54.25 3dei h ALA 244 Cb 1.17 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 19.00 3dei h ALA 244 CO 0.08 0.54 -1.73 0.25 0.00 0.00 0.00 179.25 178.40 3dei n THR 245 N -2.97 0.73 -0.02 0.00 -2.24 -0.59 -4.70 114.28 104.48 3dei n THR 245 Ca -0.03 -0.43 -0.04 0.00 -2.27 0.00 0.00 64.05 61.28 3dei n THR 245 Cb 0.71 -0.74 -0.13 0.00 -2.10 0.00 0.00 70.33 68.08 3dei n THR 245 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3dei n GLU 246 N -2.43 0.65 -3.94 -0.78 1.02 -0.72 -4.97 120.64 109.46 3dei n GLU 246 Ca -0.18 0.14 -0.32 0.00 -0.02 0.00 0.00 57.16 56.78 3dei n GLU 246 Cb 0.84 -1.70 -0.05 0.00 -0.02 0.00 0.00 31.44 30.51 3dei n GLU 246 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 3dei s PHE 247 N -2.77 3.49 -0.30 -0.32 0.08 -1.24 -5.08 117.98 111.83 3dei s PHE 247 Ca -0.06 0.28 -0.13 0.00 0.12 0.00 0.00 56.93 57.14 3dei s PHE 247 Cb 0.08 -1.78 0.15 0.00 -0.57 0.00 0.00 43.02 40.90 3dei s PHE 247 CO 0.83 0.61 0.85 -2.00 -0.10 0.00 0.00 175.22 175.41 3dei s GLU 248 N -2.16 0.41 0.62 0.44 2.12 -1.26 -4.76 118.70 114.11 3dei s GLU 248 Ca 0.30 1.02 -0.19 0.00 0.36 0.00 0.00 54.97 56.46 3dei s GLU 248 Cb -0.13 0.59 -0.02 0.00 0.26 0.00 0.00 34.13 34.83 3dei s GLU 248 CO 0.22 -0.14 1.32 -1.54 -0.54 0.00 0.00 175.26 174.58 3dei s SER 249 N 2.57 4.78 0.01 -1.70 1.04 -0.64 -4.79 113.70 114.97 3dei s SER 249 Ca -0.04 2.68 0.06 0.00 0.48 0.00 0.00 55.95 59.12 3dei s SER 249 Cb -0.08 -2.62 -0.03 0.00 0.10 0.00 0.00 66.02 63.38 3dei s SER 249 CO -0.18 -1.89 -0.16 0.12 0.98 0.00 0.00 173.24 172.10 3dei s PHE 250 N -1.36 2.62 -0.02 5.02 5.36 -1.26 0.20 117.98 128.54 3dei s PHE 250 Ca 0.80 -0.22 -0.28 0.00 -0.96 0.00 0.00 56.93 56.28 3dei s PHE 250 Cb -0.39 -1.53 0.06 0.00 -0.34 0.00 0.00 43.02 40.83 3dei s PHE 250 CO 0.42 0.23 0.61 0.45 -1.46 0.00 0.00 175.22 175.47 3dei s SER 251 N -1.18 -0.57 0.14 6.13 0.15 -1.25 -4.77 113.70 112.34 3dei s SER 251 Ca 0.14 0.53 0.26 0.00 0.70 0.00 0.00 55.95 57.58 3dei s SER 251 Cb -0.11 0.51 0.95 0.00 -1.71 0.00 0.00 66.02 65.66 3dei s SER 251 CO 0.04 -0.63 1.80 0.49 1.20 0.00 0.00 173.24 176.14 3dei n PHE 252 N 0.80 0.58 -3.76 3.44 0.99 -1.26 -4.65 117.46 113.61 3dei n PHE 252 Ca -0.19 0.18 -0.36 0.00 -0.00 0.00 0.00 57.45 57.08 3dei n PHE 252 Cb 0.58 -0.79 -0.10 0.00 -1.00 0.00 0.00 39.48 38.17 3dei n PHE 252 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 3dei s ASP 253 N -3.95 5.84 0.23 4.37 -1.08 -1.26 -5.01 116.67 115.81 3dei s ASP 253 Ca 0.11 0.05 -0.14 0.00 -0.52 0.00 0.00 52.55 52.04 3dei s ASP 253 Cb 0.14 -2.04 0.28 0.00 -1.46 0.00 0.00 42.92 39.84 3dei s ASP 253 CO 0.54 0.07 1.58 0.00 0.52 0.00 0.00 175.17 177.88 3dei h ALA 254 N 7.47 0.34 -0.97 3.66 0.00 -1.95 -2.81 119.26 125.00 3dei h ALA 254 Ca -0.38 0.28 0.32 0.00 0.00 0.00 0.00 54.91 55.13 3dei h ALA 254 Cb 1.17 0.74 -0.16 0.00 0.00 0.00 0.00 17.79 19.54 3dei h ALA 254 CO 0.65 -0.51 0.43 1.15 0.00 0.00 0.00 179.25 180.97 3dei h THR 255 N -0.04 0.21 -0.41 0.00 2.02 -1.95 0.18 112.91 112.92 3dei h THR 255 Ca 0.35 -0.07 -0.12 0.00 0.77 0.00 0.00 66.41 67.35 3dei h THR 255 Cb 0.59 -0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.93 3dei h THR 255 CO -0.84 0.04 0.05 0.49 0.37 0.00 0.00 175.52 175.62 3dei n PHE 256 N -5.18 1.35 -4.77 3.16 3.01 -1.07 -5.00 117.46 108.95 3dei n PHE 256 Ca 0.30 -1.21 -0.33 0.00 1.01 0.00 0.00 57.45 57.22 3dei n PHE 256 Cb 0.96 -0.47 -0.12 0.00 -0.01 0.00 0.00 39.48 39.84 3dei n PHE 256 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 3dei s HIS 257 N -3.02 2.81 -1.40 1.38 2.46 0.05 -3.92 115.29 113.65 3dei s HIS 257 Ca 0.46 -0.09 -0.01 0.00 0.47 0.00 0.00 55.06 55.88 3dei s HIS 257 Cb 0.39 -1.67 0.00 0.00 -0.13 0.00 0.00 32.58 31.17 3dei s HIS 257 CO 0.07 0.24 0.18 0.00 -2.47 0.00 0.00 174.74 172.75 3dei n ALA 258 N 2.31 -0.61 -2.46 1.58 0.00 0.13 -4.94 120.51 116.53 3dei n ALA 258 Ca -0.18 0.17 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 3dei n ALA 258 Cb 0.52 -2.39 -0.05 0.00 0.00 0.00 0.00 19.45 17.54 3dei n ALA 258 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3dei s LYS 259 N -5.08 3.76 0.44 0.00 -0.14 -1.26 -4.74 119.74 112.72 3dei s LYS 259 Ca 0.09 0.20 0.06 0.00 -1.36 0.00 0.00 55.97 54.95 3dei s LYS 259 Cb -0.04 -2.68 -0.05 0.00 -1.68 0.00 0.00 37.83 33.38 3dei s LYS 259 CO 0.11 0.33 0.05 0.15 -0.76 0.00 0.00 175.35 175.23 3dei s LYS 260 N -2.86 2.08 -0.12 1.68 -0.14 -0.21 -1.62 119.74 118.56 3dei s LYS 260 Ca 0.46 -2.13 -0.14 0.00 -1.36 0.00 0.00 55.97 52.80 3dei s LYS 260 Cb -0.11 -1.69 0.04 0.00 -1.68 0.00 0.00 37.83 34.38 3dei s LYS 260 CO 0.22 -0.16 0.37 -1.14 -0.76 0.00 0.00 175.35 173.89 3dei s GLN 261 N -3.81 0.50 -0.08 1.68 0.74 -1.26 -4.05 119.66 113.38 3dei s GLN 261 Ca 0.29 0.39 0.01 0.00 0.05 0.00 0.00 55.36 56.10 3dei s GLN 261 Cb 0.06 0.24 0.02 0.00 1.10 0.00 0.00 33.01 34.43 3dei s GLN 261 CO 0.15 -0.08 -0.08 -1.50 -0.55 0.00 0.00 175.29 173.23 3dei s ILE 262 N -0.11 0.91 1.06 -2.34 -1.16 -1.26 -3.59 121.20 114.72 3dei s ILE 262 Ca -0.03 -0.29 -0.16 0.00 -0.51 0.00 0.00 60.65 59.67 3dei s ILE 262 Cb -0.03 -0.90 0.22 0.00 0.61 0.00 0.00 42.46 42.36 3dei s ILE 262 CO 0.01 0.33 1.13 -2.84 -2.81 0.00 0.00 174.94 170.76 3dei s PRO 263 N 1.20 -0.12 -0.22 3.50 0.02 -1.25 -2.50 135.00 135.62 3dei s PRO 263 Ca -0.05 0.12 -0.04 0.00 0.02 0.00 0.00 61.00 61.05 3dei s PRO 263 Cb -0.14 -1.71 0.09 0.00 0.02 0.00 0.00 34.50 32.76 3dei s PRO 263 CO -0.02 -3.01 0.16 0.00 -0.33 0.00 0.00 177.00 173.79 3dei s ILE 265 N 2.20 4.89 -0.30 0.00 1.01 -1.26 -2.45 121.20 125.29 3dei s ILE 265 Ca 0.06 1.78 0.03 0.00 0.00 0.00 0.00 60.65 62.52 3dei s ILE 265 Cb -0.16 -4.20 0.08 0.00 0.01 0.00 0.00 42.46 38.19 3dei s ILE 265 CO -0.20 0.09 -0.03 -0.69 0.00 0.00 0.00 174.94 174.10 3dei s VAL 266 N 1.64 2.20 -0.24 2.92 1.01 0.45 -5.01 120.40 123.37 3dei s VAL 266 Ca 0.43 -1.95 -0.05 0.00 0.00 0.00 0.00 61.98 60.41 3dei s VAL 266 Cb -0.18 -2.45 -0.00 0.00 0.00 0.00 0.00 36.38 33.74 3dei s VAL 266 CO 0.18 -0.29 -0.01 -0.55 0.00 0.00 0.00 175.10 174.43 3dei s SER 267 N 1.02 4.57 -0.29 3.32 0.15 -1.26 -0.33 113.70 120.87 3dei s SER 267 Ca 0.00 -0.47 0.08 0.00 0.70 0.00 0.00 55.95 56.26 3dei s SER 267 Cb -0.20 -1.78 0.47 0.00 -1.71 0.00 0.00 66.02 62.80 3dei s SER 267 CO -0.07 -0.06 1.38 1.15 1.20 0.00 0.00 173.24 176.84 3dei n MET 268 N 4.81 2.18 -2.70 5.44 0.00 -0.32 -5.04 117.12 121.51 3dei n MET 268 Ca -0.17 -3.43 -0.35 0.00 0.00 0.00 0.00 57.70 53.74 3dei n MET 268 Cb 0.50 -1.89 -0.06 0.00 0.00 0.00 0.00 33.22 31.77 3dei n MET 268 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 3dei s LEU 269 N -3.36 4.12 0.00 3.17 1.43 -1.19 -0.84 118.68 122.01 3dei s LEU 269 Ca 0.45 1.87 0.11 0.00 -1.03 0.00 0.00 54.13 55.53 3dei s LEU 269 Cb 0.41 -4.27 -0.01 0.00 0.03 0.00 0.00 46.19 42.35 3dei s LEU 269 CO -0.01 -0.35 0.67 0.35 0.23 0.00 0.00 176.35 177.24 3dei n THR 270 N -0.11 0.00 -4.15 5.49 -2.24 -1.26 -4.87 114.28 107.13 3dei n THR 270 Ca 0.05 -0.38 -0.10 0.00 -2.27 0.00 0.00 64.05 61.35 3dei n THR 270 Cb 0.51 1.13 -0.10 0.00 -2.10 0.00 0.00 70.33 69.77 3dei n THR 270 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3dei s LYS 271 N -1.47 0.79 0.94 -0.78 1.02 -1.26 -4.99 119.74 113.99 3dei s LYS 271 Ca 0.09 -1.32 -0.12 0.00 0.02 0.00 0.00 55.97 54.65 3dei s LYS 271 Cb 0.09 -0.06 0.16 0.00 -0.52 0.00 0.00 37.83 37.50 3dei s LYS 271 CO 0.28 -0.07 1.09 -1.21 -0.92 0.00 0.00 175.35 174.52 3dei s GLU 272 N -3.88 0.86 -0.12 1.68 2.02 -0.30 -4.75 118.70 114.20 3dei s GLU 272 Ca 0.12 0.93 -0.06 0.00 0.02 0.00 0.00 54.97 55.98 3dei s GLU 272 Cb 0.06 -1.75 0.05 0.00 0.10 0.00 0.00 34.13 32.59 3dei s GLU 272 CO -0.05 -2.55 0.28 -1.17 0.02 0.00 0.00 175.26 171.79 3dei s LEU 273 N -6.44 0.10 -0.09 1.80 2.96 -1.26 -1.66 118.68 114.09 3dei s LEU 273 Ca 0.65 0.61 0.03 0.00 -0.22 0.00 0.00 54.13 55.20 3dei s LEU 273 Cb -0.20 0.83 0.01 0.00 0.50 0.00 0.00 46.19 47.33 3dei s LEU 273 CO 0.58 -0.19 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.94 3dei s TYR 274 N 1.67 1.96 -0.10 5.38 2.02 -1.26 -1.13 117.35 125.88 3dei s TYR 274 Ca -0.06 -0.80 0.30 0.00 -0.37 0.00 0.00 57.07 56.14 3dei s TYR 274 Cb -0.11 -1.37 1.21 0.00 -0.40 0.00 0.00 41.96 41.29 3dei s TYR 274 CO -0.09 -0.37 1.89 0.74 -1.57 0.00 0.00 175.55 176.15 3dei h PHE 275 N 6.95 0.00 -3.60 2.71 0.04 -1.85 -3.41 116.94 117.79 3dei h PHE 275 Ca -0.27 0.00 -0.49 0.00 2.80 0.00 0.00 57.97 60.01 3dei h PHE 275 Cb 1.20 0.00 0.03 0.00 2.20 0.00 0.00 35.95 39.39 3dei h PHE 275 CO 0.48 0.00 0.12 1.52 -0.60 0.00 0.00 178.31 179.83 3dei s TYR 276 N -3.54 3.56 -2.87 -0.55 -0.85 -1.25 -5.04 117.35 106.82 3dei s TYR 276 Ca 0.02 0.83 0.25 0.00 -0.52 0.00 0.00 57.07 57.66 3dei s TYR 276 Cb 0.09 -2.32 0.42 0.00 0.38 0.00 0.00 41.96 40.53 3dei s TYR 276 CO 0.51 -0.28 1.39 -2.39 -1.52 0.00 0.00 175.55 173.26