#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nvk s LYS 2 N 0.00 3.08 -0.04 2.12 1.02 -1.26 -4.36 119.74 120.30 1nvk s LYS 2 Ca 0.00 -0.80 0.01 0.00 0.02 0.00 0.00 55.97 55.20 1nvk s LYS 2 Cb 0.00 -2.61 -0.03 0.00 -0.52 0.00 0.00 37.83 34.66 1nvk s LYS 2 CO 0.00 -0.14 -0.03 0.42 -0.92 0.00 0.00 175.35 174.68 1nvk s ILE 3 N 1.17 4.02 -0.05 2.17 1.01 0.01 -0.28 121.20 129.24 1nvk s ILE 3 Ca 0.02 -0.50 0.05 0.00 0.00 0.00 0.00 60.65 60.22 1nvk s ILE 3 Cb -0.14 -2.72 -0.01 0.00 0.01 0.00 0.00 42.46 39.60 1nvk s ILE 3 CO -0.08 0.50 -0.22 0.00 0.00 0.00 0.00 174.94 175.14 1nvk s ALA 4 N -0.95 1.89 -0.03 9.38 0.00 -0.74 -1.26 121.76 130.05 1nvk s ALA 4 Ca 0.16 -0.89 0.05 0.00 0.00 0.00 0.00 51.96 51.27 1nvk s ALA 4 Cb -0.11 -0.60 -0.01 0.00 0.00 0.00 0.00 23.12 22.40 1nvk s ALA 4 CO 0.05 0.36 -0.17 -1.50 0.00 0.00 0.00 175.76 174.51 1nvk s ILE 5 N -0.09 1.36 0.06 0.00 2.07 -0.16 -0.78 121.20 123.67 1nvk s ILE 5 Ca -0.03 -0.71 -0.01 0.00 -1.41 0.00 0.00 60.65 58.49 1nvk s ILE 5 Cb -0.13 -1.15 -0.04 0.00 0.13 0.00 0.00 42.46 41.27 1nvk s ILE 5 CO 0.03 0.39 -0.01 0.27 -1.91 0.00 0.00 174.94 173.71 1nvk s ILE 6 N -0.17 0.20 -0.18 2.00 -4.36 -0.54 -1.73 121.20 116.43 1nvk s ILE 6 Ca 0.01 -1.79 -0.08 0.00 -0.26 0.00 0.00 60.65 58.53 1nvk s ILE 6 Cb -0.09 -1.57 -0.04 0.00 1.25 0.00 0.00 42.46 42.01 1nvk s ILE 6 CO 0.01 -0.92 0.10 0.21 0.24 0.00 0.00 174.94 174.57 1nvk s ASN 7 N -2.93 5.94 0.03 4.36 3.84 -1.26 -0.65 114.94 124.27 1nvk s ASN 7 Ca 0.09 0.18 0.19 0.00 0.21 0.00 0.00 52.86 53.53 1nvk s ASN 7 Cb 0.08 -2.02 0.81 0.00 -0.55 0.00 0.00 41.25 39.57 1nvk s ASN 7 CO -0.09 0.20 1.61 0.80 -2.79 0.00 0.00 177.10 176.83 1nvk n MET 8 N 3.40 0.03 -0.33 0.43 0.00 -0.95 -4.24 117.12 115.45 1nvk n MET 8 Ca -0.17 0.20 0.00 0.00 -0.00 0.00 0.00 57.70 57.74 1nvk n MET 8 Cb 0.52 -1.54 0.00 0.00 0.00 0.00 0.00 33.22 32.20 1nvk n MET 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1nvk n GLY 9 N 0.40 0.52 2.88 -5.12 0.00 -1.26 -4.29 105.19 98.33 1nvk n GLY 9 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 1nvk n GLY 9 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nvk s ASN 10 N -0.18 -0.02 0.53 1.61 -0.87 -1.26 -4.45 114.94 110.29 1nvk s ASN 10 Ca 0.00 0.07 -0.21 0.00 -1.57 0.00 0.00 52.86 51.15 1nvk s ASN 10 Cb 0.00 0.04 -0.06 0.00 -0.02 0.00 0.00 41.25 41.22 1nvk s ASN 10 CO 0.00 -0.03 1.20 0.21 -2.57 0.00 0.00 177.10 175.91 1nvk s ASN 11 N 0.22 5.67 -0.18 -1.22 2.47 -1.26 -4.69 114.94 115.95 1nvk s ASN 11 Ca -0.02 2.39 0.01 0.00 0.42 0.00 0.00 52.86 55.66 1nvk s ASN 11 Cb -0.03 -2.60 0.02 0.00 -1.45 0.00 0.00 41.25 37.19 1nvk s ASN 11 CO -0.01 -1.27 -0.19 -0.69 -3.72 0.00 0.00 177.10 171.22 1nvk s VAL 12 N -1.55 2.13 0.08 -5.21 1.01 -1.26 -4.35 120.40 111.24 1nvk s VAL 12 Ca 0.70 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.76 1nvk s VAL 12 Cb -0.30 -1.89 0.00 0.00 0.00 0.00 0.00 36.38 34.18 1nvk s VAL 12 CO 0.35 0.53 0.00 -0.38 0.00 0.00 0.00 175.10 175.61 1nvk n ILE 13 N 4.60 0.13 -2.03 2.22 5.41 -1.26 -4.87 119.36 123.56 1nvk n ILE 13 Ca -0.21 0.04 0.00 0.00 1.00 0.00 0.00 62.75 63.59 1nvk n ILE 13 Cb 0.50 -0.49 0.00 0.00 -0.71 0.00 0.00 39.64 38.94 1nvk n ILE 13 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1nvk n ASN 14 N -2.83 0.00 -1.07 4.38 0.23 -1.26 -4.58 115.26 110.12 1nvk n ASN 14 Ca 0.00 0.00 0.07 0.00 -0.53 0.00 0.00 54.58 54.12 1nvk n ASN 14 Cb 0.00 0.00 0.23 0.00 -2.08 0.00 0.00 39.78 37.93 1nvk n ASN 14 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1nvk n PHE 15 N 0.00 0.89 0.65 -2.53 3.01 -1.26 -3.53 117.46 114.69 1nvk n PHE 15 Ca 0.00 -0.38 0.12 0.00 1.01 0.00 0.00 57.45 58.21 1nvk n PHE 15 Cb 0.00 -0.12 0.46 0.00 -0.01 0.00 0.00 39.48 39.81 1nvk n PHE 15 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1nvk n LYS 16 N 0.77 0.16 -4.20 -1.08 5.02 -1.26 -4.43 118.16 113.14 1nvk n LYS 16 Ca 0.17 0.21 -0.20 0.00 -2.02 0.00 0.00 58.31 56.48 1nvk n LYS 16 Cb 0.57 -1.72 -0.12 0.00 -0.02 0.00 0.00 35.03 33.73 1nvk n LYS 16 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1nvk s THR 17 N -3.11 1.26 0.02 -0.18 -4.23 -1.26 -4.91 115.64 103.23 1nvk s THR 17 Ca 0.10 -1.39 -0.25 0.00 -1.18 0.00 0.00 61.69 58.97 1nvk s THR 17 Cb 0.13 -1.21 -0.18 0.00 1.34 0.00 0.00 72.50 72.57 1nvk s THR 17 CO 0.51 -0.20 1.41 0.58 -0.54 0.00 0.00 174.62 176.38 1nvk h VAL 18 N 4.19 1.21 -0.80 2.29 2.07 -1.92 -1.60 116.25 121.69 1nvk h VAL 18 Ca -0.42 -0.74 0.04 0.00 0.82 0.00 0.00 66.70 66.39 1nvk h VAL 18 Cb 1.19 1.71 -0.05 0.00 -1.52 0.00 0.00 31.29 32.62 1nvk h VAL 18 CO 0.41 0.19 0.53 -0.65 0.02 0.00 0.00 177.57 178.07 1nvk h PRO 19 N -0.36 0.95 -0.24 1.57 0.11 -1.96 -0.14 132.00 131.93 1nvk h PRO 19 Ca -0.00 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 66.00 1nvk h PRO 19 Cb 0.34 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.23 1nvk h PRO 19 CO 0.01 0.63 -0.02 1.03 -0.21 0.00 0.00 178.00 179.43 1nvk h SER 20 N 0.98 0.44 -0.31 -2.05 0.87 -1.75 -2.36 113.55 109.37 1nvk h SER 20 Ca 0.32 -0.34 0.05 0.00 -1.23 0.00 0.00 61.79 60.59 1nvk h SER 20 Cb 0.06 -0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 61.86 1nvk h SER 20 CO -0.10 0.67 0.05 0.28 -0.53 0.00 0.00 176.83 177.20 1nvk h SER 21 N 0.20 -0.01 -0.76 6.23 0.02 -0.51 -1.01 113.55 117.71 1nvk h SER 21 Ca 0.06 0.05 0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1nvk h SER 21 Cb 0.46 0.08 -0.04 0.00 0.14 0.00 0.00 62.40 63.04 1nvk h SER 21 CO 0.02 0.03 0.50 -0.33 -1.14 0.00 0.00 176.83 175.91 1nvk h GLU 22 N 0.16 1.00 -0.61 3.45 5.08 -1.01 0.73 114.58 123.39 1nvk h GLU 22 Ca 0.14 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.36 1nvk h GLU 22 Cb 0.16 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 1nvk h GLU 22 CO -0.20 0.67 0.06 1.15 -1.00 0.00 0.00 179.01 179.69 1nvk h THR 23 N 1.03 1.26 -0.29 1.13 2.02 -0.94 -1.52 112.91 115.60 1nvk h THR 23 Ca 0.28 -1.05 -0.16 0.00 0.77 0.00 0.00 66.41 66.24 1nvk h THR 23 Cb -0.12 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.01 1nvk h THR 23 CO -0.06 0.39 -0.46 0.40 0.37 0.00 0.00 175.52 176.15 1nvk h ILE 24 N 0.95 1.29 -0.76 3.11 2.04 -0.77 -1.09 117.51 122.27 1nvk h ILE 24 Ca 0.18 -1.66 -0.03 0.00 1.00 0.00 0.00 64.86 64.35 1nvk h ILE 24 Cb 0.47 1.56 -0.03 0.00 -0.74 0.00 0.00 36.82 38.07 1nvk h ILE 24 CO 0.02 0.54 0.35 1.88 0.00 0.00 0.00 178.15 180.93 1nvk h TYR 25 N 0.62 1.12 -0.42 1.37 0.05 -0.63 0.50 116.97 119.57 1nvk h TYR 25 Ca 0.03 -0.07 -0.09 0.00 0.05 0.00 0.00 58.73 58.66 1nvk h TYR 25 Cb 1.04 -0.34 -0.01 0.00 1.01 0.00 0.00 36.73 38.42 1nvk h TYR 25 CO 0.06 0.83 -0.08 -0.07 -1.05 0.00 0.00 178.16 177.85 1nvk h LEU 26 N 1.08 0.79 -0.66 3.88 3.38 -1.14 0.54 115.31 123.18 1nvk h LEU 26 Ca 0.26 -0.35 0.04 0.00 0.09 0.00 0.00 57.88 57.92 1nvk h LEU 26 Cb 0.15 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 1nvk h LEU 26 CO -0.03 0.96 0.39 0.15 0.09 0.00 0.00 178.44 180.00 1nvk h PHE 27 N 0.61 0.73 -0.29 1.13 3.57 -0.88 -0.99 116.94 120.82 1nvk h PHE 27 Ca 0.11 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.57 1nvk h PHE 27 Cb 0.60 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.10 1nvk h PHE 27 CO 0.05 0.40 -0.07 0.87 -2.23 0.00 0.00 178.31 177.32 1nvk h LYS 28 N 0.76 0.56 -0.16 1.11 1.57 -0.59 -1.33 116.57 118.49 1nvk h LYS 28 Ca 0.27 -0.22 -0.08 0.00 -1.87 0.00 0.00 60.65 58.75 1nvk h LYS 28 Cb 0.08 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 1nvk h LYS 28 CO -0.13 0.76 -0.27 -0.24 -0.57 0.00 0.00 179.45 179.01 1nvk h VAL 29 N 0.32 1.25 -0.26 0.50 3.04 -0.68 0.11 116.25 120.52 1nvk h VAL 29 Ca 0.07 -1.19 -0.19 0.00 -1.01 0.00 0.00 66.70 64.38 1nvk h VAL 29 Cb 0.56 1.43 0.00 0.00 -2.01 0.00 0.00 31.29 31.27 1nvk h VAL 29 CO 0.03 0.36 -0.59 0.40 -1.01 0.00 0.00 177.57 176.76 1nvk h ILE 30 N 0.26 1.27 -0.37 3.17 2.04 -1.13 -2.89 117.51 119.86 1nvk h ILE 30 Ca 0.04 -1.78 -0.08 0.00 1.00 0.00 0.00 64.86 64.04 1nvk h ILE 30 Cb 0.61 1.69 -0.02 0.00 -0.74 0.00 0.00 36.82 38.37 1nvk h ILE 30 CO 0.04 0.58 -0.10 0.28 0.00 0.00 0.00 178.15 178.95 1nvk h SER 31 N 0.65 0.63 0.62 1.72 0.02 -0.82 -2.60 113.55 113.76 1nvk h SER 31 Ca 0.00 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 1nvk h SER 31 Cb 1.20 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.58 1nvk h SER 31 CO 0.13 0.77 0.00 -0.33 -1.14 0.00 0.00 176.83 176.26 1nvk h GLU 32 N 0.59 0.00 -0.63 3.45 5.08 -0.60 -2.14 114.58 120.34 1nvk h GLU 32 Ca 0.11 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.44 1nvk h GLU 32 Cb 0.52 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 1nvk h GLU 32 CO 0.03 0.00 0.04 0.00 -1.00 0.00 0.00 179.01 178.08 1nvk n MET 33 N -2.37 4.59 -0.83 2.33 0.00 -0.99 -4.92 117.12 114.94 1nvk n MET 33 Ca 0.01 -3.01 0.00 0.00 0.00 0.00 0.00 57.70 54.70 1nvk n MET 33 Cb 0.20 -2.23 0.00 0.00 0.00 0.00 0.00 33.22 31.19 1nvk n MET 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1nvk n GLY 34 N 0.49 0.56 3.90 3.17 0.00 -0.80 -5.06 105.19 107.44 1nvk n GLY 34 Ca 0.29 -0.26 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 1nvk n GLY 34 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nvk s LEU 35 N 0.00 4.31 -0.46 0.99 1.43 -1.16 -5.05 118.68 118.74 1nvk s LEU 35 Ca 0.00 0.49 -0.22 0.00 -1.03 0.00 0.00 54.13 53.37 1nvk s LEU 35 Cb 0.00 -3.10 0.03 0.00 0.03 0.00 0.00 46.19 43.15 1nvk s LEU 35 CO 0.00 0.12 0.73 0.21 0.23 0.00 0.00 176.35 177.64 1nvk s ASN 36 N -2.33 6.36 0.02 2.29 3.84 -1.26 -4.28 114.94 119.57 1nvk s ASN 36 Ca 0.37 -0.28 0.02 0.00 0.21 0.00 0.00 52.86 53.18 1nvk s ASN 36 Cb -0.13 -2.35 -0.02 0.00 -0.55 0.00 0.00 41.25 38.20 1nvk s ASN 36 CO 0.24 -0.88 -0.07 0.54 -2.79 0.00 0.00 177.10 174.14 1nvk s VAL 37 N 3.09 0.52 0.04 -5.21 0.11 -1.26 -0.81 120.40 116.88 1nvk s VAL 37 Ca 0.26 -0.72 0.07 0.00 -2.93 0.00 0.00 61.98 58.66 1nvk s VAL 37 Cb -0.13 -0.52 -0.02 0.00 -1.53 0.00 0.00 36.38 34.17 1nvk s VAL 37 CO 0.20 -0.15 -0.21 -1.81 -3.33 0.00 0.00 175.10 169.79 1nvk s ASP 38 N -0.95 2.55 -0.18 3.54 1.01 -0.39 -4.99 116.67 117.27 1nvk s ASP 38 Ca -0.04 -0.51 -0.12 0.00 0.71 0.00 0.00 52.55 52.58 1nvk s ASP 38 Cb -0.07 -0.22 -0.05 0.00 1.01 0.00 0.00 42.92 43.59 1nvk s ASP 38 CO 0.00 0.19 0.23 -0.63 0.21 0.00 0.00 175.17 175.17 1nvk s ILE 39 N -0.76 5.34 -0.17 0.77 1.01 -1.26 -0.99 121.20 125.15 1nvk s ILE 39 Ca 0.08 0.42 -0.03 0.00 0.00 0.00 0.00 60.65 61.11 1nvk s ILE 39 Cb -0.09 -3.57 -0.02 0.00 0.01 0.00 0.00 42.46 38.79 1nvk s ILE 39 CO 0.01 0.40 -0.05 -0.63 0.00 0.00 0.00 174.94 174.67 1nvk s ILE 40 N 0.48 3.60 0.00 2.92 -1.09 -0.70 -1.44 121.20 124.97 1nvk s ILE 40 Ca 0.13 -0.45 0.00 0.00 -2.23 0.00 0.00 60.65 58.11 1nvk s ILE 40 Cb -0.12 -2.59 0.00 0.00 -1.58 0.00 0.00 42.46 38.17 1nvk s ILE 40 CO 0.02 0.47 0.00 -0.24 -1.23 0.00 0.00 174.94 173.96 1nvk n SER 41 N 3.98 0.24 -0.16 3.58 2.88 0.57 -4.54 113.62 120.16 1nvk n SER 41 Ca -0.18 -0.54 -0.07 0.00 -1.33 0.00 0.00 58.87 56.75 1nvk n SER 41 Cb 0.52 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.99 1nvk n SER 41 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1nvk h LEU 42 N 0.00 0.57 -8.88 2.46 3.38 -1.89 -0.29 115.31 110.66 1nvk h LEU 42 Ca 0.00 -0.05 -0.35 0.00 0.09 0.00 0.00 57.88 57.57 1nvk h LEU 42 Cb 0.00 -0.14 -0.14 0.00 0.09 0.00 0.00 40.66 40.46 1nvk h LEU 42 CO 0.00 0.45 -0.62 -0.54 0.09 0.00 0.00 178.44 177.82 1nvk s LYS 43 N -6.02 1.38 0.48 1.13 1.02 -1.26 -4.20 119.74 112.26 1nvk s LYS 43 Ca -0.13 -1.74 -0.22 0.00 0.02 0.00 0.00 55.97 53.90 1nvk s LYS 43 Cb 0.12 -0.32 -0.07 0.00 -0.52 0.00 0.00 37.83 37.03 1nvk s LYS 43 CO 0.74 -0.26 1.12 -0.80 -0.92 0.00 0.00 175.35 175.23 1nvk s ASN 44 N -3.31 6.16 0.04 2.83 0.01 -1.26 -4.09 114.94 115.33 1nvk s ASN 44 Ca 0.35 2.17 -0.02 0.00 -0.71 0.00 0.00 52.86 54.65 1nvk s ASN 44 Cb 0.08 -2.59 0.01 0.00 0.41 0.00 0.00 41.25 39.16 1nvk s ASN 44 CO 0.12 -0.91 0.11 0.61 -1.51 0.00 0.00 177.10 175.51 1nvk n GLY 45 N 0.24 1.72 0.21 0.66 0.00 -0.52 -4.93 105.19 102.57 1nvk n GLY 45 Ca 0.08 -1.02 -0.03 0.00 0.00 0.00 0.00 46.02 45.05 1nvk n GLY 45 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1nvk h VAL 46 N 1.12 0.88 -0.01 1.61 2.07 -1.95 -3.13 116.25 116.84 1nvk h VAL 46 Ca -0.04 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.33 1nvk h VAL 46 Cb 0.15 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1nvk h VAL 46 CO 0.05 0.08 -0.19 -1.22 0.02 0.00 0.00 177.57 176.32 1nvk n TYR 47 N -4.94 0.00 -4.35 1.57 4.01 -1.26 -5.05 117.16 107.14 1nvk n TYR 47 Ca 0.06 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.61 1nvk n TYR 47 Cb 0.18 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.11 1nvk n TYR 47 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1nvk s THR 48 N -1.60 1.51 0.16 -0.72 -4.23 -1.18 -4.09 115.64 105.48 1nvk s THR 48 Ca 0.15 -2.14 0.11 0.00 -1.18 0.00 0.00 61.69 58.63 1nvk s THR 48 Cb 0.12 -2.17 -0.04 0.00 1.34 0.00 0.00 72.50 71.75 1nvk s THR 48 CO 0.30 -0.50 -0.23 -0.54 -0.54 0.00 0.00 174.62 173.11 1nvk s LYS 49 N -3.72 1.54 0.25 3.99 1.02 -0.52 -1.44 119.74 120.87 1nvk s LYS 49 Ca 0.24 -1.39 -0.23 0.00 0.02 0.00 0.00 55.97 54.62 1nvk s LYS 49 Cb 0.02 -1.93 -0.09 0.00 -0.52 0.00 0.00 37.83 35.31 1nvk s LYS 49 CO 0.07 0.43 0.81 0.45 -0.92 0.00 0.00 175.35 176.20 1nvk s SER 50 N -2.35 7.21 0.28 2.83 0.15 -1.26 -0.32 113.70 120.23 1nvk s SER 50 Ca 0.18 1.60 0.00 0.00 0.70 0.00 0.00 55.95 58.43 1nvk s SER 50 Cb -0.09 -2.49 0.52 0.00 -1.71 0.00 0.00 66.02 62.25 1nvk s SER 50 CO 0.09 0.03 1.84 -0.26 1.20 0.00 0.00 173.24 176.13 1nvk h PHE 51 N 3.47 1.14 0.00 3.44 0.04 -1.21 -1.06 116.94 122.76 1nvk h PHE 51 Ca -0.47 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.33 1nvk h PHE 51 Cb 1.19 -0.36 0.00 0.00 2.20 0.00 0.00 35.95 38.98 1nvk h PHE 51 CO 0.63 0.47 0.00 -0.25 -0.60 0.00 0.00 178.31 178.56 1nvk n ASP 52 N -4.61 0.00 -0.24 2.17 10.43 -1.26 -3.42 116.55 119.62 1nvk n ASP 52 Ca 0.18 0.12 0.03 0.00 2.57 0.00 0.00 54.79 57.69 1nvk n ASP 52 Cb 0.32 -0.33 0.08 0.00 1.84 0.00 0.00 41.12 43.03 1nvk n ASP 52 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1nvk n GLU 53 N -1.33 2.74 -4.09 -1.24 1.02 -0.41 -5.03 120.64 112.30 1nvk n GLU 53 Ca 0.08 -1.88 -0.07 0.00 -0.02 0.00 0.00 57.16 55.27 1nvk n GLU 53 Cb 0.17 -1.19 -0.10 0.00 -0.02 0.00 0.00 31.44 30.29 1nvk n GLU 53 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1nvk s VAL 54 N -1.36 0.25 -0.33 2.62 -7.23 -1.21 -4.94 120.40 108.20 1nvk s VAL 54 Ca 0.13 -1.76 -0.09 0.00 -1.81 0.00 0.00 61.98 58.44 1nvk s VAL 54 Cb 0.09 -1.45 0.01 0.00 0.56 0.00 0.00 36.38 35.58 1nvk s VAL 54 CO 0.05 -0.96 0.15 -0.62 -0.31 0.00 0.00 175.10 173.42 1nvk s ASP 55 N -2.84 5.52 0.52 4.85 -1.08 -1.26 -4.96 116.67 117.43 1nvk s ASP 55 Ca 0.06 -0.72 0.27 0.00 -0.52 0.00 0.00 52.55 51.65 1nvk s ASP 55 Cb 0.07 -1.98 1.41 0.00 -1.46 0.00 0.00 42.92 40.95 1nvk s ASP 55 CO -0.09 -0.25 1.94 1.62 0.52 0.00 0.00 175.17 178.90 1nvk h VAL 56 N 5.78 0.65 -0.04 1.11 3.04 -1.92 0.37 116.25 125.24 1nvk h VAL 56 Ca -0.30 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.38 1nvk h VAL 56 Cb 1.13 0.62 0.00 0.00 -2.01 0.00 0.00 31.29 31.02 1nvk h VAL 56 CO 0.63 0.01 0.00 0.59 -1.01 0.00 0.00 177.57 177.78 1nvk n ASN 57 N -4.34 0.29 -0.15 3.17 3.02 -1.26 -2.65 115.26 113.34 1nvk n ASN 57 Ca 0.14 -1.71 0.13 0.00 -0.03 0.00 0.00 54.58 53.11 1nvk n ASN 57 Cb 0.77 -0.03 0.47 0.00 -0.61 0.00 0.00 39.78 40.38 1nvk n ASN 57 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1nvk n ASP 58 N -0.48 0.69 -4.80 6.41 8.00 0.12 -4.82 116.55 121.67 1nvk n ASP 58 Ca 0.09 -0.62 -0.35 0.00 0.71 0.00 0.00 54.79 54.62 1nvk n ASP 58 Cb 0.08 0.03 -0.07 0.00 -0.02 0.00 0.00 41.12 41.14 1nvk n ASP 58 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1nvk s TYR 59 N -2.57 3.38 -0.31 1.24 2.02 -1.08 -4.85 117.35 115.18 1nvk s TYR 59 Ca 0.24 0.32 0.22 0.00 -0.37 0.00 0.00 57.07 57.48 1nvk s TYR 59 Cb 0.19 -1.82 0.14 0.00 -0.40 0.00 0.00 41.96 40.07 1nvk s TYR 59 CO 0.52 0.60 1.30 -0.44 -1.57 0.00 0.00 175.55 175.97 1nvk h ASP 60 N 4.61 0.00 -3.63 2.29 3.32 -0.96 -3.46 116.42 118.59 1nvk h ASP 60 Ca -0.51 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.31 1nvk h ASP 60 Cb 1.20 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 40.46 1nvk h ASP 60 CO 0.60 0.09 -0.61 -0.13 -1.72 0.00 0.00 179.24 177.47 1nvk s ARG 61 N -3.23 0.10 -0.22 3.56 1.81 -1.17 -4.96 118.95 114.85 1nvk s ARG 61 Ca 0.03 0.23 0.00 0.00 -1.72 0.00 0.00 55.73 54.27 1nvk s ARG 61 Cb 0.07 -0.05 0.03 0.00 -0.45 0.00 0.00 34.95 34.55 1nvk s ARG 61 CO 0.74 -0.08 -0.13 -1.17 -0.68 0.00 0.00 175.30 173.97 1nvk s LEU 62 N 0.53 2.72 -0.13 2.53 2.96 -1.26 -1.79 118.68 124.23 1nvk s LEU 62 Ca -0.04 -0.82 -0.03 0.00 -0.22 0.00 0.00 54.13 53.02 1nvk s LEU 62 Cb -0.06 -1.57 -0.03 0.00 0.50 0.00 0.00 46.19 45.04 1nvk s LEU 62 CO -0.02 -0.07 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.29 1nvk s ILE 63 N 1.28 4.09 -0.14 6.68 1.01 0.04 -1.29 121.20 132.88 1nvk s ILE 63 Ca 0.01 -0.30 0.01 0.00 0.00 0.00 0.00 60.65 60.37 1nvk s ILE 63 Cb -0.15 -2.77 0.02 0.00 0.01 0.00 0.00 42.46 39.56 1nvk s ILE 63 CO -0.08 0.53 -0.16 -0.69 0.00 0.00 0.00 174.94 174.53 1nvk s VAL 64 N -0.04 1.66 0.03 2.92 1.01 0.58 -1.47 120.40 125.10 1nvk s VAL 64 Ca 0.02 -0.71 -0.30 0.00 0.00 0.00 0.00 61.98 60.99 1nvk s VAL 64 Cb -0.13 -1.53 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 1nvk s VAL 64 CO 0.02 0.47 1.01 -0.69 0.00 0.00 0.00 175.10 175.92 1nvk s VAL 65 N 1.22 4.65 0.65 2.92 1.01 0.18 -0.65 120.40 130.38 1nvk s VAL 65 Ca -0.00 1.95 -0.18 0.00 0.00 0.00 0.00 61.98 63.75 1nvk s VAL 65 Cb -0.14 -4.25 -0.01 0.00 0.00 0.00 0.00 36.38 31.98 1nvk s VAL 65 CO -0.07 0.18 1.28 0.54 0.00 0.00 0.00 175.10 177.04 1nvk s ASN 66 N 0.83 4.59 0.21 3.32 6.03 -0.76 -2.25 114.94 126.90 1nvk s ASN 66 Ca 0.52 2.60 -0.23 0.00 -1.03 0.00 0.00 52.86 54.72 1nvk s ASN 66 Cb -0.23 -2.62 0.05 0.00 -3.03 0.00 0.00 41.25 35.42 1nvk s ASN 66 CO 0.29 -2.02 0.74 -0.94 -2.03 0.00 0.00 177.10 173.15 1nvk s SER 67 N -1.45 -0.33 0.51 3.54 1.04 -1.26 -4.74 113.70 111.01 1nvk s SER 67 Ca 0.82 -0.39 -0.17 0.00 0.48 0.00 0.00 55.95 56.70 1nvk s SER 67 Cb -0.37 0.63 -0.08 0.00 0.10 0.00 0.00 66.02 66.31 1nvk s SER 67 CO 0.40 -1.13 0.98 -0.55 0.98 0.00 0.00 173.24 173.92 1nvk s SER 68 N -2.85 6.65 -0.07 7.02 0.15 -1.26 -4.78 113.70 118.55 1nvk s SER 68 Ca 0.08 1.57 0.10 0.00 0.70 0.00 0.00 55.95 58.40 1nvk s SER 68 Cb -0.04 -2.51 0.15 0.00 -1.71 0.00 0.00 66.02 61.92 1nvk s SER 68 CO 0.00 -0.57 1.07 2.30 1.20 0.00 0.00 173.24 177.24 1nvk n ILE 69 N -1.50 1.41 -2.29 6.45 -5.35 -1.26 -4.54 119.36 112.27 1nvk n ILE 69 Ca 0.07 -1.60 -0.39 0.00 -0.27 0.00 0.00 62.75 60.55 1nvk n ILE 69 Cb 0.54 0.13 -0.03 0.00 -1.74 0.00 0.00 39.64 38.54 1nvk n ILE 69 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 1nvk s ASN 70 N -1.95 6.74 0.05 7.28 0.01 -1.26 -4.99 114.94 120.82 1nvk s ASN 70 Ca 0.17 2.42 0.06 0.00 -0.71 0.00 0.00 52.86 54.79 1nvk s ASN 70 Cb 0.15 -2.63 -0.03 0.00 0.41 0.00 0.00 41.25 39.15 1nvk s ASN 70 CO 0.02 -0.53 -0.12 -0.36 -1.51 0.00 0.00 177.10 174.60 1nvk s PHE 71 N -1.29 2.72 0.00 2.20 0.08 -1.26 -5.07 117.98 115.36 1nvk s PHE 71 Ca 0.52 -0.16 0.00 0.00 0.12 0.00 0.00 56.93 57.42 1nvk s PHE 71 Cb -0.33 -1.50 0.00 0.00 -0.57 0.00 0.00 43.02 40.62 1nvk s PHE 71 CO 0.43 0.34 0.00 1.19 -0.10 0.00 0.00 175.22 177.08 1nvk n PHE 72 N 1.30 0.00 -1.59 0.36 3.01 -1.26 -5.13 117.46 114.14 1nvk n PHE 72 Ca -0.15 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.01 1nvk n PHE 72 Cb 0.52 0.00 0.10 0.00 -0.01 0.00 0.00 39.48 40.09 1nvk n PHE 72 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1nvk s GLY 73 N 0.00 1.61 0.00 1.37 0.00 -1.26 -4.94 107.32 104.11 1nvk s GLY 73 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 44.72 44.40 1nvk s GLY 73 CO 0.00 0.14 0.00 0.61 0.00 0.00 0.00 173.10 173.85 1nvk n GLY 74 N -2.26 -1.82 3.70 0.20 0.00 -1.26 -4.98 105.19 98.77 1nvk n GLY 74 Ca 0.07 -1.70 -0.34 0.00 0.00 0.00 0.00 46.02 44.05 1nvk n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nvk s LYS 75 N 0.00 1.72 0.25 1.61 -2.85 -1.26 -4.92 119.74 114.30 1nvk s LYS 75 Ca 0.00 1.81 -0.31 0.00 -1.00 0.00 0.00 55.97 56.47 1nvk s LYS 75 Cb 0.00 -1.78 -0.12 0.00 -2.06 0.00 0.00 37.83 33.87 1nvk s LYS 75 CO 0.00 -2.16 1.59 -2.30 0.10 0.00 0.00 175.35 172.57 1nvk n PRO 76 N -3.14 2.55 -2.56 1.78 -0.02 -1.26 -4.90 135.00 127.45 1nvk n PRO 76 Ca 0.14 0.91 -0.41 0.00 -2.02 0.00 0.00 63.50 62.12 1nvk n PRO 76 Cb 0.50 -2.68 -0.03 0.00 -0.02 0.00 0.00 33.50 31.27 1nvk n PRO 76 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1nvk s ASN 77 N 0.63 6.19 0.54 2.55 3.84 -1.26 -4.86 114.94 122.58 1nvk s ASN 77 Ca 0.68 -0.41 0.31 0.00 0.21 0.00 0.00 52.86 53.66 1nvk s ASN 77 Cb -0.54 -2.56 1.54 0.00 -0.55 0.00 0.00 41.25 39.14 1nvk s ASN 77 CO 0.44 -1.80 2.08 -0.07 -2.79 0.00 0.00 177.10 174.97 1nvk h LEU 78 N 12.90 0.00 -1.36 3.21 3.38 -1.98 -2.38 115.31 129.08 1nvk h LEU 78 Ca -0.28 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1nvk h LEU 78 Cb 1.05 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.77 1nvk h LEU 78 CO 1.27 0.09 0.33 0.00 0.09 0.00 0.00 178.44 180.22 1nvk h ALA 79 N 1.91 1.52 0.00 1.53 0.00 -1.89 0.57 119.26 122.91 1nvk h ALA 79 Ca -0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1nvk h ALA 79 Cb 0.35 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1nvk h ALA 79 CO 0.01 0.41 -0.26 0.82 0.00 0.00 0.00 179.25 180.23 1nvk h ILE 80 N 0.78 0.72 -0.34 0.00 2.04 -1.63 -3.29 117.51 115.78 1nvk h ILE 80 Ca 0.20 -1.61 0.02 0.00 1.00 0.00 0.00 64.86 64.47 1nvk h ILE 80 Cb -0.01 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 1nvk h ILE 80 CO -0.04 0.24 0.20 -0.07 0.00 0.00 0.00 178.15 178.48 1nvk h LEU 81 N -1.00 0.31 -1.05 1.44 3.38 -1.41 -1.58 115.31 115.40 1nvk h LEU 81 Ca -0.05 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 1nvk h LEU 81 Cb 0.59 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1nvk h LEU 81 CO -0.03 0.23 -0.30 0.28 0.09 0.00 0.00 178.44 178.70 1nvk h SER 82 N 0.40 0.30 -0.32 -0.43 0.02 -1.09 -1.23 113.55 111.20 1nvk h SER 82 Ca 0.14 -0.10 -0.07 0.00 -0.84 0.00 0.00 61.79 60.91 1nvk h SER 82 Cb 0.01 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 1nvk h SER 82 CO -0.07 0.60 -0.07 0.00 -1.14 0.00 0.00 176.83 176.15 1nvk h ALA 83 N 1.42 0.45 -0.10 3.77 0.00 -1.56 -2.11 119.26 121.14 1nvk h ALA 83 Ca 0.04 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 1nvk h ALA 83 Cb 0.67 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1nvk h ALA 83 CO 0.05 0.28 -0.49 1.96 0.00 0.00 0.00 179.25 181.05 1nvk h GLN 84 N 0.40 0.25 -0.58 0.00 4.20 -1.08 -0.80 115.11 117.49 1nvk h GLN 84 Ca 0.08 -0.14 -0.07 0.00 0.06 0.00 0.00 58.65 58.58 1nvk h GLN 84 Cb 0.57 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.33 1nvk h GLN 84 CO 0.03 0.69 0.08 0.87 -0.67 0.00 0.00 178.83 179.83 1nvk h LYS 85 N 0.20 0.95 -0.20 1.46 1.57 -1.17 0.69 116.57 120.07 1nvk h LYS 85 Ca 0.01 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.53 1nvk h LYS 85 Cb 0.94 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 1nvk h LYS 85 CO 0.08 0.89 0.05 0.35 -0.57 0.00 0.00 179.45 180.24 1nvk h PHE 86 N 0.89 0.34 -0.61 -1.35 3.57 -1.02 -2.82 116.94 115.94 1nvk h PHE 86 Ca 0.18 -0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.59 1nvk h PHE 86 Cb 0.41 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 1nvk h PHE 86 CO 0.03 0.44 0.17 0.52 -2.23 0.00 0.00 178.31 177.24 1nvk h MET 87 N 0.14 0.93 0.00 1.11 2.86 -0.87 -2.66 114.93 116.44 1nvk h MET 87 Ca 0.06 -0.19 -0.02 0.00 -2.06 0.00 0.00 59.70 57.50 1nvk h MET 87 Cb 0.28 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 31.79 1nvk h MET 87 CO 0.00 0.81 -0.09 0.00 1.06 0.00 0.00 176.91 178.69 1nvk h ALA 88 N 1.29 1.42 0.00 6.32 0.00 -0.67 -2.22 119.26 125.41 1nvk h ALA 88 Ca 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1nvk h ALA 88 Cb 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1nvk h ALA 88 CO -0.01 0.12 -0.33 0.87 0.00 0.00 0.00 179.25 179.91 1nvk h LYS 89 N 0.00 0.00 -6.73 0.00 1.57 -1.23 -3.44 116.57 106.74 1nvk h LYS 89 Ca -0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.26 1nvk h LYS 89 Cb 0.24 0.00 0.04 0.00 0.08 0.00 0.00 32.23 32.58 1nvk h LYS 89 CO 0.01 0.00 0.62 -0.47 -0.57 0.00 0.00 179.45 179.04 1nvk s TYR 90 N -3.18 3.27 -1.45 -1.35 5.04 -0.84 -4.82 117.35 114.02 1nvk s TYR 90 Ca 0.07 1.33 0.18 0.00 -2.44 0.00 0.00 57.07 56.21 1nvk s TYR 90 Cb 0.11 -3.56 0.55 0.00 0.35 0.00 0.00 41.96 39.40 1nvk s TYR 90 CO 0.68 -1.66 1.46 1.63 -1.34 0.00 0.00 175.55 176.32 1nvk n LYS 91 N 2.09 2.94 -2.07 4.97 5.02 -1.26 -4.66 118.16 125.20 1nvk n LYS 91 Ca 0.04 -2.52 -0.01 0.00 -2.02 0.00 0.00 58.31 53.80 1nvk n LYS 91 Cb 0.43 -1.54 -0.00 0.00 -0.02 0.00 0.00 35.03 33.90 1nvk n LYS 91 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1nvk n SER 92 N 1.14 1.32 -4.76 4.39 2.88 -1.26 -5.02 113.62 112.31 1nvk n SER 92 Ca 0.21 -1.06 -0.41 0.00 -1.33 0.00 0.00 58.87 56.28 1nvk n SER 92 Cb 0.62 0.02 -0.03 0.00 -0.75 0.00 0.00 64.21 64.07 1nvk n SER 92 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1nvk s LYS 93 N -2.04 4.48 -0.13 -1.46 2.20 -1.26 -4.42 119.74 117.10 1nvk s LYS 93 Ca 0.00 2.03 -0.04 0.00 -0.36 0.00 0.00 55.97 57.60 1nvk s LYS 93 Cb 0.00 -3.13 -0.03 0.00 -1.51 0.00 0.00 37.83 33.15 1nvk s LYS 93 CO 0.00 -0.03 0.00 0.42 -0.36 0.00 0.00 175.35 175.39 1nvk s ILE 94 N -1.01 4.29 -0.33 5.43 1.01 -0.54 -4.26 121.20 125.78 1nvk s ILE 94 Ca 0.48 -0.23 -0.10 0.00 0.00 0.00 0.00 60.65 60.79 1nvk s ILE 94 Cb -0.36 -2.86 0.01 0.00 0.01 0.00 0.00 42.46 39.26 1nvk s ILE 94 CO 0.46 0.54 0.17 -0.31 0.00 0.00 0.00 174.94 175.81 1nvk s TYR 95 N -0.24 3.20 -0.36 3.97 2.02 -0.41 -0.57 117.35 124.96 1nvk s TYR 95 Ca 0.06 -0.71 -0.13 0.00 -0.37 0.00 0.00 57.07 55.92 1nvk s TYR 95 Cb -0.12 -2.39 -0.01 0.00 -0.40 0.00 0.00 41.96 39.04 1nvk s TYR 95 CO 0.02 -0.52 0.25 -0.47 -1.57 0.00 0.00 175.55 173.26 1nvk s TYR 96 N 1.59 3.23 -0.54 2.71 5.04 -0.09 -0.30 117.35 128.99 1nvk s TYR 96 Ca 0.04 -0.33 -0.28 0.00 -2.44 0.00 0.00 57.07 54.06 1nvk s TYR 96 Cb -0.18 -2.50 0.03 0.00 0.35 0.00 0.00 41.96 39.66 1nvk s TYR 96 CO 0.06 -0.42 1.12 -0.51 -1.34 0.00 0.00 175.55 174.46 1nvk s LEU 97 N 1.71 3.65 -0.83 6.97 1.43 0.17 -1.13 118.68 130.65 1nvk s LEU 97 Ca 0.06 0.13 -0.13 0.00 -1.03 0.00 0.00 54.13 53.16 1nvk s LEU 97 Cb -0.18 -3.22 0.22 0.00 0.03 0.00 0.00 46.19 43.04 1nvk s LEU 97 CO 0.10 -1.35 0.76 0.12 0.23 0.00 0.00 176.35 176.22 1nvk s PHE 98 N 4.57 3.76 -0.71 0.29 5.36 -0.36 -1.83 117.98 129.06 1nvk s PHE 98 Ca 0.42 -2.08 0.19 0.00 -0.96 0.00 0.00 56.93 54.50 1nvk s PHE 98 Cb -0.08 -3.78 -0.22 0.00 -0.34 0.00 0.00 43.02 38.60 1nvk s PHE 98 CO 0.26 -0.98 0.72 0.25 -1.46 0.00 0.00 175.22 174.01 1nvk n THR 99 N 3.88 0.00 -3.88 0.12 -2.24 -1.26 -1.64 114.28 109.26 1nvk n THR 99 Ca 0.14 -0.14 -0.27 0.00 -2.27 0.00 0.00 64.05 61.52 1nvk n THR 99 Cb 0.46 0.81 -0.17 0.00 -2.10 0.00 0.00 70.33 69.33 1nvk n THR 99 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1nvk s ASP 100 N -3.07 2.31 0.56 3.42 3.68 -1.26 -4.93 116.67 117.38 1nvk s ASP 100 Ca 0.04 -0.39 0.28 0.00 2.13 0.00 0.00 52.55 54.61 1nvk s ASP 100 Cb 0.14 -0.80 1.47 0.00 -1.45 0.00 0.00 42.92 42.28 1nvk s ASP 100 CO 0.78 -0.15 1.94 -0.29 0.13 0.00 0.00 175.17 177.57 1nvk h ILE 101 N 6.27 0.52 -0.01 4.11 6.09 -2.00 -0.38 117.51 132.11 1nvk h ILE 101 Ca -0.26 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.23 1nvk h ILE 101 Cb 1.12 0.65 0.00 0.00 0.47 0.00 0.00 36.82 39.07 1nvk h ILE 101 CO 0.38 0.00 -0.02 0.54 -3.07 0.00 0.00 178.15 175.98 1nvk n ARG 102 N -4.03 1.16 -2.68 2.19 1.74 -1.26 -4.27 116.66 109.50 1nvk n ARG 102 Ca 0.10 -0.37 -0.28 0.00 -0.77 0.00 0.00 57.85 56.54 1nvk n ARG 102 Cb 0.69 -1.49 -0.02 0.00 -1.02 0.00 0.00 32.46 30.62 1nvk n ARG 102 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1nvk n LEU 103 N -0.60 4.73 -4.79 0.55 4.77 -0.15 -4.96 117.00 116.55 1nvk n LEU 103 Ca 0.20 -5.43 -0.32 0.00 -0.03 0.00 0.00 56.01 50.43 1nvk n LEU 103 Cb 0.23 -0.54 0.05 0.00 -2.33 0.00 0.00 43.42 40.83 1nvk n LEU 103 CO 0.19 2.28 0.72 -2.16 -1.33 0.00 0.00 177.39 177.08 1nvk s PRO 104 N -3.54 2.83 0.33 3.23 0.04 -1.26 -4.32 135.00 132.32 1nvk s PRO 104 Ca 0.48 1.16 -0.29 0.00 0.04 0.00 0.00 61.00 62.39 1nvk s PRO 104 Cb 0.34 -1.97 -0.11 0.00 0.04 0.00 0.00 34.50 32.80 1nvk s PRO 104 CO -0.17 -1.19 1.49 0.12 0.04 0.00 0.00 177.00 177.29 1nvk s PHE 105 N -2.72 2.74 -0.00 0.56 5.36 -1.26 -4.92 117.98 117.74 1nvk s PHE 105 Ca 0.62 1.07 -0.17 0.00 -0.96 0.00 0.00 56.93 57.49 1nvk s PHE 105 Cb -0.17 -3.97 0.03 0.00 -0.34 0.00 0.00 43.02 38.57 1nvk s PHE 105 CO 0.48 -2.99 0.36 0.45 -1.46 0.00 0.00 175.22 172.07 1nvk s SER 106 N 0.05 -0.25 0.15 6.13 0.15 -1.26 -4.84 113.70 113.83 1nvk s SER 106 Ca 0.56 0.11 -0.29 0.00 0.70 0.00 0.00 55.95 57.03 1nvk s SER 106 Cb -0.45 0.36 -0.07 0.00 -1.71 0.00 0.00 66.02 64.14 1nvk s SER 106 CO 0.55 -0.52 0.93 -1.10 1.20 0.00 0.00 173.24 174.30 1nvk s GLN 107 N -1.62 4.73 0.18 5.44 -1.52 -1.26 -4.97 119.66 120.65 1nvk s GLN 107 Ca -0.11 1.42 0.17 0.00 -1.95 0.00 0.00 55.36 54.88 1nvk s GLN 107 Cb -0.03 -3.34 -0.02 0.00 -0.22 0.00 0.00 33.01 29.40 1nvk s GLN 107 CO 0.03 0.34 1.15 0.66 -0.25 0.00 0.00 175.29 177.23 1nvk h SER 108 N 5.03 0.00 -0.57 5.90 4.64 -1.94 -3.38 113.55 123.23 1nvk h SER 108 Ca -0.44 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.00 1nvk h SER 108 Cb 1.21 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.19 1nvk h SER 108 CO 0.70 0.48 -0.12 -0.25 -0.87 0.00 0.00 176.83 176.77 1nvk h TRP 109 N 0.00 -0.26 -0.82 4.77 -0.00 -1.93 0.21 115.95 117.92 1nvk h TRP 109 Ca -0.07 0.05 0.15 0.00 -0.00 0.00 0.00 58.89 59.02 1nvk h TRP 109 Cb 1.43 0.20 -0.06 0.00 -0.00 0.00 0.00 29.16 30.73 1nvk h TRP 109 CO 0.00 -0.23 0.54 -1.35 -0.00 0.00 0.00 178.44 177.40 1nvk h PRO 110 N 0.02 0.49 -0.00 2.65 0.11 -2.01 0.12 132.00 133.38 1nvk h PRO 110 Ca 0.28 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.36 1nvk h PRO 110 Cb 0.43 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.43 1nvk h PRO 110 CO -0.57 0.32 -0.27 0.09 -0.21 0.00 0.00 178.00 177.36 1nvk n ASN 111 N -4.51 0.38 -0.13 -2.05 5.03 -0.06 -4.21 115.26 109.71 1nvk n ASN 111 Ca 0.16 -0.12 -0.28 0.00 0.87 0.00 0.00 54.58 55.21 1nvk n ASN 111 Cb 0.53 -0.04 -0.10 0.00 -1.02 0.00 0.00 39.78 39.15 1nvk n ASN 111 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 1nvk n VAL 112 N -1.35 1.53 0.31 2.41 0.31 0.20 -4.38 118.33 117.37 1nvk n VAL 112 Ca 0.08 -0.33 0.06 0.00 -0.01 0.00 0.00 64.34 64.14 1nvk n VAL 112 Cb 0.33 -1.90 0.32 0.00 -0.91 0.00 0.00 33.84 31.68 1nvk n VAL 112 CO 0.00 0.00 0.00 0.07 -1.32 0.00 0.00 176.83 175.58 1nvk h LYS 113 N -0.97 0.00 0.00 5.55 2.10 -1.10 0.36 116.57 122.51 1nvk h LYS 113 Ca -0.64 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.01 1nvk h LYS 113 Cb 1.57 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.90 1nvk h LYS 113 CO -0.38 0.00 -1.46 0.09 -2.00 0.00 0.00 179.45 175.70 1nvk n ASN 114 N -2.55 0.75 -4.73 7.07 3.02 -1.26 -4.89 115.26 112.68 1nvk n ASN 114 Ca -0.01 -0.38 -0.32 0.00 -0.03 0.00 0.00 54.58 53.84 1nvk n ASN 114 Cb 0.71 1.51 0.11 0.00 -0.61 0.00 0.00 39.78 41.50 1nvk n ASN 114 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1nvk s ARG 115 N -3.08 1.97 0.42 3.52 1.81 0.13 -4.93 118.95 118.79 1nvk s ARG 115 Ca -0.01 1.47 0.16 0.00 -1.72 0.00 0.00 55.73 55.63 1nvk s ARG 115 Cb 0.13 -1.84 0.93 0.00 -0.45 0.00 0.00 34.95 33.72 1nvk s ARG 115 CO 0.77 -1.91 1.91 -1.00 -0.68 0.00 0.00 175.30 174.40 1nvk h PRO 116 N -0.92 0.00 -0.60 3.54 0.13 -1.95 -2.02 132.00 130.19 1nvk h PRO 116 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1nvk h PRO 116 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1nvk h PRO 116 CO 0.49 0.27 0.00 -2.67 -0.23 0.00 0.00 178.00 175.86 1nvk n TRP 117 N -4.02 1.03 -0.08 1.56 4.27 -1.26 -4.44 117.44 114.50 1nvk n TRP 117 Ca -0.02 -0.42 0.16 0.00 -3.89 0.00 0.00 57.50 53.33 1nvk n TRP 117 Cb 0.34 -0.17 0.57 0.00 -1.36 0.00 0.00 31.31 30.69 1nvk n TRP 117 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1nvk h ALA 118 N 3.74 2.22 0.00 -1.67 0.00 -1.55 -1.62 119.26 120.38 1nvk h ALA 118 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1nvk h ALA 118 Cb 1.06 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1nvk h ALA 118 CO 0.15 -0.38 0.00 0.10 0.00 0.00 0.00 179.25 179.12 1nvk h TYR 119 N 0.26 0.00 0.00 0.00 -0.00 -1.83 -1.70 116.97 113.70 1nvk h TYR 119 Ca 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 59.03 1nvk h TYR 119 Cb 0.80 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.53 1nvk h TYR 119 CO -0.00 0.00 0.00 1.28 -0.00 0.00 0.00 178.16 179.44 1nvk n LEU 120 N -2.55 0.78 -4.44 0.10 4.77 -0.61 -4.86 117.00 110.19 1nvk n LEU 120 Ca -0.02 0.62 -0.21 0.00 -0.03 0.00 0.00 56.01 56.37 1nvk n LEU 120 Cb 0.07 -0.43 -0.10 0.00 -2.33 0.00 0.00 43.42 40.62 1nvk n LEU 120 CO 0.14 -0.36 -0.26 -0.31 -1.33 0.00 0.00 177.39 175.27 1nvk s TYR 121 N -3.21 1.89 0.12 -1.77 1.51 -0.64 -5.17 117.35 110.08 1nvk s TYR 121 Ca 0.08 -1.02 0.03 0.00 -1.01 0.00 0.00 57.07 55.15 1nvk s TYR 121 Cb 0.11 -1.22 -0.04 0.00 -0.11 0.00 0.00 41.96 40.69 1nvk s TYR 121 CO 0.51 -0.07 -0.09 0.95 -1.11 0.00 0.00 175.55 175.74 1nvk s THR 122 N -3.35 0.96 0.18 -0.71 -4.23 -1.26 -5.00 115.64 102.22 1nvk s THR 122 Ca 0.35 -1.91 -0.11 0.00 -1.18 0.00 0.00 61.69 58.85 1nvk s THR 122 Cb 0.08 -1.66 0.08 0.00 1.34 0.00 0.00 72.50 72.34 1nvk s THR 122 CO 0.15 -0.74 1.72 -0.08 -0.54 0.00 0.00 174.62 175.14 1nvk h GLU 123 N 3.05 0.94 -0.23 3.99 4.81 -1.98 -2.19 114.58 122.98 1nvk h GLU 123 Ca -0.36 -0.19 0.01 0.00 -0.13 0.00 0.00 59.36 58.69 1nvk h GLU 123 Cb 1.18 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.41 1nvk h GLU 123 CO 0.61 0.82 0.15 1.49 -0.73 0.00 0.00 179.01 181.35 1nvk h GLU 124 N 0.88 0.28 0.04 1.92 4.81 -1.97 0.42 114.58 120.96 1nvk h GLU 124 Ca 0.20 -0.02 -0.22 0.00 -0.13 0.00 0.00 59.36 59.19 1nvk h GLU 124 Cb 0.24 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 1nvk h GLU 124 CO -0.01 0.19 -1.01 1.49 -0.73 0.00 0.00 179.01 178.94 1nvk h GLU 125 N 0.29 0.19 0.00 1.92 4.81 -1.85 -3.37 114.58 116.57 1nvk h GLU 125 Ca 0.08 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 1nvk h GLU 125 Cb -0.01 0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.45 1nvk h GLU 125 CO -0.02 1.05 -1.76 1.28 -0.73 0.00 0.00 179.01 178.83 1nvk n LEU 126 N -3.56 0.00 -4.62 1.64 4.77 -0.87 -4.39 117.00 109.97 1nvk n LEU 126 Ca -0.04 -0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.51 1nvk n LEU 126 Cb 0.90 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.96 1nvk n LEU 126 CO 0.50 0.00 1.47 -0.22 -1.33 0.00 0.00 177.39 177.81 1nvk s LEU 127 N -4.16 3.73 -0.36 2.23 2.96 0.14 -4.75 118.68 118.48 1nvk s LEU 127 Ca -0.06 1.56 -0.22 0.00 -0.22 0.00 0.00 54.13 55.19 1nvk s LEU 127 Cb 0.11 -3.53 0.01 0.00 0.50 0.00 0.00 46.19 43.27 1nvk s LEU 127 CO 0.69 -1.47 0.71 -0.63 -1.32 0.00 0.00 176.35 174.34 1nvk s ILE 128 N 6.02 4.81 -0.97 6.68 1.01 -1.26 -4.75 121.20 132.73 1nvk s ILE 128 Ca 0.77 0.75 0.15 0.00 0.00 0.00 0.00 60.65 62.33 1nvk s ILE 128 Cb -0.25 -4.15 -0.10 0.00 0.01 0.00 0.00 42.46 37.97 1nvk s ILE 128 CO 0.32 -0.37 0.70 0.29 0.00 0.00 0.00 174.94 175.88 1nvk n LYS 129 N 6.23 1.97 -2.02 2.79 5.02 -1.26 -4.97 118.16 125.93 1nvk n LYS 129 Ca 0.01 -0.29 -0.35 0.00 -2.02 0.00 0.00 58.31 55.66 1nvk n LYS 129 Cb 0.48 -1.22 0.03 0.00 -0.02 0.00 0.00 35.03 34.30 1nvk n LYS 129 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1nvk s SER 130 N -2.20 5.29 0.48 4.39 0.01 -1.26 -4.96 113.70 115.45 1nvk s SER 130 Ca 0.08 2.26 -0.23 0.00 1.31 0.00 0.00 55.95 59.37 1nvk s SER 130 Cb 0.12 -2.58 -0.07 0.00 0.21 0.00 0.00 66.02 63.70 1nvk s SER 130 CO 0.53 -1.52 1.29 -2.16 0.41 0.00 0.00 173.24 171.79 1nvk s PRO 131 N -3.47 3.55 -0.04 12.44 0.04 -1.26 -4.83 135.00 141.43 1nvk s PRO 131 Ca 0.74 2.09 0.06 0.00 0.04 0.00 0.00 61.00 63.93 1nvk s PRO 131 Cb -0.27 -2.44 -0.01 0.00 0.04 0.00 0.00 34.50 31.83 1nvk s PRO 131 CO 0.33 -0.82 -0.22 0.42 0.04 0.00 0.00 177.00 176.76 1nvk s ILE 132 N -1.36 1.75 -0.19 0.56 1.01 -0.09 -1.47 121.20 121.42 1nvk s ILE 132 Ca 0.65 -0.92 -0.03 0.00 0.00 0.00 0.00 60.65 60.36 1nvk s ILE 132 Cb -0.36 -1.48 -0.01 0.00 0.01 0.00 0.00 42.46 40.62 1nvk s ILE 132 CO 0.45 0.49 -0.07 -0.75 0.00 0.00 0.00 174.94 175.06 1nvk s LYS 133 N -0.23 3.41 -0.23 2.79 2.20 0.27 -2.06 119.74 125.89 1nvk s LYS 133 Ca 0.01 -0.63 -0.17 0.00 -0.36 0.00 0.00 55.97 54.81 1nvk s LYS 133 Cb -0.11 -2.88 -0.03 0.00 -1.51 0.00 0.00 37.83 33.29 1nvk s LYS 133 CO 0.02 -0.03 0.47 0.08 -0.36 0.00 0.00 175.35 175.52 1nvk s VAL 134 N 1.02 5.13 -0.45 4.02 1.01 0.67 -0.91 120.40 130.89 1nvk s VAL 134 Ca -0.00 0.81 -0.15 0.00 0.00 0.00 0.00 61.98 62.64 1nvk s VAL 134 Cb -0.15 -3.79 0.06 0.00 0.00 0.00 0.00 36.38 32.51 1nvk s VAL 134 CO -0.00 0.17 0.36 -0.63 0.00 0.00 0.00 175.10 174.99 1nvk s ILE 135 N 1.82 5.16 -0.14 2.22 1.01 -0.28 -1.56 121.20 129.43 1nvk s ILE 135 Ca 0.21 -0.98 -0.19 0.00 0.00 0.00 0.00 60.65 59.69 1nvk s ILE 135 Cb -0.15 -4.03 -0.04 0.00 0.01 0.00 0.00 42.46 38.25 1nvk s ILE 135 CO 0.09 -0.50 0.52 -0.55 0.00 0.00 0.00 174.94 174.51 1nvk s SER 136 N 2.32 6.68 0.29 3.58 0.15 0.02 -1.23 113.70 125.51 1nvk s SER 136 Ca 0.04 0.81 0.03 0.00 0.70 0.00 0.00 55.95 57.53 1nvk s SER 136 Cb -0.23 -2.31 0.44 0.00 -1.71 0.00 0.00 66.02 62.22 1nvk s SER 136 CO 0.07 -0.09 1.74 -0.61 1.20 0.00 0.00 173.24 175.56 1nvk h GLN 137 N 7.00 0.49 -6.79 5.44 5.75 -1.43 -1.06 115.11 124.50 1nvk h GLN 137 Ca -0.38 -0.17 -0.48 0.00 -0.15 0.00 0.00 58.65 57.46 1nvk h GLN 137 Cb 1.17 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.67 1nvk h GLN 137 CO 0.75 0.68 0.35 0.20 -2.65 0.00 0.00 178.83 178.16 1nvk s GLY 138 N -3.98 3.02 0.40 2.39 0.00 -1.26 -4.58 107.32 103.30 1nvk s GLY 138 Ca -0.07 0.60 0.21 0.00 0.00 0.00 0.00 44.72 45.46 1nvk s GLY 138 CO 0.79 1.13 1.74 0.16 0.00 0.00 0.00 173.10 176.91 1nvk h ILE 139 N 2.99 0.68 -2.56 0.90 3.07 -1.75 -3.41 117.51 117.43 1nvk h ILE 139 Ca -0.46 -1.40 -0.57 0.00 1.55 0.00 0.00 64.86 63.98 1nvk h ILE 139 Cb 1.20 1.92 -0.10 0.00 -0.27 0.00 0.00 36.82 39.57 1nvk h ILE 139 CO 0.67 0.30 0.87 0.21 -1.05 0.00 0.00 178.15 179.15 1nvk s ASN 140 N -6.30 6.19 0.43 2.16 3.84 -1.26 -4.88 114.94 115.12 1nvk s ASN 140 Ca 0.01 -0.57 0.29 0.00 0.21 0.00 0.00 52.86 52.80 1nvk s ASN 140 Cb 0.10 -2.51 1.11 0.00 -0.55 0.00 0.00 41.25 39.40 1nvk s ASN 140 CO 0.67 -1.66 1.85 -0.07 -2.79 0.00 0.00 177.10 175.10 1nvk h LEU 141 N 12.33 0.00 -0.63 3.21 3.38 -2.00 -2.96 115.31 128.63 1nvk h LEU 141 Ca -0.28 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.58 1nvk h LEU 141 Cb 1.06 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 1nvk h LEU 141 CO 1.23 0.00 -0.18 0.44 0.09 0.00 0.00 178.44 180.03 1nvk h ASP 142 N 0.00 0.90 -0.11 -0.43 3.32 -1.97 0.96 116.42 119.09 1nvk h ASP 142 Ca 0.00 -0.31 -0.10 0.00 0.02 0.00 0.00 57.03 56.63 1nvk h ASP 142 Cb 0.53 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 1nvk h ASP 142 CO 0.00 1.06 -0.26 0.40 -1.72 0.00 0.00 179.24 178.72 1nvk h ILE 143 N 0.78 1.27 -0.24 0.35 2.04 -1.94 -0.60 117.51 119.17 1nvk h ILE 143 Ca 0.11 -1.32 -0.19 0.00 1.00 0.00 0.00 64.86 64.47 1nvk h ILE 143 Cb 0.71 1.34 0.00 0.00 -0.74 0.00 0.00 36.82 38.13 1nvk h ILE 143 CO 0.05 0.42 -0.60 0.00 0.00 0.00 0.00 178.15 178.03 1nvk h ALA 144 N 1.23 0.49 -0.42 1.87 0.00 -1.46 -2.61 119.26 118.36 1nvk h ALA 144 Ca 0.07 -0.53 -0.12 0.00 0.00 0.00 0.00 54.91 54.32 1nvk h ALA 144 Cb 0.71 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1nvk h ALA 144 CO 0.05 0.69 -0.23 0.87 0.00 0.00 0.00 179.25 180.63 1nvk h LYS 145 N 0.59 0.85 -0.53 0.00 1.57 -0.61 -2.83 116.57 115.60 1nvk h LYS 145 Ca -0.00 -0.35 -0.05 0.00 -1.87 0.00 0.00 60.65 58.37 1nvk h LYS 145 Cb 1.20 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.45 1nvk h LYS 145 CO 0.13 0.99 0.13 0.00 -0.57 0.00 0.00 179.45 180.12 1nvk h ALA 146 N 1.00 1.22 0.00 3.86 0.00 -1.08 -1.76 119.26 122.50 1nvk h ALA 146 Ca 0.10 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1nvk h ALA 146 Cb 0.77 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1nvk h ALA 146 CO 0.06 0.54 -0.02 0.00 0.00 0.00 0.00 179.25 179.83 1nvk h ALA 147 N 1.35 1.02 -0.20 0.00 0.00 -1.23 -2.95 119.26 117.25 1nvk h ALA 147 Ca 0.17 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1nvk h ALA 147 Cb 0.29 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1nvk h ALA 147 CO -0.00 0.02 -0.02 0.72 0.00 0.00 0.00 179.25 179.97 1nvk n HIS 148 N -3.13 0.72 0.29 0.00 -0.00 -0.71 -4.73 115.22 107.66 1nvk n HIS 148 Ca -0.00 -1.00 0.16 0.00 -0.00 0.00 0.00 57.72 56.88 1nvk n HIS 148 Cb 0.25 -0.29 0.76 0.00 -0.00 0.00 0.00 29.99 30.71 1nvk n HIS 148 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.34 177.91 1nvk h LYS 149 N 1.26 0.00 0.00 -0.41 2.10 -1.24 -2.68 116.57 115.60 1nvk h LYS 149 Ca 0.03 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.68 1nvk h LYS 149 Cb 1.36 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.69 1nvk h LYS 149 CO 0.19 0.00 -0.55 1.57 -2.00 0.00 0.00 179.45 178.66 1nvk h LYS 150 N 0.00 0.00 -4.96 0.07 2.10 -1.86 -3.44 116.57 108.48 1nvk h LYS 150 Ca 0.00 0.00 -0.63 0.00 -2.00 0.00 0.00 60.65 58.02 1nvk h LYS 150 Cb 0.21 0.00 -0.16 0.00 -0.90 0.00 0.00 32.23 31.38 1nvk h LYS 150 CO 0.00 0.00 -0.51 0.14 -2.00 0.00 0.00 179.45 177.08 1nvk s VAL 151 N -3.21 5.32 0.14 0.07 -7.23 -1.01 -5.00 120.40 109.48 1nvk s VAL 151 Ca 0.05 0.18 -0.05 0.00 -1.81 0.00 0.00 61.98 60.35 1nvk s VAL 151 Cb 0.11 -3.52 -0.15 0.00 0.56 0.00 0.00 36.38 33.38 1nvk s VAL 151 CO 0.71 0.28 1.34 0.44 -0.31 0.00 0.00 175.10 177.56 1nvk h ASP 152 N 8.12 0.62 -0.00 4.85 3.32 -1.87 -3.31 116.42 128.16 1nvk h ASP 152 Ca -0.36 -0.44 0.00 0.00 0.02 0.00 0.00 57.03 56.25 1nvk h ASP 152 Cb 1.18 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.55 1nvk h ASP 152 CO 0.58 1.22 0.00 -0.46 -1.72 0.00 0.00 179.24 178.86 1nvk n ASN 153 N -3.82 0.02 -4.47 6.45 6.94 -1.26 -4.60 115.26 114.52 1nvk n ASN 153 Ca -0.06 -1.22 -0.43 0.00 -0.02 0.00 0.00 54.58 52.85 1nvk n ASN 153 Cb 0.77 -0.00 -0.04 0.00 -2.36 0.00 0.00 39.78 38.16 1nvk n ASN 153 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1nvk s VAL 154 N -2.00 4.24 -1.08 3.53 1.01 -1.25 -0.91 120.40 123.94 1nvk s VAL 154 Ca 0.38 -0.34 0.09 0.00 0.00 0.00 0.00 61.98 62.11 1nvk s VAL 154 Cb 0.17 -4.75 0.06 0.00 0.00 0.00 0.00 36.38 31.87 1nvk s VAL 154 CO 0.29 -1.55 0.75 2.30 0.00 0.00 0.00 175.10 176.90 1nvk n ILE 155 N 6.00 0.00 -4.12 2.22 -5.35 -0.87 -4.94 119.36 112.29 1nvk n ILE 155 Ca 0.01 -0.48 -0.15 0.00 -0.27 0.00 0.00 62.75 61.86 1nvk n ILE 155 Cb 0.46 1.17 -0.13 0.00 -1.74 0.00 0.00 39.64 39.40 1nvk n ILE 155 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 1nvk s GLU 156 N -0.85 0.44 -0.02 6.28 2.02 -1.15 -5.05 118.70 120.38 1nvk s GLU 156 Ca 0.10 -0.36 0.00 0.00 0.02 0.00 0.00 54.97 54.74 1nvk s GLU 156 Cb 0.07 -0.35 0.02 0.00 0.10 0.00 0.00 34.13 33.97 1nvk s GLU 156 CO 0.13 0.09 -0.01 -0.06 0.02 0.00 0.00 175.26 175.43 1nvk s PHE 157 N -0.51 0.23 -0.13 1.61 0.08 -1.26 -0.24 117.98 117.77 1nvk s PHE 157 Ca -0.02 -0.00 -0.09 0.00 0.12 0.00 0.00 56.93 56.94 1nvk s PHE 157 Cb -0.04 -0.27 0.04 0.00 -0.57 0.00 0.00 43.02 42.18 1nvk s PHE 157 CO -0.00 -0.07 0.32 -2.00 -0.10 0.00 0.00 175.22 173.37 1nvk s GLU 158 N 0.57 0.33 0.19 0.44 2.12 -0.60 -4.97 118.70 116.78 1nvk s GLU 158 Ca -0.05 0.57 -0.29 0.00 0.36 0.00 0.00 54.97 55.55 1nvk s GLU 158 Cb -0.08 0.03 -0.08 0.00 0.26 0.00 0.00 34.13 34.26 1nvk s GLU 158 CO -0.01 -0.11 0.93 -0.47 -0.54 0.00 0.00 175.26 175.06 1nvk s TYR 159 N 0.84 3.92 -0.29 5.30 5.04 -1.26 -0.80 117.35 130.10 1nvk s TYR 159 Ca -0.05 1.85 -0.13 0.00 -2.44 0.00 0.00 57.07 56.30 1nvk s TYR 159 Cb -0.06 -2.98 0.11 0.00 0.35 0.00 0.00 41.96 39.37 1nvk s TYR 159 CO -0.06 0.38 0.66 0.12 -1.34 0.00 0.00 175.55 175.31 1nvk s PHE 160 N -0.77 -1.22 -0.89 4.97 5.36 -0.40 -4.88 117.98 120.15 1nvk s PHE 160 Ca 0.42 2.24 -0.21 0.00 -0.96 0.00 0.00 56.93 58.42 1nvk s PHE 160 Cb -0.25 0.73 -0.13 0.00 -0.34 0.00 0.00 43.02 43.03 1nvk s PHE 160 CO 0.31 -0.60 1.96 -0.35 -1.46 0.00 0.00 175.22 175.07 1nvk n PRO 161 N 4.95 1.68 -0.21 10.12 -0.04 -1.26 -3.95 135.00 146.30 1nvk n PRO 161 Ca -0.16 -2.00 -0.01 0.00 -0.04 0.00 0.00 63.50 61.30 1nvk n PRO 161 Cb 0.53 -3.03 0.06 0.00 -0.04 0.00 0.00 33.50 31.02 1nvk n PRO 161 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1nvk h ILE 162 N 4.58 0.38 0.00 0.52 2.04 -1.88 -2.59 117.51 120.56 1nvk h ILE 162 Ca 0.42 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.28 1nvk h ILE 162 Cb 0.69 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1nvk h ILE 162 CO 1.89 0.00 0.00 -0.62 0.00 0.00 0.00 178.15 179.42 1nvk n GLU 163 N -5.42 0.38 0.00 2.37 1.02 -1.26 -2.10 120.64 115.63 1nvk n GLU 163 Ca 0.07 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.34 1nvk n GLU 163 Cb 0.32 -1.19 0.61 0.00 -0.02 0.00 0.00 31.44 31.16 1nvk n GLU 163 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1nvk n GLN 164 N -0.69 0.22 -0.27 3.49 6.02 -0.98 -3.83 117.38 121.35 1nvk n GLN 164 Ca 0.04 0.05 0.21 0.00 -0.01 0.00 0.00 57.00 57.29 1nvk n GLN 164 Cb 0.02 -1.50 0.53 0.00 1.02 0.00 0.00 30.24 30.31 1nvk n GLN 164 CO 0.00 0.00 0.00 0.10 -1.01 0.00 0.00 177.06 176.15 1nvk h TYR 165 N 0.00 0.52 -0.66 1.08 -0.00 -1.67 -1.38 116.97 114.86 1nvk h TYR 165 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 58.73 58.75 1nvk h TYR 165 Cb 0.33 -0.15 -0.03 0.00 0.00 0.00 0.00 36.73 36.87 1nvk h TYR 165 CO 0.00 0.11 0.43 -0.22 -0.00 0.00 0.00 178.16 178.47 1nvk h LYS 166 N 0.36 0.88 0.00 0.10 3.64 -1.87 -2.14 116.57 117.53 1nvk h LYS 166 Ca 0.51 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.83 1nvk h LYS 166 Cb 1.35 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 1nvk h LYS 166 CO -0.19 0.60 -0.23 0.44 -2.27 0.00 0.00 179.45 177.79 1nvk n ILE 167 N -4.42 0.20 1.06 2.00 -5.35 -0.53 -3.67 119.36 108.65 1nvk n ILE 167 Ca 0.07 -0.12 0.12 0.00 -0.27 0.00 0.00 62.75 62.55 1nvk n ILE 167 Cb 0.05 -0.28 0.12 0.00 -1.74 0.00 0.00 39.64 37.79 1nvk n ILE 167 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 1nvk n HIS 168 N -1.79 0.00 -1.87 4.28 8.25 -0.83 -4.89 115.22 118.37 1nvk n HIS 168 Ca 0.06 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.12 1nvk n HIS 168 Cb 0.38 -0.01 0.01 0.00 1.12 0.00 0.00 29.99 31.49 1nvk n HIS 168 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1nvk s MET 169 N -2.19 3.75 0.46 -0.41 -1.94 -1.05 -4.89 119.30 113.03 1nvk s MET 169 Ca 0.26 2.34 0.15 0.00 -1.71 0.00 0.00 55.69 56.73 1nvk s MET 169 Cb 0.19 -2.68 1.09 0.00 2.01 0.00 0.00 34.83 35.45 1nvk s MET 169 CO 0.41 -0.74 2.02 -0.91 -0.01 0.00 0.00 175.02 175.79 1nvk h ASN 170 N 2.41 0.27 -0.56 3.03 -0.26 -1.93 -1.91 115.58 116.62 1nvk h ASN 170 Ca -0.51 0.00 -0.13 0.00 -0.56 0.00 0.00 56.30 55.11 1nvk h ASN 170 Cb 1.26 -0.06 -0.08 0.00 -1.06 0.00 0.00 38.32 38.39 1nvk h ASN 170 CO 0.61 0.17 0.16 -0.90 -1.06 0.00 0.00 177.43 176.42 1nvk n ASP 171 N -4.47 4.40 -4.77 5.81 3.85 -1.26 -4.98 116.55 115.13 1nvk n ASP 171 Ca 0.07 -2.90 -0.40 0.00 -0.71 0.00 0.00 54.79 50.84 1nvk n ASP 171 Cb 0.31 -0.69 -0.01 0.00 -1.35 0.00 0.00 41.12 39.38 1nvk n ASP 171 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.20 176.31 1nvk s PHE 172 N -2.46 2.78 -0.12 2.11 2.19 -0.72 -5.03 117.98 116.73 1nvk s PHE 172 Ca 0.44 1.33 -0.08 0.00 0.33 0.00 0.00 56.93 58.95 1nvk s PHE 172 Cb 0.34 -3.80 0.04 0.00 -1.31 0.00 0.00 43.02 38.30 1nvk s PHE 172 CO 0.11 -2.36 0.31 -0.65 1.83 0.00 0.00 175.22 174.46 1nvk s GLN 173 N -2.08 0.30 0.54 10.12 -0.21 -1.26 -5.08 119.66 121.99 1nvk s GLN 173 Ca 0.54 0.56 -0.19 0.00 0.02 0.00 0.00 55.36 56.28 1nvk s GLN 173 Cb -0.42 0.00 -0.06 0.00 1.00 0.00 0.00 33.01 33.53 1nvk s GLN 173 CO 0.55 -0.12 1.12 -0.51 -2.12 0.00 0.00 175.29 174.21 1nvk s LEU 174 N 0.93 3.75 0.44 2.90 1.43 -1.26 -5.00 118.68 121.87 1nvk s LEU 174 Ca -0.06 2.15 -0.22 0.00 -1.03 0.00 0.00 54.13 54.96 1nvk s LEU 174 Cb -0.07 -4.58 -0.09 0.00 0.03 0.00 0.00 46.19 41.48 1nvk s LEU 174 CO -0.07 -1.17 1.06 -0.44 0.23 0.00 0.00 176.35 175.96 1nvk s SER 175 N -1.81 6.55 0.37 2.29 0.01 -0.53 -5.05 113.70 115.53 1nvk s SER 175 Ca 0.72 2.02 0.05 0.00 1.31 0.00 0.00 55.95 60.05 1nvk s SER 175 Cb -0.23 -2.58 -0.01 0.00 0.21 0.00 0.00 66.02 63.42 1nvk s SER 175 CO 0.26 -0.64 0.53 -0.54 0.41 0.00 0.00 173.24 173.26 1nvk s LYS 176 N -2.79 3.10 0.04 12.44 1.02 -1.26 -4.63 119.74 127.66 1nvk s LYS 176 Ca 0.62 -0.84 -0.37 0.00 0.02 0.00 0.00 55.97 55.39 1nvk s LYS 176 Cb -0.21 -2.74 -0.17 0.00 -0.52 0.00 0.00 37.83 34.20 1nvk s LYS 176 CO 0.25 -0.04 1.36 -2.30 -0.92 0.00 0.00 175.35 173.70 1nvk n PRO 177 N -1.78 1.04 -4.80 -1.68 -0.02 -1.26 -4.75 135.00 121.75 1nvk n PRO 177 Ca 0.00 0.37 -0.26 0.00 -2.02 0.00 0.00 63.50 61.60 1nvk n PRO 177 Cb 0.58 -2.01 -0.15 0.00 -0.02 0.00 0.00 33.50 31.90 1nvk n PRO 177 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1nvk s THR 178 N 0.76 1.58 0.11 3.45 2.01 -1.26 -5.10 115.64 117.19 1nvk s THR 178 Ca 0.87 -0.99 -0.31 0.00 0.31 0.00 0.00 61.69 61.57 1nvk s THR 178 Cb -1.00 -1.34 -0.10 0.00 0.01 0.00 0.00 72.50 70.07 1nvk s THR 178 CO 0.50 0.33 1.80 -0.75 -0.69 0.00 0.00 174.62 175.81 1nvk s LYS 179 N -0.78 4.15 0.07 4.92 2.47 -1.26 -4.94 119.74 124.37 1nvk s LYS 179 Ca 0.07 2.55 -0.26 0.00 -1.56 0.00 0.00 55.97 56.78 1nvk s LYS 179 Cb -0.08 -3.61 -0.06 0.00 -1.46 0.00 0.00 37.83 32.62 1nvk s LYS 179 CO 0.00 -0.83 0.79 0.15 0.16 0.00 0.00 175.35 175.63 1nvk s LYS 180 N 2.78 4.53 0.00 4.03 -0.14 -1.26 -4.79 119.74 124.88 1nvk s LYS 180 Ca 0.80 1.13 0.00 0.00 -1.36 0.00 0.00 55.97 56.54 1nvk s LYS 180 Cb -0.45 -3.35 0.00 0.00 -1.68 0.00 0.00 37.83 32.35 1nvk s LYS 180 CO 0.36 0.31 0.17 0.25 -0.76 0.00 0.00 175.35 175.67 1nvk n THR 181 N 2.65 0.00 -4.10 2.17 -2.24 -0.38 -5.05 114.28 107.34 1nvk n THR 181 Ca -0.02 -0.30 -0.09 0.00 -2.27 0.00 0.00 64.05 61.37 1nvk n THR 181 Cb 0.50 1.23 -0.10 0.00 -2.10 0.00 0.00 70.33 69.86 1nvk n THR 181 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1nvk s LEU 182 N -0.52 2.44 -0.19 3.22 1.43 -1.04 -5.02 118.68 119.00 1nvk s LEU 182 Ca 0.00 -0.89 -0.18 0.00 -1.03 0.00 0.00 54.13 52.04 1nvk s LEU 182 Cb 0.00 0.06 -0.14 0.00 0.03 0.00 0.00 46.19 46.14 1nvk s LEU 182 CO 0.00 -0.48 0.09 0.44 0.23 0.00 0.00 176.35 176.64 1nvk h ASP 183 N 3.44 0.00 -4.41 2.29 3.32 -1.41 -1.56 116.42 118.08 1nvk h ASP 183 Ca -0.34 -0.35 -0.37 0.00 0.02 0.00 0.00 57.03 55.99 1nvk h ASP 183 Cb 1.16 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.48 1nvk h ASP 183 CO 0.60 1.25 -0.77 -0.69 -1.72 0.00 0.00 179.24 177.91 1nvk s VAL 184 N -2.31 0.83 0.03 -1.35 1.01 -1.09 -1.34 120.40 116.16 1nvk s VAL 184 Ca -0.24 -0.94 -0.02 0.00 0.00 0.00 0.00 61.98 60.78 1nvk s VAL 184 Cb 0.05 -0.79 -0.02 0.00 0.00 0.00 0.00 36.38 35.62 1nvk s VAL 184 CO 0.47 -0.12 0.01 -0.51 0.00 0.00 0.00 175.10 174.95 1nvk s ILE 185 N -0.94 0.13 -0.19 2.22 2.07 -0.78 -1.86 121.20 121.84 1nvk s ILE 185 Ca -0.02 -1.06 -0.11 0.00 -1.41 0.00 0.00 60.65 58.05 1nvk s ILE 185 Cb -0.08 -0.59 0.06 0.00 0.13 0.00 0.00 42.46 41.99 1nvk s ILE 185 CO 0.01 -0.58 0.47 -0.47 -1.91 0.00 0.00 174.94 172.46 1nvk s TYR 186 N -2.03 -0.70 -0.10 3.50 6.14 -0.82 -1.96 117.35 121.38 1nvk s TYR 186 Ca -0.10 1.47 0.03 0.00 0.64 0.00 0.00 57.07 59.11 1nvk s TYR 186 Cb -0.05 0.35 -0.01 0.00 0.42 0.00 0.00 41.96 42.66 1nvk s TYR 186 CO -0.03 -0.38 -0.21 0.20 0.64 0.00 0.00 175.55 175.77 1nvk s GLY 187 N 1.46 1.38 0.00 8.97 0.00 -1.26 -1.03 107.32 116.84 1nvk s GLY 187 Ca -0.10 -0.97 0.00 0.00 0.00 0.00 0.00 44.72 43.66 1nvk s GLY 187 CO -0.14 -0.38 0.00 0.61 0.00 0.00 0.00 173.10 173.18 1nvk n GLY 188 N 3.34 -1.81 3.99 0.20 0.00 0.18 -4.97 105.19 106.13 1nvk n GLY 188 Ca -0.18 -1.13 -0.21 0.00 0.00 0.00 0.00 46.02 44.50 1nvk n GLY 188 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nvk s SER 189 N -1.56 5.04 0.33 1.61 1.04 -1.26 -2.97 113.70 115.93 1nvk s SER 189 Ca 0.00 -0.89 0.26 0.00 0.48 0.00 0.00 55.95 55.80 1nvk s SER 189 Cb 0.00 0.14 0.94 0.00 0.10 0.00 0.00 66.02 67.21 1nvk s SER 189 CO 0.00 -1.16 1.78 0.15 0.98 0.00 0.00 173.24 174.99 1nvk h PHE 190 N 0.45 0.00 -6.42 5.02 3.57 -1.94 -3.44 116.94 114.17 1nvk h PHE 190 Ca -0.34 0.00 -0.50 0.00 3.53 0.00 0.00 57.97 60.66 1nvk h PHE 190 Cb 1.29 0.00 -0.16 0.00 2.79 0.00 0.00 35.95 39.87 1nvk h PHE 190 CO 0.57 0.00 -0.76 0.54 -2.23 0.00 0.00 178.31 176.43 1nvk n ARG 191 N -2.54 -3.61 -2.73 1.11 1.74 -1.26 -1.05 116.66 108.31 1nvk n ARG 191 Ca 0.03 0.43 -0.17 0.00 -0.77 0.00 0.00 57.85 57.37 1nvk n ARG 191 Cb 0.34 -5.18 -0.00 0.00 -1.02 0.00 0.00 32.46 26.59 1nvk n ARG 191 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1nvk n SER 192 N -2.60 -4.25 0.00 0.55 7.64 -1.26 -1.38 113.62 112.32 1nvk n SER 192 Ca 0.06 -0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.92 1nvk n SER 192 Cb 0.50 -3.56 0.00 0.00 -1.01 0.00 0.00 64.21 60.15 1nvk n SER 192 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nvk n GLY 193 N -0.99 0.35 0.00 0.23 0.00 -0.22 -4.89 105.19 99.67 1nvk n GLY 193 Ca -0.12 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.95 1nvk n GLY 193 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1nvk n GLN 194 N -1.81 0.00 -0.30 1.61 1.13 -0.48 -2.67 117.38 114.87 1nvk n GLN 194 Ca 0.00 0.32 0.02 0.00 -1.94 0.00 0.00 57.00 55.40 1nvk n GLN 194 Cb 0.15 -1.50 0.03 0.00 0.11 0.00 0.00 30.24 29.02 1nvk n GLN 194 CO 0.00 0.00 0.00 -2.13 -1.44 0.00 0.00 177.06 173.49 1nvk n ARG 195 N -1.50 0.41 -0.28 -1.09 0.63 -1.26 -4.50 116.66 109.07 1nvk n ARG 195 Ca 0.03 -1.22 0.02 0.00 -0.92 0.00 0.00 57.85 55.76 1nvk n ARG 195 Cb 0.12 -0.71 0.16 0.00 0.45 0.00 0.00 32.46 32.48 1nvk n ARG 195 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1nvk h GLU 196 N 0.00 0.71 -0.48 -0.14 4.81 -1.82 -2.08 114.58 115.59 1nvk h GLU 196 Ca 0.00 -0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.24 1nvk h GLU 196 Cb 1.20 -0.16 -0.05 0.00 0.63 0.00 0.00 28.75 30.37 1nvk h GLU 196 CO 0.00 0.47 0.20 1.03 -0.73 0.00 0.00 179.01 179.98 1nvk h SER 197 N 0.74 0.25 0.12 1.04 0.87 -1.90 -1.01 113.55 113.65 1nvk h SER 197 Ca 0.38 0.04 -0.16 0.00 -1.23 0.00 0.00 61.79 60.83 1nvk h SER 197 Cb 0.36 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.32 1nvk h SER 197 CO -0.25 0.18 -0.58 0.11 -0.53 0.00 0.00 176.83 175.76 1nvk h LYS 198 N 0.40 0.47 -0.50 2.24 1.79 -1.87 -1.59 116.57 117.51 1nvk h LYS 198 Ca 0.22 -0.31 -0.05 0.00 -2.18 0.00 0.00 60.65 58.33 1nvk h LYS 198 Cb 0.19 0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.86 1nvk h LYS 198 CO -0.20 0.92 0.12 0.52 -1.08 0.00 0.00 179.45 179.73 1nvk h MET 199 N 0.36 0.81 -0.40 3.15 2.86 -1.01 -1.99 114.93 118.72 1nvk h MET 199 Ca 0.00 -0.20 -0.11 0.00 -2.06 0.00 0.00 59.70 57.33 1nvk h MET 199 Cb 1.12 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.66 1nvk h MET 199 CO 0.10 0.79 -0.18 0.28 1.06 0.00 0.00 176.91 178.96 1nvk h VAL 200 N 0.70 1.28 -0.05 -2.22 2.07 -1.15 -0.58 116.25 116.30 1nvk h VAL 200 Ca 0.16 -1.31 0.02 0.00 0.82 0.00 0.00 66.70 66.38 1nvk h VAL 200 Cb 0.35 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 1nvk h VAL 200 CO 0.00 0.44 -0.06 -0.08 0.02 0.00 0.00 177.57 177.89 1nvk h GLU 201 N 0.64 -0.09 0.00 1.57 4.57 -1.12 -2.76 114.58 117.39 1nvk h GLU 201 Ca 0.09 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 1nvk h GLU 201 Cb 0.73 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.34 1nvk h GLU 201 CO 0.06 -0.06 -1.21 1.19 -1.18 0.00 0.00 179.01 177.80 1nvk n PHE 202 N -5.19 0.23 0.17 0.92 3.72 -0.76 -4.21 117.46 112.34 1nvk n PHE 202 Ca -0.05 0.07 0.03 0.00 -0.05 0.00 0.00 57.45 57.44 1nvk n PHE 202 Cb 0.12 -0.43 -0.03 0.00 -0.94 0.00 0.00 39.48 38.20 1nvk n PHE 202 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1nvk n LEU 203 N -2.01 0.17 -4.71 4.37 4.77 -0.23 -4.96 117.00 114.41 1nvk n LEU 203 Ca 0.01 -0.35 -0.27 0.00 -0.03 0.00 0.00 56.01 55.37 1nvk n LEU 203 Cb 0.46 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.48 1nvk n LEU 203 CO 0.42 0.04 -0.30 -0.36 -1.33 0.00 0.00 177.39 175.86 1nvk s PHE 204 N -1.75 2.96 -1.71 -1.77 0.40 -1.04 -3.89 117.98 111.18 1nvk s PHE 204 Ca 0.01 -0.08 -0.18 0.00 -0.60 0.00 0.00 56.93 56.08 1nvk s PHE 204 Cb 0.04 -1.45 0.16 0.00 0.51 0.00 0.00 43.02 42.28 1nvk s PHE 204 CO 0.21 0.51 0.75 -0.25 0.70 0.00 0.00 175.22 177.15 1nvk n ASP 205 N -0.06 -3.03 0.04 1.36 8.00 0.08 -4.83 116.55 118.11 1nvk n ASP 205 Ca -0.09 -1.04 0.10 0.00 0.71 0.00 0.00 54.79 54.47 1nvk n ASP 205 Cb 0.54 -2.66 -0.10 0.00 -0.02 0.00 0.00 41.12 38.89 1nvk n ASP 205 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1nvk n THR 206 N -4.36 0.36 -0.94 -3.53 -2.24 -1.26 -4.96 114.28 97.35 1nvk n THR 206 Ca 0.06 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 1nvk n THR 206 Cb 0.50 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 1nvk n THR 206 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nvk n GLY 207 N 1.25 0.97 4.00 3.38 0.00 -1.26 -4.97 105.19 108.56 1nvk n GLY 207 Ca -0.04 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.79 1nvk n GLY 207 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nvk s LEU 208 N 0.00 3.40 -0.75 0.99 1.43 -1.26 -5.04 118.68 117.45 1nvk s LEU 208 Ca 0.00 -0.35 -0.19 0.00 -1.03 0.00 0.00 54.13 52.56 1nvk s LEU 208 Cb 0.00 -2.52 0.12 0.00 0.03 0.00 0.00 46.19 43.82 1nvk s LEU 208 CO 0.00 -1.05 0.91 0.21 0.23 0.00 0.00 176.35 176.64 1nvk s ASN 209 N -4.45 6.41 -0.02 2.29 2.47 -1.26 -5.02 114.94 115.36 1nvk s ASN 209 Ca 0.58 -1.73 0.04 0.00 0.42 0.00 0.00 52.86 52.17 1nvk s ASN 209 Cb -0.09 -2.34 -0.03 0.00 -1.45 0.00 0.00 41.25 37.34 1nvk s ASN 209 CO 0.36 -1.09 -0.15 -0.63 -3.72 0.00 0.00 177.10 171.88 1nvk s ILE 210 N 2.61 3.02 -0.03 -5.21 1.01 -1.26 -1.03 121.20 120.30 1nvk s ILE 210 Ca 0.22 -0.84 0.06 0.00 0.00 0.00 0.00 60.65 60.09 1nvk s ILE 210 Cb -0.14 -2.21 -0.01 0.00 0.01 0.00 0.00 42.46 40.11 1nvk s ILE 210 CO -0.01 0.52 -0.21 -0.70 0.00 0.00 0.00 174.94 174.55 1nvk s GLU 211 N -0.94 1.83 -0.28 2.79 2.12 -0.78 -1.42 118.70 122.02 1nvk s GLU 211 Ca 0.13 -0.74 0.03 0.00 0.36 0.00 0.00 54.97 54.75 1nvk s GLU 211 Cb -0.11 -1.70 0.07 0.00 0.26 0.00 0.00 34.13 32.66 1nvk s GLU 211 CO 0.02 0.40 -0.06 0.12 -0.54 0.00 0.00 175.26 175.20 1nvk s PHE 212 N -0.34 3.41 0.22 5.30 2.19 0.47 -1.95 117.98 127.28 1nvk s PHE 212 Ca 0.04 -2.53 0.06 0.00 0.33 0.00 0.00 56.93 54.82 1nvk s PHE 212 Cb -0.10 -2.24 -0.03 0.00 -1.31 0.00 0.00 43.02 39.34 1nvk s PHE 212 CO 0.00 -0.90 0.24 -0.59 1.83 0.00 0.00 175.22 175.81 1nvk s PHE 213 N 1.04 3.25 -1.04 10.12 -0.71 -0.20 -2.19 117.98 128.25 1nvk s PHE 213 Ca -0.03 -0.05 0.00 0.00 -1.04 0.00 0.00 56.93 55.82 1nvk s PHE 213 Cb -0.20 -1.50 0.00 0.00 -1.21 0.00 0.00 43.02 40.12 1nvk s PHE 213 CO -0.06 0.50 0.00 0.41 -1.34 0.00 0.00 175.22 174.73 1nvk n GLY 214 N -1.04 0.49 0.07 1.99 0.00 -1.05 -0.65 105.19 104.99 1nvk n GLY 214 Ca -0.08 -2.22 0.12 0.00 0.00 0.00 0.00 46.02 43.84 1nvk n GLY 214 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1nvk n ASN 215 N 0.36 0.44 -4.76 1.61 2.85 -1.16 -3.45 115.26 111.16 1nvk n ASN 215 Ca 0.00 0.57 -0.36 0.00 -0.11 0.00 0.00 54.58 54.68 1nvk n ASN 215 Cb 0.00 -0.68 0.01 0.00 1.24 0.00 0.00 39.78 40.35 1nvk n ASN 215 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1nvk s ALA 216 N -3.13 2.74 0.04 5.20 0.00 -1.23 -4.78 121.76 120.61 1nvk s ALA 216 Ca 0.08 0.99 0.04 0.00 0.00 0.00 0.00 51.96 53.07 1nvk s ALA 216 Cb 0.12 -3.42 -0.02 0.00 0.00 0.00 0.00 23.12 19.79 1nvk s ALA 216 CO 0.45 -0.95 -0.11 1.03 0.00 0.00 0.00 175.76 176.18 1nvk s ARG 217 N -3.08 0.69 0.27 0.00 0.52 -1.26 -4.85 118.95 111.25 1nvk s ARG 217 Ca 0.71 -0.75 -0.00 0.00 -0.52 0.00 0.00 55.73 55.17 1nvk s ARG 217 Cb -0.30 -0.61 0.55 0.00 0.52 0.00 0.00 34.95 35.11 1nvk s ARG 217 CO 0.34 0.14 1.79 1.49 0.02 0.00 0.00 175.30 179.07 1nvk h GLU 218 N 4.70 0.72 0.00 3.54 4.81 -1.97 -1.59 114.58 124.80 1nvk h GLU 218 Ca -0.37 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.82 1nvk h GLU 218 Cb 1.19 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.41 1nvk h GLU 218 CO 0.42 0.48 0.00 0.36 -0.73 0.00 0.00 179.01 179.54 1nvk n LYS 219 N -4.79 0.04 0.21 1.92 2.85 -1.26 -2.06 118.16 115.07 1nvk n LYS 219 Ca 0.18 0.40 0.12 0.00 -1.05 0.00 0.00 58.31 57.96 1nvk n LYS 219 Cb 0.42 -1.59 0.17 0.00 -0.65 0.00 0.00 35.03 33.38 1nvk n LYS 219 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 177.40 179.31 1nvk h GLN 220 N 0.00 0.00 -5.19 -1.58 4.20 -1.72 -3.41 115.11 107.42 1nvk h GLN 220 Ca 0.00 0.00 -0.67 0.00 0.06 0.00 0.00 58.65 58.04 1nvk h GLN 220 Cb 0.15 0.00 -0.16 0.00 0.30 0.00 0.00 27.48 27.76 1nvk h GLN 220 CO 0.00 0.00 0.80 -0.06 -0.67 0.00 0.00 178.83 178.90 1nvk s PHE 221 N -3.21 2.97 0.00 2.96 0.40 -0.87 -4.69 117.98 115.54 1nvk s PHE 221 Ca 0.07 -1.15 0.02 0.00 -0.60 0.00 0.00 56.93 55.27 1nvk s PHE 221 Cb 0.06 -4.31 0.03 0.00 0.51 0.00 0.00 43.02 39.31 1nvk s PHE 221 CO 0.67 -1.55 0.96 0.36 0.70 0.00 0.00 175.22 176.36 1nvk n LYS 222 N 6.97 0.00 -2.19 0.44 2.85 -1.26 -5.03 118.16 119.95 1nvk n LYS 222 Ca 0.17 -0.96 -0.42 0.00 -1.05 0.00 0.00 58.31 56.05 1nvk n LYS 222 Cb 0.48 -0.40 -0.03 0.00 -0.65 0.00 0.00 35.03 34.44 1nvk n LYS 222 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 1nvk s ASN 223 N -0.96 6.81 0.65 -5.58 3.84 -1.26 -4.89 114.94 113.54 1nvk s ASN 223 Ca 0.02 2.07 0.38 0.00 0.21 0.00 0.00 52.86 55.55 1nvk s ASN 223 Cb 0.03 -2.55 2.11 0.00 -0.55 0.00 0.00 41.25 40.29 1nvk s ASN 223 CO -0.01 -0.80 2.25 1.55 -2.79 0.00 0.00 177.10 177.30 1nvk h PRO 224 N 8.45 0.00 0.00 0.43 0.13 -2.02 -1.58 132.00 137.40 1nvk h PRO 224 Ca -0.36 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.70 1nvk h PRO 224 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 1nvk h PRO 224 CO 0.93 0.00 -0.31 0.87 -0.23 0.00 0.00 178.00 179.26 1nvk h LYS 225 N 0.00 0.00 -2.27 0.86 1.57 -2.05 -3.37 116.57 111.32 1nvk h LYS 225 Ca 0.01 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.20 1nvk h LYS 225 Cb 0.18 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.08 1nvk h LYS 225 CO -0.00 0.31 -0.75 0.66 -0.57 0.00 0.00 179.45 179.10 1nvk n TYR 226 N -3.41 2.23 -1.30 -1.35 4.01 -0.60 -5.11 117.16 111.63 1nvk n TYR 226 Ca 0.00 -3.96 -0.31 0.00 -0.16 0.00 0.00 57.90 53.47 1nvk n TYR 226 Cb 0.50 -0.46 0.09 0.00 -0.31 0.00 0.00 39.34 39.16 1nvk n TYR 226 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1nvk s PRO 227 N -1.84 2.34 0.22 -0.72 0.04 -1.26 -4.73 135.00 129.06 1nvk s PRO 227 Ca 0.36 1.14 -0.17 0.00 0.04 0.00 0.00 61.00 62.37 1nvk s PRO 227 Cb 0.12 -1.91 0.02 0.00 0.04 0.00 0.00 34.50 32.78 1nvk s PRO 227 CO -0.07 -1.58 0.55 1.67 0.04 0.00 0.00 177.00 177.61 1nvk s TRP 228 N -2.92 -0.04 -0.01 0.56 1.48 -1.26 -5.05 118.94 111.69 1nvk s TRP 228 Ca 0.61 -0.32 -0.01 0.00 -1.06 0.00 0.00 56.10 55.32 1nvk s TRP 228 Cb -0.17 0.41 -0.01 0.00 -1.16 0.00 0.00 33.47 32.55 1nvk s TRP 228 CO 0.56 -0.99 -0.02 2.41 -4.06 0.00 0.00 176.95 174.86 1nvk n THR 229 N -0.37 0.07 -4.11 0.66 -1.04 -1.26 -5.02 114.28 103.21 1nvk n THR 229 Ca -0.07 -0.02 -0.33 0.00 -2.04 0.00 0.00 64.05 61.58 1nvk n THR 229 Cb 0.62 -1.42 -0.16 0.00 -1.82 0.00 0.00 70.33 67.55 1nvk n THR 229 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1nvk s LYS 230 N -2.02 3.09 0.38 -2.82 2.20 -1.26 -5.03 119.74 114.28 1nvk s LYS 230 Ca -0.02 -0.78 0.01 0.00 -0.36 0.00 0.00 55.97 54.82 1nvk s LYS 230 Cb 0.01 -2.67 -0.02 0.00 -1.51 0.00 0.00 37.83 33.64 1nvk s LYS 230 CO 0.02 -0.19 0.59 0.00 -0.36 0.00 0.00 175.35 175.41 1nvk s ALA 231 N 1.30 3.74 1.00 3.13 0.00 -1.26 -0.74 121.76 128.93 1nvk s ALA 231 Ca 0.04 -0.98 -0.15 0.00 0.00 0.00 0.00 51.96 50.87 1nvk s ALA 231 Cb -0.13 -2.11 0.19 0.00 0.00 0.00 0.00 23.12 21.07 1nvk s ALA 231 CO -0.10 -0.15 1.16 -1.25 0.00 0.00 0.00 175.76 175.42 1nvk s PRO 232 N -4.40 0.36 -0.09 0.00 0.04 -1.25 -4.90 135.00 124.75 1nvk s PRO 232 Ca 0.43 0.09 -0.26 0.00 0.04 0.00 0.00 61.00 61.31 1nvk s PRO 232 Cb -0.10 -1.77 -0.03 0.00 0.04 0.00 0.00 34.50 32.65 1nvk s PRO 232 CO 0.37 -2.68 0.82 0.08 0.04 0.00 0.00 177.00 175.63 1nvk s VAL 233 N -3.29 4.93 -0.19 -0.36 1.01 -0.51 -4.86 120.40 117.13 1nvk s VAL 233 Ca 0.68 1.67 -0.11 0.00 0.00 0.00 0.00 61.98 64.21 1nvk s VAL 233 Cb -0.12 -4.15 -0.05 0.00 0.00 0.00 0.00 36.38 32.06 1nvk s VAL 233 CO 0.54 0.13 0.19 -0.36 0.00 0.00 0.00 175.10 175.61 1nvk s PHE 234 N 1.42 3.41 0.29 5.22 0.40 -1.26 -0.40 117.98 127.07 1nvk s PHE 234 Ca 0.41 0.40 0.08 0.00 -0.60 0.00 0.00 56.93 57.23 1nvk s PHE 234 Cb -0.18 -2.24 -0.06 0.00 0.51 0.00 0.00 43.02 41.05 1nvk s PHE 234 CO 0.18 0.24 -0.10 0.95 0.70 0.00 0.00 175.22 177.18 1nvk s THR 235 N 0.52 1.94 1.37 0.64 -4.23 -0.93 -4.98 115.64 109.97 1nvk s THR 235 Ca 0.11 -2.20 -0.22 0.00 -1.18 0.00 0.00 61.69 58.19 1nvk s THR 235 Cb -0.12 -2.43 0.35 0.00 1.34 0.00 0.00 72.50 71.64 1nvk s THR 235 CO 0.01 -0.33 0.99 -0.83 -0.54 0.00 0.00 174.62 173.92 1nvk s GLY 236 N -3.48 1.47 0.52 3.99 0.00 -1.26 -2.96 107.32 105.59 1nvk s GLY 236 Ca 0.29 -0.91 -0.11 0.00 0.00 0.00 0.00 44.72 44.00 1nvk s GLY 236 CO 0.13 0.08 0.91 -1.59 0.00 0.00 0.00 173.10 172.63 1nvk s LYS 237 N -5.23 3.69 0.22 2.90 -2.85 -1.22 -2.54 119.74 114.70 1nvk s LYS 237 Ca 0.70 0.60 0.05 0.00 -1.00 0.00 0.00 55.97 56.31 1nvk s LYS 237 Cb -0.11 -2.23 -0.05 0.00 -2.06 0.00 0.00 37.83 33.38 1nvk s LYS 237 CO 0.57 -0.32 -0.06 0.96 0.10 0.00 0.00 175.35 176.61 1nvk s ILE 238 N -2.80 1.30 0.50 3.79 -4.36 -1.26 -4.90 121.20 113.47 1nvk s ILE 238 Ca 0.53 -2.09 -0.23 0.00 -0.26 0.00 0.00 60.65 58.60 1nvk s ILE 238 Cb -0.10 -2.21 -0.07 0.00 1.25 0.00 0.00 42.46 41.33 1nvk s ILE 238 CO 0.43 -0.46 1.38 -2.65 0.24 0.00 0.00 174.94 173.88 1nvk n PRO 239 N -0.40 1.93 -0.18 0.37 -0.02 -1.26 -4.88 135.00 130.56 1nvk n PRO 239 Ca -0.07 0.70 0.09 0.00 -2.02 0.00 0.00 63.50 62.20 1nvk n PRO 239 Cb 0.62 -2.58 0.40 0.00 -0.02 0.00 0.00 33.50 31.92 1nvk n PRO 239 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1nvk h MET 240 N 1.81 0.63 0.00 -0.52 4.05 -1.89 -0.87 114.93 118.14 1nvk h MET 240 Ca -0.51 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 58.88 1nvk h MET 240 Cb 1.29 -0.14 0.00 0.00 -0.80 0.00 0.00 31.60 31.95 1nvk h MET 240 CO 0.59 0.42 0.00 0.27 0.23 0.00 0.00 176.91 178.41 1nvk n ASN 241 N -4.49 0.00 -0.25 1.39 6.94 -1.26 -2.58 115.26 115.01 1nvk n ASN 241 Ca 0.12 -0.98 0.03 0.00 -0.02 0.00 0.00 54.58 53.73 1nvk n ASN 241 Cb 0.33 0.00 0.04 0.00 -2.36 0.00 0.00 39.78 37.79 1nvk n ASN 241 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 1nvk n MET 242 N -0.83 1.12 -0.06 -3.83 2.81 -0.33 -4.78 117.12 111.21 1nvk n MET 242 Ca 0.12 -1.22 -0.10 0.00 -1.81 0.00 0.00 57.70 54.68 1nvk n MET 242 Cb 0.05 -1.11 -0.04 0.00 -0.71 0.00 0.00 33.22 31.42 1nvk n MET 242 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1nvk h VAL 243 N 1.00 1.12 -0.31 2.03 2.07 -1.52 -1.70 116.25 118.94 1nvk h VAL 243 Ca 0.00 -0.34 -0.05 0.00 0.82 0.00 0.00 66.70 67.13 1nvk h VAL 243 Cb 0.39 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 1nvk h VAL 243 CO 0.00 0.12 -0.04 0.28 0.02 0.00 0.00 177.57 177.95 1nvk h SER 244 N 0.24 0.47 -0.36 0.57 0.02 -1.84 0.10 113.55 112.76 1nvk h SER 244 Ca 0.08 -0.09 -0.12 0.00 -0.84 0.00 0.00 61.79 60.81 1nvk h SER 244 Cb 0.09 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 1nvk h SER 244 CO -0.01 0.56 -0.24 -0.08 -1.14 0.00 0.00 176.83 175.93 1nvk h GLU 245 N 0.47 0.86 -0.23 3.45 4.81 -1.86 -2.05 114.58 120.03 1nvk h GLU 245 Ca 0.10 -0.36 -0.03 0.00 -0.13 0.00 0.00 59.36 58.93 1nvk h GLU 245 Cb 0.37 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 1nvk h GLU 245 CO 0.02 1.00 0.02 -0.22 -0.73 0.00 0.00 179.01 179.10 1nvk h LYS 246 N 0.74 0.39 -0.84 1.92 1.63 -0.68 -2.87 116.57 116.87 1nvk h LYS 246 Ca 0.10 -0.12 0.09 0.00 -0.85 0.00 0.00 60.65 59.87 1nvk h LYS 246 Cb 0.78 -0.04 -0.06 0.00 -0.60 0.00 0.00 32.23 32.31 1nvk h LYS 246 CO 0.06 0.56 0.55 -0.91 -3.45 0.00 0.00 179.45 176.26 1nvk h ASN 247 N 0.18 0.75 0.04 4.20 2.35 -0.85 -1.86 115.58 120.39 1nvk h ASN 247 Ca 0.07 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1nvk h ASN 247 Cb 0.37 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.60 1nvk h ASN 247 CO 0.01 0.45 0.00 -1.20 -1.65 0.00 0.00 177.43 175.04 1nvk n SER 248 N -4.51 0.13 0.23 5.81 7.64 -0.78 -1.95 113.62 120.18 1nvk n SER 248 Ca 0.14 0.56 0.15 0.00 1.01 0.00 0.00 58.87 60.73 1nvk n SER 248 Cb 0.30 -0.58 0.49 0.00 -1.01 0.00 0.00 64.21 63.42 1nvk n SER 248 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1nvk h GLN 249 N 0.00 0.00 -6.19 1.43 1.08 -1.41 -3.43 115.11 106.58 1nvk h GLN 249 Ca 0.00 0.00 -0.51 0.00 -1.45 0.00 0.00 58.65 56.69 1nvk h GLN 249 Cb 0.02 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 27.40 1nvk h GLN 249 CO 0.00 0.00 -0.54 0.00 -0.95 0.00 0.00 178.83 177.34 1nvk s ALA 250 N -3.44 3.53 0.16 3.87 0.00 -0.82 -1.25 121.76 123.81 1nvk s ALA 250 Ca 0.04 -1.50 -0.09 0.00 0.00 0.00 0.00 51.96 50.41 1nvk s ALA 250 Cb 0.08 -1.18 0.01 0.00 0.00 0.00 0.00 23.12 22.04 1nvk s ALA 250 CO 0.56 0.22 1.52 0.82 0.00 0.00 0.00 175.76 178.89 1nvk h ILE 251 N 1.54 1.27 -4.05 0.00 2.04 -1.06 -3.38 117.51 113.87 1nvk h ILE 251 Ca -0.47 -1.48 -0.17 0.00 1.00 0.00 0.00 64.86 63.74 1nvk h ILE 251 Cb 1.24 1.28 -0.17 0.00 -0.74 0.00 0.00 36.82 38.43 1nvk h ILE 251 CO 0.60 0.50 -0.69 0.00 0.00 0.00 0.00 178.15 178.56 1nvk s ALA 252 N -4.50 0.54 -0.03 1.87 0.00 -0.45 -1.09 121.76 118.08 1nvk s ALA 252 Ca -0.11 -1.05 0.03 0.00 0.00 0.00 0.00 51.96 50.83 1nvk s ALA 252 Cb 0.12 0.19 0.00 0.00 0.00 0.00 0.00 23.12 23.43 1nvk s ALA 252 CO 0.87 -0.25 -0.10 0.00 0.00 0.00 0.00 175.76 176.28 1nvk s ALA 253 N -2.99 0.97 0.12 0.00 0.00 -0.22 -1.87 121.76 117.77 1nvk s ALA 253 Ca 0.01 -0.39 -0.24 0.00 0.00 0.00 0.00 51.96 51.33 1nvk s ALA 253 Cb 0.01 -0.35 -0.07 0.00 0.00 0.00 0.00 23.12 22.71 1nvk s ALA 253 CO -0.06 0.16 0.75 -1.17 0.00 0.00 0.00 175.76 175.45 1nvk s LEU 254 N 0.16 4.55 -0.24 0.00 2.96 -0.83 -1.66 118.68 123.63 1nvk s LEU 254 Ca -0.03 1.55 0.01 0.00 -0.22 0.00 0.00 54.13 55.43 1nvk s LEU 254 Cb -0.09 -3.23 0.04 0.00 0.50 0.00 0.00 46.19 43.41 1nvk s LEU 254 CO 0.01 0.17 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.47 1nvk s ILE 255 N -0.87 2.44 0.16 6.68 -1.09 -0.31 -4.89 121.20 123.31 1nvk s ILE 255 Ca 0.36 -1.23 -0.02 0.00 -2.23 0.00 0.00 60.65 57.52 1nvk s ILE 255 Cb -0.22 -2.26 -0.04 0.00 -1.58 0.00 0.00 42.46 38.36 1nvk s ILE 255 CO 0.25 0.19 0.12 0.27 -1.23 0.00 0.00 174.94 174.53 1nvk s ILE 256 N 1.24 0.06 0.36 2.92 -4.36 -1.26 -1.75 121.20 118.41 1nvk s ILE 256 Ca -0.02 -1.86 -0.08 0.00 -0.26 0.00 0.00 60.65 58.43 1nvk s ILE 256 Cb -0.17 -2.16 0.02 0.00 1.25 0.00 0.00 42.46 41.40 1nvk s ILE 256 CO -0.07 -0.29 0.60 -0.83 0.24 0.00 0.00 174.94 174.59 1nvk s GLY 257 N -3.07 1.05 0.73 6.27 0.00 -1.26 -5.08 107.32 105.96 1nvk s GLY 257 Ca 0.28 -1.22 -0.12 0.00 0.00 0.00 0.00 44.72 43.66 1nvk s GLY 257 CO 0.05 -0.73 1.09 0.99 0.00 0.00 0.00 173.10 174.50 1nvk s ASP 258 N -3.17 4.77 0.25 1.64 1.11 -1.26 -4.89 116.67 115.12 1nvk s ASP 258 Ca 0.25 1.84 -0.04 0.00 0.18 0.00 0.00 52.55 54.77 1nvk s ASP 258 Cb -0.02 -2.53 0.47 0.00 1.07 0.00 0.00 42.92 41.91 1nvk s ASP 258 CO 0.17 -1.85 1.70 0.50 1.18 0.00 0.00 175.17 176.87 1nvk h LYS 259 N -0.77 0.33 0.00 8.23 1.63 -2.00 0.91 116.57 124.89 1nvk h LYS 259 Ca -0.44 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.34 1nvk h LYS 259 Cb 1.23 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.79 1nvk h LYS 259 CO 0.53 0.22 0.00 0.09 -3.45 0.00 0.00 179.45 176.84 1nvk n ASN 260 N -5.09 0.00 0.05 4.20 5.03 -1.26 -2.51 115.26 115.68 1nvk n ASN 260 Ca 0.14 -0.18 0.03 0.00 0.87 0.00 0.00 54.58 55.45 1nvk n ASN 260 Cb 0.45 -0.20 -0.06 0.00 -1.02 0.00 0.00 39.78 38.95 1nvk n ASN 260 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1nvk n TYR 261 N -1.20 0.98 -1.67 3.10 4.02 0.31 -4.64 117.16 118.05 1nvk n TYR 261 Ca 0.11 0.31 -0.46 0.00 -0.01 0.00 0.00 57.90 57.85 1nvk n TYR 261 Cb 0.12 -1.05 -0.04 0.00 -0.02 0.00 0.00 39.34 38.35 1nvk n TYR 261 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1nvk n ASN 262 N -2.83 3.19 -2.37 7.72 3.02 -1.04 -0.60 115.26 122.35 1nvk n ASN 262 Ca -0.07 1.07 -0.12 0.00 -0.03 0.00 0.00 54.58 55.43 1nvk n ASN 262 Cb 0.76 -1.43 -0.01 0.00 -0.61 0.00 0.00 39.78 38.49 1nvk n ASN 262 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1nvk n ASP 263 N 3.75 -3.89 0.11 6.41 8.00 -0.25 -4.69 116.55 125.98 1nvk n ASP 263 Ca 0.17 0.20 0.00 0.00 0.71 0.00 0.00 54.79 55.87 1nvk n ASP 263 Cb 0.29 -3.33 0.00 0.00 -0.02 0.00 0.00 41.12 38.06 1nvk n ASP 263 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1nvk n ASN 264 N -1.71 -0.05 -4.78 -2.24 5.15 -0.20 -4.90 115.26 106.53 1nvk n ASN 264 Ca -0.15 0.36 -0.36 0.00 -0.60 0.00 0.00 54.58 53.83 1nvk n ASN 264 Cb 0.60 0.27 -0.07 0.00 -0.53 0.00 0.00 39.78 40.04 1nvk n ASN 264 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1nvk s PHE 265 N -2.00 3.45 -0.57 1.20 0.40 0.23 -2.44 117.98 118.26 1nvk s PHE 265 Ca 0.00 0.37 -0.04 0.00 -0.60 0.00 0.00 56.93 56.66 1nvk s PHE 265 Cb 0.00 -2.04 0.15 0.00 0.51 0.00 0.00 43.02 41.64 1nvk s PHE 265 CO 0.00 0.46 0.40 0.42 0.70 0.00 0.00 175.22 177.20 1nvk s ILE 266 N -0.26 3.79 0.81 0.64 -1.09 -1.26 -4.84 121.20 118.99 1nvk s ILE 266 Ca 0.10 -2.60 -0.11 0.00 -2.23 0.00 0.00 60.65 55.81 1nvk s ILE 266 Cb -0.12 -3.49 0.08 0.00 -1.58 0.00 0.00 42.46 37.36 1nvk s ILE 266 CO 0.01 -0.83 1.09 0.42 -1.23 0.00 0.00 174.94 174.39 1nvk s THR 267 N 0.38 3.10 0.33 2.92 -4.23 -1.26 -4.82 115.64 112.07 1nvk s THR 267 Ca 0.14 0.36 0.07 0.00 -1.18 0.00 0.00 61.69 61.07 1nvk s THR 267 Cb -0.21 -2.96 0.31 0.00 1.34 0.00 0.00 72.50 70.98 1nvk s THR 267 CO -0.04 -0.47 1.86 0.25 -0.54 0.00 0.00 174.62 175.68 1nvk h LEU 268 N -1.21 0.73 -2.25 4.79 5.85 -1.97 -0.63 115.31 120.62 1nvk h LEU 268 Ca -0.47 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.30 1nvk h LEU 268 Cb 1.26 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.19 1nvk h LEU 268 CO 0.56 0.37 -0.01 0.08 -0.34 0.00 0.00 178.44 179.10 1nvk h ARG 269 N 0.77 0.00 -0.29 1.25 0.11 -1.94 -0.72 114.38 113.56 1nvk h ARG 269 Ca 0.47 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.55 1nvk h ARG 269 Cb 0.67 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.73 1nvk h ARG 269 CO -0.23 0.01 0.19 0.28 0.10 0.00 0.00 179.97 180.31 1nvk h VAL 270 N 0.00 1.09 -0.29 0.08 2.07 -1.47 0.04 116.25 117.77 1nvk h VAL 270 Ca -0.00 -0.18 -0.18 0.00 0.82 0.00 0.00 66.70 67.15 1nvk h VAL 270 Cb 0.02 0.69 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1nvk h VAL 270 CO 0.00 0.09 -0.53 -0.50 0.02 0.00 0.00 177.57 176.64 1nvk h TRP 271 N 0.38 1.06 -0.09 1.57 -0.00 -1.31 -0.05 115.95 117.52 1nvk h TRP 271 Ca 0.11 -0.37 -0.05 0.00 -0.00 0.00 0.00 58.89 58.57 1nvk h TRP 271 Cb -0.02 -0.20 -0.01 0.00 -0.00 0.00 0.00 29.16 28.93 1nvk h TRP 271 CO -0.05 1.19 -0.18 0.93 -0.00 0.00 0.00 178.44 180.33 1nvk h GLU 272 N 0.65 0.14 0.08 0.49 5.08 -1.01 -1.55 114.58 118.46 1nvk h GLU 272 Ca 0.02 -0.03 -0.15 0.00 -1.00 0.00 0.00 59.36 58.19 1nvk h GLU 272 Cb 1.13 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.37 1nvk h GLU 272 CO 0.12 0.33 -0.74 1.15 -1.00 0.00 0.00 179.01 178.86 1nvk h THR 273 N 0.14 1.43 -0.87 1.13 2.02 -0.90 -3.15 112.91 112.70 1nvk h THR 273 Ca 0.03 -2.41 0.07 0.00 0.77 0.00 0.00 66.41 64.87 1nvk h THR 273 Cb 0.40 3.04 -0.06 0.00 -1.74 0.00 0.00 68.15 69.80 1nvk h THR 273 CO 0.03 0.63 0.57 -0.03 0.37 0.00 0.00 175.52 177.09 1nvk h MET 274 N -0.63 0.93 0.00 6.66 -1.53 -0.91 -1.06 114.93 118.39 1nvk h MET 274 Ca -0.16 -0.06 0.00 0.00 -3.44 0.00 0.00 59.70 56.05 1nvk h MET 274 Cb 1.43 -0.21 0.00 0.00 -0.55 0.00 0.00 31.60 32.27 1nvk h MET 274 CO 0.04 0.61 0.00 0.00 0.14 0.00 0.00 176.91 177.71 1nvk n ALA 275 N -2.41 2.28 -1.95 0.39 0.00 -0.59 -4.55 120.51 113.68 1nvk n ALA 275 Ca 0.13 -0.10 -0.28 0.00 0.00 0.00 0.00 53.44 53.19 1nvk n ALA 275 Cb 0.22 -1.45 0.18 0.00 0.00 0.00 0.00 19.45 18.39 1nvk n ALA 275 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nvk s SER 276 N -3.00 3.30 0.00 0.00 1.04 -0.40 -1.46 113.70 113.18 1nvk s SER 276 Ca 0.14 0.01 0.19 0.00 0.48 0.00 0.00 55.95 56.76 1nvk s SER 276 Cb 0.18 -0.09 0.63 0.00 0.10 0.00 0.00 66.02 66.84 1nvk s SER 276 CO 0.51 -2.59 1.47 -0.67 0.98 0.00 0.00 173.24 172.94 1nvk n ASP 277 N -3.56 1.83 -4.84 7.02 2.03 -1.26 -4.72 116.55 113.06 1nvk n ASP 277 Ca 0.16 -1.80 -0.37 0.00 0.52 0.00 0.00 54.79 53.31 1nvk n ASP 277 Cb 0.60 -0.15 -0.06 0.00 -0.72 0.00 0.00 41.12 40.78 1nvk n ASP 277 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1nvk s ALA 278 N -1.70 3.81 0.11 -1.67 0.00 -1.26 -4.91 121.76 116.14 1nvk s ALA 278 Ca 0.31 -0.61 -0.31 0.00 0.00 0.00 0.00 51.96 51.35 1nvk s ALA 278 Cb 0.17 -2.06 -0.08 0.00 0.00 0.00 0.00 23.12 21.14 1nvk s ALA 278 CO 0.24 0.49 1.38 0.08 0.00 0.00 0.00 175.76 177.95 1nvk s VAL 279 N -0.67 3.34 -0.25 0.00 1.01 -0.25 -4.65 120.40 118.93 1nvk s VAL 279 Ca 0.14 0.95 -0.29 0.00 0.00 0.00 0.00 61.98 62.79 1nvk s VAL 279 Cb -0.12 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.65 1nvk s VAL 279 CO 0.03 0.07 1.17 -0.32 0.00 0.00 0.00 175.10 176.05 1nvk s MET 280 N 1.13 4.14 -0.21 2.72 1.75 -1.26 -1.06 119.30 126.51 1nvk s MET 280 Ca 0.64 1.36 -0.02 0.00 -1.25 0.00 0.00 55.69 56.43 1nvk s MET 280 Cb -0.36 -3.75 0.01 0.00 2.84 0.00 0.00 34.83 33.56 1nvk s MET 280 CO 0.30 -0.82 -0.10 -0.51 -0.65 0.00 0.00 175.02 173.25 1nvk s LEU 281 N 3.64 2.72 -0.15 4.11 1.43 -0.67 -4.71 118.68 125.04 1nvk s LEU 281 Ca 0.50 -0.58 -0.04 0.00 -1.03 0.00 0.00 54.13 52.98 1nvk s LEU 281 Cb -0.17 -1.64 -0.03 0.00 0.03 0.00 0.00 46.19 44.38 1nvk s LEU 281 CO 0.14 -0.04 -0.01 -0.63 0.23 0.00 0.00 176.35 176.04 1nvk s ILE 282 N 1.39 4.15 0.09 -0.59 1.01 0.91 -1.16 121.20 126.99 1nvk s ILE 282 Ca 0.04 -0.27 -0.31 0.00 0.00 0.00 0.00 60.65 60.12 1nvk s ILE 282 Cb -0.14 -2.82 -0.10 0.00 0.01 0.00 0.00 42.46 39.41 1nvk s ILE 282 CO -0.07 0.50 1.89 -0.62 0.00 0.00 0.00 174.94 176.65 1nvk s ASP 283 N 0.17 6.43 0.29 3.58 2.15 -0.72 -0.99 116.67 127.57 1nvk s ASP 283 Ca 0.00 2.74 0.03 0.00 0.43 0.00 0.00 52.55 55.75 1nvk s ASP 283 Cb -0.13 -2.55 0.72 0.00 -0.30 0.00 0.00 42.92 40.65 1nvk s ASP 283 CO 0.02 -1.03 1.69 -0.08 -0.17 0.00 0.00 175.17 175.60 1nvk h GLU 284 N 9.37 0.35 0.00 4.34 4.57 -1.44 -0.07 114.58 131.70 1nvk h GLU 284 Ca -0.47 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 57.68 1nvk h GLU 284 Cb 1.23 -0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 29.74 1nvk h GLU 284 CO 0.95 0.23 -0.01 0.93 -1.18 0.00 0.00 179.01 179.92 1nvk h GLU 285 N 0.36 0.00 0.00 1.92 5.08 -1.89 -2.37 114.58 117.68 1nvk h GLU 285 Ca 0.55 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.84 1nvk h GLU 285 Cb 1.06 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 1nvk h GLU 285 CO -0.55 0.01 -0.35 0.35 -1.00 0.00 0.00 179.01 177.47 1nvk h PHE 286 N 0.00 0.00 -0.96 4.33 3.57 -1.37 -3.39 116.94 119.12 1nvk h PHE 286 Ca -0.00 0.00 -0.30 0.00 3.53 0.00 0.00 57.97 61.20 1nvk h PHE 286 Cb 0.02 0.00 -0.22 0.00 2.79 0.00 0.00 35.95 38.54 1nvk h PHE 286 CO 0.00 0.35 -0.66 -3.47 -2.23 0.00 0.00 178.31 172.31 1nvk n ASP 287 N -3.63 -2.26 0.27 0.41 2.03 -0.93 -1.09 116.55 111.35 1nvk n ASP 287 Ca -0.01 -2.96 0.11 0.00 0.52 0.00 0.00 54.79 52.45 1nvk n ASP 287 Cb 0.47 1.09 0.73 0.00 -0.72 0.00 0.00 41.12 42.69 1nvk n ASP 287 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1nvk h THR 288 N 3.69 0.78 -0.17 5.18 1.35 -1.65 -1.89 112.91 120.20 1nvk h THR 288 Ca 0.01 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 1nvk h THR 288 Cb 1.01 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 68.56 1nvk h THR 288 CO 0.26 0.06 0.00 0.29 -0.25 0.00 0.00 175.52 175.87 1nvk n LYS 289 N -4.09 1.86 -3.81 4.72 4.76 -1.26 -4.94 118.16 115.40 1nvk n LYS 289 Ca -0.03 -1.29 -0.25 0.00 -2.87 0.00 0.00 58.31 53.87 1nvk n LYS 289 Cb 0.14 -1.43 0.02 0.00 -1.84 0.00 0.00 35.03 31.93 1nvk n LYS 289 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1nvk n HIS 290 N 0.53 -1.99 0.19 2.13 8.25 -0.71 -4.88 115.22 118.73 1nvk n HIS 290 Ca 0.17 0.85 0.07 0.00 -0.26 0.00 0.00 57.72 58.54 1nvk n HIS 290 Cb 0.39 -4.14 0.24 0.00 1.12 0.00 0.00 29.99 27.59 1nvk n HIS 290 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 1nvk h ARG 291 N -1.92 0.00 0.02 -0.41 0.11 -1.92 -3.28 114.38 106.97 1nvk h ARG 291 Ca -0.60 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.48 1nvk h ARG 291 Cb 1.37 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.45 1nvk h ARG 291 CO 0.61 0.33 -0.01 0.82 0.10 0.00 0.00 179.97 181.82 1nvk h ILE 292 N 0.00 1.32 -2.96 0.08 2.04 -1.92 -3.44 117.51 112.63 1nvk h ILE 292 Ca -0.00 -1.03 -0.22 0.00 1.00 0.00 0.00 64.86 64.61 1nvk h ILE 292 Cb 1.05 2.01 -0.32 0.00 -0.74 0.00 0.00 36.82 38.82 1nvk h ILE 292 CO 0.04 0.26 -0.52 -0.63 0.00 0.00 0.00 178.15 177.30 1nvk s ILE 293 N -4.40 -0.24 -1.48 -0.67 1.01 -1.24 -5.02 121.20 109.17 1nvk s ILE 293 Ca -0.16 0.23 -0.11 0.00 0.00 0.00 0.00 60.65 60.62 1nvk s ILE 293 Cb 0.02 -0.40 0.02 0.00 0.01 0.00 0.00 42.46 42.12 1nvk s ILE 293 CO 0.66 0.10 2.45 -3.20 0.00 0.00 0.00 174.94 174.95 1nvk n ASN 294 N 4.86 6.25 -3.39 3.58 5.15 -1.24 -4.71 115.26 125.77 1nvk n ASN 294 Ca -0.14 -2.82 -0.07 0.00 -0.60 0.00 0.00 54.58 50.95 1nvk n ASN 294 Cb 0.51 -1.56 -0.07 0.00 -0.53 0.00 0.00 39.78 38.13 1nvk n ASN 294 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1nvk s ASP 295 N 2.15 -0.18 0.63 1.20 -1.08 -1.26 -5.05 116.67 113.09 1nvk s ASP 295 Ca 0.55 0.54 0.36 0.00 -0.52 0.00 0.00 52.55 53.47 1nvk s ASP 295 Cb 0.15 1.38 2.04 0.00 -1.46 0.00 0.00 42.92 45.03 1nvk s ASP 295 CO -0.07 -0.28 2.26 0.00 0.52 0.00 0.00 175.17 177.61 1nvk h ALA 296 N 8.14 1.34 0.00 3.66 0.00 -1.96 -2.58 119.26 127.86 1nvk h ALA 296 Ca -0.19 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1nvk h ALA 296 Cb 1.14 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1nvk h ALA 296 CO 0.23 -0.07 -0.00 0.00 0.00 0.00 0.00 179.25 179.41 1nvk h ARG 297 N 0.00 0.00 -0.10 0.00 3.08 -1.96 -1.68 114.38 113.71 1nvk h ARG 297 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1nvk h ARG 297 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1nvk h ARG 297 CO -0.00 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.09 1nvk n PHE 298 N -3.10 0.13 -5.04 3.04 3.01 -0.97 -4.88 117.46 109.65 1nvk n PHE 298 Ca -0.02 -0.06 -0.31 0.00 1.01 0.00 0.00 57.45 58.06 1nvk n PHE 298 Cb 0.15 0.00 -0.14 0.00 -0.01 0.00 0.00 39.48 39.47 1nvk n PHE 298 CO 0.00 0.00 0.00 0.71 1.01 0.00 0.00 176.76 178.48 1nvk s TYR 299 N -1.87 2.49 -0.06 1.38 1.51 -0.63 -0.07 117.35 120.09 1nvk s TYR 299 Ca 0.34 -0.32 0.02 0.00 -1.01 0.00 0.00 57.07 56.10 1nvk s TYR 299 Cb 0.18 -1.53 0.01 0.00 -0.11 0.00 0.00 41.96 40.51 1nvk s TYR 299 CO 0.28 0.09 -0.12 0.14 -1.11 0.00 0.00 175.55 174.83 1nvk s VAL 300 N -0.71 1.13 -0.08 0.71 -7.23 -0.16 -4.89 120.40 109.16 1nvk s VAL 300 Ca 0.11 -0.48 0.14 0.00 -1.81 0.00 0.00 61.98 59.95 1nvk s VAL 300 Cb -0.10 -1.03 -0.11 0.00 0.56 0.00 0.00 36.38 35.70 1nvk s VAL 300 CO 0.01 0.35 1.04 -1.13 -0.31 0.00 0.00 175.10 175.06 1nvk h ASN 301 N 6.96 0.00 -5.06 4.85 -0.73 -1.93 -0.76 115.58 118.91 1nvk h ASN 301 Ca -0.31 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.86 1nvk h ASN 301 Cb 1.19 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.78 1nvk h ASN 301 CO 0.47 0.69 0.32 0.54 -0.37 0.00 0.00 177.43 179.08 1nvk s ASN 302 N -6.15 0.02 0.26 1.15 2.20 -1.26 -4.78 114.94 106.37 1nvk s ASN 302 Ca -0.01 -1.11 -0.02 0.00 -0.94 0.00 0.00 52.86 50.78 1nvk s ASN 302 Cb 0.08 0.81 0.50 0.00 -2.00 0.00 0.00 41.25 40.65 1nvk s ASN 302 CO 0.80 -1.62 1.75 -0.09 -2.94 0.00 0.00 177.10 175.00 1nvk h ARG 303 N 2.00 0.54 -0.60 3.55 2.43 -1.95 -1.58 114.38 118.77 1nvk h ARG 303 Ca -0.32 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 58.82 1nvk h ARG 303 Cb 1.25 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 30.64 1nvk h ARG 303 CO 0.41 0.36 0.39 0.00 -1.51 0.00 0.00 179.97 179.62 1nvk h ALA 304 N 1.55 0.76 -0.22 2.80 0.00 -1.96 -1.57 119.26 120.62 1nvk h ALA 304 Ca 0.44 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 55.18 1nvk h ALA 304 Cb 0.64 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1nvk h ALA 304 CO -0.37 0.18 -0.44 1.49 0.00 0.00 0.00 179.25 180.10 1nvk h GLU 305 N 0.80 0.53 -0.37 0.00 4.81 -1.75 -2.07 114.58 116.53 1nvk h GLU 305 Ca 0.22 -0.29 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 1nvk h GLU 305 Cb -0.08 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 1nvk h GLU 305 CO -0.06 0.87 0.19 1.25 -0.73 0.00 0.00 179.01 180.54 1nvk h LEU 306 N 0.43 0.47 -0.51 1.64 5.85 -0.97 0.74 115.31 122.96 1nvk h LEU 306 Ca 0.03 -0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.65 1nvk h LEU 306 Cb 0.95 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 1nvk h LEU 306 CO 0.08 0.45 0.33 0.40 -0.34 0.00 0.00 178.44 179.36 1nvk h ILE 307 N 0.46 1.12 -0.34 4.05 2.04 -1.17 -0.25 117.51 123.42 1nvk h ILE 307 Ca 0.13 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 1nvk h ILE 307 Cb 0.09 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.54 1nvk h ILE 307 CO -0.02 0.12 0.15 0.44 0.00 0.00 0.00 178.15 178.85 1nvk h ASP 308 N 0.68 0.45 -0.51 1.72 3.45 -1.06 -1.66 116.42 119.49 1nvk h ASP 308 Ca 0.19 -0.14 -0.04 0.00 0.43 0.00 0.00 57.03 57.46 1nvk h ASP 308 Cb -0.07 -0.12 -0.02 0.00 -0.56 0.00 0.00 39.33 38.57 1nvk h ASP 308 CO -0.05 0.47 0.15 -0.09 -1.57 0.00 0.00 179.24 178.15 1nvk h ARG 309 N 0.40 0.80 -0.69 3.56 9.65 -0.60 -1.07 114.38 126.44 1nvk h ARG 309 Ca 0.11 -0.18 -0.06 0.00 -1.10 0.00 0.00 59.98 58.76 1nvk h ARG 309 Cb 0.14 -0.11 -0.03 0.00 -1.39 0.00 0.00 29.97 28.58 1nvk h ARG 309 CO -0.01 0.75 0.20 0.28 2.80 0.00 0.00 179.97 183.99 1nvk h VAL 310 N 0.70 1.26 -0.04 0.20 2.07 -0.96 -1.73 116.25 117.73 1nvk h VAL 310 Ca 0.16 -0.90 -0.09 0.00 0.82 0.00 0.00 66.70 66.69 1nvk h VAL 310 Cb 0.30 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1nvk h VAL 310 CO -0.00 0.35 -0.41 0.78 0.02 0.00 0.00 177.57 178.30 1nvk h ASN 311 N 1.01 0.09 -0.06 0.57 2.35 -1.08 -0.87 115.58 117.58 1nvk h ASN 311 Ca 0.22 -0.04 -0.10 0.00 -0.55 0.00 0.00 56.30 55.83 1nvk h ASN 311 Cb 0.32 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 1nvk h ASN 311 CO -0.00 0.50 -0.27 -0.33 -1.65 0.00 0.00 177.43 175.68 1nvk h GLU 312 N 0.08 0.50 -0.07 0.81 5.08 -0.73 0.02 114.58 120.27 1nvk h GLU 312 Ca 0.01 -0.20 -0.17 0.00 -1.00 0.00 0.00 59.36 58.00 1nvk h GLU 312 Cb 0.76 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 1nvk h GLU 312 CO 0.06 0.73 -0.70 -0.07 -1.00 0.00 0.00 179.01 178.03 1nvk h LEU 313 N 0.44 0.39 -0.47 1.33 3.38 -0.79 -1.77 115.31 117.82 1nvk h LEU 313 Ca 0.06 -0.25 -0.17 0.00 0.09 0.00 0.00 57.88 57.61 1nvk h LEU 313 Cb 0.70 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 1nvk h LEU 313 CO 0.05 0.97 -0.58 0.11 0.09 0.00 0.00 178.44 179.08 1nvk h LYS 314 N 0.23 0.57 -0.28 1.13 1.57 -0.84 -3.26 116.57 115.69 1nvk h LYS 314 Ca -0.02 -0.37 -0.19 0.00 -1.87 0.00 0.00 60.65 58.19 1nvk h LYS 314 Cb 1.26 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.62 1nvk h LYS 314 CO 0.11 0.99 -0.57 1.25 -0.57 0.00 0.00 179.45 180.66 1nvk h HIS 315 N 0.43 1.10 -3.78 -1.35 2.76 -0.91 -3.42 115.15 109.99 1nvk h HIS 315 Ca 0.00 -0.40 -0.67 0.00 -2.20 0.00 0.00 60.37 57.10 1nvk h HIS 315 Cb 1.14 -0.20 -0.38 0.00 1.55 0.00 0.00 27.41 29.51 1nvk h HIS 315 CO 0.05 1.23 -0.76 0.45 -1.30 0.00 0.00 177.93 177.60 1nvk s SER 316 N -6.97 4.62 0.45 3.26 0.15 -0.67 -4.95 113.70 109.58 1nvk s SER 316 Ca -0.11 -1.77 0.17 0.00 0.70 0.00 0.00 55.95 54.94 1nvk s SER 316 Cb 0.10 -1.59 1.03 0.00 -1.71 0.00 0.00 66.02 63.85 1nvk s SER 316 CO 0.89 -0.29 1.97 -0.78 1.20 0.00 0.00 173.24 176.24 1nvk h ASP 317 N 7.70 0.00 -0.35 5.45 3.58 -1.82 -2.35 116.42 128.63 1nvk h ASP 317 Ca -0.12 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.27 1nvk h ASP 317 Cb 1.03 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.07 1nvk h ASP 317 CO 0.49 0.21 -0.04 0.58 -2.88 0.00 0.00 179.24 177.60 1nvk h VAL 318 N 0.00 1.27 -0.70 2.25 2.07 -1.92 -1.21 116.25 118.00 1nvk h VAL 318 Ca -0.00 -1.07 0.01 0.00 0.82 0.00 0.00 66.70 66.46 1nvk h VAL 318 Cb 0.39 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.39 1nvk h VAL 318 CO 0.03 0.35 0.46 0.25 0.02 0.00 0.00 177.57 178.68 1nvk h LEU 319 N 0.45 0.81 0.12 2.57 5.85 -1.80 0.21 115.31 123.53 1nvk h LEU 319 Ca 0.09 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1nvk h LEU 319 Cb 0.52 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.35 1nvk h LEU 319 CO 0.03 0.59 -0.06 -0.09 -0.34 0.00 0.00 178.44 178.57 1nvk h ARG 320 N 0.95 -0.16 -0.45 1.25 2.43 -1.28 -0.96 114.38 116.16 1nvk h ARG 320 Ca 0.26 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.40 1nvk h ARG 320 Cb -0.10 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 1nvk h ARG 320 CO -0.05 -0.07 0.11 0.87 -1.51 0.00 0.00 179.97 179.32 1nvk h LYS 321 N -0.21 0.68 -0.24 0.20 1.57 -1.03 -1.09 116.57 116.45 1nvk h LYS 321 Ca -0.02 -0.12 -0.02 0.00 -1.87 0.00 0.00 60.65 58.62 1nvk h LYS 321 Cb 0.17 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1nvk h LYS 321 CO 0.03 0.62 0.05 1.49 -0.57 0.00 0.00 179.45 181.07 1nvk h GLU 322 N 0.66 0.39 -0.51 3.15 4.81 -0.70 -0.86 114.58 121.52 1nvk h GLU 322 Ca 0.15 -0.10 -0.09 0.00 -0.13 0.00 0.00 59.36 59.19 1nvk h GLU 322 Cb 0.25 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 1nvk h GLU 322 CO -0.00 0.50 -0.05 0.52 -0.73 0.00 0.00 179.01 179.24 1nvk h MET 323 N 0.21 0.90 -0.59 1.92 2.86 -0.90 -1.76 114.93 117.57 1nvk h MET 323 Ca 0.07 -0.28 -0.02 0.00 -2.06 0.00 0.00 59.70 57.41 1nvk h MET 323 Cb 0.29 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.84 1nvk h MET 323 CO 0.00 0.92 0.30 -0.07 1.06 0.00 0.00 176.91 179.12 1nvk h LEU 324 N 0.82 0.76 -1.00 1.22 3.38 -1.06 -0.79 115.31 118.63 1nvk h LEU 324 Ca 0.14 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1nvk h LEU 324 Cb 0.56 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 1nvk h LEU 324 CO 0.03 0.66 0.55 -1.28 0.09 0.00 0.00 178.44 178.49 1nvk h SER 325 N 0.80 1.09 -0.30 -0.43 0.87 -0.82 -0.97 113.55 113.79 1nvk h SER 325 Ca 0.20 -0.06 -0.04 0.00 -1.23 0.00 0.00 61.79 60.65 1nvk h SER 325 Cb 0.09 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.77 1nvk h SER 325 CO -0.03 0.84 0.02 0.40 -0.53 0.00 0.00 176.83 177.53 1nvk h ILE 326 N 1.25 1.25 -0.12 2.23 2.04 -0.77 -1.60 117.51 121.80 1nvk h ILE 326 Ca 0.33 -0.90 -0.12 0.00 1.00 0.00 0.00 64.86 65.17 1nvk h ILE 326 Cb -0.05 1.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 1nvk h ILE 326 CO -0.06 0.29 -0.46 0.06 0.00 0.00 0.00 178.15 177.98 1nvk h GLN 327 N 0.33 0.29 -0.17 2.37 3.07 -0.89 -1.53 115.11 118.58 1nvk h GLN 327 Ca 0.09 -0.16 -0.13 0.00 0.09 0.00 0.00 58.65 58.54 1nvk h GLN 327 Cb 0.41 0.01 -0.01 0.00 0.08 0.00 0.00 27.48 27.96 1nvk h GLN 327 CO 0.01 0.70 -0.44 0.45 0.09 0.00 0.00 178.83 179.64 1nvk h HIS 328 N 0.24 0.51 -0.29 0.06 3.86 -1.12 -1.04 115.15 117.37 1nvk h HIS 328 Ca 0.01 -0.15 -0.04 0.00 -1.16 0.00 0.00 60.37 59.03 1nvk h HIS 328 Cb 0.91 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 29.26 1nvk h HIS 328 CO 0.02 0.80 0.03 0.22 0.86 0.00 0.00 177.93 179.86 1nvk h ASP 329 N 0.35 0.48 -0.42 2.45 1.82 -0.99 -1.68 116.42 118.42 1nvk h ASP 329 Ca 0.02 -0.28 -0.07 0.00 -0.39 0.00 0.00 57.03 56.31 1nvk h ASP 329 Cb 0.92 -0.13 -0.02 0.00 0.68 0.00 0.00 39.33 40.78 1nvk h ASP 329 CO 0.08 0.64 0.01 0.40 -1.61 0.00 0.00 179.24 178.76 1nvk h ILE 330 N 0.30 1.24 -0.30 2.25 1.08 -1.14 -1.78 117.51 119.17 1nvk h ILE 330 Ca 0.09 -1.00 -0.01 0.00 -0.39 0.00 0.00 64.86 63.54 1nvk h ILE 330 Cb 0.38 0.86 -0.01 0.00 -3.07 0.00 0.00 36.82 34.97 1nvk h ILE 330 CO 0.01 0.36 0.15 0.25 -0.69 0.00 0.00 178.15 178.22 1nvk h LEU 331 N 0.76 0.39 -1.61 1.44 6.46 -1.01 -2.45 115.31 119.29 1nvk h LEU 331 Ca 0.15 -0.12 -0.03 0.00 -0.12 0.00 0.00 57.88 57.76 1nvk h LEU 331 Cb 0.45 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 40.27 1nvk h LEU 331 CO 0.02 0.39 -0.07 0.78 -0.62 0.00 0.00 178.44 178.94 1nvk h ASN 332 N 0.35 0.15 -0.09 1.25 -0.26 -1.01 -1.12 115.58 114.86 1nvk h ASN 332 Ca 0.10 -0.02 -0.04 0.00 -0.56 0.00 0.00 56.30 55.78 1nvk h ASN 332 Cb 0.11 -0.04 -0.01 0.00 -1.06 0.00 0.00 38.32 37.31 1nvk h ASN 332 CO -0.01 0.25 -0.04 0.11 -1.06 0.00 0.00 177.43 176.67 1nvk h LYS 333 N 0.16 0.32 0.12 0.81 1.57 -0.85 -0.55 116.57 118.14 1nvk h LYS 333 Ca 0.04 -0.06 -0.27 0.00 -1.87 0.00 0.00 60.65 58.48 1nvk h LYS 333 Cb 0.23 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 32.50 1nvk h LYS 333 CO 0.01 0.38 -1.22 1.15 -0.57 0.00 0.00 179.45 179.21 1nvk h THR 334 N 0.31 1.45 0.00 -0.16 2.02 -1.03 -3.15 112.91 112.35 1nvk h THR 334 Ca 0.07 -2.89 -0.03 0.00 0.77 0.00 0.00 66.41 64.33 1nvk h THR 334 Cb 0.28 2.85 -0.00 0.00 -1.74 0.00 0.00 68.15 69.54 1nvk h THR 334 CO 0.01 0.85 -0.15 0.03 0.37 0.00 0.00 175.52 176.63 1nvk h ARG 335 N 0.12 0.00 0.00 6.66 3.08 -0.74 -1.63 114.38 121.87 1nvk h ARG 335 Ca -0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.91 1nvk h ARG 335 Cb 1.92 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.97 1nvk h ARG 335 CO 0.21 0.15 0.00 0.00 -1.07 0.00 0.00 179.97 179.26 1nvk n ALA 336 N -2.28 1.65 -1.04 0.04 0.00 -0.26 -2.44 120.51 116.17 1nvk n ALA 336 Ca -0.02 0.04 -0.00 0.00 0.00 0.00 0.00 53.44 53.46 1nvk n ALA 336 Cb 0.28 -1.33 0.31 0.00 0.00 0.00 0.00 19.45 18.71 1nvk n ALA 336 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1nvk n LYS 337 N -1.97 3.70 -0.30 0.00 5.02 -0.61 -4.67 118.16 119.33 1nvk n LYS 337 Ca 0.03 -3.08 0.05 0.00 -2.02 0.00 0.00 58.31 53.29 1nvk n LYS 337 Cb 0.20 -2.14 0.19 0.00 -0.02 0.00 0.00 35.03 33.27 1nvk n LYS 337 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1nvk h LYS 338 N 2.68 0.73 -0.41 1.97 3.64 -1.61 -1.92 116.57 121.64 1nvk h LYS 338 Ca 0.16 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.54 1nvk h LYS 338 Cb 2.06 -0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 33.67 1nvk h LYS 338 CO 0.57 0.48 0.16 0.00 -2.27 0.00 0.00 179.45 178.39 1nvk h ALA 339 N 1.49 0.50 -0.66 5.00 0.00 -1.88 0.82 119.26 124.54 1nvk h ALA 339 Ca 0.43 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.31 1nvk h ALA 339 Cb 0.47 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1nvk h ALA 339 CO -0.29 -0.22 0.15 0.93 0.00 0.00 0.00 179.25 179.82 1nvk h GLU 340 N 0.33 1.05 -0.36 0.00 3.07 -1.79 -1.31 114.58 115.57 1nvk h GLU 340 Ca 0.19 -0.25 -0.02 0.00 -0.50 0.00 0.00 59.36 58.78 1nvk h GLU 340 Cb 0.16 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 27.91 1nvk h GLU 340 CO -0.18 0.93 0.14 2.35 -1.40 0.00 0.00 179.01 180.85 1nvk h TRP 341 N 0.99 0.56 -0.48 4.33 7.01 -0.69 -1.34 115.95 126.33 1nvk h TRP 341 Ca 0.21 -0.05 -0.03 0.00 2.11 0.00 0.00 58.89 61.14 1nvk h TRP 341 Cb 0.37 -0.17 -0.02 0.00 -2.10 0.00 0.00 29.16 27.24 1nvk h TRP 341 CO 0.03 0.52 0.20 1.96 -2.79 0.00 0.00 178.44 178.36 1nvk h GLN 342 N 0.44 0.71 -0.56 2.65 4.20 -0.63 -1.64 115.11 120.27 1nvk h GLN 342 Ca 0.12 -0.12 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 1nvk h GLN 342 Cb 0.20 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 27.84 1nvk h GLN 342 CO -0.01 0.63 0.21 -0.44 -0.67 0.00 0.00 178.83 178.56 1nvk h ASP 343 N 0.64 0.75 -0.01 1.46 3.32 -1.09 -1.36 116.42 120.13 1nvk h ASP 343 Ca 0.16 -0.10 -0.12 0.00 0.02 0.00 0.00 57.03 56.99 1nvk h ASP 343 Cb 0.17 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1nvk h ASP 343 CO -0.02 0.68 -0.36 0.00 -1.72 0.00 0.00 179.24 177.82 1nvk h ALA 344 N 1.43 0.95 -0.19 3.45 0.00 -0.93 -1.59 119.26 122.38 1nvk h ALA 344 Ca 0.19 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1nvk h ALA 344 Cb 0.18 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1nvk h ALA 344 CO -0.02 0.62 -0.04 0.35 0.00 0.00 0.00 179.25 180.16 1nvk h PHE 345 N 0.42 0.40 -0.98 0.00 3.57 -0.75 -0.80 116.94 118.81 1nvk h PHE 345 Ca 0.04 -0.08 0.07 0.00 3.53 0.00 0.00 57.97 61.53 1nvk h PHE 345 Cb 0.83 -0.10 -0.07 0.00 2.79 0.00 0.00 35.95 39.41 1nvk h PHE 345 CO 0.03 0.60 0.63 0.87 -2.23 0.00 0.00 178.31 178.21 1nvk h LYS 346 N 0.08 1.10 -0.52 1.11 1.57 -1.11 -1.16 116.57 117.64 1nvk h LYS 346 Ca 0.05 -0.07 -0.10 0.00 -1.87 0.00 0.00 60.65 58.67 1nvk h LYS 346 Cb 0.47 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 1nvk h LYS 346 CO 0.02 0.73 -0.06 -0.22 -0.57 0.00 0.00 179.45 179.35 1nvk h LYS 347 N 1.14 0.92 -0.29 3.15 3.64 -1.09 0.20 116.57 124.24 1nvk h LYS 347 Ca 0.42 -0.30 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 1nvk h LYS 347 Cb 0.17 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 1nvk h LYS 347 CO -0.17 0.95 0.12 0.00 -2.27 0.00 0.00 179.45 178.07 1nvk h ALA 348 N 1.09 1.68 -0.85 5.00 0.00 0.07 -1.44 119.26 124.80 1nvk h ALA 348 Ca 0.14 -0.08 -0.34 0.00 0.00 0.00 0.00 54.91 54.64 1nvk h ALA 348 Cb 0.58 -0.12 -0.20 0.00 0.00 0.00 0.00 17.79 18.05 1nvk h ALA 348 CO 0.04 0.26 0.43 0.44 0.00 0.00 0.00 179.25 180.42 1nvk n ILE 349 N -4.42 3.04 -3.65 0.00 -5.35 -0.82 -4.93 119.36 103.23 1nvk n ILE 349 Ca 0.01 -1.73 -0.24 0.00 -0.27 0.00 0.00 62.75 60.52 1nvk n ILE 349 Cb 0.13 -0.41 0.07 0.00 -1.74 0.00 0.00 39.64 37.68 1nvk n ILE 349 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1nvk n ASP 350 N -0.53 -4.92 -0.46 7.28 8.00 -0.54 -5.05 116.55 120.33 1nvk n ASP 350 Ca 0.49 -0.63 0.06 0.00 0.71 0.00 0.00 54.79 55.41 1nvk n ASP 350 Cb 1.51 -4.72 0.05 0.00 -0.02 0.00 0.00 41.12 37.93 1nvk n ASP 350 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99