#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qtv h PHE 3 N 0.00 0.00 0.00 -0.67 0.05 -2.02 0.10 116.94 114.41 2qtv h PHE 3 Ca 0.00 0.00 -0.19 0.00 3.82 0.00 0.00 57.97 61.60 2qtv h PHE 3 Cb 0.00 0.00 -0.03 0.00 2.00 0.00 0.00 35.95 37.92 2qtv h PHE 3 CO 0.00 0.00 -0.90 0.93 -0.18 0.00 0.00 178.31 178.16 2qtv h GLU 4 N 0.00 0.00 0.03 1.51 5.08 -2.00 -3.28 114.58 115.92 2qtv h GLU 4 Ca 0.10 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2qtv h GLU 4 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2qtv h GLU 4 CO -0.00 0.90 -0.01 1.15 -1.00 0.00 0.00 179.01 180.05 2qtv h THR 5 N 0.00 1.00 0.00 1.13 2.02 -1.21 -0.70 112.91 115.15 2qtv h THR 5 Ca -0.01 -0.10 -0.01 0.00 0.77 0.00 0.00 66.41 67.06 2qtv h THR 5 Cb 1.61 1.07 -0.00 0.00 -1.74 0.00 0.00 68.15 69.09 2qtv h THR 5 CO 0.12 0.03 -0.05 -1.13 0.37 0.00 0.00 175.52 174.86 2qtv h ASN 6 N -0.08 0.00 0.71 4.18 -1.24 -1.65 -0.36 115.58 117.13 2qtv h ASN 6 Ca -0.00 0.00 -0.17 0.00 0.71 0.00 0.00 56.30 56.83 2qtv h ASN 6 Cb 0.07 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.10 2qtv h ASN 6 CO 0.01 0.05 -0.80 -0.08 -1.29 0.00 0.00 177.43 175.31 2qtv h GLU 7 N 0.00 0.06 0.00 6.67 4.81 -1.41 0.11 114.58 124.82 2qtv h GLU 7 Ca -0.00 -0.07 -0.10 0.00 -0.13 0.00 0.00 59.36 59.06 2qtv h GLU 7 Cb 0.09 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 2qtv h GLU 7 CO 0.01 0.83 -0.50 -0.44 -0.73 0.00 0.00 179.01 178.18 2qtv h ASP 8 N 0.04 0.00 0.08 1.04 3.32 0.38 -0.39 116.42 120.88 2qtv h ASP 8 Ca -0.02 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.69 2qtv h ASP 8 Cb 1.41 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.93 2qtv h ASP 8 CO 0.11 0.50 -1.89 -0.38 -1.72 0.00 0.00 179.24 175.86 2qtv n ILE 9 N -3.53 1.69 -0.17 0.35 5.41 -0.43 -4.68 119.36 118.00 2qtv n ILE 9 Ca -0.00 -0.48 0.00 0.00 1.00 0.00 0.00 62.75 63.27 2qtv n ILE 9 Cb 0.60 -1.79 0.00 0.00 -0.71 0.00 0.00 39.64 37.74 2qtv n ILE 9 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2qtv n ASN 10 N -3.73 1.52 -3.92 4.38 3.02 0.37 -4.63 115.26 112.28 2qtv n ASN 10 Ca -0.34 -1.69 -0.29 0.00 -0.03 0.00 0.00 54.58 52.23 2qtv n ASN 10 Cb 0.95 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 40.13 2qtv n ASN 10 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qtv n GLY 11 N -0.35 -0.42 3.02 7.41 0.00 -0.15 -4.80 105.19 109.90 2qtv n GLY 11 Ca 0.00 0.17 -0.19 0.00 0.00 0.00 0.00 46.02 46.00 2qtv n GLY 11 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qtv s VAL 12 N -3.44 0.75 -0.15 1.61 1.01 -1.25 -1.71 120.40 117.22 2qtv s VAL 12 Ca 0.47 -0.39 -0.03 0.00 0.00 0.00 0.00 61.98 62.03 2qtv s VAL 12 Cb -0.24 -0.63 0.05 0.00 0.00 0.00 0.00 36.38 35.56 2qtv s VAL 12 CO 0.85 0.22 0.05 -0.13 0.00 0.00 0.00 175.10 176.08 2qtv s ARG 13 N -0.16 0.38 0.06 2.72 1.81 -1.00 -3.43 118.95 119.34 2qtv s ARG 13 Ca 0.03 -0.14 -0.02 0.00 -1.72 0.00 0.00 55.73 53.88 2qtv s ARG 13 Cb -0.04 -1.67 -0.04 0.00 -0.45 0.00 0.00 34.95 32.74 2qtv s ARG 13 CO -0.00 -0.56 0.24 -0.06 -0.68 0.00 0.00 175.30 174.24 2qtv s PHE 14 N 2.00 3.52 0.11 -0.53 0.40 -1.26 -1.31 117.98 120.91 2qtv s PHE 14 Ca 0.02 0.35 -0.15 0.00 -0.60 0.00 0.00 56.93 56.54 2qtv s PHE 14 Cb -0.15 -1.83 -0.04 0.00 0.51 0.00 0.00 43.02 41.50 2qtv s PHE 14 CO -0.07 0.57 1.52 1.79 0.70 0.00 0.00 175.22 179.72 2qtv h THR 15 N 2.23 1.28 -3.22 0.64 1.35 -1.47 -3.39 112.91 110.34 2qtv h THR 15 Ca -0.46 -1.13 -0.56 0.00 -0.55 0.00 0.00 66.41 63.71 2qtv h THR 15 Cb 1.17 1.28 -0.36 0.00 -1.73 0.00 0.00 68.15 68.51 2qtv h THR 15 CO 0.74 0.37 -0.82 0.26 -0.25 0.00 0.00 175.52 175.82 2qtv s TRP 16 N -4.81 1.82 -2.50 4.73 0.52 -1.26 -1.22 118.94 116.21 2qtv s TRP 16 Ca -0.13 -0.91 0.28 0.00 0.02 0.00 0.00 56.10 55.37 2qtv s TRP 16 Cb 0.09 -1.37 1.05 0.00 -1.15 0.00 0.00 33.47 32.09 2qtv s TRP 16 CO 0.80 -0.52 1.75 0.09 0.02 0.00 0.00 176.95 179.08 2qtv n ASN 17 N 4.54 1.50 -3.68 2.95 4.13 0.34 -4.61 115.26 120.43 2qtv n ASN 17 Ca -0.17 -1.50 -0.26 0.00 1.68 0.00 0.00 54.58 54.33 2qtv n ASN 17 Cb 0.51 0.00 -0.17 0.00 -1.54 0.00 0.00 39.78 38.58 2qtv n ASN 17 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2qtv s VAL 18 N -2.00 0.22 0.50 2.41 1.01 -1.26 -4.40 120.40 116.87 2qtv s VAL 18 Ca 0.38 -0.26 -0.14 0.00 0.00 0.00 0.00 61.98 61.96 2qtv s VAL 18 Cb 0.21 -0.74 -0.07 0.00 0.00 0.00 0.00 36.38 35.78 2qtv s VAL 18 CO 0.34 -0.16 0.92 -0.36 0.00 0.00 0.00 175.10 175.84 2qtv s PHE 19 N 2.00 3.48 0.37 5.22 0.08 -0.29 -4.69 117.98 124.15 2qtv s PHE 19 Ca 0.01 1.31 -0.25 0.00 0.12 0.00 0.00 56.93 58.12 2qtv s PHE 19 Cb -0.16 -2.67 -0.09 0.00 -0.57 0.00 0.00 43.02 39.53 2qtv s PHE 19 CO -0.08 -0.33 1.05 -2.14 -0.10 0.00 0.00 175.22 173.63 2qtv s PRO 20 N -4.16 4.27 0.47 0.24 0.02 -1.26 -1.25 135.00 133.34 2qtv s PRO 20 Ca 0.56 1.56 0.24 0.00 0.02 0.00 0.00 61.00 63.37 2qtv s PRO 20 Cb -0.10 -2.67 1.18 0.00 0.02 0.00 0.00 34.50 32.92 2qtv s PRO 20 CO 0.34 -0.06 1.96 0.66 -0.33 0.00 0.00 177.00 179.58 2qtv h SER 21 N 2.77 0.00 -3.19 2.53 4.64 -0.76 -3.43 113.55 116.12 2qtv h SER 21 Ca -0.48 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.35 2qtv h SER 21 Cb 1.21 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.15 2qtv h SER 21 CO 0.63 0.19 -0.75 0.42 -0.87 0.00 0.00 176.83 176.45 2qtv s THR 22 N -4.05 1.86 0.37 2.95 -4.23 -1.26 -4.59 115.64 106.68 2qtv s THR 22 Ca -0.02 -2.14 0.19 0.00 -1.18 0.00 0.00 61.69 58.54 2qtv s THR 22 Cb 0.13 -2.01 0.19 0.00 1.34 0.00 0.00 72.50 72.14 2qtv s THR 22 CO 0.62 -0.48 1.93 -0.09 -0.54 0.00 0.00 174.62 176.06 2qtv h ARG 23 N 2.74 0.00 -0.22 3.99 2.43 -0.20 -1.57 114.38 121.56 2qtv h ARG 23 Ca -0.40 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 58.74 2qtv h ARG 23 Cb 1.22 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.76 2qtv h ARG 23 CO 0.58 0.25 0.02 0.77 -1.51 0.00 0.00 179.97 180.08 2qtv h SER 24 N 0.00 0.36 -0.36 -3.80 0.02 -1.93 0.12 113.55 107.96 2qtv h SER 24 Ca -0.00 -0.28 -0.09 0.00 -0.84 0.00 0.00 61.79 60.58 2qtv h SER 24 Cb 0.51 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.94 2qtv h SER 24 CO 0.03 0.55 -0.07 0.44 -1.14 0.00 0.00 176.83 176.64 2qtv h ASP 25 N 0.16 0.77 -0.84 3.07 3.32 -1.88 -0.52 116.42 120.49 2qtv h ASP 25 Ca 0.07 -0.21 -0.02 0.00 0.02 0.00 0.00 57.03 56.88 2qtv h ASP 25 Cb 0.35 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.66 2qtv h ASP 25 CO 0.01 0.88 0.44 0.00 -1.72 0.00 0.00 179.24 178.84 2qtv h ALA 26 N 1.20 1.08 -0.05 3.45 0.00 -0.93 -2.26 119.26 121.75 2qtv h ALA 26 Ca 0.13 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2qtv h ALA 26 Cb 0.54 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2qtv h ALA 26 CO 0.03 0.62 -0.07 -0.91 0.00 0.00 0.00 179.25 178.92 2qtv h ASN 27 N 1.18 0.15 0.10 0.00 2.35 -0.36 -2.99 115.58 116.02 2qtv h ASN 27 Ca 0.29 -0.52 0.00 0.00 -0.55 0.00 0.00 56.30 55.53 2qtv h ASN 27 Cb 0.07 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.40 2qtv h ASN 27 CO -0.04 0.64 0.00 -1.54 -1.65 0.00 0.00 177.43 174.84 2qtv n SER 28 N -4.72 0.05 -0.24 5.81 3.41 -0.24 -0.99 113.62 116.70 2qtv n SER 28 Ca -0.08 0.52 0.12 0.00 -0.26 0.00 0.00 58.87 59.17 2qtv n SER 28 Cb 0.31 -0.53 0.58 0.00 -0.26 0.00 0.00 64.21 64.32 2qtv n SER 28 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2qtv n ASN 29 N -1.57 0.74 0.00 4.04 3.02 -0.87 -4.92 115.26 115.70 2qtv n ASN 29 Ca 0.01 -1.43 0.00 0.00 -0.03 0.00 0.00 54.58 53.13 2qtv n ASN 29 Cb 0.04 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.18 2qtv n ASN 29 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2qtv n VAL 30 N -0.35 0.00 -2.40 2.41 0.31 -0.17 -4.79 118.33 113.35 2qtv n VAL 30 Ca 0.18 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 64.08 2qtv n VAL 30 Cb 0.20 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.10 2qtv n VAL 30 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2qtv s VAL 31 N 0.00 4.14 0.86 2.52 1.01 -1.26 -4.99 120.40 122.68 2qtv s VAL 31 Ca 0.00 1.46 -0.12 0.00 0.00 0.00 0.00 61.98 63.32 2qtv s VAL 31 Cb 0.00 -3.94 0.11 0.00 0.00 0.00 0.00 36.38 32.55 2qtv s VAL 31 CO 0.00 -0.03 1.16 -2.65 0.00 0.00 0.00 175.10 173.57 2qtv n PRO 32 N 5.58 -0.12 -2.82 2.72 -0.02 -1.26 -4.94 135.00 134.13 2qtv n PRO 32 Ca 0.12 0.04 -0.42 0.00 -2.02 0.00 0.00 63.50 61.22 2qtv n PRO 32 Cb 0.45 -2.39 -0.04 0.00 -0.02 0.00 0.00 33.50 31.50 2qtv n PRO 32 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2qtv s VAL 33 N -2.36 4.80 0.13 -1.45 1.01 -1.26 -4.78 120.40 116.50 2qtv s VAL 33 Ca 0.70 1.72 -0.24 0.00 0.00 0.00 0.00 61.98 64.15 2qtv s VAL 33 Cb -0.26 -4.18 0.08 0.00 0.00 0.00 0.00 36.38 32.02 2qtv s VAL 33 CO 0.54 -0.08 1.08 -0.83 0.00 0.00 0.00 175.10 175.81 2qtv s GLY 34 N 1.26 -0.06 -0.04 4.51 0.00 -1.26 -0.57 107.32 111.15 2qtv s GLY 34 Ca 0.38 -0.06 -0.14 0.00 0.00 0.00 0.00 44.72 44.90 2qtv s GLY 34 CO 0.08 1.88 0.31 0.00 0.00 0.00 0.00 173.10 175.37 2qtv s LEU 36 N -1.02 4.05 -0.04 0.00 2.96 -0.43 -1.03 118.68 123.17 2qtv s LEU 36 Ca -0.11 0.46 0.06 0.00 -0.22 0.00 0.00 54.13 54.32 2qtv s LEU 36 Cb -0.05 -2.60 -0.02 0.00 0.50 0.00 0.00 46.19 44.02 2qtv s LEU 36 CO 0.03 -0.26 -0.22 -0.47 -1.32 0.00 0.00 176.35 174.12 2qtv s TYR 37 N 2.25 2.48 -0.54 5.38 5.04 0.12 -2.39 117.35 129.69 2qtv s TYR 37 Ca 0.20 -0.39 0.02 0.00 -2.44 0.00 0.00 57.07 54.46 2qtv s TYR 37 Cb -0.16 -1.56 0.14 0.00 0.35 0.00 0.00 41.96 40.73 2qtv s TYR 37 CO 0.09 0.01 0.31 0.99 -1.34 0.00 0.00 175.55 175.61 2qtv s THR 38 N -0.57 2.97 0.24 4.34 2.01 -0.69 0.04 115.64 123.97 2qtv s THR 38 Ca 0.08 -3.12 -0.06 0.00 0.31 0.00 0.00 61.69 58.91 2qtv s THR 38 Cb -0.11 -3.01 0.20 0.00 0.01 0.00 0.00 72.50 69.58 2qtv s THR 38 CO 0.00 -0.81 1.81 1.55 -0.69 0.00 0.00 174.62 176.48 2qtv h PRO 39 N 6.77 0.74 -0.98 4.92 0.13 -1.86 -2.82 132.00 138.89 2qtv h PRO 39 Ca -0.06 -0.04 -0.59 0.00 -0.87 0.00 0.00 66.00 64.44 2qtv h PRO 39 Cb 0.92 -0.17 -0.30 0.00 0.13 0.00 0.00 31.00 31.59 2qtv h PRO 39 CO 0.69 0.49 0.73 1.28 -0.23 0.00 0.00 178.00 180.96 2qtv n LEU 40 N -4.76 7.15 -4.75 1.56 4.77 -1.26 -4.97 117.00 114.74 2qtv n LEU 40 Ca 0.12 -3.97 -0.40 0.00 -0.03 0.00 0.00 56.01 51.74 2qtv n LEU 40 Cb 0.25 -0.90 0.02 0.00 -2.33 0.00 0.00 43.42 40.47 2qtv n LEU 40 CO 0.27 1.28 1.04 1.17 -1.33 0.00 0.00 177.39 179.82 2qtv n LYS 41 N -1.03 2.12 -2.92 3.23 4.81 -1.07 -3.93 118.16 119.37 2qtv n LYS 41 Ca 0.61 0.76 -0.41 0.00 -0.87 0.00 0.00 58.31 58.40 2qtv n LYS 41 Cb 1.15 -2.60 -0.04 0.00 0.02 0.00 0.00 35.03 33.56 2qtv n LYS 41 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 2qtv s GLU 42 N -2.51 4.37 0.08 1.64 2.02 -1.26 -5.05 118.70 117.99 2qtv s GLU 42 Ca 0.63 1.01 0.05 0.00 0.02 0.00 0.00 54.97 56.68 2qtv s GLU 42 Cb -0.45 -3.52 -0.04 0.00 0.10 0.00 0.00 34.13 30.22 2qtv s GLU 42 CO 0.56 -0.16 -0.05 0.71 0.02 0.00 0.00 175.26 176.34 2qtv s TYR 43 N 1.57 2.89 0.20 1.61 1.51 -1.26 -5.02 117.35 118.84 2qtv s TYR 43 Ca 0.39 -0.07 -0.10 0.00 -1.01 0.00 0.00 57.07 56.28 2qtv s TYR 43 Cb -0.17 -1.52 0.24 0.00 -0.11 0.00 0.00 41.96 40.40 2qtv s TYR 43 CO 0.16 0.44 1.76 -0.44 -1.11 0.00 0.00 175.55 176.36 2qtv h ASP 44 N 3.74 0.29 -1.18 2.29 3.32 -1.97 -3.35 116.42 119.56 2qtv h ASP 44 Ca -0.48 0.06 -0.38 0.00 0.02 0.00 0.00 57.03 56.25 2qtv h ASP 44 Cb 1.17 0.02 -0.26 0.00 0.22 0.00 0.00 39.33 40.48 2qtv h ASP 44 CO 0.56 0.18 -0.77 -0.62 -1.72 0.00 0.00 179.24 176.87 2qtv n GLU 45 N -4.95 0.62 -0.49 3.56 1.02 -1.26 -5.14 120.64 114.00 2qtv n GLU 45 Ca 0.08 -2.49 -0.28 0.00 -0.02 0.00 0.00 57.16 54.45 2qtv n GLU 45 Cb 0.23 -1.42 0.26 0.00 -0.02 0.00 0.00 31.44 30.50 2qtv n GLU 45 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2qtv s LEU 46 N -0.47 0.65 -0.27 -4.62 2.96 -1.26 -5.02 118.68 110.66 2qtv s LEU 46 Ca 0.33 1.51 -0.05 0.00 -0.22 0.00 0.00 54.13 55.70 2qtv s LEU 46 Cb 0.14 -3.36 0.01 0.00 0.50 0.00 0.00 46.19 43.48 2qtv s LEU 46 CO -0.16 -4.37 0.02 0.20 -1.32 0.00 0.00 176.35 170.72 2qtv s ASN 47 N -2.44 4.77 -0.19 3.68 0.01 -1.26 -5.07 114.94 114.44 2qtv s ASN 47 Ca 0.69 -0.68 -0.03 0.00 -0.71 0.00 0.00 52.86 52.12 2qtv s ASN 47 Cb -0.26 -1.80 -0.01 0.00 0.41 0.00 0.00 41.25 39.59 2qtv s ASN 47 CO 0.65 -0.14 -0.05 -0.69 -1.51 0.00 0.00 177.10 175.36 2qtv s VAL 48 N 1.45 3.44 -0.41 1.60 1.01 -1.26 -1.20 120.40 125.04 2qtv s VAL 48 Ca 0.03 -0.49 -0.12 0.00 0.00 0.00 0.00 61.98 61.40 2qtv s VAL 48 Cb -0.16 -2.53 0.04 0.00 0.00 0.00 0.00 36.38 33.72 2qtv s VAL 48 CO -0.00 0.45 0.26 0.00 0.00 0.00 0.00 175.10 175.81 2qtv s ALA 49 N 1.05 3.35 0.00 5.51 0.00 0.00 -4.98 121.76 126.69 2qtv s ALA 49 Ca 0.01 -1.87 -0.01 0.00 0.00 0.00 0.00 51.96 50.08 2qtv s ALA 49 Cb -0.15 -2.73 -0.07 0.00 0.00 0.00 0.00 23.12 20.18 2qtv s ALA 49 CO -0.00 -1.51 1.33 -2.30 0.00 0.00 0.00 175.76 173.27 2qtv n PRO 50 N 5.04 0.60 -3.69 0.00 -0.02 -1.26 -1.38 135.00 134.28 2qtv n PRO 50 Ca -0.11 -0.24 -0.06 0.00 -2.02 0.00 0.00 63.50 61.06 2qtv n PRO 50 Cb 0.45 -1.56 -0.02 0.00 -0.02 0.00 0.00 33.50 32.35 2qtv n PRO 50 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 2qtv s TYR 51 N 1.96 -0.24 0.47 6.00 -0.85 -1.12 -4.90 117.35 118.68 2qtv s TYR 51 Ca 0.16 -0.07 -0.22 0.00 -0.52 0.00 0.00 57.07 56.43 2qtv s TYR 51 Cb 0.08 0.63 -0.07 0.00 0.38 0.00 0.00 41.96 42.97 2qtv s TYR 51 CO 0.00 -0.89 1.13 -0.80 -1.52 0.00 0.00 175.55 173.47 2qtv s ASN 52 N -2.83 6.16 0.95 -0.18 -0.87 -1.26 -4.07 114.94 112.83 2qtv s ASN 52 Ca 0.09 2.20 -0.12 0.00 -1.57 0.00 0.00 52.86 53.47 2qtv s ASN 52 Cb -0.02 -2.59 0.16 0.00 -0.02 0.00 0.00 41.25 38.78 2qtv s ASN 52 CO -0.01 -0.92 1.09 -2.84 -2.57 0.00 0.00 177.10 171.85 2qtv s PRO 53 N -2.86 0.79 -0.61 -0.60 0.02 -1.26 -5.00 135.00 125.47 2qtv s PRO 53 Ca 0.65 0.82 -0.12 0.00 0.02 0.00 0.00 61.00 62.37 2qtv s PRO 53 Cb -0.25 -1.75 0.16 0.00 0.02 0.00 0.00 34.50 32.67 2qtv s PRO 53 CO 0.30 -2.56 0.53 0.08 -0.33 0.00 0.00 177.00 175.02 2qtv s VAL 54 N -2.86 4.92 0.30 3.83 1.01 -1.26 -5.05 120.40 121.30 2qtv s VAL 54 Ca 0.65 -2.00 -0.25 0.00 0.00 0.00 0.00 61.98 60.38 2qtv s VAL 54 Cb -0.19 -4.14 -0.10 0.00 0.00 0.00 0.00 36.38 31.95 2qtv s VAL 54 CO 0.58 -0.89 0.89 -0.69 0.00 0.00 0.00 175.10 174.99 2qtv s VAL 55 N 0.96 4.29 0.75 2.92 1.01 -1.26 -2.03 120.40 127.03 2qtv s VAL 55 Ca 0.09 1.70 -0.12 0.00 0.00 0.00 0.00 61.98 63.65 2qtv s VAL 55 Cb -0.22 -3.97 0.05 0.00 0.00 0.00 0.00 36.38 32.24 2qtv s VAL 55 CO -0.02 0.15 1.12 0.00 0.00 0.00 0.00 175.10 176.35 2qtv n SER 57 N -3.19 0.75 -4.42 0.00 7.64 -1.26 -4.25 113.62 108.89 2qtv n SER 57 Ca 0.10 -0.66 -0.49 0.00 1.01 0.00 0.00 58.87 58.83 2qtv n SER 57 Cb 0.52 1.29 -0.03 0.00 -1.01 0.00 0.00 64.21 64.98 2qtv n SER 57 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qtv n GLY 58 N 1.43 -1.52 3.71 0.23 0.00 -1.26 -4.77 105.19 103.00 2qtv n GLY 58 Ca 0.01 0.39 -0.42 0.00 0.00 0.00 0.00 46.02 46.00 2qtv n GLY 58 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2qtv s PRO 59 N -0.91 4.17 -1.69 1.61 0.02 -1.26 -2.00 135.00 134.94 2qtv s PRO 59 Ca 0.67 2.48 0.00 0.00 0.02 0.00 0.00 61.00 64.16 2qtv s PRO 59 Cb -0.96 -3.35 0.00 0.00 0.02 0.00 0.00 34.50 30.22 2qtv s PRO 59 CO 0.56 -0.73 0.00 0.72 -0.33 0.00 0.00 177.00 177.22 2qtv n HIS 60 N 4.78 -1.01 0.00 6.54 8.25 -1.26 -4.90 115.22 127.63 2qtv n HIS 60 Ca 0.16 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.62 2qtv n HIS 60 Cb 0.38 -3.75 0.00 0.00 1.12 0.00 0.00 29.99 27.74 2qtv n HIS 60 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qtv n LYS 62 N -1.84 -1.12 -1.07 0.00 5.02 -1.26 -5.00 118.16 112.89 2qtv n LYS 62 Ca 0.00 0.82 -0.28 0.00 -2.02 0.00 0.00 58.31 56.82 2qtv n LYS 62 Cb 0.00 -5.07 0.19 0.00 -0.02 0.00 0.00 35.03 30.14 2qtv n LYS 62 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2qtv s SER 63 N -2.52 2.26 -0.03 4.39 0.01 -1.26 -4.58 113.70 111.97 2qtv s SER 63 Ca 0.00 1.20 0.06 0.00 1.31 0.00 0.00 55.95 58.52 2qtv s SER 63 Cb 0.00 -1.88 -0.01 0.00 0.21 0.00 0.00 66.02 64.33 2qtv s SER 63 CO 0.00 -3.36 -0.22 -0.63 0.41 0.00 0.00 173.24 169.44 2qtv s ILE 64 N -2.90 1.77 -0.24 1.44 1.01 -1.26 -0.17 121.20 120.85 2qtv s ILE 64 Ca 0.66 -0.94 -0.42 0.00 0.00 0.00 0.00 60.65 59.94 2qtv s ILE 64 Cb -0.20 -1.48 -0.19 0.00 0.01 0.00 0.00 42.46 40.60 2qtv s ILE 64 CO 0.59 0.50 1.42 -0.11 0.00 0.00 0.00 174.94 177.34 2qtv n LEU 65 N 2.71 1.05 -4.19 2.97 7.94 -0.86 -4.96 117.00 121.65 2qtv n LEU 65 Ca -0.16 1.15 -0.14 0.00 -1.11 0.00 0.00 56.01 55.75 2qtv n LEU 65 Cb 0.52 -0.97 -0.08 0.00 0.53 0.00 0.00 43.42 43.42 2qtv n LEU 65 CO 0.24 -1.15 -0.12 0.54 -1.11 0.00 0.00 177.39 175.79 2qtv s ASN 66 N 1.82 0.64 0.61 1.96 4.22 -1.26 -4.77 114.94 118.15 2qtv s ASN 66 Ca 0.97 -1.46 0.30 0.00 -2.14 0.00 0.00 52.86 50.53 2qtv s ASN 66 Cb -1.30 0.48 1.66 0.00 1.28 0.00 0.00 41.25 43.37 2qtv s ASN 66 CO 0.67 -0.98 2.02 -0.65 -2.04 0.00 0.00 177.10 176.13 2qtv h PRO 67 N 2.40 0.00 -0.79 3.55 0.11 -1.70 -1.76 132.00 133.81 2qtv h PRO 67 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2qtv h PRO 67 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2qtv h PRO 67 CO 0.45 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.90 2qtv n TYR 68 N -3.52 0.66 -3.80 0.65 4.02 -1.26 -4.84 117.16 109.07 2qtv n TYR 68 Ca 0.02 -0.23 -0.36 0.00 -0.01 0.00 0.00 57.90 57.32 2qtv n TYR 68 Cb 0.41 -0.21 -0.10 0.00 -0.02 0.00 0.00 39.34 39.42 2qtv n TYR 68 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2qtv s VAL 70 N 0.99 4.40 -0.26 0.00 1.01 -1.24 -4.85 120.40 120.44 2qtv s VAL 70 Ca 0.05 1.68 -0.17 0.00 0.00 0.00 0.00 61.98 63.54 2qtv s VAL 70 Cb -0.14 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 2qtv s VAL 70 CO 0.03 -0.18 0.49 -0.63 0.00 0.00 0.00 175.10 174.82 2qtv s ILE 71 N 3.46 5.09 -0.60 2.22 -1.09 -1.26 -1.79 121.20 127.23 2qtv s ILE 71 Ca 0.51 0.83 -0.21 0.00 -2.23 0.00 0.00 60.65 59.56 2qtv s ILE 71 Cb -0.19 -3.81 0.08 0.00 -1.58 0.00 0.00 42.46 36.96 2qtv s ILE 71 CO 0.12 0.10 0.82 -0.62 -1.23 0.00 0.00 174.94 174.13 2qtv s ASP 72 N 1.56 6.20 0.00 3.58 -1.08 0.61 -4.98 116.67 122.56 2qtv s ASP 72 Ca 0.20 -1.07 0.00 0.00 -0.52 0.00 0.00 52.55 51.16 2qtv s ASP 72 Cb -0.16 -2.36 0.00 0.00 -1.46 0.00 0.00 42.92 38.94 2qtv s ASP 72 CO 0.09 -1.22 0.44 -2.65 0.52 0.00 0.00 175.17 172.35 2qtv n PRO 73 N 6.97 0.00 -0.28 4.34 -0.02 -1.26 -1.20 135.00 143.55 2qtv n PRO 73 Ca -0.06 0.34 0.07 0.00 -2.02 0.00 0.00 63.50 61.84 2qtv n PRO 73 Cb 0.45 -0.94 0.19 0.00 -0.02 0.00 0.00 33.50 33.18 2qtv n PRO 73 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qtv h ARG 74 N 0.00 0.11 0.00 -0.52 3.08 -1.97 0.35 114.38 115.42 2qtv h ARG 74 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2qtv h ARG 74 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.03 2qtv h ARG 74 CO 0.00 0.07 0.00 -1.71 -1.07 0.00 0.00 179.97 177.26 2qtv n ASN 75 N -5.35 0.48 -3.45 7.04 5.15 -1.19 -4.91 115.26 113.03 2qtv n ASN 75 Ca 0.16 0.61 -0.20 0.00 -0.60 0.00 0.00 54.58 54.55 2qtv n ASN 75 Cb 0.54 -0.71 0.06 0.00 -0.53 0.00 0.00 39.78 39.14 2qtv n ASN 75 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2qtv n SER 76 N -2.02 -4.54 -3.61 1.20 7.64 0.12 -4.91 113.62 107.51 2qtv n SER 76 Ca 0.03 -0.77 -0.09 0.00 1.01 0.00 0.00 58.87 59.05 2qtv n SER 76 Cb 0.24 -4.64 -0.02 0.00 -1.01 0.00 0.00 64.21 58.78 2qtv n SER 76 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2qtv s SER 77 N -3.76 0.00 0.03 6.43 1.04 -1.06 -1.79 113.70 114.59 2qtv s SER 77 Ca 0.29 -0.94 0.03 0.00 0.48 0.00 0.00 55.95 55.81 2qtv s SER 77 Cb -0.06 0.71 -0.02 0.00 0.10 0.00 0.00 66.02 66.75 2qtv s SER 77 CO 0.77 -1.36 -0.09 -1.66 0.98 0.00 0.00 173.24 171.89 2qtv s TRP 78 N -3.47 0.77 -0.09 5.02 1.48 -0.50 -0.28 118.94 121.87 2qtv s TRP 78 Ca 0.18 -0.38 -0.07 0.00 -1.06 0.00 0.00 56.10 54.77 2qtv s TRP 78 Cb -0.03 -0.46 -0.04 0.00 -1.16 0.00 0.00 33.47 31.77 2qtv s TRP 78 CO 0.10 -0.03 0.18 -1.54 -4.06 0.00 0.00 176.95 171.60 2qtv s SER 79 N -1.18 6.44 -0.28 -2.66 1.04 -0.74 -0.71 113.70 115.60 2qtv s SER 79 Ca -0.05 0.51 -0.17 0.00 0.48 0.00 0.00 55.95 56.73 2qtv s SER 79 Cb -0.08 -2.08 -0.02 0.00 0.10 0.00 0.00 66.02 63.94 2qtv s SER 79 CO 0.01 0.38 0.47 0.00 0.98 0.00 0.00 173.24 175.08 2qtv h PRO 81 N 8.16 0.00 0.00 0.00 0.11 -1.92 0.41 132.00 138.76 2qtv h PRO 81 Ca -0.29 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.78 2qtv h PRO 81 Cb 1.14 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 2qtv h PRO 81 CO 0.71 0.01 -0.28 0.82 -0.21 0.00 0.00 178.00 179.05 2qtv h ILE 82 N 0.00 0.55 0.00 4.15 1.08 -1.92 -3.42 117.51 117.95 2qtv h ILE 82 Ca -0.00 -1.48 0.00 0.00 -0.39 0.00 0.00 64.86 62.99 2qtv h ILE 82 Cb 0.04 1.11 0.00 0.00 -3.07 0.00 0.00 36.82 34.90 2qtv h ILE 82 CO 0.00 0.19 -0.83 0.00 -0.69 0.00 0.00 178.15 176.82 2qtv n ASN 84 N -1.44 -1.85 -4.84 0.00 3.02 0.14 -5.02 115.26 105.28 2qtv n ASN 84 Ca 0.02 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.26 2qtv n ASN 84 Cb 0.25 -0.93 0.01 0.00 -0.61 0.00 0.00 39.78 38.51 2qtv n ASN 84 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2qtv s SER 85 N -2.38 6.07 0.21 6.41 1.04 -1.26 -4.61 113.70 119.18 2qtv s SER 85 Ca 0.00 1.55 -0.22 0.00 0.48 0.00 0.00 55.95 57.77 2qtv s SER 85 Cb 0.00 -2.49 -0.08 0.00 0.10 0.00 0.00 66.02 63.54 2qtv s SER 85 CO 0.00 -0.97 0.75 -0.13 0.98 0.00 0.00 173.24 173.87 2qtv s ARG 86 N -4.73 4.37 -0.03 4.02 0.52 -1.26 -2.10 118.95 119.73 2qtv s ARG 86 Ca 0.58 0.99 0.02 0.00 -0.52 0.00 0.00 55.73 56.80 2qtv s ARG 86 Cb -0.12 -2.99 0.01 0.00 0.52 0.00 0.00 34.95 32.37 2qtv s ARG 86 CO 0.46 0.44 -0.09 -0.80 0.02 0.00 0.00 175.30 175.34 2qtv s ASN 87 N -1.49 1.24 0.29 0.23 0.01 0.11 -4.84 114.94 110.49 2qtv s ASN 87 Ca 0.41 -0.19 -0.30 0.00 -0.71 0.00 0.00 52.86 52.07 2qtv s ASN 87 Cb -0.19 -0.39 -0.12 0.00 0.41 0.00 0.00 41.25 40.96 2qtv s ASN 87 CO 0.23 0.05 1.53 1.41 -1.51 0.00 0.00 177.10 178.81 2qtv n HIS 88 N 3.43 2.68 -3.07 2.20 8.25 -1.26 -1.41 115.22 126.03 2qtv n HIS 88 Ca -0.20 0.32 -0.40 0.00 -0.26 0.00 0.00 57.72 57.18 2qtv n HIS 88 Cb 0.54 -2.55 -0.06 0.00 1.12 0.00 0.00 29.99 29.04 2qtv n HIS 88 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2qtv s LEU 89 N -0.46 4.13 0.60 2.41 2.96 -0.74 -4.77 118.68 122.81 2qtv s LEU 89 Ca 0.64 0.87 -0.18 0.00 -0.22 0.00 0.00 54.13 55.24 2qtv s LEU 89 Cb -0.53 -2.95 -0.07 0.00 0.50 0.00 0.00 46.19 43.14 2qtv s LEU 89 CO 0.50 -0.32 0.70 -0.81 -1.32 0.00 0.00 176.35 175.10 2qtv n PRO 90 N 5.24 0.63 -0.32 0.98 -0.04 -1.26 -4.68 135.00 135.55 2qtv n PRO 90 Ca -0.00 0.25 0.10 0.00 -0.04 0.00 0.00 63.50 63.81 2qtv n PRO 90 Cb 0.49 -1.90 0.22 0.00 -0.04 0.00 0.00 33.50 32.28 2qtv n PRO 90 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 2qtv h PRO 91 N 0.26 0.03 0.00 0.54 0.11 -1.99 -0.96 132.00 129.99 2qtv h PRO 91 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2qtv h PRO 91 Cb 1.38 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.49 2qtv h PRO 91 CO 0.48 0.02 0.00 0.00 -0.21 0.00 0.00 178.00 178.29 2qtv n GLN 92 N -5.47 0.05 -0.01 1.05 10.64 -1.26 -3.06 117.38 119.32 2qtv n GLN 92 Ca 0.19 0.05 0.10 0.00 -1.83 0.00 0.00 57.00 55.51 2qtv n GLN 92 Cb 0.63 -1.50 -0.15 0.00 -0.86 0.00 0.00 30.24 28.36 2qtv n GLN 92 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 2qtv n TYR 93 N -1.47 0.00 0.00 2.61 0.53 -0.41 -4.69 117.16 113.73 2qtv n TYR 93 Ca 0.07 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.95 2qtv n TYR 93 Cb 0.29 -0.39 0.00 0.00 -1.03 0.00 0.00 39.34 38.22 2qtv n TYR 93 CO 0.00 0.00 0.00 2.41 -1.02 0.00 0.00 176.86 178.25 2qtv n THR 94 N -2.08 0.00 -2.87 -0.72 -1.04 -0.92 -3.94 114.28 102.70 2qtv n THR 94 Ca -0.02 0.99 -0.42 0.00 -2.04 0.00 0.00 64.05 62.56 2qtv n THR 94 Cb 0.50 -1.38 -0.04 0.00 -1.82 0.00 0.00 70.33 67.59 2qtv n THR 94 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 2qtv s ASN 95 N -2.70 6.83 0.00 8.00 3.84 -1.26 -5.02 114.94 124.64 2qtv s ASN 95 Ca 0.00 1.01 0.00 0.00 0.21 0.00 0.00 52.86 54.08 2qtv s ASN 95 Cb 0.00 -2.44 0.00 0.00 -0.55 0.00 0.00 41.25 38.26 2qtv s ASN 95 CO 0.00 -0.55 0.00 -0.11 -2.79 0.00 0.00 177.10 173.65 2qtv n LEU 96 N 6.09 0.00 0.00 3.21 7.94 -1.25 -5.07 117.00 127.91 2qtv n LEU 96 Ca 0.06 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.96 2qtv n LEU 96 Cb 0.47 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.42 2qtv n LEU 96 CO 0.48 -0.02 0.00 -1.54 -1.11 0.00 0.00 177.39 175.21 2qtv n SER 97 N -0.40 0.00 0.00 1.96 3.41 -1.26 -4.98 113.62 112.34 2qtv n SER 97 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2qtv n SER 97 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2qtv n SER 97 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qtv n GLN 98 N -0.65 0.00 -0.04 4.33 6.02 -1.26 -2.28 117.38 123.50 2qtv n GLN 98 Ca 0.00 0.25 -0.07 0.00 -0.01 0.00 0.00 57.00 57.17 2qtv n GLN 98 Cb 0.00 -1.55 -0.06 0.00 1.02 0.00 0.00 30.24 29.65 2qtv n GLN 98 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 2qtv h GLU 99 N 0.00 -0.04 -1.22 -1.09 5.08 -2.05 -3.37 114.58 111.88 2qtv h GLU 99 Ca 0.00 0.00 -0.65 0.00 -1.00 0.00 0.00 59.36 57.72 2qtv h GLU 99 Cb 0.10 0.01 -0.35 0.00 0.50 0.00 0.00 28.75 29.01 2qtv h GLU 99 CO 0.00 0.40 0.16 0.27 -1.00 0.00 0.00 179.01 178.84 2qtv n ASN 100 N -4.75 6.38 -4.66 1.42 0.23 -0.97 -5.05 115.26 107.87 2qtv n ASN 100 Ca -0.05 -3.78 -0.42 0.00 -0.53 0.00 0.00 54.58 49.80 2qtv n ASN 100 Cb 0.22 -0.73 -0.00 0.00 -2.08 0.00 0.00 39.78 37.19 2qtv n ASN 100 CO 0.00 0.00 0.00 0.23 -0.93 0.00 0.00 177.26 176.56 2qtv n MET 101 N -0.71 1.79 -1.89 -3.83 2.81 -1.16 -4.85 117.12 109.29 2qtv n MET 101 Ca 0.52 0.63 -0.42 0.00 -1.81 0.00 0.00 57.70 56.62 2qtv n MET 101 Cb 0.66 -2.18 -0.02 0.00 -0.71 0.00 0.00 33.22 30.96 2qtv n MET 101 CO 0.00 0.00 0.00 -2.14 1.51 0.00 0.00 175.97 175.34 2qtv s PRO 102 N -1.89 4.19 0.25 0.03 0.02 -1.26 -4.90 135.00 131.44 2qtv s PRO 102 Ca 0.58 2.44 -0.05 0.00 0.02 0.00 0.00 61.00 64.00 2qtv s PRO 102 Cb -0.58 -3.09 0.50 0.00 0.02 0.00 0.00 34.50 31.35 2qtv s PRO 102 CO 0.60 -0.57 1.65 -0.07 -0.33 0.00 0.00 177.00 178.28 2qtv h LEU 103 N 5.54 -0.20 0.00 -5.54 3.38 -2.00 0.34 115.31 116.83 2qtv h LEU 103 Ca -0.45 0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2qtv h LEU 103 Cb 1.21 0.30 0.00 0.00 0.09 0.00 0.00 40.66 42.26 2qtv h LEU 103 CO 0.83 -0.15 0.00 -1.84 0.09 0.00 0.00 178.44 177.38 2qtv n GLU 104 N -5.28 0.08 0.00 1.13 0.00 -1.26 -0.75 120.64 114.55 2qtv n GLU 104 Ca 0.15 0.25 0.11 0.00 0.00 0.00 0.00 57.16 57.67 2qtv n GLU 104 Cb 0.51 -1.50 0.03 0.00 0.00 0.00 0.00 31.44 30.48 2qtv n GLU 104 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2qtv n LEU 105 N -1.39 1.43 -0.09 -1.84 4.77 0.10 -2.65 117.00 117.33 2qtv n LEU 105 Ca 0.04 -0.55 -0.09 0.00 -0.03 0.00 0.00 56.01 55.38 2qtv n LEU 105 Cb 0.10 -0.04 -0.12 0.00 -2.33 0.00 0.00 43.42 41.04 2qtv n LEU 105 CO 0.09 0.29 -1.07 1.67 -1.33 0.00 0.00 177.39 177.04 2qtv n GLN 106 N -0.72 1.15 -4.93 3.23 7.27 0.07 -4.32 117.38 119.14 2qtv n GLN 106 Ca 0.08 0.02 -0.33 0.00 0.07 0.00 0.00 57.00 56.84 2qtv n GLN 106 Cb 0.40 -1.42 -0.15 0.00 2.41 0.00 0.00 30.24 31.47 2qtv n GLN 106 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 2qtv s SER 107 N -5.23 3.71 0.46 1.69 0.01 -0.41 -4.99 113.70 108.95 2qtv s SER 107 Ca -0.12 -0.40 0.29 0.00 1.31 0.00 0.00 55.95 57.03 2qtv s SER 107 Cb 0.05 -1.52 0.95 0.00 0.21 0.00 0.00 66.02 65.72 2qtv s SER 107 CO 0.64 0.17 1.82 0.71 0.41 0.00 0.00 173.24 176.99 2qtv h THR 108 N 5.47 0.00 -3.19 1.44 1.35 -1.88 -3.41 112.91 112.68 2qtv h THR 108 Ca -0.24 -0.65 -0.51 0.00 -0.55 0.00 0.00 66.41 64.46 2qtv h THR 108 Cb 1.22 1.62 -0.37 0.00 -1.73 0.00 0.00 68.15 68.89 2qtv h THR 108 CO 0.53 0.00 -0.80 -0.89 -0.25 0.00 0.00 175.52 174.11 2qtv s THR 109 N -3.44 0.92 0.07 6.82 2.01 -1.25 -0.80 115.64 119.96 2qtv s THR 109 Ca 0.04 -0.23 -0.10 0.00 0.31 0.00 0.00 61.69 61.72 2qtv s THR 109 Cb 0.08 -0.97 0.00 0.00 0.01 0.00 0.00 72.50 71.63 2qtv s THR 109 CO 0.57 0.34 0.21 -0.51 -0.69 0.00 0.00 174.62 174.55 2qtv s ILE 110 N 1.75 0.12 -0.12 1.82 2.07 -0.42 -4.55 121.20 121.87 2qtv s ILE 110 Ca 0.05 -1.01 0.02 0.00 -1.41 0.00 0.00 60.65 58.30 2qtv s ILE 110 Cb -0.13 -1.16 0.01 0.00 0.13 0.00 0.00 42.46 41.32 2qtv s ILE 110 CO -0.08 -0.56 -0.19 -0.70 -1.91 0.00 0.00 174.94 171.50 2qtv s GLU 111 N -3.32 2.68 -0.07 3.50 2.12 -0.34 -0.19 118.70 123.08 2qtv s GLU 111 Ca 0.01 -0.73 -0.11 0.00 0.36 0.00 0.00 54.97 54.50 2qtv s GLU 111 Cb 0.02 -2.19 -0.05 0.00 0.26 0.00 0.00 34.13 32.18 2qtv s GLU 111 CO -0.08 -0.02 0.27 0.71 -0.54 0.00 0.00 175.26 175.59 2qtv s TYR 112 N 0.85 3.65 -0.44 5.30 1.51 0.18 -0.82 117.35 127.59 2qtv s TYR 112 Ca -0.08 0.74 -0.11 0.00 -1.01 0.00 0.00 57.07 56.61 2qtv s TYR 112 Cb -0.15 -2.11 0.08 0.00 -0.11 0.00 0.00 41.96 39.67 2qtv s TYR 112 CO -0.01 0.68 0.32 0.42 -1.11 0.00 0.00 175.55 175.85 2qtv s ILE 113 N -1.00 4.57 1.33 2.71 1.01 -0.48 -0.82 121.20 128.51 2qtv s ILE 113 Ca 0.19 -1.33 -0.21 0.00 0.00 0.00 0.00 60.65 59.30 2qtv s ILE 113 Cb -0.14 -3.79 0.33 0.00 0.01 0.00 0.00 42.46 38.87 2qtv s ILE 113 CO 0.08 -0.56 1.01 -0.89 0.00 0.00 0.00 174.94 174.58 2qtv s THR 114 N 1.49 1.39 -0.34 2.92 2.01 -0.23 -2.79 115.64 120.09 2qtv s THR 114 Ca 0.04 0.00 0.10 0.00 0.31 0.00 0.00 61.69 62.13 2qtv s THR 114 Cb -0.24 -2.25 0.24 0.00 0.01 0.00 0.00 72.50 70.26 2qtv s THR 114 CO 0.03 0.00 1.18 -0.46 -0.69 0.00 0.00 174.62 174.68 2qtv n ASN 115 N -5.25 2.68 -4.67 3.53 6.94 -1.26 -4.71 115.26 112.51 2qtv n ASN 115 Ca 0.13 -2.38 -0.42 0.00 -0.02 0.00 0.00 54.58 51.88 2qtv n ASN 115 Cb 0.60 -0.25 -0.03 0.00 -2.36 0.00 0.00 39.78 37.74 2qtv n ASN 115 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 2qtv s LYS 116 N -1.67 4.34 0.38 -3.83 2.20 -1.26 -5.02 119.74 114.87 2qtv s LYS 116 Ca 0.20 1.25 -0.13 0.00 -0.36 0.00 0.00 55.97 56.93 2qtv s LYS 116 Cb 0.15 -3.58 -0.08 0.00 -1.51 0.00 0.00 37.83 32.81 2qtv s LYS 116 CO 0.07 -0.40 0.78 -1.25 -0.36 0.00 0.00 175.35 174.19 2qtv s PRO 117 N 2.36 3.91 -0.26 4.03 0.04 -1.26 -3.46 135.00 140.36 2qtv s PRO 117 Ca 0.44 0.62 -0.17 0.00 0.04 0.00 0.00 61.00 61.93 2qtv s PRO 117 Cb -0.17 -2.38 -0.03 0.00 0.04 0.00 0.00 34.50 31.96 2qtv s PRO 117 CO 0.13 0.03 0.47 0.08 0.04 0.00 0.00 177.00 177.75 2qtv s VAL 118 N -2.21 5.10 -0.26 -0.36 1.01 -1.25 -4.92 120.40 117.51 2qtv s VAL 118 Ca 0.54 0.78 0.22 0.00 0.00 0.00 0.00 61.98 63.52 2qtv s VAL 118 Cb -0.10 -3.79 0.04 0.00 0.00 0.00 0.00 36.38 32.53 2qtv s VAL 118 CO 0.24 0.11 1.11 0.71 0.00 0.00 0.00 175.10 177.27 2qtv h THR 119 N 5.40 0.01 -3.66 3.92 1.35 -1.96 -3.47 112.91 114.49 2qtv h THR 119 Ca -0.30 -1.02 -0.50 0.00 -0.55 0.00 0.00 66.41 64.04 2qtv h THR 119 Cb 1.15 1.57 -0.32 0.00 -1.73 0.00 0.00 68.15 68.82 2qtv h THR 119 CO 0.69 0.01 -0.81 -0.69 -0.25 0.00 0.00 175.52 174.47 2qtv s VAL 120 N -3.34 1.11 1.00 6.82 1.01 -1.26 -5.14 120.40 120.60 2qtv s VAL 120 Ca 0.00 -0.51 -0.11 0.00 0.00 0.00 0.00 61.98 61.36 2qtv s VAL 120 Cb 0.09 -0.99 0.19 0.00 0.00 0.00 0.00 36.38 35.67 2qtv s VAL 120 CO 0.78 0.34 1.09 -2.84 0.00 0.00 0.00 175.10 174.47 2qtv s PRO 121 N 0.36 0.41 0.64 2.72 0.02 -1.26 -4.94 135.00 132.96 2qtv s PRO 121 Ca -0.08 1.16 -0.18 0.00 0.02 0.00 0.00 61.00 61.92 2qtv s PRO 121 Cb -0.13 -1.69 -0.01 0.00 0.02 0.00 0.00 34.50 32.70 2qtv s PRO 121 CO 0.02 -2.92 1.23 -1.25 -0.33 0.00 0.00 177.00 173.75 2qtv s PRO 122 N -4.64 2.65 -0.16 5.54 0.04 -1.26 -4.68 135.00 132.49 2qtv s PRO 122 Ca 0.67 1.87 0.01 0.00 0.04 0.00 0.00 61.00 63.59 2qtv s PRO 122 Cb -0.22 -1.88 0.01 0.00 0.04 0.00 0.00 34.50 32.44 2qtv s PRO 122 CO 0.60 -1.47 -0.19 0.42 0.04 0.00 0.00 177.00 176.39 2qtv s ILE 123 N -1.65 2.24 -0.26 0.56 1.01 -1.24 -1.70 121.20 120.16 2qtv s ILE 123 Ca 0.78 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 60.52 2qtv s ILE 123 Cb -0.32 -1.92 0.04 0.00 0.01 0.00 0.00 42.46 40.28 2qtv s ILE 123 CO 0.38 0.54 -0.08 -0.36 0.00 0.00 0.00 174.94 175.42 2qtv s PHE 124 N 0.95 3.16 -0.49 3.97 0.40 -0.73 0.37 117.98 125.61 2qtv s PHE 124 Ca -0.03 -1.93 -0.13 0.00 -0.60 0.00 0.00 56.93 54.24 2qtv s PHE 124 Cb -0.15 -2.01 0.11 0.00 0.51 0.00 0.00 43.02 41.48 2qtv s PHE 124 CO -0.04 -0.81 0.39 0.12 0.70 0.00 0.00 175.22 175.58 2qtv s PHE 125 N 1.22 3.32 0.02 0.36 2.19 0.90 -1.25 117.98 124.75 2qtv s PHE 125 Ca -0.04 -1.46 -0.28 0.00 0.33 0.00 0.00 56.93 55.48 2qtv s PHE 125 Cb -0.18 -3.47 -0.04 0.00 -1.31 0.00 0.00 43.02 38.02 2qtv s PHE 125 CO -0.05 -0.95 0.88 -0.06 1.83 0.00 0.00 175.22 176.88 2qtv s PHE 126 N 1.50 3.69 -0.31 10.12 0.40 -0.80 -0.95 117.98 131.64 2qtv s PHE 126 Ca 0.04 1.59 0.02 0.00 -0.60 0.00 0.00 56.93 57.98 2qtv s PHE 126 Cb -0.27 -2.99 0.09 0.00 0.51 0.00 0.00 43.02 40.37 2qtv s PHE 126 CO 0.02 0.11 0.04 0.08 0.70 0.00 0.00 175.22 176.17 2qtv s VAL 127 N 0.54 1.71 -0.21 -0.44 1.01 0.20 0.78 120.40 124.00 2qtv s VAL 127 Ca 0.45 -1.82 -0.06 0.00 0.00 0.00 0.00 61.98 60.56 2qtv s VAL 127 Cb -0.21 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 33.95 2qtv s VAL 127 CO 0.26 -0.50 0.04 -0.69 0.00 0.00 0.00 175.10 174.20 2qtv s VAL 128 N 1.22 4.28 -0.31 2.92 1.01 0.30 -1.70 120.40 128.12 2qtv s VAL 128 Ca 0.06 -0.20 -0.26 0.00 0.00 0.00 0.00 61.98 61.59 2qtv s VAL 128 Cb -0.18 -2.95 0.01 0.00 0.00 0.00 0.00 36.38 33.25 2qtv s VAL 128 CO -0.13 0.41 0.90 -0.62 0.00 0.00 0.00 175.10 175.67 2qtv s ASP 129 N 0.99 6.78 0.00 3.32 2.15 -0.88 -0.68 116.67 128.35 2qtv s ASP 129 Ca 0.03 0.82 0.18 0.00 0.43 0.00 0.00 52.55 54.02 2qtv s ASP 129 Cb -0.14 -2.46 0.89 0.00 -0.30 0.00 0.00 42.92 40.91 2qtv s ASP 129 CO 0.02 -0.72 1.60 0.18 -0.17 0.00 0.00 175.17 176.09 2qtv n LEU 130 N 6.45 0.75 -2.31 -1.34 4.77 0.11 -4.29 117.00 121.13 2qtv n LEU 130 Ca 0.07 -0.32 -0.24 0.00 -0.03 0.00 0.00 56.01 55.49 2qtv n LEU 130 Cb 0.48 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.48 2qtv n LEU 130 CO 0.54 0.16 1.48 0.35 -1.33 0.00 0.00 177.39 178.59 2qtv n THR 131 N -0.28 3.17 -4.24 -5.08 -2.24 -1.26 0.48 114.28 104.83 2qtv n THR 131 Ca 0.14 -2.60 -0.27 0.00 -2.27 0.00 0.00 64.05 59.06 2qtv n THR 131 Cb 0.18 -1.53 -0.08 0.00 -2.10 0.00 0.00 70.33 66.80 2qtv n THR 131 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2qtv s SER 132 N 0.30 4.54 0.69 3.42 0.01 -1.26 -4.87 113.70 116.53 2qtv s SER 132 Ca 0.52 -0.47 -0.16 0.00 1.31 0.00 0.00 55.95 57.15 2qtv s SER 132 Cb 0.35 -0.89 0.02 0.00 0.21 0.00 0.00 66.02 65.71 2qtv s SER 132 CO -0.15 0.10 1.19 -1.61 0.41 0.00 0.00 173.24 173.18 2qtv s GLU 133 N -2.86 2.42 0.14 12.44 2.02 -1.26 -4.68 118.70 126.92 2qtv s GLU 133 Ca 0.26 1.72 -0.30 0.00 0.02 0.00 0.00 54.97 56.68 2qtv s GLU 133 Cb -0.09 -1.87 -0.05 0.00 0.10 0.00 0.00 34.13 32.21 2qtv s GLU 133 CO 0.17 -1.61 1.57 1.15 0.02 0.00 0.00 175.26 176.55 2qtv h THR 134 N 0.01 0.07 -0.52 3.63 2.02 -1.99 -1.37 112.91 114.77 2qtv h THR 134 Ca -0.48 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.70 2qtv h THR 134 Cb 1.29 0.07 -0.03 0.00 -1.74 0.00 0.00 68.15 67.74 2qtv h THR 134 CO 0.52 0.00 0.31 -0.33 0.37 0.00 0.00 175.52 176.39 2qtv h GLU 135 N -0.41 0.70 -0.52 6.66 4.39 -1.99 -0.49 114.58 122.92 2qtv h GLU 135 Ca 0.10 -0.06 -0.10 0.00 0.34 0.00 0.00 59.36 59.64 2qtv h GLU 135 Cb 0.61 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.09 2qtv h GLU 135 CO -0.54 0.49 -0.07 -0.97 -1.16 0.00 0.00 179.01 176.76 2qtv h ASN 136 N 0.71 0.92 0.06 1.42 -0.73 -1.77 -2.55 115.58 113.65 2qtv h ASN 136 Ca 0.19 -0.28 -0.21 0.00 1.87 0.00 0.00 56.30 57.87 2qtv h ASN 136 Cb -0.03 -0.25 0.00 0.00 0.27 0.00 0.00 38.32 38.32 2qtv h ASN 136 CO -0.04 1.02 -0.79 0.25 -0.37 0.00 0.00 177.43 177.50 2qtv h LEU 137 N 0.84 0.73 -0.77 0.34 5.85 -0.63 -2.85 115.31 118.82 2qtv h LEU 137 Ca 0.14 -0.49 -0.03 0.00 0.84 0.00 0.00 57.88 58.34 2qtv h LEU 137 Cb 0.60 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 2qtv h LEU 137 CO 0.04 1.27 0.35 -0.78 -0.34 0.00 0.00 178.44 178.98 2qtv h ASP 138 N 0.40 1.02 -0.65 1.25 3.58 -1.01 -1.02 116.42 120.00 2qtv h ASP 138 Ca -0.05 -0.14 -0.06 0.00 0.42 0.00 0.00 57.03 57.19 2qtv h ASP 138 Cb 1.41 -0.26 -0.03 0.00 1.72 0.00 0.00 39.33 42.17 2qtv h ASP 138 CO 0.15 0.88 0.16 -1.28 -2.88 0.00 0.00 179.24 176.27 2qtv h SER 139 N 1.09 0.98 -0.84 2.28 0.87 -1.48 -2.29 113.55 114.17 2qtv h SER 139 Ca 0.26 -0.23 0.02 0.00 -1.23 0.00 0.00 61.79 60.61 2qtv h SER 139 Cb 0.14 -0.26 -0.05 0.00 -0.44 0.00 0.00 62.40 61.80 2qtv h SER 139 CO -0.03 0.96 0.54 0.25 -0.53 0.00 0.00 176.83 178.02 2qtv h LEU 140 N 0.95 0.92 -0.25 2.23 5.85 -1.16 -1.34 115.31 122.51 2qtv h LEU 140 Ca 0.20 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.92 2qtv h LEU 140 Cb 0.36 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2qtv h LEU 140 CO 0.00 0.65 0.14 0.11 -0.34 0.00 0.00 178.44 179.00 2qtv h LYS 141 N 1.08 0.29 -0.89 1.25 1.57 -0.80 0.03 116.57 119.10 2qtv h LYS 141 Ca 0.32 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 59.07 2qtv h LYS 141 Cb -0.05 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.15 2qtv h LYS 141 CO -0.09 0.19 0.52 1.49 -0.57 0.00 0.00 179.45 180.98 2qtv h GLU 142 N 0.30 1.23 0.07 3.15 4.22 -0.92 0.22 114.58 122.84 2qtv h GLU 142 Ca 0.10 -0.12 -0.00 0.00 0.08 0.00 0.00 59.36 59.41 2qtv h GLU 142 Cb -0.00 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.00 2qtv h GLU 142 CO -0.05 0.88 -0.03 0.77 -2.18 0.00 0.00 179.01 178.40 2qtv h SER 143 N 1.24 -0.08 -0.03 1.04 0.02 -0.75 0.73 113.55 115.73 2qtv h SER 143 Ca 0.32 -0.24 0.01 0.00 -0.84 0.00 0.00 61.79 61.04 2qtv h SER 143 Cb -0.02 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 2qtv h SER 143 CO -0.06 0.20 -0.02 0.40 -1.14 0.00 0.00 176.83 176.21 2qtv h ILE 144 N -0.36 0.94 -0.92 3.27 2.04 -0.80 0.29 117.51 121.97 2qtv h ILE 144 Ca -0.01 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.91 2qtv h ILE 144 Cb 0.31 0.94 -0.06 0.00 -0.74 0.00 0.00 36.82 37.27 2qtv h ILE 144 CO 0.02 0.00 0.58 0.40 0.00 0.00 0.00 178.15 179.15 2qtv h ILE 145 N -0.02 1.07 0.10 -0.67 2.04 -0.94 -1.32 117.51 117.77 2qtv h ILE 145 Ca 0.02 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 2qtv h ILE 145 Cb 0.05 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.04 2qtv h ILE 145 CO -0.04 0.19 -0.05 0.74 0.00 0.00 0.00 178.15 178.99 2qtv h THR 146 N 1.06 1.00 -0.85 -0.27 2.02 -0.10 -2.83 112.91 112.93 2qtv h THR 146 Ca 0.39 -0.38 0.13 0.00 0.77 0.00 0.00 66.41 67.33 2qtv h THR 146 Cb 0.15 1.24 -0.06 0.00 -1.74 0.00 0.00 68.15 67.74 2qtv h THR 146 CO -0.17 0.09 0.55 0.77 0.37 0.00 0.00 175.52 177.14 2qtv h SER 147 N -0.31 0.62 -0.78 4.18 4.64 0.06 -0.90 113.55 121.05 2qtv h SER 147 Ca -0.01 0.03 0.04 0.00 -0.47 0.00 0.00 61.79 61.38 2qtv h SER 147 Cb 0.26 -0.09 -0.05 0.00 -0.31 0.00 0.00 62.40 62.21 2qtv h SER 147 CO 0.02 0.32 0.51 -0.07 -0.87 0.00 0.00 176.83 176.75 2qtv h LEU 148 N 0.66 0.81 -0.97 5.97 3.38 -1.01 -0.31 115.31 123.84 2qtv h LEU 148 Ca 0.42 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.38 2qtv h LEU 148 Cb 0.68 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2qtv h LEU 148 CO -0.18 0.55 0.00 -1.54 0.09 0.00 0.00 178.44 177.36 2qtv n SER 149 N -4.46 0.63 0.02 -0.43 3.41 -0.34 -2.35 113.62 110.10 2qtv n SER 149 Ca 0.10 0.70 0.11 0.00 -0.26 0.00 0.00 58.87 59.52 2qtv n SER 149 Cb 0.13 -0.82 -0.06 0.00 -0.26 0.00 0.00 64.21 63.21 2qtv n SER 149 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2qtv n LEU 150 N -2.25 0.52 -4.81 1.04 4.77 -0.14 -4.99 117.00 111.14 2qtv n LEU 150 Ca 0.01 -0.06 -0.31 0.00 -0.03 0.00 0.00 56.01 55.61 2qtv n LEU 150 Cb 0.16 -0.05 0.05 0.00 -2.33 0.00 0.00 43.42 41.25 2qtv n LEU 150 CO 0.16 0.04 0.71 -0.76 -1.33 0.00 0.00 177.39 176.21 2qtv s LEU 151 N -4.07 3.17 0.20 2.23 1.43 -0.99 -4.99 118.68 115.65 2qtv s LEU 151 Ca 0.01 1.66 -0.31 0.00 -1.03 0.00 0.00 54.13 54.46 2qtv s LEU 151 Cb 0.14 -4.50 -0.10 0.00 0.03 0.00 0.00 46.19 41.76 2qtv s LEU 151 CO 0.84 -1.47 1.46 -2.84 0.23 0.00 0.00 176.35 174.57 2qtv s PRO 152 N -4.91 4.27 0.27 1.29 0.02 -1.26 -4.91 135.00 129.76 2qtv s PRO 152 Ca 0.59 2.27 -0.03 0.00 0.02 0.00 0.00 61.00 63.85 2qtv s PRO 152 Cb -0.15 -3.15 0.57 0.00 0.02 0.00 0.00 34.50 31.79 2qtv s PRO 152 CO 0.53 -0.47 1.64 -1.35 -0.33 0.00 0.00 177.00 177.02 2qtv h PRO 153 N 5.83 0.14 -0.33 5.54 0.11 -1.95 -0.77 132.00 140.58 2qtv h PRO 153 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2qtv h PRO 153 Cb 1.21 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2qtv h PRO 153 CO 0.83 0.09 0.00 0.27 -0.21 0.00 0.00 178.00 178.99 2qtv n ASN 154 N -5.30 0.92 -4.74 -2.05 6.94 -1.26 -0.99 115.26 108.79 2qtv n ASN 154 Ca 0.17 -2.04 -0.41 0.00 -0.02 0.00 0.00 54.58 52.29 2qtv n ASN 154 Cb 0.57 -0.20 -0.04 0.00 -2.36 0.00 0.00 39.78 37.76 2qtv n ASN 154 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2qtv s ALA 155 N -1.70 3.38 0.19 -2.53 0.00 -0.30 -4.67 121.76 116.13 2qtv s ALA 155 Ca 0.08 0.83 -0.30 0.00 0.00 0.00 0.00 51.96 52.57 2qtv s ALA 155 Cb 0.05 -3.35 -0.08 0.00 0.00 0.00 0.00 23.12 19.74 2qtv s ALA 155 CO 0.05 -0.21 1.07 -0.51 0.00 0.00 0.00 175.76 176.15 2qtv s LEU 156 N -0.45 4.52 -0.06 0.00 1.43 -0.69 -0.27 118.68 123.17 2qtv s LEU 156 Ca 0.49 2.06 0.05 0.00 -1.03 0.00 0.00 54.13 55.70 2qtv s LEU 156 Cb -0.30 -3.61 -0.00 0.00 0.03 0.00 0.00 46.19 42.31 2qtv s LEU 156 CO 0.35 -0.15 -0.20 -0.63 0.23 0.00 0.00 176.35 175.96 2qtv s ILE 157 N -0.44 1.67 0.31 -0.59 -1.09 0.12 -1.77 121.20 119.41 2qtv s ILE 157 Ca 0.47 -0.84 0.10 0.00 -2.23 0.00 0.00 60.65 58.15 2qtv s ILE 157 Cb -0.29 -1.44 -0.06 0.00 -1.58 0.00 0.00 42.46 39.10 2qtv s ILE 157 CO 0.35 0.47 -0.12 -0.83 -1.23 0.00 0.00 174.94 173.58 2qtv s GLY 158 N 0.09 2.02 -0.17 6.18 0.00 -0.38 -2.42 107.32 112.63 2qtv s GLY 158 Ca -0.07 -1.99 -0.09 0.00 0.00 0.00 0.00 44.72 42.57 2qtv s GLY 158 CO 0.04 -1.98 0.42 -2.27 0.00 0.00 0.00 173.10 169.31 2qtv s LEU 159 N -3.54 -0.12 -0.03 0.66 2.96 -1.26 -1.91 118.68 115.43 2qtv s LEU 159 Ca 0.31 0.91 0.02 0.00 -0.22 0.00 0.00 54.13 55.15 2qtv s LEU 159 Cb 0.00 1.38 0.01 0.00 0.50 0.00 0.00 46.19 48.09 2qtv s LEU 159 CO 0.15 -0.19 -0.07 -0.63 -1.32 0.00 0.00 176.35 174.28 2qtv s ILE 160 N 1.41 0.69 0.09 6.68 1.01 0.23 -1.86 121.20 129.46 2qtv s ILE 160 Ca -0.10 -0.28 0.09 0.00 0.00 0.00 0.00 60.65 60.37 2qtv s ILE 160 Cb -0.08 -0.65 -0.03 0.00 0.01 0.00 0.00 42.46 41.71 2qtv s ILE 160 CO -0.13 0.23 -0.24 0.42 0.00 0.00 0.00 174.94 175.22 2qtv s THR 161 N 0.41 2.00 0.27 2.92 -4.23 -0.62 0.11 115.64 116.50 2qtv s THR 161 Ca -0.06 -1.52 -0.18 0.00 -1.18 0.00 0.00 61.69 58.74 2qtv s THR 161 Cb -0.10 -1.76 0.01 0.00 1.34 0.00 0.00 72.50 71.99 2qtv s THR 161 CO 0.01 0.14 0.64 -0.72 -0.54 0.00 0.00 174.62 174.15 2qtv s TYR 162 N -0.98 -0.00 0.00 3.99 -0.85 0.15 0.75 117.35 120.40 2qtv s TYR 162 Ca 0.10 -0.43 0.00 0.00 -0.52 0.00 0.00 57.07 56.22 2qtv s TYR 162 Cb -0.10 0.54 0.00 0.00 0.38 0.00 0.00 41.96 42.79 2qtv s TYR 162 CO 0.04 -1.17 0.00 0.41 -1.52 0.00 0.00 175.55 173.31 2qtv n GLY 163 N -0.44 0.65 0.21 5.49 0.00 -1.26 0.05 105.19 109.89 2qtv n GLY 163 Ca -0.03 0.41 0.10 0.00 0.00 0.00 0.00 46.02 46.49 2qtv n GLY 163 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 2qtv h ASN 164 N 0.00 0.00 -3.15 1.61 -0.00 -1.89 0.98 115.58 113.13 2qtv h ASN 164 Ca 0.00 0.00 -0.46 0.00 -0.00 0.00 0.00 56.30 55.84 2qtv h ASN 164 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 38.32 38.18 2qtv h ASN 164 CO 0.00 0.09 -0.68 0.68 -0.00 0.00 0.00 177.43 177.52 2qtv s VAL 165 N -3.17 1.54 -0.10 6.14 -7.23 -1.26 -3.03 120.40 113.29 2qtv s VAL 165 Ca 0.06 -2.12 0.03 0.00 -1.81 0.00 0.00 61.98 58.14 2qtv s VAL 165 Cb 0.05 -2.37 -0.01 0.00 0.56 0.00 0.00 36.38 34.62 2qtv s VAL 165 CO 0.68 -0.35 -0.19 0.68 -0.31 0.00 0.00 175.10 175.62 2qtv s VAL 166 N -3.08 2.57 -0.27 1.32 -7.23 -0.84 -4.37 120.40 108.49 2qtv s VAL 166 Ca 0.28 -0.85 -0.06 0.00 -1.81 0.00 0.00 61.98 59.54 2qtv s VAL 166 Cb 0.03 -2.02 -0.00 0.00 0.56 0.00 0.00 36.38 34.95 2qtv s VAL 166 CO 0.10 0.55 0.05 -1.10 -0.31 0.00 0.00 175.10 174.39 2qtv s GLN 167 N 0.15 3.26 -0.39 4.82 -0.21 0.23 -1.81 119.66 125.72 2qtv s GLN 167 Ca -0.10 -0.73 -0.18 0.00 0.02 0.00 0.00 55.36 54.37 2qtv s GLN 167 Cb -0.16 -3.27 0.01 0.00 1.00 0.00 0.00 33.01 30.59 2qtv s GLN 167 CO 0.06 -0.34 0.49 -1.17 -2.12 0.00 0.00 175.29 172.21 2qtv s LEU 168 N 1.51 4.57 0.17 2.90 2.96 0.22 -1.59 118.68 129.42 2qtv s LEU 168 Ca 0.04 -0.34 -0.27 0.00 -0.22 0.00 0.00 54.13 53.34 2qtv s LEU 168 Cb -0.16 -2.50 -0.08 0.00 0.50 0.00 0.00 46.19 43.95 2qtv s LEU 168 CO 0.01 -0.55 0.83 -1.00 -1.32 0.00 0.00 176.35 174.33 2qtv s HIS 169 N 2.32 3.91 -0.12 5.38 3.76 -0.78 -1.06 115.29 128.70 2qtv s HIS 169 Ca 0.16 1.71 0.01 0.00 -0.15 0.00 0.00 55.06 56.79 2qtv s HIS 169 Cb -0.16 -2.85 -0.01 0.00 1.11 0.00 0.00 32.58 30.67 2qtv s HIS 169 CO 0.14 0.46 -0.17 0.34 -0.85 0.00 0.00 174.74 174.66 2qtv s ASP 170 N -0.97 3.64 -0.06 1.40 -1.08 -0.33 -4.65 116.67 114.62 2qtv s ASP 170 Ca 0.38 -0.43 0.09 0.00 -0.52 0.00 0.00 52.55 52.07 2qtv s ASP 170 Cb -0.24 -1.53 0.14 0.00 -1.46 0.00 0.00 42.92 39.83 2qtv s ASP 170 CO 0.28 0.15 1.07 0.18 0.52 0.00 0.00 175.17 177.37 2qtv n LEU 171 N 3.58 1.04 0.15 -1.34 4.32 -1.26 -3.37 117.00 120.12 2qtv n LEU 171 Ca -0.19 -1.94 0.13 0.00 -0.02 0.00 0.00 56.01 53.99 2qtv n LEU 171 Cb 0.53 -0.18 0.53 0.00 -1.62 0.00 0.00 43.42 42.67 2qtv n LEU 171 CO 0.29 0.47 0.87 0.77 -1.22 0.00 0.00 177.39 178.58 2qtv h SER 172 N 0.07 0.00 -3.73 -1.43 4.64 -1.90 -3.42 113.55 107.78 2qtv h SER 172 Ca -0.01 0.00 -0.69 0.00 -0.47 0.00 0.00 61.79 60.63 2qtv h SER 172 Cb 1.25 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.14 2qtv h SER 172 CO 0.00 0.00 -0.71 -0.55 -0.87 0.00 0.00 176.83 174.70 2qtv s SER 173 N -4.39 4.52 0.09 4.97 0.15 -1.26 -5.01 113.70 112.77 2qtv s SER 173 Ca 0.03 -0.06 0.24 0.00 0.70 0.00 0.00 55.95 56.87 2qtv s SER 173 Cb 0.09 -1.12 0.37 0.00 -1.71 0.00 0.00 66.02 63.65 2qtv s SER 173 CO 0.39 0.35 1.33 -0.62 1.20 0.00 0.00 173.24 175.89 2qtv n GLU 174 N 2.27 0.24 0.00 5.44 1.02 -1.26 -4.00 120.64 124.35 2qtv n GLU 174 Ca -0.18 0.07 0.07 0.00 -0.02 0.00 0.00 57.16 57.10 2qtv n GLU 174 Cb 0.53 -1.65 -0.05 0.00 -0.02 0.00 0.00 31.44 30.25 2qtv n GLU 174 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2qtv n THR 175 N -2.00 0.00 -3.97 2.62 -2.24 -1.26 -5.00 114.28 102.43 2qtv n THR 175 Ca 0.04 -0.23 -0.09 0.00 -2.27 0.00 0.00 64.05 61.49 2qtv n THR 175 Cb 0.42 1.08 -0.11 0.00 -2.10 0.00 0.00 70.33 69.62 2qtv n THR 175 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2qtv s ILE 176 N -2.17 0.10 -0.60 2.28 -1.09 -1.26 -5.11 121.20 113.35 2qtv s ILE 176 Ca 0.09 -0.82 -0.04 0.00 -2.23 0.00 0.00 60.65 57.65 2qtv s ILE 176 Cb 0.12 -0.24 0.16 0.00 -1.58 0.00 0.00 42.46 40.92 2qtv s ILE 176 CO 0.52 -0.45 0.42 -1.81 -1.23 0.00 0.00 174.94 172.39 2qtv s ASP 177 N -1.31 5.37 0.25 3.58 1.01 -1.26 -4.47 116.67 119.83 2qtv s ASP 177 Ca -0.14 -2.67 -0.15 0.00 0.71 0.00 0.00 52.55 50.30 2qtv s ASP 177 Cb -0.09 -1.88 -0.08 0.00 1.01 0.00 0.00 42.92 41.88 2qtv s ASP 177 CO -0.01 -0.43 0.66 -0.13 0.21 0.00 0.00 175.17 175.47 2qtv s ARG 178 N 0.21 4.00 -0.08 8.23 0.52 -1.22 -5.00 118.95 125.61 2qtv s ARG 178 Ca 0.15 0.59 -0.04 0.00 -0.52 0.00 0.00 55.73 55.91 2qtv s ARG 178 Cb -0.20 -2.66 0.05 0.00 0.52 0.00 0.00 34.95 32.66 2qtv s ARG 178 CO -0.04 0.30 0.18 0.00 0.02 0.00 0.00 175.30 175.76 2qtv s ASN 180 N 1.71 6.30 -0.13 0.00 0.01 -0.22 -4.94 114.94 117.66 2qtv s ASN 180 Ca -0.04 0.34 0.00 0.00 -0.71 0.00 0.00 52.86 52.46 2qtv s ASN 180 Cb -0.12 -2.09 -0.01 0.00 0.41 0.00 0.00 41.25 39.44 2qtv s ASN 180 CO -0.06 0.25 -0.14 -0.69 -1.51 0.00 0.00 177.10 174.95 2qtv s VAL 181 N -0.10 2.98 0.11 1.60 1.01 -1.26 -0.61 120.40 124.13 2qtv s VAL 181 Ca 0.11 -0.69 0.09 0.00 0.00 0.00 0.00 61.98 61.49 2qtv s VAL 181 Cb -0.12 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.98 2qtv s VAL 181 CO 0.01 0.53 -0.19 -0.36 0.00 0.00 0.00 175.10 175.08 2qtv s PHE 182 N 0.37 2.51 0.54 5.22 0.40 -0.75 -5.00 117.98 121.27 2qtv s PHE 182 Ca -0.11 -0.28 -0.20 0.00 -0.60 0.00 0.00 56.93 55.74 2qtv s PHE 182 Cb -0.16 -1.34 -0.05 0.00 0.51 0.00 0.00 43.02 41.98 2qtv s PHE 182 CO 0.06 0.37 1.22 1.03 0.70 0.00 0.00 175.22 178.59 2qtv s ARG 183 N -2.07 3.25 0.03 0.44 0.52 -1.26 -2.00 118.95 117.87 2qtv s ARG 183 Ca 0.17 1.87 0.23 0.00 -0.52 0.00 0.00 55.73 57.48 2qtv s ARG 183 Cb -0.10 -2.12 0.12 0.00 0.52 0.00 0.00 34.95 33.36 2qtv s ARG 183 CO 0.09 -0.99 1.10 0.41 0.02 0.00 0.00 175.30 175.93 2qtv n GLY 184 N 0.50 -1.19 1.46 -3.53 0.00 -1.17 -4.08 105.19 97.17 2qtv n GLY 184 Ca 0.11 -0.42 0.09 0.00 0.00 0.00 0.00 46.02 45.80 2qtv n GLY 184 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2qtv n ASP 185 N -1.79 4.67 -3.98 1.61 5.75 -1.26 -4.23 116.55 117.33 2qtv n ASP 185 Ca 0.03 -2.59 -0.21 0.00 -0.01 0.00 0.00 54.79 52.01 2qtv n ASP 185 Cb 0.40 -0.56 -0.16 0.00 -1.03 0.00 0.00 41.12 39.76 2qtv n ASP 185 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 2qtv s ARG 186 N -2.10 1.04 -0.61 0.11 3.52 -1.26 -4.54 118.95 115.11 2qtv s ARG 186 Ca 0.48 -0.28 -0.22 0.00 -0.13 0.00 0.00 55.73 55.58 2qtv s ARG 186 Cb 0.33 -0.96 0.07 0.00 -1.56 0.00 0.00 34.95 32.84 2qtv s ARG 186 CO 0.20 0.06 0.86 -2.00 -0.81 0.00 0.00 175.30 173.61 2qtv s GLU 187 N 0.40 3.13 0.31 5.12 2.12 -1.26 -4.79 118.70 123.73 2qtv s GLU 187 Ca -0.06 -0.85 -0.28 0.00 0.36 0.00 0.00 54.97 54.14 2qtv s GLU 187 Cb -0.11 -4.19 -0.09 0.00 0.26 0.00 0.00 34.13 30.00 2qtv s GLU 187 CO 0.01 -1.63 1.11 0.71 -0.54 0.00 0.00 175.26 174.92 2qtv s TYR 188 N 3.58 3.46 0.49 5.30 1.51 -1.26 -5.04 117.35 125.39 2qtv s TYR 188 Ca 0.20 1.67 -0.03 0.00 -1.01 0.00 0.00 57.07 57.90 2qtv s TYR 188 Cb -0.18 -3.29 -0.01 0.00 -0.11 0.00 0.00 41.96 38.37 2qtv s TYR 188 CO 0.11 -0.69 0.75 -0.65 -1.11 0.00 0.00 175.55 173.96 2qtv s GLN 189 N -1.68 3.19 0.20 -0.62 -0.21 -1.26 -4.96 119.66 114.32 2qtv s GLN 189 Ca 0.48 -0.15 -0.11 0.00 0.02 0.00 0.00 55.36 55.60 2qtv s GLN 189 Cb -0.31 -2.44 0.24 0.00 1.00 0.00 0.00 33.01 31.50 2qtv s GLN 189 CO 0.40 -0.33 1.73 1.25 -2.12 0.00 0.00 175.29 176.22 2qtv h LEU 190 N 0.22 0.13 -0.60 2.90 5.85 -1.96 -2.87 115.31 118.98 2qtv h LEU 190 Ca -0.47 0.08 0.07 0.00 0.84 0.00 0.00 57.88 58.41 2qtv h LEU 190 Cb 1.24 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 42.29 2qtv h LEU 190 CO 0.60 0.09 0.29 -0.08 -0.34 0.00 0.00 178.44 179.00 2qtv h GLU 191 N 0.33 0.51 0.17 1.25 4.81 -1.99 -0.42 114.58 119.24 2qtv h GLU 191 Ca 0.28 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.47 2qtv h GLU 191 Cb 0.36 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.63 2qtv h GLU 191 CO -0.31 0.34 -0.08 0.00 -0.73 0.00 0.00 179.01 178.23 2qtv h ALA 192 N 1.36 -0.22 -0.83 2.92 0.00 -1.91 -1.87 119.26 118.70 2qtv h ALA 192 Ca 0.28 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.17 2qtv h ALA 192 Cb 0.25 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 2qtv h ALA 192 CO -0.22 -0.63 0.54 1.25 0.00 0.00 0.00 179.25 180.19 2qtv h LEU 193 N -0.23 0.90 -0.53 0.00 6.46 -1.39 -1.00 115.31 119.54 2qtv h LEU 193 Ca -0.02 -0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.71 2qtv h LEU 193 Cb 0.17 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 39.87 2qtv h LEU 193 CO 0.04 0.63 0.26 0.74 -0.62 0.00 0.00 178.44 179.48 2qtv h THR 194 N 1.06 1.20 0.19 1.05 2.02 -0.88 -2.42 112.91 115.13 2qtv h THR 194 Ca 0.33 -0.55 -0.01 0.00 0.77 0.00 0.00 66.41 66.95 2qtv h THR 194 Cb -0.02 0.59 0.00 0.00 -1.74 0.00 0.00 68.15 66.98 2qtv h THR 194 CO -0.10 0.22 -0.09 -0.08 0.37 0.00 0.00 175.52 175.83 2qtv h GLU 195 N 0.70 -0.24 -0.90 6.66 4.81 -0.95 -1.11 114.58 123.55 2qtv h GLU 195 Ca 0.18 0.02 0.19 0.00 -0.13 0.00 0.00 59.36 59.62 2qtv h GLU 195 Cb 0.11 0.06 -0.11 0.00 0.63 0.00 0.00 28.75 29.44 2qtv h GLU 195 CO -0.02 -0.01 0.46 0.52 -0.73 0.00 0.00 179.01 179.23 2qtv h MET 196 N -0.46 0.55 0.00 1.92 2.86 -1.07 2.27 114.93 121.00 2qtv h MET 196 Ca -0.03 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2qtv h MET 196 Cb 0.35 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 31.89 2qtv h MET 196 CO 0.04 0.36 -1.04 1.28 1.06 0.00 0.00 176.91 178.61 2qtv n LEU 197 N -4.92 0.82 -0.00 1.22 4.77 -0.92 -4.40 117.00 113.57 2qtv n LEU 197 Ca 0.21 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 2qtv n LEU 197 Cb 0.56 -0.06 -0.01 0.00 -2.33 0.00 0.00 43.42 41.59 2qtv n LEU 197 CO 0.18 -0.18 -0.23 0.35 -1.33 0.00 0.00 177.39 176.18 2qtv n THR 198 N -2.66 0.00 -1.11 -5.08 -2.24 -0.42 -4.71 114.28 98.06 2qtv n THR 198 Ca -0.00 -0.28 -0.04 0.00 -2.27 0.00 0.00 64.05 61.47 2qtv n THR 198 Cb 0.55 0.77 -0.02 0.00 -2.10 0.00 0.00 70.33 69.53 2qtv n THR 198 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qtv n GLY 199 N 1.65 0.66 0.00 3.38 0.00 0.76 -4.96 105.19 106.68 2qtv n GLY 199 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.51 2qtv n GLY 199 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qtv n GLN 200 N -2.49 0.00 -1.47 1.61 6.02 -1.24 -5.01 117.38 114.80 2qtv n GLN 200 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.95 2qtv n GLN 200 Cb 0.17 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.43 2qtv n GLN 200 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 2qtv n LYS 218 N 0.00 0.00 -2.70 -1.09 3.00 -1.26 -3.62 118.16 112.49 2qtv n LYS 218 Ca 0.00 0.00 -0.40 0.00 -0.00 0.00 0.00 58.31 57.91 2qtv n LYS 218 Cb 0.00 -0.49 -0.06 0.00 0.00 0.00 0.00 35.03 34.48 2qtv n LYS 218 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2qtv s VAL 219 N 0.00 3.97 0.26 3.15 1.01 -1.26 -4.93 120.40 122.60 2qtv s VAL 219 Ca 0.00 1.94 -0.14 0.00 0.00 0.00 0.00 61.98 63.77 2qtv s VAL 219 Cb 0.00 -4.21 0.00 0.00 0.00 0.00 0.00 36.38 32.17 2qtv s VAL 219 CO 0.00 0.42 0.54 0.42 0.00 0.00 0.00 175.10 176.49 2qtv s THR 220 N -1.24 0.00 -1.58 3.92 -4.23 -1.26 -5.02 115.64 106.23 2qtv s THR 220 Ca 0.43 -1.31 0.09 0.00 -1.18 0.00 0.00 61.69 59.72 2qtv s THR 220 Cb -0.26 -2.20 0.18 0.00 1.34 0.00 0.00 72.50 71.56 2qtv s THR 220 CO 0.33 0.00 1.11 -2.65 -0.54 0.00 0.00 174.62 172.87 2qtv n PRO 221 N -0.41 0.17 0.00 3.99 -0.02 -1.26 -2.85 135.00 134.62 2qtv n PRO 221 Ca -0.02 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 2qtv n PRO 221 Cb 0.61 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.59 2qtv n PRO 221 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2qtv n PHE 222 N -1.21 0.00 -3.25 6.00 3.01 -1.26 -5.02 117.46 115.73 2qtv n PHE 222 Ca 0.05 -0.08 -0.33 0.00 1.01 0.00 0.00 57.45 58.09 2qtv n PHE 222 Cb 0.06 -0.01 -0.06 0.00 -0.01 0.00 0.00 39.48 39.46 2qtv n PHE 222 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2qtv s SER 223 N -0.17 6.79 0.32 4.37 1.04 -1.13 -4.29 113.70 120.64 2qtv s SER 223 Ca 0.00 1.17 0.05 0.00 0.48 0.00 0.00 55.95 57.65 2qtv s SER 223 Cb 0.00 -2.33 0.56 0.00 0.10 0.00 0.00 66.02 64.35 2qtv s SER 223 CO 0.00 -0.07 1.82 -0.07 0.98 0.00 0.00 173.24 175.90 2qtv h LEU 224 N 2.78 0.43 0.00 2.42 3.38 -1.90 -2.65 115.31 119.77 2qtv h LEU 224 Ca -0.48 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.38 2qtv h LEU 224 Cb 1.18 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2qtv h LEU 224 CO 0.66 0.59 0.00 -0.46 0.09 0.00 0.00 178.44 179.33 2qtv n ASN 225 N -4.21 0.00 0.08 -0.43 6.94 -1.26 -2.92 115.26 113.46 2qtv n ASN 225 Ca 0.00 -0.59 0.13 0.00 -0.02 0.00 0.00 54.58 54.10 2qtv n ASN 225 Cb 0.31 0.00 0.46 0.00 -2.36 0.00 0.00 39.78 38.20 2qtv n ASN 225 CO 0.00 0.00 0.00 -2.11 -1.03 0.00 0.00 177.26 174.12 2qtv n ARG 226 N -0.85 0.17 0.00 -3.83 1.85 -1.00 -3.27 116.66 109.73 2qtv n ARG 226 Ca 0.08 0.20 0.14 0.00 -1.00 0.00 0.00 57.85 57.27 2qtv n ARG 226 Cb 0.04 -1.72 0.64 0.00 -1.05 0.00 0.00 32.46 30.36 2qtv n ARG 226 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 2qtv n PHE 227 N -2.03 0.00 -3.84 2.89 3.01 -1.15 -4.32 117.46 112.02 2qtv n PHE 227 Ca 0.05 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.21 2qtv n PHE 227 Cb 0.36 -0.07 -0.15 0.00 -0.01 0.00 0.00 39.48 39.61 2qtv n PHE 227 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 2qtv s PHE 228 N -2.19 2.42 0.17 1.38 0.40 -1.20 -4.17 117.98 114.78 2qtv s PHE 228 Ca 0.36 -2.15 0.09 0.00 -0.60 0.00 0.00 56.93 54.64 2qtv s PHE 228 Cb 0.21 -2.11 -0.04 0.00 0.51 0.00 0.00 43.02 41.59 2qtv s PHE 228 CO 0.40 -0.89 -0.15 -0.51 0.70 0.00 0.00 175.22 174.77 2qtv s LEU 229 N 1.37 2.79 0.08 -0.37 1.43 -1.02 -4.69 118.68 118.27 2qtv s LEU 229 Ca 0.09 -0.63 -0.36 0.00 -1.03 0.00 0.00 54.13 52.20 2qtv s LEU 229 Cb -0.18 -1.52 -0.15 0.00 0.03 0.00 0.00 46.19 44.37 2qtv s LEU 229 CO -0.18 0.13 1.51 -2.65 0.23 0.00 0.00 176.35 175.38 2qtv n PRO 230 N 0.29 1.66 -0.14 1.29 -0.02 -1.26 -0.70 135.00 136.13 2qtv n PRO 230 Ca -0.12 0.60 0.07 0.00 -2.02 0.00 0.00 63.50 62.03 2qtv n PRO 230 Cb 0.55 -2.32 0.39 0.00 -0.02 0.00 0.00 33.50 32.10 2qtv n PRO 230 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2qtv h LEU 231 N 5.68 0.57 -1.03 2.45 5.85 -0.59 0.23 115.31 128.49 2qtv h LEU 231 Ca -0.46 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.26 2qtv h LEU 231 Cb 1.29 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.20 2qtv h LEU 231 CO 0.85 0.37 0.00 -0.08 -0.34 0.00 0.00 178.44 179.24 2qtv h GLU 232 N 0.65 0.00 0.05 1.25 4.81 -1.34 0.37 114.58 120.37 2qtv h GLU 232 Ca 0.29 0.00 -0.34 0.00 -0.13 0.00 0.00 59.36 59.18 2qtv h GLU 232 Cb 0.29 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.63 2qtv h GLU 232 CO -0.09 0.00 -1.95 0.94 -0.73 0.00 0.00 179.01 177.18 2qtv n GLN 233 N -2.74 0.69 -0.07 1.92 7.27 -0.01 -4.39 117.38 120.05 2qtv n GLN 233 Ca 0.02 0.24 0.07 0.00 0.07 0.00 0.00 57.00 57.40 2qtv n GLN 233 Cb 0.30 -1.71 0.10 0.00 2.41 0.00 0.00 30.24 31.34 2qtv n GLN 233 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 2qtv n VAL 234 N -3.20 0.31 -0.24 1.69 0.31 -0.73 -4.77 118.33 111.71 2qtv n VAL 234 Ca -0.27 -0.66 -0.04 0.00 -0.01 0.00 0.00 64.34 63.37 2qtv n VAL 234 Cb 1.06 1.05 -0.02 0.00 -0.91 0.00 0.00 33.84 35.02 2qtv n VAL 234 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2qtv n GLU 235 N 0.81 -0.20 -0.06 5.55 2.13 0.13 -1.23 120.64 127.77 2qtv n GLU 235 Ca 0.10 0.90 -0.14 0.00 0.66 0.00 0.00 57.16 58.69 2qtv n GLU 235 Cb 0.40 -1.33 -0.07 0.00 0.27 0.00 0.00 31.44 30.71 2qtv n GLU 235 CO 0.00 0.00 0.00 0.74 -0.41 0.00 0.00 177.13 177.46 2qtv h PHE 236 N 0.00 0.59 -0.87 4.31 -1.00 -1.86 -2.83 116.94 115.28 2qtv h PHE 236 Ca 0.15 -0.20 0.07 0.00 2.81 0.00 0.00 57.97 60.80 2qtv h PHE 236 Cb 0.29 -0.12 -0.06 0.00 3.61 0.00 0.00 35.95 39.68 2qtv h PHE 236 CO -0.57 0.88 0.57 -0.22 -1.61 0.00 0.00 178.31 177.37 2qtv h LYS 237 N 0.13 0.93 -0.08 1.51 3.64 -1.59 -1.33 116.57 119.77 2qtv h LYS 237 Ca 0.02 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2qtv h LYS 237 Cb 0.82 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 32.42 2qtv h LYS 237 CO 0.06 0.62 0.05 -0.07 -2.27 0.00 0.00 179.45 177.83 2qtv h LEU 238 N 0.96 0.11 -1.33 5.20 3.38 -1.13 -1.50 115.31 121.00 2qtv h LEU 238 Ca 0.38 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.21 2qtv h LEU 238 Cb 0.24 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2qtv h LEU 238 CO -0.14 0.17 -0.10 0.78 0.09 0.00 0.00 178.44 179.24 2qtv h ASN 239 N 0.04 0.31 0.64 -0.43 2.35 -1.19 -0.26 115.58 117.04 2qtv h ASN 239 Ca 0.03 -0.06 -0.03 0.00 -0.55 0.00 0.00 56.30 55.69 2qtv h ASN 239 Cb 0.08 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.37 2qtv h ASN 239 CO -0.00 0.45 -0.36 -0.61 -1.65 0.00 0.00 177.43 175.25 2qtv h GLN 240 N 0.31 -0.90 0.27 0.81 4.15 -0.87 0.11 115.11 119.00 2qtv h GLN 240 Ca 0.06 0.06 -0.01 0.00 0.77 0.00 0.00 58.65 59.54 2qtv h GLN 240 Cb 0.37 0.20 -0.01 0.00 0.21 0.00 0.00 27.48 28.26 2qtv h GLN 240 CO 0.02 -0.60 -0.18 -0.07 -1.93 0.00 0.00 178.83 176.07 2qtv h LEU 241 N -0.93 -0.44 -0.25 -2.39 3.38 -0.99 -2.12 115.31 111.57 2qtv h LEU 241 Ca -0.08 0.03 0.03 0.00 0.09 0.00 0.00 57.88 57.95 2qtv h LEU 241 Cb 0.74 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 2qtv h LEU 241 CO 0.10 -0.28 0.04 -0.07 0.09 0.00 0.00 178.44 178.32 2qtv h LEU 242 N -0.44 -0.01 -1.36 1.67 3.38 -1.02 -2.03 115.31 115.50 2qtv h LEU 242 Ca -0.03 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.01 2qtv h LEU 242 Cb 0.37 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.14 2qtv h LEU 242 CO 0.02 0.03 0.45 -0.33 0.09 0.00 0.00 178.44 178.70 2qtv h GLU 243 N 0.13 0.83 -0.00 1.13 4.39 -0.68 -2.58 114.58 117.80 2qtv h GLU 243 Ca 0.11 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.76 2qtv h GLU 243 Cb 0.12 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 28.58 2qtv h GLU 243 CO -0.16 0.55 -0.22 0.09 -1.16 0.00 0.00 179.01 178.12 2qtv n ASN 244 N -4.45 0.40 -4.56 1.42 3.02 -0.81 -4.93 115.26 105.36 2qtv n ASN 244 Ca 0.08 -0.22 -0.47 0.00 -0.03 0.00 0.00 54.58 53.94 2qtv n ASN 244 Cb 0.09 -0.06 -0.03 0.00 -0.61 0.00 0.00 39.78 39.16 2qtv n ASN 244 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2qtv n LEU 245 N -1.24 1.22 -4.07 3.41 4.32 -0.80 -4.99 117.00 114.83 2qtv n LEU 245 Ca 0.10 1.16 -0.12 0.00 -0.02 0.00 0.00 56.01 57.13 2qtv n LEU 245 Cb 0.32 -1.21 -0.11 0.00 -1.62 0.00 0.00 43.42 40.80 2qtv n LEU 245 CO 0.28 -1.61 -0.39 -0.94 -1.22 0.00 0.00 177.39 173.51 2qtv s SER 246 N -0.41 0.83 0.35 -1.43 1.04 -1.26 -5.00 113.70 107.81 2qtv s SER 246 Ca 0.65 -0.65 -0.26 0.00 0.48 0.00 0.00 55.95 56.17 2qtv s SER 246 Cb -0.80 0.06 -0.12 0.00 0.10 0.00 0.00 66.02 65.26 2qtv s SER 246 CO 0.57 -0.28 1.06 -2.65 0.98 0.00 0.00 173.24 172.92 2qtv n PRO 247 N 1.14 1.51 -1.79 4.02 -0.02 -1.26 -4.87 135.00 133.72 2qtv n PRO 247 Ca -0.21 0.53 -0.42 0.00 -2.02 0.00 0.00 63.50 61.39 2qtv n PRO 247 Cb 0.56 -2.02 -0.03 0.00 -0.02 0.00 0.00 33.50 31.99 2qtv n PRO 247 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2qtv s ASP 248 N -0.58 6.50 0.00 2.55 -1.08 0.18 -4.88 116.67 119.35 2qtv s ASP 248 Ca 0.60 2.63 0.25 0.00 -0.52 0.00 0.00 52.55 55.51 2qtv s ASP 248 Cb -0.61 -2.56 0.78 0.00 -1.46 0.00 0.00 42.92 39.07 2qtv s ASP 248 CO 0.59 -0.97 1.59 0.00 0.52 0.00 0.00 175.17 176.90 2qtv n GLN 249 N 6.09 1.86 -1.55 4.34 1.13 -1.26 -4.89 117.38 123.10 2qtv n GLN 249 Ca 0.18 -1.26 -0.47 0.00 -1.94 0.00 0.00 57.00 53.51 2qtv n GLN 249 Cb 0.40 -1.46 -0.05 0.00 0.11 0.00 0.00 30.24 29.24 2qtv n GLN 249 CO 0.00 0.00 0.00 0.91 -1.44 0.00 0.00 177.06 176.53 2qtv n TRP 250 N 0.51 1.88 -1.65 1.08 7.02 -1.26 -4.81 117.44 120.21 2qtv n TRP 250 Ca 0.17 0.05 -0.55 0.00 -1.02 0.00 0.00 57.50 56.15 2qtv n TRP 250 Cb 0.41 -2.64 -0.07 0.00 -2.42 0.00 0.00 31.31 26.59 2qtv n TRP 250 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2qtv n SER 251 N 10.15 1.96 -4.36 -0.99 2.88 -1.26 -4.93 113.62 117.07 2qtv n SER 251 Ca 0.33 1.10 -0.42 0.00 -1.33 0.00 0.00 58.87 58.55 2qtv n SER 251 Cb 0.34 -1.15 -0.10 0.00 -0.75 0.00 0.00 64.21 62.55 2qtv n SER 251 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2qtv s VAL 252 N 2.02 4.78 0.69 2.46 0.11 -1.26 -5.06 120.40 124.14 2qtv s VAL 252 Ca 0.92 -1.05 -0.16 0.00 -2.93 0.00 0.00 61.98 58.75 2qtv s VAL 252 Cb -1.03 -3.80 -0.03 0.00 -1.53 0.00 0.00 36.38 29.99 2qtv s VAL 252 CO 0.57 -0.43 0.72 -0.81 -3.33 0.00 0.00 175.10 171.81 2qtv n PRO 253 N 5.06 0.45 -1.66 1.54 -0.04 -1.26 -4.86 135.00 134.24 2qtv n PRO 253 Ca -0.11 0.20 -0.40 0.00 -0.04 0.00 0.00 63.50 63.15 2qtv n PRO 253 Cb 0.44 -1.98 0.03 0.00 -0.04 0.00 0.00 33.50 31.95 2qtv n PRO 253 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qtv n ALA 254 N -2.28 0.69 -1.13 0.55 0.00 -1.26 -1.90 120.51 115.18 2qtv n ALA 254 Ca 0.12 0.15 -0.05 0.00 0.00 0.00 0.00 53.44 53.66 2qtv n ALA 254 Cb 0.49 -2.18 -0.02 0.00 0.00 0.00 0.00 19.45 17.74 2qtv n ALA 254 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qtv n GLY 255 N 1.05 0.72 3.28 0.00 0.00 -1.26 -5.00 105.19 103.97 2qtv n GLY 255 Ca 0.10 -0.45 -0.15 0.00 0.00 0.00 0.00 46.02 45.51 2qtv n GLY 255 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qtv s HIS 256 N -2.04 1.40 0.40 1.61 4.02 -0.80 -1.06 115.29 118.82 2qtv s HIS 256 Ca 0.00 -0.74 0.08 0.00 1.02 0.00 0.00 55.06 55.42 2qtv s HIS 256 Cb 0.00 -0.71 -0.01 0.00 -1.02 0.00 0.00 32.58 30.84 2qtv s HIS 256 CO 0.00 0.13 0.47 1.03 1.02 0.00 0.00 174.74 177.39 2qtv s ARG 257 N -3.74 2.76 0.83 1.40 0.52 0.51 -4.85 118.95 116.38 2qtv s ARG 257 Ca 0.19 -1.31 -0.11 0.00 -0.52 0.00 0.00 55.73 53.98 2qtv s ARG 257 Cb 0.02 -2.62 0.09 0.00 0.52 0.00 0.00 34.95 32.97 2qtv s ARG 257 CO 0.03 -0.17 1.09 -2.14 0.02 0.00 0.00 175.30 174.13 2qtv s PRO 258 N -4.22 1.80 -0.49 3.54 0.02 -1.26 -4.85 135.00 129.54 2qtv s PRO 258 Ca 0.50 0.90 -0.19 0.00 0.02 0.00 0.00 61.00 62.23 2qtv s PRO 258 Cb -0.07 -1.87 0.05 0.00 0.02 0.00 0.00 34.50 32.63 2qtv s PRO 258 CO 0.30 -1.88 0.61 -0.51 -0.33 0.00 0.00 177.00 175.19 2qtv s LEU 259 N -6.01 4.92 -0.33 -5.54 1.43 -1.26 -4.72 118.68 107.16 2qtv s LEU 259 Ca 0.62 -0.83 -0.04 0.00 -1.03 0.00 0.00 54.13 52.85 2qtv s LEU 259 Cb -0.17 -2.47 0.05 0.00 0.03 0.00 0.00 46.19 43.64 2qtv s LEU 259 CO 0.56 -0.85 0.06 -0.60 0.23 0.00 0.00 176.35 175.76 2qtv s ARG 260 N 2.59 2.44 -1.08 1.70 3.52 -1.26 -2.63 118.95 124.23 2qtv s ARG 260 Ca 0.15 -1.31 -0.05 0.00 -0.13 0.00 0.00 55.73 54.39 2qtv s ARG 260 Cb -0.18 -3.33 0.08 0.00 -1.56 0.00 0.00 34.95 29.95 2qtv s ARG 260 CO 0.13 -0.70 2.57 0.00 -0.81 0.00 0.00 175.30 176.49 2qtv n ALA 261 N 4.69 6.76 -0.16 6.12 0.00 0.34 -1.65 120.51 136.60 2qtv n ALA 261 Ca -0.11 -3.71 -0.05 0.00 0.00 0.00 0.00 53.44 49.57 2qtv n ALA 261 Cb 0.43 -2.64 0.04 0.00 0.00 0.00 0.00 19.45 17.29 2qtv n ALA 261 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2qtv h THR 262 N 2.45 1.01 -0.04 0.00 2.02 -1.85 -1.35 112.91 115.15 2qtv h THR 262 Ca 0.62 -0.18 0.03 0.00 0.77 0.00 0.00 66.41 67.65 2qtv h THR 262 Cb 0.45 0.42 -0.04 0.00 -1.74 0.00 0.00 68.15 67.24 2qtv h THR 262 CO 1.30 0.10 -0.17 1.23 0.37 0.00 0.00 175.52 178.35 2qtv h GLY 263 N 0.54 -0.19 0.81 2.16 0.00 -1.79 -0.78 103.07 103.82 2qtv h GLY 263 Ca 0.21 0.20 0.03 0.00 0.00 0.00 0.00 47.33 47.76 2qtv h GLY 263 CO -0.12 -0.16 0.19 0.23 0.00 0.00 0.00 176.54 176.69 2qtv h SER 264 N -0.25 0.29 -0.15 0.19 0.87 -1.66 -0.48 113.55 112.36 2qtv h SER 264 Ca 0.07 0.02 0.04 0.00 -1.23 0.00 0.00 61.79 60.69 2qtv h SER 264 Cb 0.35 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 62.23 2qtv h SER 264 CO -0.19 0.21 -0.11 0.00 -0.53 0.00 0.00 176.83 176.21 2qtv h ALA 265 N 1.20 0.00 -0.78 6.23 0.00 -0.84 -0.04 119.26 125.03 2qtv h ALA 265 Ca 0.16 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 2qtv h ALA 265 Cb 0.07 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 2qtv h ALA 265 CO -0.11 -0.56 0.35 -0.07 0.00 0.00 0.00 179.25 178.86 2qtv h LEU 266 N -0.12 1.04 -0.07 0.00 3.38 -0.86 0.80 115.31 119.48 2qtv h LEU 266 Ca 0.09 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2qtv h LEU 266 Cb 0.26 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 2qtv h LEU 266 CO -0.23 0.89 0.04 -1.13 0.09 0.00 0.00 178.44 178.11 2qtv h ASN 267 N 1.12 0.07 0.07 -0.43 -1.24 -0.52 0.22 115.58 114.86 2qtv h ASN 267 Ca 0.27 -0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.27 2qtv h ASN 267 Cb 0.15 -0.01 0.00 0.00 0.73 0.00 0.00 38.32 39.19 2qtv h ASN 267 CO -0.03 0.05 -0.03 0.40 -1.29 0.00 0.00 177.43 176.53 2qtv h ILE 268 N 0.08 1.06 -0.27 2.57 1.08 -0.68 0.30 117.51 121.65 2qtv h ILE 268 Ca 0.03 -0.41 0.06 0.00 -0.39 0.00 0.00 64.86 64.15 2qtv h ILE 268 Cb -0.01 1.33 -0.06 0.00 -3.07 0.00 0.00 36.82 35.01 2qtv h ILE 268 CO -0.01 0.10 -0.14 0.00 -0.69 0.00 0.00 178.15 177.42 2qtv h ALA 269 N 0.65 0.08 -0.35 1.87 0.00 -0.73 0.65 119.26 121.43 2qtv h ALA 269 Ca -0.01 0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 2qtv h ALA 269 Cb 0.24 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2qtv h ALA 269 CO 0.01 -0.54 -0.25 0.66 0.00 0.00 0.00 179.25 179.14 2qtv h SER 270 N -0.10 0.72 -0.16 0.00 4.64 -0.41 -2.54 113.55 115.69 2qtv h SER 270 Ca 0.14 -0.26 -0.10 0.00 -0.47 0.00 0.00 61.79 61.10 2qtv h SER 270 Cb 0.32 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.20 2qtv h SER 270 CO -0.34 0.94 -0.24 -0.07 -0.87 0.00 0.00 176.83 176.26 2qtv h LEU 271 N 0.61 0.62 0.10 5.97 3.38 0.15 -2.55 115.31 123.59 2qtv h LEU 271 Ca 0.08 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 2qtv h LEU 271 Cb 0.74 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2qtv h LEU 271 CO 0.06 0.85 -0.05 0.25 0.09 0.00 0.00 178.44 179.64 2qtv h LEU 272 N 0.54 -0.11 -1.26 1.67 5.85 -0.71 -1.68 115.31 119.61 2qtv h LEU 272 Ca 0.08 -0.25 0.08 0.00 0.84 0.00 0.00 57.88 58.63 2qtv h LEU 272 Cb 0.70 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.70 2qtv h LEU 272 CO 0.05 0.19 0.54 -0.07 -0.34 0.00 0.00 178.44 178.82 2qtv h LEU 273 N -0.42 0.76 -1.23 2.25 3.38 -1.46 0.23 115.31 118.83 2qtv h LEU 273 Ca -0.01 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 2qtv h LEU 273 Cb 0.35 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2qtv h LEU 273 CO 0.02 0.47 -0.37 -0.61 0.09 0.00 0.00 178.44 178.05 2qtv h GLN 274 N 0.86 0.00 0.00 1.13 4.15 -1.26 0.27 115.11 120.26 2qtv h GLN 274 Ca 0.37 0.00 -0.09 0.00 0.77 0.00 0.00 58.65 59.70 2qtv h GLN 274 Cb 0.32 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.99 2qtv h GLN 274 CO -0.14 0.37 -0.43 0.78 -1.93 0.00 0.00 178.83 177.48 2qtv h GLY 275 N 1.33 0.00 0.00 2.39 0.00 0.01 -3.35 103.07 103.45 2qtv h GLY 275 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2qtv h GLY 275 CO 0.05 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.59 2qtv n TYR 277 N -0.38 0.89 -2.06 0.00 4.02 0.94 -4.94 117.16 115.63 2qtv n TYR 277 Ca 0.00 -2.53 -0.42 0.00 -0.01 0.00 0.00 57.90 54.94 2qtv n TYR 277 Cb 0.03 -0.17 -0.03 0.00 -0.02 0.00 0.00 39.34 39.15 2qtv n TYR 277 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 176.86 176.06 2qtv s LYS 278 N -3.04 4.22 -0.52 -0.72 2.20 -1.21 -2.42 119.74 118.24 2qtv s LYS 278 Ca 0.26 2.15 -0.01 0.00 -0.36 0.00 0.00 55.97 58.02 2qtv s LYS 278 Cb 0.42 -3.71 0.00 0.00 -1.51 0.00 0.00 37.83 33.03 2qtv s LYS 278 CO 0.01 -0.72 0.11 0.09 -0.36 0.00 0.00 175.35 174.48 2qtv n ASN 279 N 6.01 -2.80 -3.80 1.43 3.02 -0.76 -5.03 115.26 113.33 2qtv n ASN 279 Ca 0.15 -0.05 -0.24 0.00 -0.03 0.00 0.00 54.58 54.41 2qtv n ASN 279 Cb 0.42 -1.91 -0.17 0.00 -0.61 0.00 0.00 39.78 37.51 2qtv n ASN 279 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2qtv s ILE 280 N -2.55 0.52 0.08 2.41 -1.09 -1.02 -5.01 121.20 114.54 2qtv s ILE 280 Ca 0.05 0.00 -0.37 0.00 -2.23 0.00 0.00 60.65 58.10 2qtv s ILE 280 Cb -0.02 -0.67 -0.17 0.00 -1.58 0.00 0.00 42.46 40.02 2qtv s ILE 280 CO 0.07 0.26 1.29 -0.81 -1.23 0.00 0.00 174.94 174.52 2qtv n PRO 281 N 5.10 0.96 -3.87 2.79 -0.04 -1.26 -4.78 135.00 133.91 2qtv n PRO 281 Ca -0.08 0.35 -0.10 0.00 -0.04 0.00 0.00 63.50 63.62 2qtv n PRO 281 Cb 0.50 -1.96 -0.09 0.00 -0.04 0.00 0.00 33.50 31.91 2qtv n PRO 281 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qtv s ALA 282 N 0.38 -0.28 -0.22 0.55 0.00 -1.26 -3.61 121.76 117.33 2qtv s ALA 282 Ca 0.85 -0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.48 2qtv s ALA 282 Cb -1.00 0.25 0.06 0.00 0.00 0.00 0.00 23.12 22.43 2qtv s ALA 282 CO 0.49 -0.33 -0.05 0.50 0.00 0.00 0.00 175.76 176.36 2qtv s ARG 283 N -2.46 1.57 -0.30 0.00 3.52 0.16 -0.92 118.95 120.52 2qtv s ARG 283 Ca -0.06 -0.86 -0.21 0.00 -0.13 0.00 0.00 55.73 54.47 2qtv s ARG 283 Cb -0.02 -2.45 -0.01 0.00 -1.56 0.00 0.00 34.95 30.91 2qtv s ARG 283 CO -0.03 -0.56 0.65 0.42 -0.81 0.00 0.00 175.30 174.97 2qtv s ILE 284 N 1.47 4.92 -0.30 4.11 1.01 0.12 -0.07 121.20 132.46 2qtv s ILE 284 Ca -0.04 0.94 -0.06 0.00 0.00 0.00 0.00 60.65 61.50 2qtv s ILE 284 Cb -0.18 -4.01 0.02 0.00 0.01 0.00 0.00 42.46 38.30 2qtv s ILE 284 CO -0.07 -0.14 0.06 -0.63 0.00 0.00 0.00 174.94 174.17 2qtv s ILE 285 N 2.65 3.67 -0.21 2.92 1.01 -0.12 0.26 121.20 131.37 2qtv s ILE 285 Ca 0.26 -0.94 -0.12 0.00 0.00 0.00 0.00 60.65 59.86 2qtv s ILE 285 Cb -0.15 -2.97 -0.05 0.00 0.01 0.00 0.00 42.46 39.31 2qtv s ILE 285 CO 0.11 -0.00 0.22 -0.22 0.00 0.00 0.00 174.94 175.05 2qtv s LEU 286 N 1.42 4.16 -0.33 2.97 2.96 0.17 -0.63 118.68 129.40 2qtv s LEU 286 Ca 0.00 0.26 -0.00 0.00 -0.22 0.00 0.00 54.13 54.18 2qtv s LEU 286 Cb -0.18 -2.22 0.08 0.00 0.50 0.00 0.00 46.19 44.37 2qtv s LEU 286 CO 0.01 0.06 0.05 -0.36 -1.32 0.00 0.00 176.35 174.80 2qtv s PHE 287 N 0.91 3.47 -0.13 5.38 0.40 -0.69 0.13 117.98 127.46 2qtv s PHE 287 Ca 0.11 -2.35 0.00 0.00 -0.60 0.00 0.00 56.93 54.09 2qtv s PHE 287 Cb -0.13 -2.59 -0.01 0.00 0.51 0.00 0.00 43.02 40.79 2qtv s PHE 287 CO 0.04 -0.90 -0.14 0.00 0.70 0.00 0.00 175.22 174.93 2qtv s ALA 288 N 1.12 2.60 -2.48 5.36 0.00 -0.63 -2.07 121.76 125.65 2qtv s ALA 288 Ca 0.02 -0.89 0.25 0.00 0.00 0.00 0.00 51.96 51.33 2qtv s ALA 288 Cb -0.20 -1.19 0.78 0.00 0.00 0.00 0.00 23.12 22.51 2qtv s ALA 288 CO -0.04 0.25 1.59 0.43 0.00 0.00 0.00 175.76 177.99 2qtv n SER 289 N 3.53 1.92 -1.73 0.00 7.64 -1.26 -1.59 113.62 122.11 2qtv n SER 289 Ca -0.18 -1.68 0.01 0.00 1.01 0.00 0.00 58.87 58.03 2qtv n SER 289 Cb 0.53 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.67 2qtv n SER 289 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qtv n GLY 290 N 1.21 0.49 3.85 0.23 0.00 -1.26 -4.52 105.19 105.19 2qtv n GLY 290 Ca 0.17 -0.88 -0.32 0.00 0.00 0.00 0.00 46.02 45.00 2qtv n GLY 290 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qtv s PRO 291 N -2.00 3.84 0.05 1.61 0.04 -1.25 -4.70 135.00 132.59 2qtv s PRO 291 Ca 0.08 0.85 -0.31 0.00 0.04 0.00 0.00 61.00 61.66 2qtv s PRO 291 Cb -0.00 -2.15 -0.06 0.00 0.04 0.00 0.00 34.50 32.33 2qtv s PRO 291 CO -0.00 -0.32 1.26 0.20 0.04 0.00 0.00 177.00 178.18 2qtv s GLY 292 N -3.37 2.23 -0.10 0.56 0.00 -1.25 -4.66 107.32 100.72 2qtv s GLY 292 Ca 0.57 0.89 0.15 0.00 0.00 0.00 0.00 44.72 46.33 2qtv s GLY 292 CO 0.37 2.17 1.12 -1.30 0.00 0.00 0.00 173.10 175.46 2qtv n THR 293 N 4.08 1.67 -3.69 0.90 -2.24 -0.66 -1.24 114.28 113.10 2qtv n THR 293 Ca 0.10 -1.97 -0.17 0.00 -2.27 0.00 0.00 64.05 59.74 2qtv n THR 293 Cb 0.45 -0.08 -0.16 0.00 -2.10 0.00 0.00 70.33 68.44 2qtv n THR 293 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2qtv s VAL 294 N -2.45 -0.15 0.49 2.28 1.01 -1.22 -4.32 120.40 116.03 2qtv s VAL 294 Ca 0.25 0.34 -0.22 0.00 0.00 0.00 0.00 61.98 62.35 2qtv s VAL 294 Cb 0.22 -0.20 -0.07 0.00 0.00 0.00 0.00 36.38 36.33 2qtv s VAL 294 CO 0.02 0.14 1.20 0.00 0.00 0.00 0.00 175.10 176.46 2qtv s ALA 295 N 1.93 2.91 0.80 5.51 0.00 -1.26 -4.20 121.76 127.44 2qtv s ALA 295 Ca 0.01 0.99 -0.14 0.00 0.00 0.00 0.00 51.96 52.82 2qtv s ALA 295 Cb -0.12 -3.41 0.06 0.00 0.00 0.00 0.00 23.12 19.65 2qtv s ALA 295 CO -0.04 -0.80 1.08 -2.30 0.00 0.00 0.00 175.76 173.69 2qtv n PRO 296 N -0.69 0.21 -3.70 0.00 -0.02 -1.26 -4.05 135.00 125.49 2qtv n PRO 296 Ca 0.08 0.14 -0.23 0.00 -2.02 0.00 0.00 63.50 61.48 2qtv n PRO 296 Cb 0.48 -2.34 0.04 0.00 -0.02 0.00 0.00 33.50 31.66 2qtv n PRO 296 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qtv n GLY 297 N 0.75 -0.35 3.68 -1.23 0.00 -1.26 -3.85 105.19 102.92 2qtv n GLY 297 Ca 0.13 0.14 -0.43 0.00 0.00 0.00 0.00 46.02 45.87 2qtv n GLY 297 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qtv s LEU 298 N -6.79 4.21 -0.02 0.99 0.20 -1.26 -4.50 118.68 111.52 2qtv s LEU 298 Ca 0.17 1.51 0.07 0.00 0.69 0.00 0.00 54.13 56.56 2qtv s LEU 298 Cb -0.08 -3.55 -0.24 0.00 -0.43 0.00 0.00 46.19 41.89 2qtv s LEU 298 CO 0.80 -0.51 0.76 0.40 -0.29 0.00 0.00 176.35 177.51 2qtv h ILE 299 N 5.18 1.02 -1.63 6.68 1.08 -1.52 -3.41 117.51 124.90 2qtv h ILE 299 Ca -0.28 -2.79 0.06 0.00 -0.39 0.00 0.00 64.86 61.45 2qtv h ILE 299 Cb 1.13 2.56 -0.23 0.00 -3.07 0.00 0.00 36.82 37.20 2qtv h ILE 299 CO 0.89 0.67 0.47 0.54 -0.69 0.00 0.00 178.15 180.03 2qtv s VAL 300 N -2.62 0.00 0.94 1.67 0.11 -1.12 -4.78 120.40 114.60 2qtv s VAL 300 Ca -0.07 0.00 -0.11 0.00 -2.93 0.00 0.00 61.98 58.87 2qtv s VAL 300 Cb 0.08 -1.00 0.15 0.00 -1.53 0.00 0.00 36.38 34.08 2qtv s VAL 300 CO 0.82 0.00 1.09 0.20 -3.33 0.00 0.00 175.10 173.88 2qtv s ASN 301 N -0.68 3.04 0.21 3.54 0.01 -1.26 -4.16 114.94 115.64 2qtv s ASN 301 Ca -0.01 1.61 -0.06 0.00 -0.71 0.00 0.00 52.86 53.69 2qtv s ASN 301 Cb -0.02 -2.26 0.16 0.00 0.41 0.00 0.00 41.25 39.54 2qtv s ASN 301 CO 0.00 -2.93 1.67 0.77 -1.51 0.00 0.00 177.10 175.10 2qtv h SER 302 N -1.75 0.93 -2.02 -1.22 4.64 -1.89 -3.43 113.55 108.81 2qtv h SER 302 Ca -0.50 -0.27 -0.62 0.00 -0.47 0.00 0.00 61.79 59.93 2qtv h SER 302 Cb 1.29 -0.25 0.02 0.00 -0.31 0.00 0.00 62.40 63.15 2qtv h SER 302 CO 0.52 1.01 1.05 -1.84 -0.87 0.00 0.00 176.83 176.70 2qtv n GLU 303 N -4.17 2.10 0.27 4.77 0.28 -1.26 -0.36 120.64 122.26 2qtv n GLU 303 Ca 0.02 0.77 0.11 0.00 -0.16 0.00 0.00 57.16 57.90 2qtv n GLU 303 Cb 0.36 -2.59 0.73 0.00 1.43 0.00 0.00 31.44 31.36 2qtv n GLU 303 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 2qtv h LEU 304 N 8.65 0.00 -2.77 -1.84 3.38 -1.37 -1.09 115.31 120.27 2qtv h LEU 304 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2qtv h LEU 304 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 2qtv h LEU 304 CO 0.94 0.05 0.04 0.07 0.09 0.00 0.00 178.44 179.63 2qtv h LYS 305 N 0.00 0.00 -6.08 1.13 2.10 -1.89 -3.35 116.57 108.48 2qtv h LYS 305 Ca -0.00 0.00 -0.59 0.00 -2.00 0.00 0.00 60.65 58.06 2qtv h LYS 305 Cb 0.10 0.00 -0.11 0.00 -0.90 0.00 0.00 32.23 31.32 2qtv h LYS 305 CO 0.01 0.00 0.67 0.34 -2.00 0.00 0.00 179.45 178.47 2qtv s ASP 306 N -4.99 6.39 0.61 7.07 3.68 -0.41 -5.02 116.67 124.00 2qtv s ASP 306 Ca -0.05 -0.18 -0.14 0.00 2.13 0.00 0.00 52.55 54.32 2qtv s ASP 306 Cb 0.12 -2.47 -0.03 0.00 -1.45 0.00 0.00 42.92 39.09 2qtv s ASP 306 CO 0.38 -1.27 1.04 -2.16 0.13 0.00 0.00 175.17 173.30 2qtv s PRO 307 N 4.17 3.33 0.01 4.34 0.04 -1.26 -4.78 135.00 140.86 2qtv s PRO 307 Ca 0.34 1.07 -0.30 0.00 0.04 0.00 0.00 61.00 62.15 2qtv s PRO 307 Cb -0.11 -2.04 -0.04 0.00 0.04 0.00 0.00 34.50 32.35 2qtv s PRO 307 CO 0.22 -0.79 1.14 -0.51 0.04 0.00 0.00 177.00 177.10 2qtv s LEU 308 N -4.76 4.34 0.33 -3.56 1.43 -1.26 -4.97 118.68 110.24 2qtv s LEU 308 Ca 0.61 1.85 -0.28 0.00 -1.03 0.00 0.00 54.13 55.28 2qtv s LEU 308 Cb -0.14 -3.57 -0.13 0.00 0.03 0.00 0.00 46.19 42.38 2qtv s LEU 308 CO 0.42 -0.45 1.18 -2.11 0.23 0.00 0.00 176.35 175.62 2qtv n ARG 309 N 4.32 1.81 -4.21 1.70 0.00 -1.26 -5.00 116.66 114.02 2qtv n ARG 309 Ca 0.09 0.64 -0.26 0.00 -0.00 0.00 0.00 57.85 58.31 2qtv n ARG 309 Cb 0.48 -2.15 -0.07 0.00 -0.00 0.00 0.00 32.46 30.72 2qtv n ARG 309 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 2qtv s SER 310 N -0.43 4.37 0.24 2.89 1.04 -1.26 -4.78 113.70 115.78 2qtv s SER 310 Ca 0.57 -1.19 -0.04 0.00 0.48 0.00 0.00 55.95 55.77 2qtv s SER 310 Cb -0.61 -0.25 0.44 0.00 0.10 0.00 0.00 66.02 65.71 2qtv s SER 310 CO 0.61 -0.64 1.75 0.45 0.98 0.00 0.00 173.24 176.39 2qtv h HIS 311 N 1.36 0.61 -0.94 5.02 3.86 -1.95 0.33 115.15 123.44 2qtv h HIS 311 Ca -0.42 0.03 0.03 0.00 -1.16 0.00 0.00 60.37 58.85 2qtv h HIS 311 Cb 1.26 -0.15 -0.05 0.00 1.06 0.00 0.00 27.41 29.53 2qtv h HIS 311 CO 0.78 0.14 0.62 1.25 0.86 0.00 0.00 177.93 181.57 2qtv h HIS 312 N 0.53 1.16 -0.43 2.45 -0.00 -1.96 -0.77 115.15 116.13 2qtv h HIS 312 Ca 0.41 0.03 -0.10 0.00 -0.00 0.00 0.00 60.37 60.71 2qtv h HIS 312 Cb 0.56 -0.39 -0.02 0.00 -0.00 0.00 0.00 27.41 27.57 2qtv h HIS 312 CO -0.13 0.69 -0.12 -0.44 -0.00 0.00 0.00 177.93 177.92 2qtv h ASP 313 N 1.21 0.77 -0.05 3.26 3.32 -1.35 -1.63 116.42 121.96 2qtv h ASP 313 Ca 0.37 -0.24 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 2qtv h ASP 313 Cb -0.04 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.30 2qtv h ASP 313 CO -0.11 0.92 -0.04 0.40 -1.72 0.00 0.00 179.24 178.69 2qtv h ILE 314 N 0.70 1.36 -0.58 0.35 2.04 -0.64 1.00 117.51 121.74 2qtv h ILE 314 Ca 0.12 -1.13 -0.06 0.00 1.00 0.00 0.00 64.86 64.78 2qtv h ILE 314 Cb 0.61 2.01 -0.03 0.00 -0.74 0.00 0.00 36.82 38.67 2qtv h ILE 314 CO 0.04 0.31 0.10 0.44 0.00 0.00 0.00 178.15 179.04 2qtv h ASP 315 N -0.31 0.88 0.31 1.72 3.32 -1.13 -1.97 116.42 119.25 2qtv h ASP 315 Ca 0.01 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 56.87 2qtv h ASP 315 Cb 0.52 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.84 2qtv h ASP 315 CO 0.01 0.88 -0.06 -1.54 -1.72 0.00 0.00 179.24 176.81 2qtv n SER 316 N -4.24 0.38 -2.88 6.45 3.41 -0.62 -4.91 113.62 111.21 2qtv n SER 316 Ca 0.04 -0.63 -0.17 0.00 -0.26 0.00 0.00 58.87 57.84 2qtv n SER 316 Cb 0.26 -0.09 0.06 0.00 -0.26 0.00 0.00 64.21 64.18 2qtv n SER 316 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2qtv n ASP 317 N -0.94 -4.73 -0.79 4.04 -0.08 -0.74 -4.91 116.55 108.39 2qtv n ASP 317 Ca 0.16 -0.43 0.07 0.00 -1.51 0.00 0.00 54.79 53.08 2qtv n ASP 317 Cb 0.25 -4.01 0.19 0.00 2.34 0.00 0.00 41.12 39.89 2qtv n ASP 317 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 2qtv n HIS 318 N -4.24 0.56 -2.79 -0.67 8.25 0.34 -4.90 115.22 111.78 2qtv n HIS 318 Ca -0.04 -0.49 -0.43 0.00 -0.26 0.00 0.00 57.72 56.51 2qtv n HIS 318 Cb 0.56 -0.02 -0.04 0.00 1.12 0.00 0.00 29.99 31.61 2qtv n HIS 318 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qtv s ALA 319 N -1.00 3.15 -0.40 -1.41 0.00 -0.85 -4.92 121.76 116.32 2qtv s ALA 319 Ca 0.28 -1.07 0.26 0.00 0.00 0.00 0.00 51.96 51.43 2qtv s ALA 319 Cb 0.15 -3.77 1.01 0.00 0.00 0.00 0.00 23.12 20.51 2qtv s ALA 319 CO 0.19 -2.37 1.77 1.96 0.00 0.00 0.00 175.76 177.31 2qtv h GLN 320 N 9.31 0.00 0.00 0.00 4.20 -1.92 -3.28 115.11 123.41 2qtv h GLN 320 Ca -0.25 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.46 2qtv h GLN 320 Cb 1.07 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.85 2qtv h GLN 320 CO 1.09 0.00 -0.37 0.72 -0.67 0.00 0.00 178.83 179.60 2qtv n HIS 321 N -2.43 0.00 -0.10 2.96 8.25 -1.26 -4.85 115.22 117.79 2qtv n HIS 321 Ca 0.02 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.39 2qtv n HIS 321 Cb 0.28 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.35 2qtv n HIS 321 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 2qtv h TYR 322 N 0.00 -1.14 -0.29 4.41 3.20 -1.87 0.08 116.97 121.37 2qtv h TYR 322 Ca 0.00 0.06 -0.01 0.00 3.14 0.00 0.00 58.73 61.92 2qtv h TYR 322 Cb 0.00 0.55 -0.01 0.00 1.54 0.00 0.00 36.73 38.81 2qtv h TYR 322 CO 0.00 -0.43 0.14 0.87 -1.64 0.00 0.00 178.16 177.10 2qtv h LYS 323 N -0.34 0.42 -0.40 1.82 1.57 -1.89 0.14 116.57 117.90 2qtv h LYS 323 Ca 0.14 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 2qtv h LYS 323 Cb 0.58 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 2qtv h LYS 323 CO -0.53 0.40 0.22 -0.22 -0.57 0.00 0.00 179.45 178.75 2qtv h LYS 324 N 0.34 0.56 -0.50 3.15 3.64 -1.86 -0.72 116.57 121.18 2qtv h LYS 324 Ca 0.10 -0.07 -0.08 0.00 -1.27 0.00 0.00 60.65 59.33 2qtv h LYS 324 Cb 0.12 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 2qtv h LYS 324 CO -0.01 0.46 0.01 0.00 -2.27 0.00 0.00 179.45 177.63 2qtv h ALA 325 N 1.07 0.67 -0.70 5.00 0.00 -0.85 -1.85 119.26 122.60 2qtv h ALA 325 Ca 0.14 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 2qtv h ALA 325 Cb 0.06 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 2qtv h ALA 325 CO -0.02 0.48 0.26 0.00 0.00 0.00 0.00 179.25 179.97 2qtv h LYS 327 N 1.01 0.33 0.33 0.00 1.79 -0.96 -1.09 116.57 117.97 2qtv h LYS 327 Ca 0.23 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.67 2qtv h LYS 327 Cb 0.24 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 2qtv h LYS 327 CO -0.02 0.23 -0.21 0.35 -1.08 0.00 0.00 179.45 178.73 2qtv h PHE 328 N 0.32 -0.54 -0.04 -1.35 3.57 -1.01 -2.32 116.94 115.57 2qtv h PHE 328 Ca 0.09 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.55 2qtv h PHE 328 Cb -0.02 0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 2qtv h PHE 328 CO -0.06 -0.32 -0.15 1.88 -2.23 0.00 0.00 178.31 177.43 2qtv h TYR 329 N -0.52 0.06 0.00 0.41 -1.99 -1.22 -2.06 116.97 111.66 2qtv h TYR 329 Ca -0.03 -0.01 -0.07 0.00 2.00 0.00 0.00 58.73 60.62 2qtv h TYR 329 Cb 0.43 -0.02 -0.01 0.00 2.00 0.00 0.00 36.73 39.13 2qtv h TYR 329 CO -0.09 0.21 -0.35 -0.91 -0.00 0.00 0.00 178.16 177.02 2qtv h ASN 330 N 0.06 0.00 0.06 3.88 2.35 -0.87 0.40 115.58 121.45 2qtv h ASN 330 Ca 0.01 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2qtv h ASN 330 Cb 0.31 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.68 2qtv h ASN 330 CO 0.02 0.35 -0.03 1.56 -1.65 0.00 0.00 177.43 177.68 2qtv h GLN 331 N 0.00 -0.08 -0.51 0.81 4.20 -0.84 0.50 115.11 119.20 2qtv h GLN 331 Ca -0.00 0.01 0.05 0.00 0.06 0.00 0.00 58.65 58.76 2qtv h GLN 331 Cb 0.67 0.02 -0.05 0.00 0.30 0.00 0.00 27.48 28.42 2qtv h GLN 331 CO 0.05 0.35 0.24 0.82 -0.67 0.00 0.00 178.83 179.62 2qtv h ILE 332 N -0.53 0.92 -0.33 2.54 1.08 -1.26 0.97 117.51 120.91 2qtv h ILE 332 Ca -0.01 -0.16 0.04 0.00 -0.39 0.00 0.00 64.86 64.34 2qtv h ILE 332 Cb 0.46 0.42 -0.04 0.00 -3.07 0.00 0.00 36.82 34.59 2qtv h ILE 332 CO 0.01 0.08 0.11 0.00 -0.69 0.00 0.00 178.15 177.67 2qtv h ALA 333 N 1.29 0.38 -0.55 1.87 0.00 -0.09 -0.87 119.26 121.30 2qtv h ALA 333 Ca 0.23 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 2qtv h ALA 333 Cb 0.17 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2qtv h ALA 333 CO -0.18 -0.29 0.33 1.96 0.00 0.00 0.00 179.25 181.07 2qtv h GLN 334 N 0.25 0.74 0.46 0.00 4.20 -0.25 -1.45 115.11 119.06 2qtv h GLN 334 Ca 0.15 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 2qtv h GLN 334 Cb 0.13 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 2qtv h GLN 334 CO -0.16 0.54 -0.47 -0.09 -0.67 0.00 0.00 178.83 177.98 2qtv h ARG 335 N 0.73 -0.90 -0.98 1.46 2.43 -0.10 -0.17 114.38 116.86 2qtv h ARG 335 Ca 0.20 0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.44 2qtv h ARG 335 Cb -0.01 0.20 -0.05 0.00 -0.42 0.00 0.00 29.97 29.69 2qtv h ARG 335 CO -0.04 -0.60 0.65 -0.39 -1.51 0.00 0.00 179.97 178.08 2qtv h VAL 336 N -0.93 1.24 -0.99 0.20 -1.51 -1.15 -0.79 116.25 112.32 2qtv h VAL 336 Ca -0.06 -0.45 0.02 0.00 -1.23 0.00 0.00 66.70 64.98 2qtv h VAL 336 Cb 0.81 -0.19 -0.05 0.00 -2.13 0.00 0.00 31.29 29.73 2qtv h VAL 336 CO -0.06 0.24 0.66 0.00 -1.23 0.00 0.00 177.57 177.17 2qtv h ALA 337 N 1.36 1.32 -0.04 5.19 0.00 -1.05 0.25 119.26 126.29 2qtv h ALA 337 Ca 0.36 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.11 2qtv h ALA 337 Cb -0.14 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.26 2qtv h ALA 337 CO -0.08 0.60 -0.46 0.00 0.00 0.00 0.00 179.25 179.32 2qtv h ALA 338 N 1.40 1.16 -0.03 0.00 0.00 -0.08 -2.69 119.26 119.02 2qtv h ALA 338 Ca 0.38 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2qtv h ALA 338 Cb -0.08 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2qtv h ALA 338 CO -0.10 0.60 0.00 0.09 0.00 0.00 0.00 179.25 179.84 2qtv n ASN 339 N -3.99 1.69 -1.10 0.00 5.03 -0.39 -4.84 115.26 111.66 2qtv n ASN 339 Ca -0.02 -1.57 -0.10 0.00 0.87 0.00 0.00 54.58 53.76 2qtv n ASN 339 Cb 0.49 -0.01 -0.01 0.00 -1.02 0.00 0.00 39.78 39.24 2qtv n ASN 339 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2qtv n GLY 340 N 1.19 0.13 3.70 7.41 0.00 0.35 -1.82 105.19 116.14 2qtv n GLY 340 Ca 0.18 -0.48 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 2qtv n GLY 340 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qtv s HIS 341 N -2.49 3.15 0.07 1.61 3.76 0.60 -4.12 115.29 117.87 2qtv s HIS 341 Ca 0.00 0.16 -0.01 0.00 -0.15 0.00 0.00 55.06 55.06 2qtv s HIS 341 Cb 0.00 -1.74 -0.04 0.00 1.11 0.00 0.00 32.58 31.90 2qtv s HIS 341 CO 0.00 0.48 0.24 0.99 -0.85 0.00 0.00 174.74 175.60 2qtv s THR 342 N -0.99 5.35 -0.11 1.30 2.01 -0.10 -4.13 115.64 118.98 2qtv s THR 342 Ca 0.16 -0.30 -0.01 0.00 0.31 0.00 0.00 61.69 61.85 2qtv s THR 342 Cb -0.11 -3.63 0.03 0.00 0.01 0.00 0.00 72.50 68.80 2qtv s THR 342 CO 0.06 0.13 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.40 2qtv s VAL 343 N -1.53 0.74 -0.08 3.82 1.01 -1.26 0.16 120.40 123.27 2qtv s VAL 343 Ca 0.36 -0.21 -0.02 0.00 0.00 0.00 0.00 61.98 62.11 2qtv s VAL 343 Cb -0.13 -0.89 -0.03 0.00 0.00 0.00 0.00 36.38 35.33 2qtv s VAL 343 CO 0.27 0.23 0.02 -1.81 0.00 0.00 0.00 175.10 173.81 2qtv s ASP 344 N 1.81 5.35 -0.21 3.32 1.01 0.14 -4.10 116.67 123.99 2qtv s ASP 344 Ca 0.04 0.16 0.01 0.00 0.71 0.00 0.00 52.55 53.47 2qtv s ASP 344 Cb -0.13 -1.52 0.04 0.00 1.01 0.00 0.00 42.92 42.32 2qtv s ASP 344 CO -0.07 0.37 -0.12 -0.63 0.21 0.00 0.00 175.17 174.93 2qtv s ILE 345 N -0.93 1.86 -0.25 0.77 1.01 0.31 -0.65 121.20 123.31 2qtv s ILE 345 Ca 0.14 -1.18 -0.04 0.00 0.00 0.00 0.00 60.65 59.58 2qtv s ILE 345 Cb -0.11 -1.90 0.01 0.00 0.01 0.00 0.00 42.46 40.46 2qtv s ILE 345 CO 0.04 0.17 -0.01 -0.36 0.00 0.00 0.00 174.94 174.78 2qtv s PHE 346 N 1.30 3.06 -0.17 3.97 0.40 0.12 -1.27 117.98 125.38 2qtv s PHE 346 Ca -0.02 -1.14 -0.08 0.00 -0.60 0.00 0.00 56.93 55.09 2qtv s PHE 346 Cb -0.17 -2.14 -0.04 0.00 0.51 0.00 0.00 43.02 41.18 2qtv s PHE 346 CO -0.08 -0.61 0.08 0.00 0.70 0.00 0.00 175.22 175.31 2qtv s ALA 347 N 1.44 3.51 -0.61 5.36 0.00 0.51 -1.60 121.76 130.37 2qtv s ALA 347 Ca 0.03 -0.72 0.06 0.00 0.00 0.00 0.00 51.96 51.33 2qtv s ALA 347 Cb -0.16 -1.95 0.23 0.00 0.00 0.00 0.00 23.12 21.24 2qtv s ALA 347 CO -0.02 0.25 0.66 0.41 0.00 0.00 0.00 175.76 177.06 2qtv n GLY 348 N 3.27 4.32 3.18 0.00 0.00 -0.62 -1.01 105.19 114.32 2qtv n GLY 348 Ca -0.17 -2.53 -0.13 0.00 0.00 0.00 0.00 46.02 43.20 2qtv n GLY 348 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qtv h TYR 350 N 4.98 0.00 -3.83 0.00 -1.99 -1.74 -3.38 116.97 111.02 2qtv h TYR 350 Ca -0.28 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.45 2qtv h TYR 350 Cb 1.19 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.92 2qtv h TYR 350 CO 0.47 0.00 0.00 -3.47 -0.00 0.00 0.00 178.16 175.16 2qtv n ASP 351 N -2.81 1.87 -4.79 3.88 -0.08 -1.26 -5.03 116.55 108.32 2qtv n ASP 351 Ca 0.02 -0.96 -0.34 0.00 -1.51 0.00 0.00 54.79 52.01 2qtv n ASP 351 Cb 0.35 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 43.79 2qtv n ASP 351 CO 0.00 0.00 0.00 -1.10 0.12 0.00 0.00 177.20 176.22 2qtv s GLN 352 N -1.87 3.64 0.00 -0.67 -0.21 -1.26 -4.97 119.66 114.32 2qtv s GLN 352 Ca 0.00 1.38 0.04 0.00 0.02 0.00 0.00 55.36 56.80 2qtv s GLN 352 Cb 0.00 -2.07 -0.05 0.00 1.00 0.00 0.00 33.01 31.90 2qtv s GLN 352 CO 0.00 -0.57 0.19 0.44 -2.12 0.00 0.00 175.29 173.23 2qtv n ILE 353 N -1.20 0.00 0.00 1.08 -5.35 -1.26 -3.91 119.36 108.72 2qtv n ILE 353 Ca 0.10 -0.40 0.00 0.00 -0.27 0.00 0.00 62.75 62.18 2qtv n ILE 353 Cb 0.52 1.00 0.00 0.00 -1.74 0.00 0.00 39.64 39.42 2qtv n ILE 353 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qtv n GLY 354 N 1.09 1.67 0.19 3.28 0.00 -1.26 -3.81 105.19 106.35 2qtv n GLY 354 Ca 0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 2qtv n GLY 354 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2qtv h MET 355 N 0.00 0.00 -0.98 1.61 0.00 -1.95 -1.90 114.93 111.71 2qtv h MET 355 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 59.70 59.78 2qtv h MET 355 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 31.60 31.53 2qtv h MET 355 CO 0.00 0.38 0.63 1.03 0.00 0.00 0.00 176.91 178.96 2qtv h SER 356 N 0.00 0.99 0.79 1.22 0.87 -1.86 0.84 113.55 116.40 2qtv h SER 356 Ca -0.00 0.02 -0.25 0.00 -1.23 0.00 0.00 61.79 60.32 2qtv h SER 356 Cb 0.73 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.49 2qtv h SER 356 CO 0.05 0.62 -1.15 -0.33 -0.53 0.00 0.00 176.83 175.49 2qtv h GLU 357 N 1.11 0.15 0.00 2.24 3.07 -1.81 -3.33 114.58 116.01 2qtv h GLU 357 Ca 0.44 -0.25 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 2qtv h GLU 357 Cb 0.23 0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.24 2qtv h GLU 357 CO -0.18 1.11 -0.58 0.52 -1.40 0.00 0.00 179.01 178.48 2qtv h MET 358 N 0.04 0.00 -0.42 2.33 2.86 -0.69 -3.42 114.93 115.63 2qtv h MET 358 Ca -0.08 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.63 2qtv h MET 358 Cb 1.88 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 33.47 2qtv h MET 358 CO 0.17 0.00 -0.15 1.17 1.06 0.00 0.00 176.91 179.16 2qtv n LYS 359 N -2.19 -0.09 0.27 1.72 4.81 0.29 -0.13 118.16 122.85 2qtv n LYS 359 Ca 0.03 0.65 0.16 0.00 -0.87 0.00 0.00 58.31 58.28 2qtv n LYS 359 Cb 0.45 -0.97 0.90 0.00 0.02 0.00 0.00 35.03 35.43 2qtv n LYS 359 CO 0.00 0.00 0.00 0.37 1.17 0.00 0.00 177.40 178.94 2qtv h GLN 360 N 0.00 0.00 -0.14 1.64 4.15 -1.86 -1.81 115.11 117.09 2qtv h GLN 360 Ca 0.16 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.57 2qtv h GLN 360 Cb 0.26 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.94 2qtv h GLN 360 CO -0.42 0.00 0.04 -0.07 -1.93 0.00 0.00 178.83 176.45 2qtv h LEU 361 N 0.00 0.17 0.02 -2.39 3.38 -0.82 -1.62 115.31 114.06 2qtv h LEU 361 Ca 0.02 -0.01 -0.39 0.00 0.09 0.00 0.00 57.88 57.59 2qtv h LEU 361 Cb 0.13 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 40.78 2qtv h LEU 361 CO -0.00 0.18 -2.22 0.35 0.09 0.00 0.00 178.44 176.84 2qtv n THR 362 N -4.46 1.55 0.40 0.22 -2.24 -0.74 -4.06 114.28 104.96 2qtv n THR 362 Ca -0.01 -0.41 0.09 0.00 -2.27 0.00 0.00 64.05 61.46 2qtv n THR 362 Cb 0.13 -1.77 0.40 0.00 -2.10 0.00 0.00 70.33 66.99 2qtv n THR 362 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2qtv n ASP 363 N -3.91 0.37 0.03 3.42 9.92 -0.87 -0.38 116.55 125.13 2qtv n ASP 363 Ca -0.45 0.60 0.11 0.00 -0.53 0.00 0.00 54.79 54.52 2qtv n ASP 363 Cb 0.90 -0.67 -0.02 0.00 -0.64 0.00 0.00 41.12 40.68 2qtv n ASP 363 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2qtv n SER 364 N -1.91 0.56 0.00 -2.24 7.64 -0.61 -2.80 113.62 114.26 2qtv n SER 364 Ca 0.02 -0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.75 2qtv n SER 364 Cb 0.18 0.97 0.00 0.00 -1.01 0.00 0.00 64.21 64.35 2qtv n SER 364 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2qtv n THR 365 N -2.07 0.00 -0.43 0.44 -2.24 -0.96 -3.59 114.28 105.42 2qtv n THR 365 Ca 0.01 -0.39 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 2qtv n THR 365 Cb 0.47 0.94 0.00 0.00 -2.10 0.00 0.00 70.33 69.64 2qtv n THR 365 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qtv n GLY 366 N 1.00 0.74 3.89 3.38 0.00 0.49 0.45 105.19 115.13 2qtv n GLY 366 Ca 0.00 -0.41 -0.29 0.00 0.00 0.00 0.00 46.02 45.32 2qtv n GLY 366 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qtv s GLY 367 N -2.37 1.59 0.18 -0.02 0.00 -0.55 -4.59 107.32 101.56 2qtv s GLY 367 Ca 0.00 -0.62 -0.14 0.00 0.00 0.00 0.00 44.72 43.96 2qtv s GLY 367 CO 0.00 -0.13 0.58 0.14 0.00 0.00 0.00 173.10 173.69 2qtv s VAL 368 N -3.53 4.83 -0.30 1.40 1.01 -1.26 -4.66 120.40 117.89 2qtv s VAL 368 Ca 0.62 0.82 -0.01 0.00 0.00 0.00 0.00 61.98 63.41 2qtv s VAL 368 Cb -0.11 -3.72 0.10 0.00 0.00 0.00 0.00 36.38 32.64 2qtv s VAL 368 CO 0.50 0.15 0.09 -0.22 0.00 0.00 0.00 175.10 175.62 2qtv s LEU 369 N -2.18 2.15 -0.10 3.92 2.96 -1.26 -0.53 118.68 123.63 2qtv s LEU 369 Ca 0.41 -1.56 0.03 0.00 -0.22 0.00 0.00 54.13 52.80 2qtv s LEU 369 Cb -0.14 -0.85 0.00 0.00 0.50 0.00 0.00 46.19 45.70 2qtv s LEU 369 CO 0.20 -0.40 -0.22 -0.22 -1.32 0.00 0.00 176.35 174.39 2qtv s LEU 370 N 1.63 2.01 -0.32 -0.68 2.96 -0.39 -4.94 118.68 118.95 2qtv s LEU 370 Ca 0.08 -0.53 -0.04 0.00 -0.22 0.00 0.00 54.13 53.43 2qtv s LEU 370 Cb -0.17 -1.32 0.05 0.00 0.50 0.00 0.00 46.19 45.24 2qtv s LEU 370 CO -0.24 0.12 0.06 -0.22 -1.32 0.00 0.00 176.35 174.75 2qtv s LEU 371 N 0.51 4.15 0.36 -0.68 2.96 -1.26 -0.36 118.68 124.36 2qtv s LEU 371 Ca -0.16 -1.26 0.08 0.00 -0.22 0.00 0.00 54.13 52.58 2qtv s LEU 371 Cb -0.17 -1.79 -0.07 0.00 0.50 0.00 0.00 46.19 44.66 2qtv s LEU 371 CO 0.06 -0.30 -0.03 0.42 -1.32 0.00 0.00 176.35 175.17 2qtv s THR 372 N 1.31 1.98 0.04 3.68 -4.23 -0.18 -4.99 115.64 113.25 2qtv s THR 372 Ca -0.03 -2.09 0.15 0.00 -1.18 0.00 0.00 61.69 58.53 2qtv s THR 372 Cb -0.20 -2.78 0.04 0.00 1.34 0.00 0.00 72.50 70.90 2qtv s THR 372 CO 0.00 -0.11 1.53 0.44 -0.54 0.00 0.00 174.62 175.94 2qtv h ASP 373 N 1.96 0.00 -4.20 3.99 3.32 -1.81 -2.43 116.42 117.25 2qtv h ASP 373 Ca -0.42 0.00 0.18 0.00 0.02 0.00 0.00 57.03 56.80 2qtv h ASP 373 Cb 1.24 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.60 2qtv h ASP 373 CO 0.74 0.55 0.68 0.00 -1.72 0.00 0.00 179.24 179.50 2qtv s ALA 374 N -3.19 -1.98 -1.54 3.45 0.00 -1.26 -2.63 121.76 114.61 2qtv s ALA 374 Ca 0.02 1.47 0.16 0.00 0.00 0.00 0.00 51.96 53.61 2qtv s ALA 374 Cb 0.10 -0.25 0.86 0.00 0.00 0.00 0.00 23.12 23.83 2qtv s ALA 374 CO 0.74 -0.52 1.46 1.19 0.00 0.00 0.00 175.76 178.63 2qtv n PHE 375 N 0.11 0.00 0.91 0.00 0.99 -1.26 -2.22 117.46 115.99 2qtv n PHE 375 Ca -0.04 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.52 2qtv n PHE 375 Cb 0.59 -0.23 0.18 0.00 -1.00 0.00 0.00 39.48 39.02 2qtv n PHE 375 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 2qtv n SER 376 N -1.23 0.58 -4.79 4.37 3.41 -1.26 -4.43 113.62 110.27 2qtv n SER 376 Ca 0.09 -0.29 -0.34 0.00 -0.26 0.00 0.00 58.87 58.07 2qtv n SER 376 Cb 0.12 0.37 -0.01 0.00 -0.26 0.00 0.00 64.21 64.43 2qtv n SER 376 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2qtv s THR 377 N -3.04 3.65 0.21 6.66 -4.23 -0.94 -4.92 115.64 113.03 2qtv s THR 377 Ca 0.09 0.95 -0.09 0.00 -1.18 0.00 0.00 61.69 61.47 2qtv s THR 377 Cb 0.17 -3.39 0.16 0.00 1.34 0.00 0.00 72.50 70.78 2qtv s THR 377 CO 0.73 -0.29 1.85 0.00 -0.54 0.00 0.00 174.62 176.36 2qtv h ALA 378 N 1.15 1.00 -0.45 3.99 0.00 -1.92 -1.77 119.26 121.26 2qtv h ALA 378 Ca -0.49 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 54.41 2qtv h ALA 378 Cb 1.23 -0.32 -0.08 0.00 0.00 0.00 0.00 17.79 18.63 2qtv h ALA 378 CO 0.58 0.48 -0.02 0.82 0.00 0.00 0.00 179.25 181.11 2qtv h ILE 379 N 1.08 0.63 0.40 0.00 2.04 -1.92 0.31 117.51 120.05 2qtv h ILE 379 Ca 0.28 -0.03 -0.02 0.00 1.00 0.00 0.00 64.86 66.09 2qtv h ILE 379 Cb -0.02 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2qtv h ILE 379 CO -0.05 0.02 -0.19 0.15 0.00 0.00 0.00 178.15 178.07 2qtv h PHE 380 N 0.09 -0.50 -0.50 1.37 3.57 -1.76 -1.63 116.94 117.57 2qtv h PHE 380 Ca 0.22 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.80 2qtv h PHE 380 Cb 0.33 0.17 -0.07 0.00 2.79 0.00 0.00 35.95 39.17 2qtv h PHE 380 CO -0.31 -0.18 0.12 0.87 -2.23 0.00 0.00 178.31 176.57 2qtv h LYS 381 N -0.98 0.25 0.00 1.11 1.57 -1.14 0.33 116.57 117.71 2qtv h LYS 381 Ca -0.06 -0.02 -0.26 0.00 -1.87 0.00 0.00 60.65 58.45 2qtv h LYS 381 Cb 0.54 -0.06 0.02 0.00 0.08 0.00 0.00 32.23 32.81 2qtv h LYS 381 CO 0.09 0.17 -1.03 1.96 -0.57 0.00 0.00 179.45 180.06 2qtv h GLN 382 N 0.26 0.64 -0.18 3.15 4.20 -0.50 -2.47 115.11 120.21 2qtv h GLN 382 Ca 0.25 -0.70 -0.00 0.00 0.06 0.00 0.00 58.65 58.26 2qtv h GLN 382 Cb 0.33 0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.30 2qtv h GLN 382 CO -0.31 1.29 0.11 0.77 -0.67 0.00 0.00 178.83 180.01 2qtv h SER 383 N 0.36 0.22 -0.29 1.46 0.02 -1.03 -0.96 113.55 113.33 2qtv h SER 383 Ca -0.12 -0.05 0.06 0.00 -0.84 0.00 0.00 61.79 60.84 2qtv h SER 383 Cb 1.68 -0.06 -0.06 0.00 0.14 0.00 0.00 62.40 64.11 2qtv h SER 383 CO 0.20 0.21 -0.08 0.22 -1.14 0.00 0.00 176.83 176.23 2qtv h TYR 384 N 0.22 -0.18 0.00 3.45 3.20 -0.39 -2.11 116.97 121.15 2qtv h TYR 384 Ca 0.07 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.90 2qtv h TYR 384 Cb 0.03 0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.41 2qtv h TYR 384 CO -0.05 -0.14 -0.31 -0.07 -1.64 0.00 0.00 178.16 175.95 2qtv h LEU 385 N -0.02 0.00 -1.71 2.82 3.38 -1.16 -2.38 115.31 116.23 2qtv h LEU 385 Ca 0.14 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 2qtv h LEU 385 Cb 0.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 2qtv h LEU 385 CO -0.31 0.31 -0.08 -0.09 0.09 0.00 0.00 178.44 178.37 2qtv h ARG 386 N 0.00 0.00 0.00 1.13 2.43 -0.48 -2.01 114.38 115.45 2qtv h ARG 386 Ca -0.00 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2qtv h ARG 386 Cb 0.58 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.13 2qtv h ARG 386 CO 0.04 0.08 -0.02 1.25 -1.51 0.00 0.00 179.97 179.81 2qtv h LEU 387 N 0.00 0.00 -3.81 3.80 5.85 -1.22 -1.93 115.31 118.00 2qtv h LEU 387 Ca -0.00 0.00 -0.44 0.00 0.84 0.00 0.00 57.88 58.28 2qtv h LEU 387 Cb 0.45 0.00 -0.26 0.00 0.37 0.00 0.00 40.66 41.22 2qtv h LEU 387 CO 0.01 0.02 0.44 0.49 -0.34 0.00 0.00 178.44 179.06 2qtv n PHE 388 N -3.41 2.54 -1.98 1.25 3.01 -0.76 -4.75 117.46 113.36 2qtv n PHE 388 Ca -0.02 -1.92 -0.40 0.00 1.01 0.00 0.00 57.45 56.12 2qtv n PHE 388 Cb 0.13 -0.86 0.00 0.00 -0.01 0.00 0.00 39.48 38.74 2qtv n PHE 388 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2qtv s ALA 389 N -3.35 3.27 0.26 4.37 0.00 -0.73 -4.85 121.76 120.73 2qtv s ALA 389 Ca 0.54 1.31 0.04 0.00 0.00 0.00 0.00 51.96 53.85 2qtv s ALA 389 Cb 0.46 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 20.03 2qtv s ALA 389 CO 0.06 -0.93 0.41 0.15 0.00 0.00 0.00 175.76 175.45 2qtv s LYS 390 N -2.29 3.45 0.70 0.00 3.01 -1.26 -0.32 119.74 123.04 2qtv s LYS 390 Ca 0.58 -0.63 0.02 0.00 -1.01 0.00 0.00 55.97 54.93 2qtv s LYS 390 Cb -0.40 -2.83 0.13 0.00 -1.01 0.00 0.00 37.83 33.72 2qtv s LYS 390 CO 0.51 0.36 0.96 -0.40 0.51 0.00 0.00 175.35 177.29 2qtv n ASP 391 N -1.46 1.55 -0.34 2.83 5.75 0.43 -4.68 116.55 120.62 2qtv n ASP 391 Ca -0.08 -2.24 0.21 0.00 -0.01 0.00 0.00 54.79 52.67 2qtv n ASP 391 Cb 0.57 -0.60 0.45 0.00 -1.03 0.00 0.00 41.12 40.51 2qtv n ASP 391 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 2qtv h GLU 392 N 0.00 0.44 -0.47 0.11 4.39 -2.00 -1.15 114.58 115.90 2qtv h GLU 392 Ca -0.32 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.36 2qtv h GLU 392 Cb 1.24 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.79 2qtv h GLU 392 CO 0.37 0.29 0.00 0.39 -1.16 0.00 0.00 179.01 178.90 2qtv n GLU 393 N -4.85 2.08 -0.42 2.33 4.71 -1.26 -4.92 120.64 118.30 2qtv n GLU 393 Ca 0.28 -1.68 0.00 0.00 -0.01 0.00 0.00 57.16 55.76 2qtv n GLU 393 Cb 0.87 -1.36 0.00 0.00 -1.01 0.00 0.00 31.44 29.94 2qtv n GLU 393 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2qtv n GLY 394 N 1.24 0.76 3.83 0.62 0.00 -0.43 -5.08 105.19 106.12 2qtv n GLY 394 Ca 0.16 -0.25 -0.24 0.00 0.00 0.00 0.00 46.02 45.69 2qtv n GLY 394 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qtv s TYR 395 N -2.00 3.17 0.24 1.61 1.51 -1.26 -4.80 117.35 115.82 2qtv s TYR 395 Ca 0.00 -0.05 -0.30 0.00 -1.01 0.00 0.00 57.07 55.71 2qtv s TYR 395 Cb 0.00 -1.48 -0.10 0.00 -0.11 0.00 0.00 41.96 40.28 2qtv s TYR 395 CO 0.00 0.52 1.44 -0.51 -1.11 0.00 0.00 175.55 175.88 2qtv s LEU 396 N -3.49 4.39 0.15 -1.29 1.43 -1.26 0.16 118.68 118.77 2qtv s LEU 396 Ca 0.32 2.64 -0.15 0.00 -1.03 0.00 0.00 54.13 55.92 2qtv s LEU 396 Cb -0.09 -3.62 0.03 0.00 0.03 0.00 0.00 46.19 42.54 2qtv s LEU 396 CO 0.25 -0.69 1.72 0.11 0.23 0.00 0.00 176.35 177.96 2qtv h LYS 397 N 5.15 0.69 -6.44 1.70 1.57 -0.95 -3.41 116.57 114.88 2qtv h LYS 397 Ca -0.46 -0.11 -0.61 0.00 -1.87 0.00 0.00 60.65 57.61 2qtv h LYS 397 Cb 1.22 -0.12 0.12 0.00 0.08 0.00 0.00 32.23 33.52 2qtv h LYS 397 CO 0.78 0.59 0.01 0.00 -0.57 0.00 0.00 179.45 180.27 2qtv n MET 398 N -4.61 1.14 -4.42 3.15 0.00 -1.26 -4.67 117.12 106.45 2qtv n MET 398 Ca 0.01 0.40 -0.21 0.00 0.00 0.00 0.00 57.70 57.91 2qtv n MET 398 Cb 0.13 -1.76 -0.10 0.00 0.00 0.00 0.00 33.22 31.49 2qtv n MET 398 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2qtv s ALA 399 N -1.13 2.35 0.35 3.17 0.00 0.53 -4.37 121.76 122.66 2qtv s ALA 399 Ca 0.60 -1.84 0.03 0.00 0.00 0.00 0.00 51.96 50.76 2qtv s ALA 399 Cb -0.69 0.02 -0.04 0.00 0.00 0.00 0.00 23.12 22.41 2qtv s ALA 399 CO 0.59 0.04 0.12 -0.06 0.00 0.00 0.00 175.76 176.44 2qtv s PHE 400 N -2.89 1.76 -1.20 0.00 0.40 -0.97 -2.04 117.98 113.04 2qtv s PHE 400 Ca 0.28 -1.22 -0.24 0.00 -0.60 0.00 0.00 56.93 55.14 2qtv s PHE 400 Cb 0.01 -1.09 0.01 0.00 0.51 0.00 0.00 43.02 42.46 2qtv s PHE 400 CO 0.11 -0.29 0.70 -1.71 0.70 0.00 0.00 175.22 174.74 2qtv n ASN 401 N -0.99 -4.34 -4.78 1.36 5.15 -0.14 -0.70 115.26 110.81 2qtv n ASN 401 Ca -0.03 -1.13 -0.39 0.00 -0.60 0.00 0.00 54.58 52.43 2qtv n ASN 401 Cb 0.65 -2.67 -0.06 0.00 -0.53 0.00 0.00 39.78 37.18 2qtv n ASN 401 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 2qtv s GLY 402 N -3.58 2.70 -0.22 8.20 0.00 0.29 -3.93 107.32 110.77 2qtv s GLY 402 Ca 0.44 0.11 -0.03 0.00 0.00 0.00 0.00 44.72 45.24 2qtv s GLY 402 CO 0.91 0.72 0.06 0.21 0.00 0.00 0.00 173.10 175.00 2qtv s ASN 403 N -0.62 3.07 -0.28 1.64 3.84 0.11 0.16 114.94 122.86 2qtv s ASN 403 Ca 0.32 -0.97 -0.07 0.00 0.21 0.00 0.00 52.86 52.35 2qtv s ASN 403 Cb -0.20 -0.55 -0.01 0.00 -0.55 0.00 0.00 41.25 39.95 2qtv s ASN 403 CO 0.20 -0.35 0.08 -0.32 -2.79 0.00 0.00 177.10 173.93 2qtv s MET 404 N 1.89 3.32 -0.04 0.43 -2.45 0.99 -1.13 119.30 122.32 2qtv s MET 404 Ca 0.02 -0.70 0.01 0.00 -1.25 0.00 0.00 55.69 53.77 2qtv s MET 404 Cb -0.17 -3.37 -0.03 0.00 1.25 0.00 0.00 34.83 32.51 2qtv s MET 404 CO -0.14 -0.35 -0.03 0.00 1.05 0.00 0.00 175.02 175.55 2qtv s ALA 405 N 1.55 3.15 -0.30 4.11 0.00 -0.32 -1.08 121.76 128.88 2qtv s ALA 405 Ca 0.04 -0.92 0.03 0.00 0.00 0.00 0.00 51.96 51.11 2qtv s ALA 405 Cb -0.16 -1.30 0.08 0.00 0.00 0.00 0.00 23.12 21.74 2qtv s ALA 405 CO 0.03 0.61 -0.02 0.08 0.00 0.00 0.00 175.76 176.46 2qtv s VAL 406 N -0.95 2.04 0.14 0.00 1.01 -0.59 -0.46 120.40 121.59 2qtv s VAL 406 Ca 0.16 -1.89 -0.14 0.00 0.00 0.00 0.00 61.98 60.11 2qtv s VAL 406 Cb -0.11 -2.36 -0.07 0.00 0.00 0.00 0.00 36.38 33.84 2qtv s VAL 406 CO 0.06 -0.34 0.53 -0.54 0.00 0.00 0.00 175.10 174.81 2qtv s LYS 407 N 1.09 3.96 0.03 2.72 -0.14 0.25 -4.93 119.74 122.72 2qtv s LYS 407 Ca 0.02 0.46 -0.11 0.00 -1.36 0.00 0.00 55.97 54.98 2qtv s LYS 407 Cb -0.19 -2.94 0.01 0.00 -1.68 0.00 0.00 37.83 33.03 2qtv s LYS 407 CO -0.08 0.49 0.23 0.95 -0.76 0.00 0.00 175.35 176.18 2qtv s THR 408 N -1.46 0.09 1.12 2.17 -4.23 -1.26 -0.79 115.64 111.29 2qtv s THR 408 Ca 0.37 -0.75 -0.12 0.00 -1.18 0.00 0.00 61.69 60.01 2qtv s THR 408 Cb -0.15 -0.80 0.26 0.00 1.34 0.00 0.00 72.50 73.15 2qtv s THR 408 CO 0.19 -0.41 1.04 -1.20 -0.54 0.00 0.00 174.62 173.69 2qtv n SER 409 N 0.87 -1.30 0.33 3.99 7.64 -0.63 -4.86 113.62 119.66 2qtv n SER 409 Ca -0.20 -0.04 0.21 0.00 1.01 0.00 0.00 58.87 59.86 2qtv n SER 409 Cb 0.58 -1.31 1.11 0.00 -1.01 0.00 0.00 64.21 63.58 2qtv n SER 409 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2qtv h LYS 410 N -2.53 0.00 -0.90 1.43 6.56 -1.92 -2.20 116.57 117.00 2qtv h LYS 410 Ca -0.58 0.00 -0.30 0.00 -1.06 0.00 0.00 60.65 58.71 2qtv h LYS 410 Cb 1.32 0.00 -0.18 0.00 -0.57 0.00 0.00 32.23 32.80 2qtv h LYS 410 CO 0.47 0.01 0.39 -0.40 -2.06 0.00 0.00 179.45 177.85 2qtv n ASP 411 N -3.17 3.99 -3.69 0.86 3.85 -1.26 -4.78 116.55 112.34 2qtv n ASP 411 Ca -0.02 -3.16 -0.11 0.00 -0.71 0.00 0.00 54.79 50.78 2qtv n ASP 411 Cb 0.11 -0.74 -0.12 0.00 -1.35 0.00 0.00 41.12 39.02 2qtv n ASP 411 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.20 175.97 2qtv s LEU 412 N -2.58 -0.06 0.31 -2.12 2.96 -0.83 -2.94 118.68 113.41 2qtv s LEU 412 Ca 0.46 0.74 0.10 0.00 -0.22 0.00 0.00 54.13 55.21 2qtv s LEU 412 Cb 0.38 1.03 -0.05 0.00 0.50 0.00 0.00 46.19 48.05 2qtv s LEU 412 CO 0.10 -0.20 -0.06 -0.54 -1.32 0.00 0.00 176.35 174.33 2qtv s LYS 413 N 1.73 2.00 -0.18 1.98 -0.14 -0.16 -4.60 119.74 120.37 2qtv s LYS 413 Ca -0.06 -1.69 -0.04 0.00 -1.36 0.00 0.00 55.97 52.81 2qtv s LYS 413 Cb -0.10 -1.92 -0.03 0.00 -1.68 0.00 0.00 37.83 34.10 2qtv s LYS 413 CO -0.11 0.25 -0.01 0.08 -0.76 0.00 0.00 175.35 174.79 2qtv s VAL 414 N -2.48 3.98 -0.15 3.17 1.01 0.12 -1.41 120.40 124.65 2qtv s VAL 414 Ca 0.32 -0.32 0.20 0.00 0.00 0.00 0.00 61.98 62.19 2qtv s VAL 414 Cb -0.03 -2.77 -0.15 0.00 0.00 0.00 0.00 36.38 33.43 2qtv s VAL 414 CO 0.18 0.46 0.75 0.00 0.00 0.00 0.00 175.10 176.49 2qtv n GLN 415 N 3.81 0.63 -2.09 2.72 6.02 0.48 -0.52 117.38 128.43 2qtv n GLN 415 Ca -0.17 0.06 0.00 0.00 -0.01 0.00 0.00 57.00 56.88 2qtv n GLN 415 Cb 0.52 -1.72 0.00 0.00 1.02 0.00 0.00 30.24 30.06 2qtv n GLN 415 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2qtv n GLY 416 N 1.32 -0.89 3.10 1.08 0.00 -1.23 -1.40 105.19 107.17 2qtv n GLY 416 Ca -0.07 -1.61 -0.16 0.00 0.00 0.00 0.00 46.02 44.18 2qtv n GLY 416 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qtv s LEU 417 N 0.00 2.22 -0.11 0.99 0.20 -0.59 -0.73 118.68 120.65 2qtv s LEU 417 Ca 0.00 -0.50 0.00 0.00 0.69 0.00 0.00 54.13 54.32 2qtv s LEU 417 Cb 0.00 -0.35 0.02 0.00 -0.43 0.00 0.00 46.19 45.43 2qtv s LEU 417 CO 0.00 -0.09 -0.09 -0.63 -0.29 0.00 0.00 176.35 175.24 2qtv s ILE 418 N -1.11 1.10 -4.10 6.68 1.01 -0.17 0.21 121.20 124.82 2qtv s ILE 418 Ca -0.04 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.25 2qtv s ILE 418 Cb -0.09 -1.09 0.00 0.00 0.01 0.00 0.00 42.46 41.29 2qtv s ILE 418 CO 0.01 0.38 0.00 0.61 0.00 0.00 0.00 174.94 175.93 2qtv n GLY 419 N 4.71 -1.26 3.09 6.18 0.00 -1.26 -1.33 105.19 115.31 2qtv n GLY 419 Ca -0.15 -1.14 -0.43 0.00 0.00 0.00 0.00 46.02 44.30 2qtv n GLY 419 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2qtv n HIS 420 N 7.38 3.75 -4.17 1.61 8.25 -1.25 -4.90 115.22 125.89 2qtv n HIS 420 Ca 0.00 -2.99 -0.13 0.00 -0.26 0.00 0.00 57.72 54.34 2qtv n HIS 420 Cb 0.00 -2.13 -0.09 0.00 1.12 0.00 0.00 29.99 28.89 2qtv n HIS 420 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qtv s ALA 421 N 1.30 1.02 -0.01 -1.41 0.00 -1.12 -3.91 121.76 117.64 2qtv s ALA 421 Ca 0.42 -1.61 0.03 0.00 0.00 0.00 0.00 51.96 50.80 2qtv s ALA 421 Cb 0.06 1.34 -0.01 0.00 0.00 0.00 0.00 23.12 24.51 2qtv s ALA 421 CO -0.00 -0.65 -0.11 0.45 0.00 0.00 0.00 175.76 175.45 2qtv s SER 422 N -3.17 1.30 0.67 0.00 0.15 -0.75 -4.55 113.70 107.35 2qtv s SER 422 Ca 0.36 -0.20 -0.14 0.00 0.70 0.00 0.00 55.95 56.67 2qtv s SER 422 Cb 0.05 -0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.21 2qtv s SER 422 CO 0.14 0.13 1.09 0.00 1.20 0.00 0.00 173.24 175.81 2qtv s ALA 423 N -0.25 2.49 -0.20 5.45 0.00 -1.26 -0.35 121.76 127.63 2qtv s ALA 423 Ca 0.04 0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.43 2qtv s ALA 423 Cb -0.04 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 19.82 2qtv s ALA 423 CO -0.00 -1.28 -0.15 0.08 0.00 0.00 0.00 175.76 174.40 2qtv s VAL 424 N -2.52 2.34 0.53 0.00 1.01 -1.05 -4.71 120.40 116.01 2qtv s VAL 424 Ca 0.65 -0.97 0.08 0.00 0.00 0.00 0.00 61.98 61.73 2qtv s VAL 424 Cb -0.19 -2.07 0.08 0.00 0.00 0.00 0.00 36.38 34.20 2qtv s VAL 424 CO 0.44 0.42 0.65 0.29 0.00 0.00 0.00 175.10 176.91 2qtv n LYS 425 N 4.63 0.66 -2.40 2.72 5.02 -1.26 -4.59 118.16 122.93 2qtv n LYS 425 Ca -0.19 -2.98 -0.21 0.00 -2.02 0.00 0.00 58.31 52.92 2qtv n LYS 425 Cb 0.49 -0.08 -0.01 0.00 -0.02 0.00 0.00 35.03 35.41 2qtv n LYS 425 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2qtv n LYS 426 N -2.05 -1.71 -2.46 1.97 5.02 -1.26 -4.98 118.16 112.69 2qtv n LYS 426 Ca 0.11 1.00 -0.28 0.00 -2.02 0.00 0.00 58.31 57.12 2qtv n LYS 426 Cb 0.56 -5.65 0.00 0.00 -0.02 0.00 0.00 35.03 29.93 2qtv n LYS 426 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2qtv s THR 427 N -3.03 4.84 -0.30 -0.18 -4.23 -1.26 -4.97 115.64 106.50 2qtv s THR 427 Ca 0.01 0.35 0.11 0.00 -1.18 0.00 0.00 61.69 60.97 2qtv s THR 427 Cb -0.00 -3.86 0.76 0.00 1.34 0.00 0.00 72.50 70.74 2qtv s THR 427 CO 0.01 -0.91 1.78 -0.90 -0.54 0.00 0.00 174.62 174.06 2qtv n ASP 428 N -2.38 4.99 -4.75 3.99 5.75 -1.26 -4.98 116.55 117.91 2qtv n ASP 428 Ca 0.02 -3.17 -0.33 0.00 -0.01 0.00 0.00 54.79 51.30 2qtv n ASP 428 Cb 0.55 -0.73 0.07 0.00 -1.03 0.00 0.00 41.12 39.98 2qtv n ASP 428 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2qtv s ALA 429 N -2.95 2.31 0.00 2.12 0.00 -1.26 -4.82 121.76 117.16 2qtv s ALA 429 Ca 0.55 0.61 0.00 0.00 0.00 0.00 0.00 51.96 53.12 2qtv s ALA 429 Cb 0.43 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 20.19 2qtv s ALA 429 CO 0.14 -1.55 0.41 0.27 0.00 0.00 0.00 175.76 175.03 2qtv n ASN 430 N -2.68 0.82 -2.03 0.00 2.04 -1.26 -4.70 115.26 107.44 2qtv n ASN 430 Ca 0.11 -0.92 -0.15 0.00 -0.44 0.00 0.00 54.58 53.17 2qtv n ASN 430 Cb 0.52 0.14 0.23 0.00 -2.53 0.00 0.00 39.78 38.13 2qtv n ASN 430 CO 0.00 0.00 0.00 -0.46 -0.44 0.00 0.00 177.26 176.36 2qtv n ASN 431 N -0.14 4.03 -4.63 0.53 6.94 -1.26 -4.95 115.26 115.78 2qtv n ASN 431 Ca 0.00 -3.48 -0.41 0.00 -0.02 0.00 0.00 54.58 50.68 2qtv n ASN 431 Cb 0.01 -0.78 -0.06 0.00 -2.36 0.00 0.00 39.78 36.58 2qtv n ASN 431 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2qtv s ILE 432 N -3.18 4.99 0.58 1.53 1.01 -1.26 0.13 121.20 124.99 2qtv s ILE 432 Ca 0.55 1.13 -0.18 0.00 0.00 0.00 0.00 60.65 62.16 2qtv s ILE 432 Cb 0.46 -3.93 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 2qtv s ILE 432 CO 0.11 0.03 1.11 -0.55 0.00 0.00 0.00 174.94 175.64 2qtv s SER 433 N 1.46 5.61 0.30 3.58 0.15 0.32 -4.80 113.70 120.31 2qtv s SER 433 Ca 0.26 2.06 0.16 0.00 0.70 0.00 0.00 55.95 59.13 2qtv s SER 433 Cb -0.15 -2.56 0.29 0.00 -1.71 0.00 0.00 66.02 61.88 2qtv s SER 433 CO 0.08 -1.29 1.55 -0.33 1.20 0.00 0.00 173.24 174.45 2qtv h GLU 434 N 0.80 0.00 -6.55 5.44 5.08 -1.97 -3.43 114.58 113.95 2qtv h GLU 434 Ca -0.49 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.35 2qtv h GLU 434 Cb 1.25 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.47 2qtv h GLU 434 CO 0.56 0.50 0.04 -1.12 -1.00 0.00 0.00 179.01 178.00 2qtv s SER 435 N -6.48 6.87 0.00 1.42 0.01 -1.26 -5.00 113.70 109.26 2qtv s SER 435 Ca 0.02 1.25 0.07 0.00 1.31 0.00 0.00 55.95 58.60 2qtv s SER 435 Cb 0.09 -2.36 -0.02 0.00 0.21 0.00 0.00 66.02 63.95 2qtv s SER 435 CO 0.73 -0.04 -0.22 -1.61 0.41 0.00 0.00 173.24 172.51 2qtv s GLU 436 N -2.38 1.66 -0.12 12.44 2.02 -1.26 -4.50 118.70 126.56 2qtv s GLU 436 Ca 0.46 -0.84 -0.03 0.00 0.02 0.00 0.00 54.97 54.58 2qtv s GLU 436 Cb -0.14 -1.67 0.05 0.00 0.10 0.00 0.00 34.13 32.47 2qtv s GLU 436 CO 0.19 0.45 0.06 0.42 0.02 0.00 0.00 175.26 176.40 2qtv s ILE 437 N -0.60 0.06 0.00 -1.63 1.01 -0.49 -5.00 121.20 114.54 2qtv s ILE 437 Ca 0.08 0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.76 2qtv s ILE 437 Cb -0.09 -0.49 0.00 0.00 0.01 0.00 0.00 42.46 41.90 2qtv s ILE 437 CO 0.00 -0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.52 2qtv n GLY 438 N 5.23 1.20 3.41 6.18 0.00 -1.26 -3.22 105.19 116.73 2qtv n GLY 438 Ca -0.06 -0.54 -0.44 0.00 0.00 0.00 0.00 46.02 44.98 2qtv n GLY 438 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qtv s ILE 439 N 0.00 4.62 0.00 -0.61 1.01 0.13 -4.84 121.20 121.51 2qtv s ILE 439 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 60.65 59.86 2qtv s ILE 439 Cb 0.00 -4.59 0.00 0.00 0.01 0.00 0.00 42.46 37.88 2qtv s ILE 439 CO 0.00 -1.28 0.00 0.61 0.00 0.00 0.00 174.94 174.27 2qtv n GLY 440 N 5.29 4.14 2.36 6.18 0.00 -1.26 -1.55 105.19 120.36 2qtv n GLY 440 Ca -0.05 -1.92 -0.17 0.00 0.00 0.00 0.00 46.02 43.88 2qtv n GLY 440 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qtv n ALA 441 N -3.00 -0.45 -3.64 4.61 0.00 -1.26 -4.94 120.51 111.83 2qtv n ALA 441 Ca 0.00 0.17 -0.01 0.00 0.00 0.00 0.00 53.44 53.59 2qtv n ALA 441 Cb 0.00 -1.86 -0.01 0.00 0.00 0.00 0.00 19.45 17.58 2qtv n ALA 441 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2qtv s THR 442 N -2.80 0.00 -0.02 0.00 -1.32 -1.26 -4.99 115.64 105.26 2qtv s THR 442 Ca 0.00 -0.29 0.02 0.00 -1.21 0.00 0.00 61.69 60.22 2qtv s THR 442 Cb 0.00 -1.77 0.04 0.00 -1.51 0.00 0.00 72.50 69.25 2qtv s THR 442 CO 0.00 0.00 0.86 -1.54 -2.21 0.00 0.00 174.62 171.73 2qtv n SER 443 N -0.41 1.24 -4.13 8.08 3.41 -1.26 -4.62 113.62 115.93 2qtv n SER 443 Ca -0.07 -1.83 -0.23 0.00 -0.26 0.00 0.00 58.87 56.49 2qtv n SER 443 Cb 0.62 -0.07 -0.15 0.00 -0.26 0.00 0.00 64.21 64.34 2qtv n SER 443 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2qtv s THR 444 N -0.84 1.22 0.03 6.66 2.01 -1.26 -1.54 115.64 121.91 2qtv s THR 444 Ca 0.04 -0.69 -0.01 0.00 0.31 0.00 0.00 61.69 61.34 2qtv s THR 444 Cb 0.04 -1.02 -0.03 0.00 0.01 0.00 0.00 72.50 71.50 2qtv s THR 444 CO 0.00 0.32 -0.02 0.26 -0.69 0.00 0.00 174.62 174.49 2qtv s TRP 445 N -0.40 0.33 0.10 4.92 0.51 -0.24 -2.52 118.94 121.64 2qtv s TRP 445 Ca 0.06 -0.69 0.09 0.00 -2.12 0.00 0.00 56.10 53.44 2qtv s TRP 445 Cb -0.06 -0.25 -0.04 0.00 -0.81 0.00 0.00 33.47 32.32 2qtv s TRP 445 CO -0.00 -0.26 -0.24 -1.59 -0.51 0.00 0.00 176.95 174.34 2qtv s LYS 446 N -2.29 1.36 -0.22 4.98 -2.85 0.52 -0.01 119.74 121.23 2qtv s LYS 446 Ca -0.08 -1.21 -0.02 0.00 -1.00 0.00 0.00 55.97 53.66 2qtv s LYS 446 Cb -0.04 -1.70 0.07 0.00 -2.06 0.00 0.00 37.83 34.10 2qtv s LYS 446 CO -0.04 0.41 0.04 -1.64 0.10 0.00 0.00 175.35 174.22 2qtv s MET 447 N -1.80 0.77 0.22 1.78 -1.94 0.41 -1.81 119.30 116.94 2qtv s MET 447 Ca 0.10 -0.61 -0.09 0.00 -1.71 0.00 0.00 55.69 53.39 2qtv s MET 447 Cb -0.10 -2.13 0.33 0.00 2.01 0.00 0.00 34.83 34.94 2qtv s MET 447 CO 0.04 -0.70 1.71 0.00 -0.01 0.00 0.00 175.02 176.06 2qtv h ALA 448 N 8.19 0.79 -3.65 3.03 0.00 -1.73 0.82 119.26 126.72 2qtv h ALA 448 Ca -0.16 0.13 -0.39 0.00 0.00 0.00 0.00 54.91 54.49 2qtv h ALA 448 Cb 1.09 0.15 -0.24 0.00 0.00 0.00 0.00 17.79 18.79 2qtv h ALA 448 CO 0.37 -0.28 -0.77 -1.12 0.00 0.00 0.00 179.25 177.45 2qtv s SER 449 N -5.31 1.32 0.06 0.00 0.01 0.17 -0.97 113.70 108.98 2qtv s SER 449 Ca -0.13 -0.42 -0.21 0.00 1.31 0.00 0.00 55.95 56.50 2qtv s SER 449 Cb 0.18 -0.07 0.05 0.00 0.21 0.00 0.00 66.02 66.39 2qtv s SER 449 CO 0.75 -0.01 0.50 -1.48 0.41 0.00 0.00 173.24 173.40 2qtv s LEU 450 N -1.08 0.02 0.33 2.44 0.05 -0.86 -4.18 118.68 115.39 2qtv s LEU 450 Ca -0.01 0.11 0.06 0.00 0.05 0.00 0.00 54.13 54.34 2qtv s LEU 450 Cb -0.07 2.06 -0.03 0.00 -2.05 0.00 0.00 46.19 46.10 2qtv s LEU 450 CO 0.01 -0.73 0.30 -0.94 -0.55 0.00 0.00 176.35 174.44 2qtv s SER 451 N -2.06 1.56 0.00 1.48 1.04 -1.26 -0.34 113.70 114.11 2qtv s SER 451 Ca -0.04 -1.72 0.11 0.00 0.48 0.00 0.00 55.95 54.78 2qtv s SER 451 Cb -0.01 0.57 0.68 0.00 0.10 0.00 0.00 66.02 67.36 2qtv s SER 451 CO -0.03 -1.09 1.18 -2.65 0.98 0.00 0.00 173.24 171.63 2qtv n PRO 452 N -0.61 0.64 -0.25 4.02 -0.02 -1.25 -2.30 135.00 135.23 2qtv n PRO 452 Ca 0.07 0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.61 2qtv n PRO 452 Cb 0.62 -1.28 0.18 0.00 -0.02 0.00 0.00 33.50 33.00 2qtv n PRO 452 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2qtv n TYR 453 N -0.78 0.54 -4.28 6.00 4.02 -1.26 -4.54 117.16 116.86 2qtv n TYR 453 Ca 0.09 -0.72 -0.34 0.00 -0.01 0.00 0.00 57.90 56.92 2qtv n TYR 453 Cb 0.04 -0.16 -0.11 0.00 -0.02 0.00 0.00 39.34 39.09 2qtv n TYR 453 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 2qtv s HIS 454 N -1.98 3.10 -0.02 -0.72 3.76 -0.97 -4.55 115.29 113.91 2qtv s HIS 454 Ca 0.29 -0.17 0.07 0.00 -0.15 0.00 0.00 55.06 55.11 2qtv s HIS 454 Cb 0.21 -1.99 -0.02 0.00 1.11 0.00 0.00 32.58 31.90 2qtv s HIS 454 CO 0.09 0.04 -0.24 -1.12 -0.85 0.00 0.00 174.74 172.66 2qtv s SER 455 N 0.32 2.84 -0.04 1.40 0.01 0.15 -4.36 113.70 114.02 2qtv s SER 455 Ca -0.02 -0.44 0.05 0.00 1.31 0.00 0.00 55.95 56.85 2qtv s SER 455 Cb -0.14 -0.31 -0.01 0.00 0.21 0.00 0.00 66.02 65.77 2qtv s SER 455 CO 0.02 0.30 -0.19 -0.31 0.41 0.00 0.00 173.24 173.47 2qtv s TYR 456 N -0.57 1.86 -0.10 2.43 1.51 0.11 -4.50 117.35 118.08 2qtv s TYR 456 Ca 0.09 -0.51 -0.21 0.00 -1.01 0.00 0.00 57.07 55.43 2qtv s TYR 456 Cb -0.09 -1.24 -0.04 0.00 -0.11 0.00 0.00 41.96 40.48 2qtv s TYR 456 CO -0.01 -0.16 0.60 0.00 -1.11 0.00 0.00 175.55 174.87 2qtv s ALA 457 N -0.08 3.42 -0.14 3.71 0.00 -0.44 0.14 121.76 128.37 2qtv s ALA 457 Ca -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 51.96 51.89 2qtv s ALA 457 Cb -0.11 -2.83 0.03 0.00 0.00 0.00 0.00 23.12 20.21 2qtv s ALA 457 CO 0.02 -0.11 -0.12 0.42 0.00 0.00 0.00 175.76 175.97 2qtv s ILE 458 N 0.85 1.41 -0.06 0.00 1.01 -0.20 -1.00 121.20 123.21 2qtv s ILE 458 Ca 0.32 -0.56 -0.04 0.00 0.00 0.00 0.00 60.65 60.36 2qtv s ILE 458 Cb -0.16 -1.37 -0.04 0.00 0.01 0.00 0.00 42.46 40.90 2qtv s ILE 458 CO 0.14 0.40 0.14 -0.36 0.00 0.00 0.00 174.94 175.26 2qtv s PHE 459 N 1.55 3.52 0.25 3.97 0.40 0.09 -1.58 117.98 126.18 2qtv s PHE 459 Ca 0.04 0.40 0.11 0.00 -0.60 0.00 0.00 56.93 56.88 2qtv s PHE 459 Cb -0.13 -1.86 -0.05 0.00 0.51 0.00 0.00 43.02 41.49 2qtv s PHE 459 CO -0.10 0.66 -0.19 -0.06 0.70 0.00 0.00 175.22 176.24 2qtv s PHE 460 N -1.17 2.14 -0.07 0.36 0.40 0.26 -0.39 117.98 119.51 2qtv s PHE 460 Ca 0.21 -0.39 0.01 0.00 -0.60 0.00 0.00 56.93 56.16 2qtv s PHE 460 Cb -0.12 -0.95 0.02 0.00 0.51 0.00 0.00 43.02 42.47 2qtv s PHE 460 CO 0.11 0.60 -0.08 -2.00 0.70 0.00 0.00 175.22 174.56 2qtv s GLU 461 N -3.43 1.28 0.02 0.44 2.12 -0.50 -4.20 118.70 114.42 2qtv s GLU 461 Ca 0.27 -0.23 -0.30 0.00 0.36 0.00 0.00 54.97 55.06 2qtv s GLU 461 Cb -0.04 -1.22 -0.07 0.00 0.26 0.00 0.00 34.13 33.06 2qtv s GLU 461 CO 0.12 -0.10 1.57 0.42 -0.54 0.00 0.00 175.26 176.73 2qtv s ILE 462 N 1.08 3.38 0.29 -3.70 -1.09 -1.26 -0.99 121.20 118.91 2qtv s ILE 462 Ca -0.08 0.74 0.07 0.00 -2.23 0.00 0.00 60.65 59.16 2qtv s ILE 462 Cb -0.14 -3.48 0.02 0.00 -1.58 0.00 0.00 42.46 37.28 2qtv s ILE 462 CO -0.01 -0.02 1.67 0.00 -1.23 0.00 0.00 174.94 175.36 2qtv h ALA 463 N 8.41 1.06 -2.54 9.38 0.00 -1.84 -3.37 119.26 130.36 2qtv h ALA 463 Ca -0.40 -0.45 -0.48 0.00 0.00 0.00 0.00 54.91 53.57 2qtv h ALA 463 Cb 1.19 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.90 2qtv h ALA 463 CO 0.93 0.63 0.41 1.21 0.00 0.00 0.00 179.25 182.43 2qtv s ASN 464 N -6.88 6.92 -0.30 0.00 3.04 -1.26 -4.88 114.94 111.57 2qtv s ASN 464 Ca -0.04 2.04 0.10 0.00 0.04 0.00 0.00 52.86 55.00 2qtv s ASN 464 Cb 0.13 -2.59 0.55 0.00 -1.54 0.00 0.00 41.25 37.80 2qtv s ASN 464 CO 0.77 -0.38 1.55 0.41 -3.04 0.00 0.00 177.10 176.41 2qtv n THR 465 N 0.21 2.63 -0.30 -5.21 -1.04 -1.26 0.43 114.28 109.74 2qtv n THR 465 Ca 0.04 -2.40 0.04 0.00 -2.04 0.00 0.00 64.05 59.68 2qtv n THR 465 Cb 0.49 -0.33 -0.01 0.00 -1.82 0.00 0.00 70.33 68.65 2qtv n THR 465 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2qtv n HIS 483 N -0.96 -2.32 -4.45 -1.42 1.44 -1.26 -4.99 115.22 101.26 2qtv n HIS 483 Ca 0.36 0.36 -0.32 0.00 -2.01 0.00 0.00 57.72 56.10 2qtv n HIS 483 Cb 1.13 -0.66 -0.10 0.00 0.12 0.00 0.00 29.99 30.48 2qtv n HIS 483 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2qtv s LEU 484 N 0.00 3.14 -0.19 2.39 1.43 -1.26 -1.95 118.68 122.24 2qtv s LEU 484 Ca 0.00 -0.17 -0.08 0.00 -1.03 0.00 0.00 54.13 52.85 2qtv s LEU 484 Cb 0.00 -1.81 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 2qtv s LEU 484 CO 0.00 0.27 0.08 0.00 0.23 0.00 0.00 176.35 176.93 2qtv s ALA 485 N -1.01 3.42 -0.07 4.21 0.00 0.18 -4.92 121.76 123.57 2qtv s ALA 485 Ca 0.17 -0.79 -0.02 0.00 0.00 0.00 0.00 51.96 51.33 2qtv s ALA 485 Cb -0.11 -1.99 -0.03 0.00 0.00 0.00 0.00 23.12 20.98 2qtv s ALA 485 CO 0.08 0.08 0.03 0.71 0.00 0.00 0.00 175.76 176.66 2qtv s TYR 486 N 0.55 3.22 -0.04 0.00 1.51 -1.26 -0.59 117.35 120.74 2qtv s TYR 486 Ca 0.04 0.22 0.00 0.00 -1.01 0.00 0.00 57.07 56.32 2qtv s TYR 486 Cb -0.13 -1.79 0.02 0.00 -0.11 0.00 0.00 41.96 39.96 2qtv s TYR 486 CO 0.01 0.51 -0.02 0.99 -1.11 0.00 0.00 175.55 175.93 2qtv s THR 487 N -0.97 0.34 -0.09 -0.71 2.01 -0.61 -1.60 115.64 114.02 2qtv s THR 487 Ca 0.15 0.02 0.02 0.00 0.31 0.00 0.00 61.69 62.19 2qtv s THR 487 Cb -0.12 -0.42 0.02 0.00 0.01 0.00 0.00 72.50 71.99 2qtv s THR 487 CO 0.05 0.20 -0.13 -1.58 -0.69 0.00 0.00 174.62 172.46 2qtv s GLN 488 N 1.16 1.95 -0.31 4.92 0.74 0.03 -0.75 119.66 127.40 2qtv s GLN 488 Ca -0.08 -0.47 -0.11 0.00 0.05 0.00 0.00 55.36 54.76 2qtv s GLN 488 Cb -0.14 -1.68 -0.02 0.00 1.10 0.00 0.00 33.01 32.28 2qtv s GLN 488 CO -0.02 -0.05 0.18 -0.06 -0.55 0.00 0.00 175.29 174.79 2qtv s PHE 489 N 0.96 3.19 -0.37 1.67 0.40 0.21 -0.58 117.98 123.46 2qtv s PHE 489 Ca -0.08 -0.30 -0.03 0.00 -0.60 0.00 0.00 56.93 55.91 2qtv s PHE 489 Cb -0.15 -2.38 0.08 0.00 0.51 0.00 0.00 43.02 41.08 2qtv s PHE 489 CO -0.00 -0.35 0.14 0.42 0.70 0.00 0.00 175.22 176.12 2qtv s ILE 490 N 1.68 3.30 -0.25 0.64 1.01 0.39 -0.91 121.20 127.05 2qtv s ILE 490 Ca 0.06 -1.75 -0.07 0.00 0.00 0.00 0.00 60.65 58.89 2qtv s ILE 490 Cb -0.17 -3.11 -0.02 0.00 0.01 0.00 0.00 42.46 39.17 2qtv s ILE 490 CO 0.08 -0.47 0.06 -0.89 0.00 0.00 0.00 174.94 173.72 2qtv s THR 491 N 1.21 4.19 -0.12 2.92 2.01 0.67 -1.18 115.64 125.34 2qtv s THR 491 Ca 0.03 -0.28 -0.05 0.00 0.31 0.00 0.00 61.69 61.70 2qtv s THR 491 Cb -0.22 -2.99 -0.04 0.00 0.01 0.00 0.00 72.50 69.27 2qtv s THR 491 CO -0.02 0.31 0.08 0.42 -0.69 0.00 0.00 174.62 174.72 2qtv s THR 492 N 1.59 5.02 0.21 -0.82 -4.23 -0.29 0.64 115.64 117.76 2qtv s THR 492 Ca 0.06 0.03 -0.22 0.00 -1.18 0.00 0.00 61.69 60.37 2qtv s THR 492 Cb -0.15 -3.18 0.05 0.00 1.34 0.00 0.00 72.50 70.56 2qtv s THR 492 CO 0.03 0.59 0.68 -0.72 -0.54 0.00 0.00 174.62 174.66 2qtv s TYR 493 N -0.77 -0.36 -0.33 3.99 -0.85 -0.39 -0.71 117.35 117.94 2qtv s TYR 493 Ca 0.13 0.03 -0.15 0.00 -0.52 0.00 0.00 57.07 56.56 2qtv s TYR 493 Cb -0.12 0.63 -0.02 0.00 0.38 0.00 0.00 41.96 42.84 2qtv s TYR 493 CO 0.03 -1.03 0.35 -1.14 -1.52 0.00 0.00 175.55 172.24 2qtv s GLN 494 N -3.80 3.62 0.12 -3.49 0.74 0.12 -1.16 119.66 115.81 2qtv s GLN 494 Ca 0.06 -0.38 -0.27 0.00 0.05 0.00 0.00 55.36 54.82 2qtv s GLN 494 Cb -0.03 -3.78 -0.07 0.00 1.10 0.00 0.00 33.01 30.22 2qtv s GLN 494 CO -0.03 -0.48 0.83 -1.58 -0.55 0.00 0.00 175.29 173.48 2qtv s HIS 495 N 2.00 3.84 -0.49 1.67 5.65 0.03 -2.30 115.29 125.69 2qtv s HIS 495 Ca 0.12 1.65 0.06 0.00 0.25 0.00 0.00 55.06 57.13 2qtv s HIS 495 Cb -0.16 -2.87 0.34 0.00 -1.18 0.00 0.00 32.58 28.70 2qtv s HIS 495 CO 0.11 0.35 1.09 0.43 -0.65 0.00 0.00 174.74 176.08 2qtv n SER 496 N 2.28 0.16 0.23 9.88 7.64 -1.26 -0.22 113.62 132.32 2qtv n SER 496 Ca -0.02 0.47 0.15 0.00 1.01 0.00 0.00 58.87 60.48 2qtv n SER 496 Cb 0.49 -0.47 0.49 0.00 -1.01 0.00 0.00 64.21 63.72 2qtv n SER 496 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2qtv h SER 497 N 0.00 0.00 0.00 6.43 4.64 -1.91 -3.45 113.55 119.26 2qtv h SER 497 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qtv h SER 497 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 2qtv h SER 497 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2qtv n GLY 498 N 0.43 1.64 3.29 -0.77 0.00 0.69 -5.11 105.19 105.36 2qtv n GLY 498 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 2qtv n GLY 498 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qtv s THR 499 N -2.00 1.71 -0.30 2.61 -4.23 -1.17 -3.89 115.64 108.38 2qtv s THR 499 Ca 0.00 -1.62 -0.16 0.00 -1.18 0.00 0.00 61.69 58.73 2qtv s THR 499 Cb 0.00 -1.60 -0.02 0.00 1.34 0.00 0.00 72.50 72.21 2qtv s THR 499 CO 0.00 -0.12 0.44 0.20 -0.54 0.00 0.00 174.62 174.60 2qtv s ASN 500 N -2.07 6.30 0.38 3.99 0.01 -1.22 -0.79 114.94 121.54 2qtv s ASN 500 Ca 0.08 0.19 0.07 0.00 -0.71 0.00 0.00 52.86 52.50 2qtv s ASN 500 Cb -0.09 -2.24 -0.07 0.00 0.41 0.00 0.00 41.25 39.25 2qtv s ASN 500 CO 0.05 -0.31 -0.01 -0.13 -1.51 0.00 0.00 177.10 175.18 2qtv s ARG 501 N 2.21 1.89 -0.04 -0.60 0.52 -0.30 -1.07 118.95 121.56 2qtv s ARG 501 Ca 0.17 -2.04 -0.00 0.00 -0.52 0.00 0.00 55.73 53.34 2qtv s ARG 501 Cb -0.16 -1.58 0.03 0.00 0.52 0.00 0.00 34.95 33.76 2qtv s ARG 501 CO 0.11 -0.01 0.01 0.42 0.02 0.00 0.00 175.30 175.85 2qtv s ILE 502 N -2.74 0.17 -0.18 1.52 1.01 -0.00 -1.26 121.20 119.72 2qtv s ILE 502 Ca 0.34 0.14 -0.10 0.00 0.00 0.00 0.00 60.65 61.03 2qtv s ILE 502 Cb 0.08 -0.30 -0.05 0.00 0.01 0.00 0.00 42.46 42.21 2qtv s ILE 502 CO 0.17 0.17 0.16 -0.13 0.00 0.00 0.00 174.94 175.31 2qtv s ARG 503 N 1.33 4.10 -0.12 2.79 1.81 0.21 0.52 118.95 129.58 2qtv s ARG 503 Ca -0.05 -0.15 -0.01 0.00 -1.72 0.00 0.00 55.73 53.80 2qtv s ARG 503 Cb -0.13 -3.39 0.03 0.00 -0.45 0.00 0.00 34.95 31.01 2qtv s ARG 503 CO -0.02 0.36 -0.06 0.08 -0.68 0.00 0.00 175.30 174.97 2qtv s VAL 504 N 0.18 0.95 -0.13 3.52 1.01 0.73 -0.24 120.40 126.43 2qtv s VAL 504 Ca 0.10 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.78 2qtv s VAL 504 Cb -0.11 -1.03 0.02 0.00 0.00 0.00 0.00 36.38 35.25 2qtv s VAL 504 CO -0.00 0.30 -0.15 -0.89 0.00 0.00 0.00 175.10 174.36 2qtv s THR 505 N 1.73 1.55 -0.08 3.92 2.01 -0.09 -1.31 115.64 123.37 2qtv s THR 505 Ca 0.04 -0.64 0.05 0.00 0.31 0.00 0.00 61.69 61.45 2qtv s THR 505 Cb -0.13 -1.43 -0.01 0.00 0.01 0.00 0.00 72.50 70.94 2qtv s THR 505 CO -0.08 0.45 -0.24 -0.89 -0.69 0.00 0.00 174.62 173.17 2qtv s THR 506 N 1.25 2.03 0.16 -0.82 2.01 0.02 0.66 115.64 120.95 2qtv s THR 506 Ca -0.01 -1.03 0.03 0.00 0.31 0.00 0.00 61.69 60.99 2qtv s THR 506 Cb -0.14 -1.73 -0.05 0.00 0.01 0.00 0.00 72.50 70.60 2qtv s THR 506 CO -0.06 0.56 -0.04 0.68 -0.69 0.00 0.00 174.62 175.07 2qtv s VAL 507 N 0.07 0.83 -0.03 3.82 -7.23 0.07 -4.81 120.40 113.14 2qtv s VAL 507 Ca -0.10 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.08 2qtv s VAL 507 Cb -0.16 -2.00 0.02 0.00 0.56 0.00 0.00 36.38 34.80 2qtv s VAL 507 CO 0.06 -0.60 -0.02 0.00 -0.31 0.00 0.00 175.10 174.24 2qtv s ALA 508 N -3.55 0.39 -0.05 1.32 0.00 -1.26 -1.57 121.76 117.04 2qtv s ALA 508 Ca 0.20 0.05 0.06 0.00 0.00 0.00 0.00 51.96 52.28 2qtv s ALA 508 Cb 0.05 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 2qtv s ALA 508 CO 0.02 -0.02 -0.22 -0.80 0.00 0.00 0.00 175.76 174.74 2qtv s ASN 509 N 0.75 2.73 0.39 0.00 0.01 0.25 -4.92 114.94 114.15 2qtv s ASN 509 Ca -0.08 -0.45 -0.24 0.00 -0.71 0.00 0.00 52.86 51.38 2qtv s ASN 509 Cb -0.11 -0.69 -0.09 0.00 0.41 0.00 0.00 41.25 40.77 2qtv s ASN 509 CO -0.01 0.22 1.05 -1.58 -1.51 0.00 0.00 177.10 175.27 2qtv s GLN 510 N -0.16 4.21 -0.16 -0.60 0.74 -1.26 0.49 119.66 122.92 2qtv s GLN 510 Ca -0.02 1.52 -0.01 0.00 0.05 0.00 0.00 55.36 56.90 2qtv s GLN 510 Cb -0.12 -2.59 -0.01 0.00 1.10 0.00 0.00 33.01 31.39 2qtv s GLN 510 CO 0.03 -0.10 -0.12 -0.51 -0.55 0.00 0.00 175.29 174.04 2qtv s LEU 511 N -2.54 2.68 0.10 3.68 1.43 -0.82 -1.14 118.68 122.06 2qtv s LEU 511 Ca 0.57 -0.39 0.05 0.00 -1.03 0.00 0.00 54.13 53.32 2qtv s LEU 511 Cb -0.22 -1.62 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 2qtv s LEU 511 CO 0.28 0.10 -0.12 -0.76 0.23 0.00 0.00 176.35 176.08 2qtv s LEU 512 N 0.77 2.37 0.72 1.79 1.43 -0.38 -4.26 118.68 121.12 2qtv s LEU 512 Ca -0.05 -0.75 -0.12 0.00 -1.03 0.00 0.00 54.13 52.18 2qtv s LEU 512 Cb -0.15 -0.43 0.03 0.00 0.03 0.00 0.00 46.19 45.67 2qtv s LEU 512 CO 0.01 -0.18 1.10 -2.84 0.23 0.00 0.00 176.35 174.67 2qtv s PRO 513 N -2.43 2.54 0.26 1.29 0.02 -1.26 -0.02 135.00 135.39 2qtv s PRO 513 Ca 0.04 1.25 -0.27 0.00 0.02 0.00 0.00 61.00 62.04 2qtv s PRO 513 Cb -0.06 -1.93 -0.16 0.00 0.02 0.00 0.00 34.50 32.38 2qtv s PRO 513 CO 0.02 -1.44 0.60 0.34 -0.33 0.00 0.00 177.00 176.19 2qtv n PHE 514 N -3.02 -0.21 0.00 6.54 7.35 -1.26 -1.89 117.46 124.97 2qtv n PHE 514 Ca 0.09 0.84 0.00 0.00 -0.76 0.00 0.00 57.45 57.62 2qtv n PHE 514 Cb 0.53 -2.02 0.00 0.00 0.35 0.00 0.00 39.48 38.34 2qtv n PHE 514 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2qtv n GLY 515 N 1.82 2.87 3.58 7.13 0.00 -1.26 -4.98 105.19 114.35 2qtv n GLY 515 Ca 0.15 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.63 2qtv n GLY 515 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2qtv n THR 516 N -1.20 0.30 -0.36 2.61 -1.04 -0.79 -4.80 114.28 108.99 2qtv n THR 516 Ca 0.00 -0.15 0.32 0.00 -2.04 0.00 0.00 64.05 62.19 2qtv n THR 516 Cb 0.00 -1.48 0.66 0.00 -1.82 0.00 0.00 70.33 67.68 2qtv n THR 516 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 2qtv h PRO 517 N 9.76 0.15 -0.27 -2.82 0.11 -1.93 -2.13 132.00 134.86 2qtv h PRO 517 Ca -0.38 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 65.78 2qtv h PRO 517 Cb 1.32 -0.03 -0.05 0.00 0.11 0.00 0.00 31.00 32.35 2qtv h PRO 517 CO 0.99 0.10 -0.03 0.00 -0.21 0.00 0.00 178.00 178.84 2qtv h ALA 518 N 1.48 0.21 -0.45 -0.75 0.00 -1.99 -2.79 119.26 114.98 2qtv h ALA 518 Ca 0.63 0.09 0.08 0.00 0.00 0.00 0.00 54.91 55.72 2qtv h ALA 518 Cb 2.14 0.16 -0.10 0.00 0.00 0.00 0.00 17.79 19.99 2qtv h ALA 518 CO -0.17 -0.44 -0.34 0.82 0.00 0.00 0.00 179.25 179.12 2qtv h ILE 519 N 0.04 0.20 -0.55 0.00 2.04 -1.66 0.96 117.51 118.56 2qtv h ILE 519 Ca 0.13 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.05 2qtv h ILE 519 Cb 0.18 0.20 -0.05 0.00 -0.74 0.00 0.00 36.82 36.41 2qtv h ILE 519 CO -0.24 0.00 0.24 0.00 0.00 0.00 0.00 178.15 178.15 2qtv h ALA 520 N 0.78 0.70 0.00 1.87 0.00 -1.68 -1.61 119.26 119.32 2qtv h ALA 520 Ca 0.18 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 2qtv h ALA 520 Cb 0.55 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 2qtv h ALA 520 CO -0.58 -0.13 -0.13 0.00 0.00 0.00 0.00 179.25 178.42 2qtv h ALA 521 N 1.33 1.51 -0.16 0.00 0.00 -0.83 -2.55 119.26 118.56 2qtv h ALA 521 Ca 0.26 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2qtv h ALA 521 Cb 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2qtv h ALA 521 CO -0.22 0.16 0.00 -1.13 0.00 0.00 0.00 179.25 178.06 2qtv n SER 522 N -3.98 0.88 -4.68 0.00 3.41 0.16 -4.87 113.62 104.55 2qtv n SER 522 Ca -0.02 -1.98 -0.42 0.00 -0.26 0.00 0.00 58.87 56.19 2qtv n SER 522 Cb 0.21 -0.11 -0.03 0.00 -0.26 0.00 0.00 64.21 64.03 2qtv n SER 522 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2qtv s PHE 523 N -1.78 3.45 -0.79 7.33 5.36 -0.96 -0.50 117.98 130.08 2qtv s PHE 523 Ca 0.12 1.45 -0.10 0.00 -0.96 0.00 0.00 56.93 57.44 2qtv s PHE 523 Cb 0.06 -3.13 0.21 0.00 -0.34 0.00 0.00 43.02 39.82 2qtv s PHE 523 CO 0.08 -0.26 0.70 0.34 -1.46 0.00 0.00 175.22 174.62 2qtv s ASP 524 N 1.13 6.34 0.58 6.13 -1.08 -0.36 -4.91 116.67 124.50 2qtv s ASP 524 Ca 0.44 -2.83 0.28 0.00 -0.52 0.00 0.00 52.55 49.91 2qtv s ASP 524 Cb -0.17 -2.10 1.54 0.00 -1.46 0.00 0.00 42.92 40.73 2qtv s ASP 524 CO 0.14 -0.48 2.02 0.06 0.52 0.00 0.00 175.17 177.43 2qtv h GLN 525 N 7.44 0.00 -0.05 4.34 3.07 -1.85 0.27 115.11 128.32 2qtv h GLN 525 Ca 0.08 0.00 -0.22 0.00 0.09 0.00 0.00 58.65 58.60 2qtv h GLN 525 Cb 1.00 0.00 0.02 0.00 0.08 0.00 0.00 27.48 28.57 2qtv h GLN 525 CO 0.76 0.00 -0.82 0.93 0.09 0.00 0.00 178.83 179.78 2qtv h GLU 526 N 0.00 0.65 0.00 0.06 5.08 -1.92 0.19 114.58 118.63 2qtv h GLU 526 Ca 0.16 -0.63 -0.12 0.00 -1.00 0.00 0.00 59.36 57.76 2qtv h GLU 526 Cb 0.79 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.18 2qtv h GLU 526 CO -0.00 1.23 -0.59 0.00 -1.00 0.00 0.00 179.01 178.65 2qtv h ALA 527 N 0.43 0.82 -0.13 3.43 0.00 -1.46 -2.27 119.26 120.08 2qtv h ALA 527 Ca -0.09 -0.54 -0.20 0.00 0.00 0.00 0.00 54.91 54.08 2qtv h ALA 527 Cb 1.48 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.18 2qtv h ALA 527 CO 0.16 0.74 -0.73 0.00 0.00 0.00 0.00 179.25 179.43 2qtv h ALA 528 N 1.41 0.47 -0.35 0.00 0.00 -0.50 -1.82 119.26 118.47 2qtv h ALA 528 Ca -0.01 -0.59 -0.08 0.00 0.00 0.00 0.00 54.91 54.23 2qtv h ALA 528 Cb 1.20 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2qtv h ALA 528 CO 0.08 0.72 -0.09 0.00 0.00 0.00 0.00 179.25 179.95 2qtv h ALA 529 N 0.76 0.48 -0.17 0.00 0.00 -0.83 -1.64 119.26 117.86 2qtv h ALA 529 Ca -0.04 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 2qtv h ALA 529 Cb 1.33 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 2qtv h ALA 529 CO 0.14 0.34 -0.14 0.28 0.00 0.00 0.00 179.25 179.86 2qtv h VAL 530 N 0.47 1.33 -0.31 0.00 2.07 -1.44 -1.94 116.25 116.43 2qtv h VAL 530 Ca 0.09 -1.27 -0.10 0.00 0.82 0.00 0.00 66.70 66.23 2qtv h VAL 530 Cb 0.60 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 32.13 2qtv h VAL 530 CO 0.04 0.38 -0.23 -0.07 0.02 0.00 0.00 177.57 177.71 2qtv h LEU 531 N 0.06 0.59 -0.73 2.57 3.38 -1.36 0.25 115.31 120.07 2qtv h LEU 531 Ca 0.03 -0.20 -0.11 0.00 0.09 0.00 0.00 57.88 57.69 2qtv h LEU 531 Cb 0.66 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 2qtv h LEU 531 CO 0.04 0.81 -0.25 0.24 0.09 0.00 0.00 178.44 179.37 2qtv h MET 532 N 0.52 0.70 -0.30 1.13 2.86 -1.31 -1.11 114.93 117.42 2qtv h MET 532 Ca 0.08 -0.29 -0.04 0.00 -2.06 0.00 0.00 59.70 57.39 2qtv h MET 532 Cb 0.67 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.29 2qtv h MET 532 CO 0.05 0.88 0.02 0.00 1.06 0.00 0.00 176.91 178.92 2qtv h ALA 533 N 1.12 0.40 -0.84 6.32 0.00 -0.89 0.02 119.26 125.39 2qtv h ALA 533 Ca 0.08 -0.22 0.12 0.00 0.00 0.00 0.00 54.91 54.90 2qtv h ALA 533 Cb 0.74 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.33 2qtv h ALA 533 CO 0.06 0.12 0.45 -0.09 0.00 0.00 0.00 179.25 179.79 2qtv h ARG 534 N 0.32 0.68 -0.45 0.00 9.65 -0.16 0.12 114.38 124.54 2qtv h ARG 534 Ca 0.09 -0.04 -0.13 0.00 -1.10 0.00 0.00 59.98 58.80 2qtv h ARG 534 Cb 0.40 -0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 28.81 2qtv h ARG 534 CO 0.01 0.45 -0.24 0.82 2.80 0.00 0.00 179.97 183.82 2qtv h ILE 535 N 0.70 1.27 -0.27 1.20 2.04 -0.89 -2.27 117.51 119.29 2qtv h ILE 535 Ca 0.43 -1.39 -0.04 0.00 1.00 0.00 0.00 64.86 64.86 2qtv h ILE 535 Cb 0.52 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 2qtv h ILE 535 CO -0.31 0.47 0.00 0.00 0.00 0.00 0.00 178.15 178.32 2qtv h ALA 536 N 0.92 1.51 0.06 1.87 0.00 0.11 -0.01 119.26 123.72 2qtv h ALA 536 Ca 0.10 -0.16 -0.26 0.00 0.00 0.00 0.00 54.91 54.59 2qtv h ALA 536 Cb 0.80 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.48 2qtv h ALA 536 CO 0.07 0.36 -1.10 0.28 0.00 0.00 0.00 179.25 178.85 2qtv h VAL 537 N 0.40 1.36 -0.42 0.00 2.07 -0.74 -0.87 116.25 118.05 2qtv h VAL 537 Ca 0.09 -2.52 -0.05 0.00 0.82 0.00 0.00 66.70 65.04 2qtv h VAL 537 Cb 0.26 2.59 -0.02 0.00 -1.52 0.00 0.00 31.29 32.59 2qtv h VAL 537 CO 0.01 0.76 0.05 -0.74 0.02 0.00 0.00 177.57 177.67 2qtv h HIS 538 N 0.24 0.66 -0.07 1.57 6.17 -0.90 -2.53 115.15 120.30 2qtv h HIS 538 Ca -0.13 -0.06 -0.22 0.00 0.71 0.00 0.00 60.37 60.66 2qtv h HIS 538 Cb 1.77 -0.19 0.01 0.00 2.52 0.00 0.00 27.41 31.51 2qtv h HIS 538 CO 0.08 0.60 -0.86 0.87 0.71 0.00 0.00 177.93 179.33 2qtv h LYS 539 N 0.62 0.60 0.00 5.26 1.57 -0.97 -3.13 116.57 120.51 2qtv h LYS 539 Ca 0.13 -0.55 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 2qtv h LYS 539 Cb 0.31 0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2qtv h LYS 539 CO 0.01 1.17 0.00 0.00 -0.57 0.00 0.00 179.45 180.06 2qtv n ALA 540 N -2.58 1.32 0.02 3.86 0.00 -0.34 -0.54 120.51 122.26 2qtv n ALA 540 Ca -0.07 0.12 -0.05 0.00 0.00 0.00 0.00 53.44 53.43 2qtv n ALA 540 Cb 0.79 -1.30 0.14 0.00 0.00 0.00 0.00 19.45 19.08 2qtv n ALA 540 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2qtv h GLU 541 N 0.00 0.47 0.00 0.00 5.08 -1.44 -3.41 114.58 115.29 2qtv h GLU 541 Ca 0.00 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 2qtv h GLU 541 Cb 0.16 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 2qtv h GLU 541 CO 0.00 0.79 0.00 2.41 -1.00 0.00 0.00 179.01 181.21 2qtv n THR 542 N -4.04 0.00 -1.15 1.13 -1.04 -0.55 -5.03 114.28 103.60 2qtv n THR 542 Ca -0.01 0.17 -0.35 0.00 -2.04 0.00 0.00 64.05 61.82 2qtv n THR 542 Cb 0.49 -1.09 0.09 0.00 -1.82 0.00 0.00 70.33 68.00 2qtv n THR 542 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2qtv n ASP 543 N -2.11 -0.82 -4.88 8.00 8.00 0.30 -4.96 116.55 120.09 2qtv n ASP 543 Ca 0.00 0.55 -0.31 0.00 0.71 0.00 0.00 54.79 55.74 2qtv n ASP 543 Cb 0.00 -1.28 -0.04 0.00 -0.02 0.00 0.00 41.12 39.77 2qtv n ASP 543 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 2qtv s ASP 544 N -1.70 6.57 0.21 -2.24 -4.77 -1.26 -4.32 116.67 109.15 2qtv s ASP 544 Ca 0.66 0.94 -0.09 0.00 -3.30 0.00 0.00 52.55 50.75 2qtv s ASP 544 Cb -0.31 -2.24 0.30 0.00 -1.09 0.00 0.00 42.92 39.58 2qtv s ASP 544 CO 0.58 -0.18 1.24 0.61 0.70 0.00 0.00 175.17 178.12 2qtv n GLY 545 N -0.59 -1.46 0.31 2.12 0.00 -1.26 -0.81 105.19 103.50 2qtv n GLY 545 Ca 0.01 0.87 0.08 0.00 0.00 0.00 0.00 46.02 46.98 2qtv n GLY 545 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qtv h ALA 546 N 1.40 1.92 -0.06 4.61 0.00 -1.94 -1.83 119.26 123.35 2qtv h ALA 546 Ca 0.34 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.18 2qtv h ALA 546 Cb 0.54 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2qtv h ALA 546 CO -0.81 0.03 -0.20 -0.44 0.00 0.00 0.00 179.25 177.83 2qtv h ASP 547 N 0.32 0.28 -0.88 0.00 3.32 -1.36 -2.41 116.42 115.68 2qtv h ASP 547 Ca 0.14 -0.62 -0.01 0.00 0.02 0.00 0.00 57.03 56.56 2qtv h ASP 547 Cb 0.17 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.60 2qtv h ASP 547 CO -0.03 0.85 0.51 0.58 -1.72 0.00 0.00 179.24 179.43 2qtv h VAL 548 N -0.28 1.25 -0.48 -1.35 2.07 -1.33 0.07 116.25 116.20 2qtv h VAL 548 Ca -0.01 -0.58 -0.09 0.00 0.82 0.00 0.00 66.70 66.84 2qtv h VAL 548 Cb 0.82 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 2qtv h VAL 548 CO 0.04 0.27 -0.06 0.40 0.02 0.00 0.00 177.57 178.25 2qtv h ILE 549 N 1.23 1.26 -0.20 4.57 2.04 -1.40 -0.69 117.51 124.32 2qtv h ILE 549 Ca 0.32 -1.12 -0.12 0.00 1.00 0.00 0.00 64.86 64.94 2qtv h ILE 549 Cb -0.02 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 2qtv h ILE 549 CO -0.06 0.39 -0.38 -0.09 0.00 0.00 0.00 178.15 178.02 2qtv h ARG 550 N 0.78 0.45 -0.49 2.37 2.43 -0.85 -1.02 114.38 118.05 2qtv h ARG 550 Ca 0.14 -0.21 -0.11 0.00 -0.81 0.00 0.00 59.98 58.99 2qtv h ARG 550 Cb 0.55 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.07 2qtv h ARG 550 CO 0.03 0.76 -0.13 2.35 -1.51 0.00 0.00 179.97 181.48 2qtv h TRP 551 N 0.38 1.03 -0.56 2.20 7.01 -0.55 0.11 115.95 125.57 2qtv h TRP 551 Ca 0.04 -0.21 -0.07 0.00 2.11 0.00 0.00 58.89 60.76 2qtv h TRP 551 Cb 0.84 -0.26 -0.02 0.00 -2.10 0.00 0.00 29.16 27.62 2qtv h TRP 551 CO 0.03 0.98 0.09 -0.07 -2.79 0.00 0.00 178.44 176.67 2qtv h LEU 552 N 0.82 0.89 -0.39 0.65 4.07 -0.79 -0.53 115.31 120.03 2qtv h LEU 552 Ca 0.13 -0.26 -0.09 0.00 0.08 0.00 0.00 57.88 57.74 2qtv h LEU 552 Cb 0.66 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 42.16 2qtv h LEU 552 CO 0.05 0.93 -0.10 0.44 -1.08 0.00 0.00 178.44 178.68 2qtv h ASP 553 N 0.82 0.77 -0.27 -0.43 3.32 -0.89 -1.90 116.42 117.84 2qtv h ASP 553 Ca 0.17 -0.36 -0.18 0.00 0.02 0.00 0.00 57.03 56.68 2qtv h ASP 553 Cb 0.42 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.76 2qtv h ASP 553 CO 0.01 0.95 -0.52 0.03 -1.72 0.00 0.00 179.24 177.99 2qtv h ARG 554 N 0.57 0.84 -0.25 3.56 3.08 -0.66 -2.05 114.38 119.48 2qtv h ARG 554 Ca 0.10 -0.54 -0.09 0.00 0.07 0.00 0.00 59.98 59.53 2qtv h ARG 554 Cb 0.62 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.72 2qtv h ARG 554 CO 0.04 1.17 -0.22 1.79 -1.07 0.00 0.00 179.97 181.67 2qtv h THR 555 N 0.60 1.25 0.13 2.04 1.35 -1.12 -2.33 112.91 114.84 2qtv h THR 555 Ca 0.01 -1.19 -0.01 0.00 -0.55 0.00 0.00 66.41 64.67 2qtv h THR 555 Cb 1.13 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 68.87 2qtv h THR 555 CO 0.12 0.38 -0.06 0.25 -0.25 0.00 0.00 175.52 175.95 2qtv h LEU 556 N 0.41 -0.15 -0.21 3.87 5.85 -1.18 -1.05 115.31 122.84 2qtv h LEU 556 Ca 0.06 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.82 2qtv h LEU 556 Cb 0.62 0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.63 2qtv h LEU 556 CO 0.04 -0.08 -0.15 0.40 -0.34 0.00 0.00 178.44 178.31 2qtv h ILE 557 N -0.20 0.57 -0.68 4.05 2.04 -1.17 -1.67 117.51 120.45 2qtv h ILE 557 Ca -0.02 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 2qtv h ILE 557 Cb 0.15 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 36.77 2qtv h ILE 557 CO 0.03 0.00 0.39 0.11 0.00 0.00 0.00 178.15 178.68 2qtv h LYS 558 N -0.15 0.93 -0.35 2.37 1.57 -1.24 0.11 116.57 119.81 2qtv h LYS 558 Ca 0.12 -0.10 0.03 0.00 -1.87 0.00 0.00 60.65 58.84 2qtv h LYS 558 Cb 0.33 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 2qtv h LYS 558 CO -0.30 0.68 0.15 1.25 -0.57 0.00 0.00 179.45 180.66 2qtv h LEU 559 N 0.93 0.20 0.17 2.94 5.85 -0.86 -2.66 115.31 121.88 2qtv h LEU 559 Ca 0.24 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.98 2qtv h LEU 559 Cb 0.00 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.03 2qtv h LEU 559 CO -0.04 0.15 -0.08 0.00 -0.34 0.00 0.00 178.44 178.13 2qtv h GLN 561 N -0.36 0.14 0.03 0.00 4.20 -0.71 0.34 115.11 118.74 2qtv h GLN 561 Ca -0.02 -0.01 -0.27 0.00 0.06 0.00 0.00 58.65 58.41 2qtv h GLN 561 Cb 0.28 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.00 2qtv h GLN 561 CO 0.04 0.09 -1.47 -0.22 -0.67 0.00 0.00 178.83 176.60 2qtv h LYS 562 N 0.14 0.06 0.00 1.46 3.64 -1.22 -3.41 116.57 117.24 2qtv h LYS 562 Ca 0.48 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.75 2qtv h LYS 562 Cb 1.64 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.50 2qtv h LYS 562 CO -0.08 0.80 -0.90 0.66 -2.27 0.00 0.00 179.45 177.66 2qtv n TYR 563 N -3.24 0.00 -1.90 1.91 4.02 -0.49 -5.02 117.16 112.45 2qtv n TYR 563 Ca -0.12 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.47 2qtv n TYR 563 Cb 1.02 -0.10 0.04 0.00 -0.02 0.00 0.00 39.34 40.28 2qtv n TYR 563 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2qtv s ALA 564 N -2.27 2.94 -0.11 -0.72 0.00 0.11 -4.71 121.76 117.00 2qtv s ALA 564 Ca 0.00 -0.32 -0.01 0.00 0.00 0.00 0.00 51.96 51.64 2qtv s ALA 564 Cb 0.07 -3.02 -0.03 0.00 0.00 0.00 0.00 23.12 20.15 2qtv s ALA 564 CO 0.41 -1.06 -0.08 -0.51 0.00 0.00 0.00 175.76 174.52 2qtv s ASP 565 N -4.33 4.53 0.05 0.00 1.01 0.26 -4.92 116.67 113.26 2qtv s ASP 565 Ca 0.58 -0.13 -0.28 0.00 0.71 0.00 0.00 52.55 53.42 2qtv s ASP 565 Cb -0.11 -1.46 0.10 0.00 1.01 0.00 0.00 42.92 42.46 2qtv s ASP 565 CO 0.52 0.25 1.16 -0.72 0.21 0.00 0.00 175.17 176.59 2qtv s TYR 566 N -0.15 -0.07 -0.05 4.23 -0.85 -1.26 -0.33 117.35 118.86 2qtv s TYR 566 Ca 0.02 -0.11 0.00 0.00 -0.52 0.00 0.00 57.07 56.46 2qtv s TYR 566 Cb -0.13 0.58 -0.03 0.00 0.38 0.00 0.00 41.96 42.76 2qtv s TYR 566 CO 0.03 -0.50 -0.01 -0.80 -1.52 0.00 0.00 175.55 172.75 2qtv s ASN 567 N -2.97 5.06 0.42 -0.18 0.01 -1.26 -5.01 114.94 111.00 2qtv s ASN 567 Ca 0.14 0.04 -0.25 0.00 -0.71 0.00 0.00 52.86 52.08 2qtv s ASN 567 Cb 0.02 -1.35 -0.10 0.00 0.41 0.00 0.00 41.25 40.23 2qtv s ASN 567 CO -0.01 0.33 1.13 0.29 -1.51 0.00 0.00 177.10 177.33 2qtv n LYS 568 N 1.84 1.61 -1.42 -0.60 4.76 -1.26 -1.45 118.16 121.64 2qtv n LYS 568 Ca -0.17 0.57 -0.14 0.00 -2.87 0.00 0.00 58.31 55.71 2qtv n LYS 568 Cb 0.53 -2.20 -0.06 0.00 -1.84 0.00 0.00 35.03 31.47 2qtv n LYS 568 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2qtv n ASP 569 N 0.36 -3.60 -3.66 4.39 8.00 0.17 -4.87 116.55 117.34 2qtv n ASP 569 Ca 0.08 0.33 -0.29 0.00 0.71 0.00 0.00 54.79 55.62 2qtv n ASP 569 Cb 0.39 -3.34 -0.08 0.00 -0.02 0.00 0.00 41.12 38.07 2qtv n ASP 569 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2qtv n ASP 570 N -0.58 3.87 -0.32 -2.24 -0.08 -0.53 -4.96 116.55 111.71 2qtv n ASP 570 Ca -0.14 -3.36 0.22 0.00 -1.51 0.00 0.00 54.79 50.00 2qtv n ASP 570 Cb 0.45 -0.78 0.43 0.00 2.34 0.00 0.00 41.12 43.56 2qtv n ASP 570 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2qtv h PRO 571 N 4.75 0.24 0.00 -0.67 0.11 -1.83 0.95 132.00 135.55 2qtv h PRO 571 Ca 0.18 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.28 2qtv h PRO 571 Cb 0.69 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.75 2qtv h PRO 571 CO 0.85 0.16 0.00 1.04 -0.21 0.00 0.00 178.00 179.85 2qtv n GLN 572 N -5.13 0.53 0.00 1.05 6.02 -1.26 -2.81 117.38 115.78 2qtv n GLN 572 Ca 0.30 0.00 0.13 0.00 -0.01 0.00 0.00 57.00 57.41 2qtv n GLN 572 Cb 0.93 -1.50 0.35 0.00 1.02 0.00 0.00 30.24 31.04 2qtv n GLN 572 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2qtv n SER 573 N -1.23 0.40 -4.67 1.08 3.41 0.33 -4.91 113.62 108.03 2qtv n SER 573 Ca 0.16 -0.11 -0.48 0.00 -0.26 0.00 0.00 58.87 58.18 2qtv n SER 573 Cb 0.21 0.06 -0.05 0.00 -0.26 0.00 0.00 64.21 64.18 2qtv n SER 573 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2qtv n PHE 574 N -1.45 2.20 -3.77 7.33 7.35 -1.12 -4.26 117.46 123.72 2qtv n PHE 574 Ca 0.06 0.23 -0.13 0.00 -0.76 0.00 0.00 57.45 56.86 2qtv n PHE 574 Cb 0.33 -2.55 -0.13 0.00 0.35 0.00 0.00 39.48 37.48 2qtv n PHE 574 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 2qtv s ARG 575 N 2.03 0.16 -0.04 -4.13 1.81 0.55 -4.95 118.95 114.38 2qtv s ARG 575 Ca 0.85 0.35 0.05 0.00 -1.72 0.00 0.00 55.73 55.26 2qtv s ARG 575 Cb -0.74 -0.05 -0.01 0.00 -0.45 0.00 0.00 34.95 33.71 2qtv s ARG 575 CO 0.45 -0.10 -0.21 -1.17 -0.68 0.00 0.00 175.30 173.59 2qtv s LEU 576 N 0.72 1.99 0.77 2.53 2.96 -1.26 0.88 118.68 127.27 2qtv s LEU 576 Ca -0.05 -0.42 -0.14 0.00 -0.22 0.00 0.00 54.13 53.30 2qtv s LEU 576 Cb -0.07 -1.14 0.06 0.00 0.50 0.00 0.00 46.19 45.54 2qtv s LEU 576 CO -0.04 0.20 1.19 0.00 -1.32 0.00 0.00 176.35 176.39 2qtv s ALA 577 N -0.12 1.99 0.54 5.97 0.00 -1.26 -4.53 121.76 124.34 2qtv s ALA 577 Ca -0.02 0.80 0.33 0.00 0.00 0.00 0.00 51.96 53.07 2qtv s ALA 577 Cb -0.12 -3.46 1.50 0.00 0.00 0.00 0.00 23.12 21.03 2qtv s ALA 577 CO 0.02 -2.07 1.87 -1.35 0.00 0.00 0.00 175.76 174.23 2qtv h PRO 578 N -0.66 0.01 -0.15 0.00 0.11 -2.00 0.20 132.00 129.51 2qtv h PRO 578 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2qtv h PRO 578 Cb 1.29 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2qtv h PRO 578 CO 0.48 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.54 2qtv n ASN 579 N -4.25 0.98 0.00 -2.05 6.94 -1.26 -3.62 115.26 111.99 2qtv n ASN 579 Ca 0.20 -1.82 0.00 0.00 -0.02 0.00 0.00 54.58 52.95 2qtv n ASN 579 Cb 1.03 -0.10 0.00 0.00 -2.36 0.00 0.00 39.78 38.35 2qtv n ASN 579 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 2qtv n PHE 580 N -0.04 0.00 -0.16 -2.53 3.01 -0.19 -4.09 117.46 113.45 2qtv n PHE 580 Ca 0.10 0.00 0.29 0.00 1.01 0.00 0.00 57.45 58.85 2qtv n PHE 580 Cb 0.18 0.00 0.70 0.00 -0.01 0.00 0.00 39.48 40.36 2qtv n PHE 580 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2qtv h SER 581 N 0.00 0.00 0.81 4.37 4.64 -1.10 -1.37 113.55 120.90 2qtv h SER 581 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2qtv h SER 581 Cb 0.38 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2qtv h SER 581 CO 0.00 0.00 -1.20 0.18 -0.87 0.00 0.00 176.83 174.94 2qtv n LEU 582 N -3.89 0.70 -0.16 5.97 4.77 -1.26 -4.31 117.00 118.81 2qtv n LEU 582 Ca 0.19 0.27 -0.02 0.00 -0.03 0.00 0.00 56.01 56.41 2qtv n LEU 582 Cb 1.07 -0.04 0.05 0.00 -2.33 0.00 0.00 43.42 42.16 2qtv n LEU 582 CO 0.34 -0.14 0.81 0.22 -1.33 0.00 0.00 177.39 177.28 2qtv h TYR 583 N 0.00 -0.13 -0.52 -1.77 3.20 -1.55 -0.13 116.97 116.08 2qtv h TYR 583 Ca -0.01 0.04 0.06 0.00 3.14 0.00 0.00 58.73 61.97 2qtv h TYR 583 Cb 1.02 0.13 -0.03 0.00 1.54 0.00 0.00 36.73 39.39 2qtv h TYR 583 CO 0.00 -0.16 0.35 -1.35 -1.64 0.00 0.00 178.16 175.36 2qtv h PRO 584 N 0.06 0.43 -0.24 1.82 0.11 -1.75 -1.09 132.00 131.35 2qtv h PRO 584 Ca 0.25 -0.03 -0.20 0.00 0.11 0.00 0.00 66.00 66.14 2qtv h PRO 584 Cb 0.38 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.40 2qtv h PRO 584 CO -0.46 0.29 -0.62 0.37 -0.21 0.00 0.00 178.00 177.37 2qtv h GLN 585 N 0.45 0.82 -0.49 1.05 4.15 -1.29 -2.06 115.11 117.74 2qtv h GLN 585 Ca 0.23 -0.57 -0.07 0.00 0.77 0.00 0.00 58.65 59.01 2qtv h GLN 585 Cb 0.33 0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.08 2qtv h GLN 585 CO -0.06 1.19 0.02 0.74 -1.93 0.00 0.00 178.83 178.79 2qtv h PHE 586 N 0.61 0.92 -0.35 3.99 0.05 -0.61 -2.75 116.94 118.81 2qtv h PHE 586 Ca -0.01 -0.15 0.04 0.00 3.82 0.00 0.00 57.97 61.67 2qtv h PHE 586 Cb 1.23 -0.24 -0.04 0.00 2.00 0.00 0.00 35.95 38.90 2qtv h PHE 586 CO 0.07 0.87 0.12 1.15 -0.18 0.00 0.00 178.31 180.35 2qtv h THR 587 N 0.71 0.91 -0.74 -1.55 2.02 -1.15 0.10 112.91 113.21 2qtv h THR 587 Ca 0.14 -0.09 0.08 0.00 0.77 0.00 0.00 66.41 67.31 2qtv h THR 587 Cb 0.49 0.61 -0.07 0.00 -1.74 0.00 0.00 68.15 67.44 2qtv h THR 587 CO 0.02 0.05 0.40 0.22 0.37 0.00 0.00 175.52 176.58 2qtv h TYR 588 N 0.27 0.73 0.01 3.16 3.20 -1.19 0.10 116.97 123.25 2qtv h TYR 588 Ca 0.16 0.03 -0.20 0.00 3.14 0.00 0.00 58.73 61.86 2qtv h TYR 588 Cb 0.13 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 2qtv h TYR 588 CO -0.14 0.30 -0.91 1.88 -1.64 0.00 0.00 178.16 177.65 2qtv h TYR 589 N 0.70 0.11 0.10 -3.82 -1.99 -1.16 -3.21 116.97 107.69 2qtv h TYR 589 Ca 0.35 -0.07 -0.01 0.00 2.00 0.00 0.00 58.73 61.01 2qtv h TYR 589 Cb 0.31 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.03 2qtv h TYR 589 CO -0.08 0.94 -0.05 1.25 -0.00 0.00 0.00 178.16 180.22 2qtv h LEU 590 N 0.03 -0.12 -1.96 3.88 5.85 -0.32 -1.80 115.31 120.87 2qtv h LEU 590 Ca -0.03 -0.34 0.16 0.00 0.84 0.00 0.00 57.88 58.51 2qtv h LEU 590 Cb 1.59 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.62 2qtv h LEU 590 CO 0.13 0.30 0.42 0.08 -0.34 0.00 0.00 178.44 179.02 2qtv h ARG 591 N -0.56 0.04 -0.60 1.25 0.11 -1.09 0.95 114.38 114.49 2qtv h ARG 591 Ca -0.01 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.06 2qtv h ARG 591 Cb 0.45 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.52 2qtv h ARG 591 CO 0.02 0.02 0.00 2.89 0.10 0.00 0.00 179.97 183.01 2qtv n ARG 592 N -4.38 2.64 -1.71 0.08 1.85 -1.16 -4.50 116.66 109.48 2qtv n ARG 592 Ca 0.11 -2.53 -0.29 0.00 -1.00 0.00 0.00 57.85 54.14 2qtv n ARG 592 Cb 0.63 -1.55 0.10 0.00 -1.05 0.00 0.00 32.46 30.59 2qtv n ARG 592 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 2qtv s SER 593 N -1.21 4.25 0.00 2.89 1.04 0.33 -4.78 113.70 116.22 2qtv s SER 593 Ca 0.45 0.97 0.20 0.00 0.48 0.00 0.00 55.95 58.05 2qtv s SER 593 Cb 0.25 -1.56 1.08 0.00 0.10 0.00 0.00 66.02 65.89 2qtv s SER 593 CO 0.33 -2.08 1.61 0.00 0.98 0.00 0.00 173.24 174.08 2qtv n GLN 594 N -3.46 0.42 0.06 4.02 6.02 -1.26 -0.98 117.38 122.21 2qtv n GLN 594 Ca 0.07 0.06 -0.12 0.00 -0.01 0.00 0.00 57.00 57.00 2qtv n GLN 594 Cb 0.59 -1.50 -0.13 0.00 1.02 0.00 0.00 30.24 30.22 2qtv n GLN 594 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 2qtv h PHE 595 N 0.00 0.27 0.00 1.08 -1.00 -1.91 -3.39 116.94 111.99 2qtv h PHE 595 Ca 0.00 -0.20 -0.21 0.00 2.81 0.00 0.00 57.97 60.37 2qtv h PHE 595 Cb 0.11 -0.01 -0.04 0.00 3.61 0.00 0.00 35.95 39.62 2qtv h PHE 595 CO 0.00 1.19 -1.79 1.28 -1.61 0.00 0.00 178.31 177.38 2qtv n LEU 596 N -3.40 0.19 -4.23 1.54 4.77 -1.08 -4.89 117.00 109.90 2qtv n LEU 596 Ca -0.09 -0.01 -0.39 0.00 -0.03 0.00 0.00 56.01 55.49 2qtv n LEU 596 Cb 1.01 0.23 -0.10 0.00 -2.33 0.00 0.00 43.42 42.22 2qtv n LEU 596 CO 0.50 0.31 -0.12 -0.55 -1.33 0.00 0.00 177.39 176.20 2qtv s SER 597 N -4.47 5.54 -0.42 -1.43 0.15 -0.15 -4.68 113.70 108.24 2qtv s SER 597 Ca -0.07 -1.64 0.04 0.00 0.70 0.00 0.00 55.95 54.99 2qtv s SER 597 Cb 0.03 -1.95 0.65 0.00 -1.71 0.00 0.00 66.02 63.05 2qtv s SER 597 CO 0.46 -0.55 1.88 1.33 1.20 0.00 0.00 173.24 177.56 2qtv n VAL 598 N 4.85 3.11 -2.40 4.45 0.24 -1.26 -4.35 118.33 122.96 2qtv n VAL 598 Ca -0.09 -1.83 -0.35 0.00 -2.04 0.00 0.00 64.34 60.03 2qtv n VAL 598 Cb 0.42 -0.48 -0.02 0.00 -1.47 0.00 0.00 33.84 32.30 2qtv n VAL 598 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 2qtv s PHE 599 N -3.16 2.88 -2.01 6.34 5.36 -1.26 -2.64 117.98 123.50 2qtv s PHE 599 Ca 0.55 1.57 0.00 0.00 -0.96 0.00 0.00 56.93 58.08 2qtv s PHE 599 Cb 0.46 -3.20 0.00 0.00 -0.34 0.00 0.00 43.02 39.94 2qtv s PHE 599 CO 0.11 -1.18 0.00 -1.71 -1.46 0.00 0.00 175.22 170.98 2qtv n ASN 600 N -0.94 -5.11 -4.44 6.13 5.15 -1.26 -4.95 115.26 109.84 2qtv n ASN 600 Ca 0.09 0.43 -0.23 0.00 -0.60 0.00 0.00 54.58 54.28 2qtv n ASN 600 Cb 0.51 -4.52 -0.10 0.00 -0.53 0.00 0.00 39.78 35.14 2qtv n ASN 600 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 2qtv s ASN 601 N -2.58 3.37 0.15 1.20 0.02 -1.08 -5.15 114.94 110.88 2qtv s ASN 601 Ca 0.00 -1.03 0.05 0.00 -1.02 0.00 0.00 52.86 50.86 2qtv s ASN 601 Cb 0.00 -0.26 -0.04 0.00 0.02 0.00 0.00 41.25 40.97 2qtv s ASN 601 CO 0.00 -0.01 0.12 -0.94 0.02 0.00 0.00 177.10 176.29 2qtv s SER 602 N -3.47 5.48 0.18 -1.22 1.04 -1.26 -4.74 113.70 109.70 2qtv s SER 602 Ca 0.28 -0.12 -0.13 0.00 0.48 0.00 0.00 55.95 56.46 2qtv s SER 602 Cb -0.04 -1.42 0.15 0.00 0.10 0.00 0.00 66.02 64.81 2qtv s SER 602 CO 0.13 0.09 1.75 -0.65 0.98 0.00 0.00 173.24 175.54 2qtv h PRO 603 N 2.58 0.32 -0.51 4.02 0.11 -1.93 -0.35 132.00 136.23 2qtv h PRO 603 Ca -0.47 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.62 2qtv h PRO 603 Cb 1.19 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 2qtv h PRO 603 CO 0.63 0.21 0.34 -0.44 -0.21 0.00 0.00 178.00 178.53 2qtv h ASP 604 N 0.33 0.58 0.17 -2.05 5.19 -1.94 0.14 116.42 118.84 2qtv h ASP 604 Ca 0.23 -0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.61 2qtv h ASP 604 Cb 0.24 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 39.61 2qtv h ASP 604 CO -0.24 0.42 -0.08 -0.08 -3.12 0.00 0.00 179.24 176.14 2qtv h GLU 605 N 0.69 -0.22 -0.85 3.56 4.81 -1.60 -1.33 114.58 119.64 2qtv h GLU 605 Ca 0.19 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.44 2qtv h GLU 605 Cb -0.07 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.32 2qtv h GLU 605 CO -0.04 -0.05 0.56 1.15 -0.73 0.00 0.00 179.01 179.90 2qtv h THR 606 N -0.35 1.22 -0.70 0.32 2.02 -0.62 -1.75 112.91 113.06 2qtv h THR 606 Ca -0.02 -0.41 -0.03 0.00 0.77 0.00 0.00 66.41 66.71 2qtv h THR 606 Cb 0.27 -0.03 -0.03 0.00 -1.74 0.00 0.00 68.15 66.62 2qtv h THR 606 CO 0.04 0.22 0.30 0.00 0.37 0.00 0.00 175.52 176.44 2qtv h ALA 607 N 1.31 1.21 -0.25 6.16 0.00 -0.79 -1.72 119.26 125.17 2qtv h ALA 607 Ca 0.31 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 2qtv h ALA 607 Cb -0.13 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 2qtv h ALA 607 CO -0.07 0.59 -0.01 0.35 0.00 0.00 0.00 179.25 180.11 2qtv h PHE 608 N 1.00 0.49 -0.59 0.00 3.57 -0.68 -1.62 116.94 119.11 2qtv h PHE 608 Ca 0.24 -0.09 -0.01 0.00 3.53 0.00 0.00 57.97 61.64 2qtv h PHE 608 Cb 0.16 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.75 2qtv h PHE 608 CO 0.01 0.62 0.31 1.88 -2.23 0.00 0.00 178.31 178.91 2qtv h TYR 609 N 0.22 0.82 -0.23 0.41 0.99 -1.02 -2.58 116.97 115.59 2qtv h TYR 609 Ca 0.07 -0.03 -0.12 0.00 2.00 0.00 0.00 58.73 60.65 2qtv h TYR 609 Cb 0.43 -0.26 -0.01 0.00 1.00 0.00 0.00 36.73 37.88 2qtv h TYR 609 CO 0.04 0.61 -0.37 0.00 -0.00 0.00 0.00 178.16 178.43 2qtv h ARG 610 N 0.80 0.51 0.08 4.88 3.08 -1.30 -2.04 114.38 120.39 2qtv h ARG 610 Ca 0.21 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2qtv h ARG 610 Cb 0.07 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.11 2qtv h ARG 610 CO -0.03 0.81 -0.06 1.25 -1.07 0.00 0.00 179.97 180.87 2qtv h HIS 611 N 0.43 -0.16 0.08 3.04 2.76 -1.07 -2.38 115.15 117.85 2qtv h HIS 611 Ca 0.04 -0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.21 2qtv h HIS 611 Cb 0.84 0.06 0.00 0.00 1.55 0.00 0.00 27.41 29.86 2qtv h HIS 611 CO 0.03 -0.10 -0.04 0.82 -1.30 0.00 0.00 177.93 177.35 2qtv h ILE 612 N -0.14 0.98 -0.79 6.26 2.04 -1.37 -3.10 117.51 121.39 2qtv h ILE 612 Ca -0.00 -0.20 0.11 0.00 1.00 0.00 0.00 64.86 65.78 2qtv h ILE 612 Cb 0.13 1.11 -0.08 0.00 -0.74 0.00 0.00 36.82 37.24 2qtv h ILE 612 CO -0.01 0.05 0.41 0.15 0.00 0.00 0.00 178.15 178.75 2qtv h PHE 613 N -0.19 0.73 0.00 1.37 3.57 -1.31 -1.74 116.94 119.37 2qtv h PHE 613 Ca -0.01 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2qtv h PHE 613 Cb 0.16 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.69 2qtv h PHE 613 CO -0.04 0.24 0.00 0.25 -2.23 0.00 0.00 178.31 176.52 2qtv n THR 614 N -4.84 0.15 0.00 4.41 -2.24 -0.90 -2.56 114.28 108.30 2qtv n THR 614 Ca 0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 2qtv n THR 614 Cb 0.33 -0.57 0.00 0.00 -2.10 0.00 0.00 70.33 68.00 2qtv n THR 614 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2qtv n ARG 615 N 0.09 3.10 -1.89 -0.78 0.63 -0.68 -3.94 116.66 113.18 2qtv n ARG 615 Ca 0.00 0.00 -0.31 0.00 -0.92 0.00 0.00 57.85 56.62 2qtv n ARG 615 Cb 0.28 -0.68 0.02 0.00 0.45 0.00 0.00 32.46 32.53 2qtv n ARG 615 CO 0.00 0.00 0.00 -2.00 -2.51 0.00 0.00 177.63 173.12 2qtv s GLU 616 N -0.92 3.48 0.69 -0.14 2.56 -1.05 -0.67 118.70 122.65 2qtv s GLU 616 Ca 0.00 0.69 -0.01 0.00 0.00 0.00 0.00 54.97 55.65 2qtv s GLU 616 Cb 0.00 -2.08 0.11 0.00 2.00 0.00 0.00 34.13 34.16 2qtv s GLU 616 CO 0.00 -0.64 0.96 0.16 -0.56 0.00 0.00 175.26 175.19 2qtv s ASP 617 N -4.21 4.51 0.25 -1.70 3.84 -1.26 -4.51 116.67 113.59 2qtv s ASP 617 Ca 0.55 -0.26 -0.04 0.00 -0.00 0.00 0.00 52.55 52.81 2qtv s ASP 617 Cb -0.11 -0.21 0.43 0.00 -1.38 0.00 0.00 42.92 41.64 2qtv s ASP 617 CO 0.53 -1.74 1.80 0.74 -0.00 0.00 0.00 175.17 176.50 2qtv h THR 618 N -0.44 0.86 0.41 2.11 2.02 -1.97 0.82 112.91 116.72 2qtv h THR 618 Ca -0.38 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 66.53 2qtv h THR 618 Cb 1.27 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 2qtv h THR 618 CO 0.43 0.13 -0.20 0.74 0.37 0.00 0.00 175.52 177.00 2qtv h THR 619 N 0.73 0.57 0.00 3.16 2.02 -1.98 -2.10 112.91 115.32 2qtv h THR 619 Ca 0.41 -0.36 -0.05 0.00 0.77 0.00 0.00 66.41 67.17 2qtv h THR 619 Cb 0.44 0.75 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 2qtv h THR 619 CO -0.28 0.07 -0.26 0.78 0.37 0.00 0.00 175.52 176.20 2qtv h ASN 620 N -0.77 0.00 -0.15 4.18 2.35 -1.91 -2.87 115.58 116.42 2qtv h ASN 620 Ca -0.06 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.55 2qtv h ASN 620 Cb 0.53 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.89 2qtv h ASN 620 CO 0.09 0.26 -0.40 0.28 -1.65 0.00 0.00 177.43 176.00 2qtv h SER 621 N 0.00 0.73 -0.60 5.81 0.02 -0.73 -2.67 113.55 116.10 2qtv h SER 621 Ca -0.00 -0.33 -0.06 0.00 -0.84 0.00 0.00 61.79 60.56 2qtv h SER 621 Cb 0.50 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.81 2qtv h SER 621 CO 0.03 1.04 0.13 -0.07 -1.14 0.00 0.00 176.83 176.83 2qtv h LEU 622 N 0.56 0.92 -0.98 5.07 3.38 -1.17 -1.65 115.31 121.43 2qtv h LEU 622 Ca 0.05 -0.24 0.04 0.00 0.09 0.00 0.00 57.88 57.82 2qtv h LEU 622 Cb 0.94 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 41.38 2qtv h LEU 622 CO 0.08 0.92 0.64 0.40 0.09 0.00 0.00 178.44 180.58 2qtv h ILE 623 N 0.88 1.15 -0.32 1.22 2.04 -1.36 0.64 117.51 121.75 2qtv h ILE 623 Ca 0.19 -0.42 -0.12 0.00 1.00 0.00 0.00 64.86 65.50 2qtv h ILE 623 Cb 0.37 -0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.26 2qtv h ILE 623 CO 0.00 0.22 -0.31 0.24 0.00 0.00 0.00 178.15 178.31 2qtv h MET 624 N 1.23 0.69 -0.02 2.37 2.86 -1.12 -2.03 114.93 118.90 2qtv h MET 624 Ca 0.40 -0.31 -0.02 0.00 -2.06 0.00 0.00 59.70 57.71 2qtv h MET 624 Cb 0.04 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.68 2qtv h MET 624 CO -0.13 0.91 -0.08 0.82 1.06 0.00 0.00 176.91 179.49 2qtv h ILE 625 N 0.58 1.51 -2.87 -1.22 2.04 -0.37 -3.41 117.51 113.77 2qtv h ILE 625 Ca 0.07 -1.60 -0.59 0.00 1.00 0.00 0.00 64.86 63.73 2qtv h ILE 625 Cb 0.81 2.53 -0.40 0.00 -0.74 0.00 0.00 36.82 39.03 2qtv h ILE 625 CO 0.07 0.43 -0.78 -1.58 0.00 0.00 0.00 178.15 176.29 2qtv s GLN 626 N -3.57 0.92 0.69 2.37 0.74 0.21 -4.31 119.66 116.71 2qtv s GLN 626 Ca -0.16 -1.60 -0.17 0.00 0.05 0.00 0.00 55.36 53.48 2qtv s GLN 626 Cb 0.01 -1.90 -0.06 0.00 1.10 0.00 0.00 33.01 32.16 2qtv s GLN 626 CO 0.70 -1.15 0.41 -2.30 -0.55 0.00 0.00 175.29 172.41 2qtv n PRO 627 N 3.95 0.30 -3.28 1.67 -0.02 -0.77 -4.35 135.00 132.50 2qtv n PRO 627 Ca 0.08 0.13 -0.39 0.00 -2.02 0.00 0.00 63.50 61.30 2qtv n PRO 627 Cb 0.37 -1.70 -0.06 0.00 -0.02 0.00 0.00 33.50 32.08 2qtv n PRO 627 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2qtv s THR 628 N -1.89 4.78 -0.13 3.45 2.01 -0.56 -4.87 115.64 118.43 2qtv s THR 628 Ca 0.64 1.19 -0.00 0.00 0.31 0.00 0.00 61.69 63.83 2qtv s THR 628 Cb -0.37 -3.89 0.03 0.00 0.01 0.00 0.00 72.50 68.28 2qtv s THR 628 CO 0.59 0.54 -0.09 -0.22 -0.69 0.00 0.00 174.62 174.75 2qtv s LEU 629 N -0.98 1.41 -0.08 4.42 2.96 -1.26 -1.13 118.68 124.02 2qtv s LEU 629 Ca 0.29 -0.43 0.04 0.00 -0.22 0.00 0.00 54.13 53.82 2qtv s LEU 629 Cb -0.19 -0.95 -0.00 0.00 0.50 0.00 0.00 46.19 45.55 2qtv s LEU 629 CO 0.18 -0.12 -0.23 -0.89 -1.32 0.00 0.00 176.35 173.98 2qtv s THR 630 N 1.63 1.97 -0.19 3.68 2.01 -0.47 -0.91 115.64 123.36 2qtv s THR 630 Ca 0.04 -0.98 -0.07 0.00 0.31 0.00 0.00 61.69 60.99 2qtv s THR 630 Cb -0.13 -1.70 -0.04 0.00 0.01 0.00 0.00 72.50 70.64 2qtv s THR 630 CO -0.09 0.54 0.05 -0.55 -0.69 0.00 0.00 174.62 173.88 2qtv s SER 631 N 0.22 5.43 -0.06 3.53 0.15 0.61 -0.99 113.70 122.59 2qtv s SER 631 Ca -0.14 0.01 0.01 0.00 0.70 0.00 0.00 55.95 56.53 2qtv s SER 631 Cb -0.17 -1.93 -0.03 0.00 -1.71 0.00 0.00 66.02 62.18 2qtv s SER 631 CO 0.07 0.15 -0.08 -0.36 1.20 0.00 0.00 173.24 174.22 2qtv s PHE 632 N 0.53 2.91 0.22 3.44 0.40 -0.15 -1.40 117.98 123.93 2qtv s PHE 632 Ca 0.02 -0.00 0.04 0.00 -0.60 0.00 0.00 56.93 56.39 2qtv s PHE 632 Cb -0.13 -1.70 -0.01 0.00 0.51 0.00 0.00 43.02 41.69 2qtv s PHE 632 CO 0.01 0.32 0.21 -1.13 0.70 0.00 0.00 175.22 175.33 2qtv n SER 633 N 2.22 -0.56 -0.06 1.36 3.41 -1.25 -1.94 113.62 116.79 2qtv n SER 633 Ca -0.18 -2.37 -0.08 0.00 -0.26 0.00 0.00 58.87 55.98 2qtv n SER 633 Cb 0.53 1.22 -0.07 0.00 -0.26 0.00 0.00 64.21 65.63 2qtv n SER 633 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 2qtv h MET 634 N 0.00 0.00 -0.02 4.33 4.05 -1.95 -3.35 114.93 117.99 2qtv h MET 634 Ca -0.16 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.26 2qtv h MET 634 Cb 0.77 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.57 2qtv h MET 634 CO 0.23 0.51 0.00 0.39 0.23 0.00 0.00 176.91 178.27 2qtv n GLU 635 N -4.67 1.07 -4.02 0.39 4.71 -1.26 -4.91 120.64 111.95 2qtv n GLU 635 Ca -0.07 -0.10 -0.10 0.00 -0.01 0.00 0.00 57.16 56.88 2qtv n GLU 635 Cb 0.28 -1.26 -0.07 0.00 -1.01 0.00 0.00 31.44 29.37 2qtv n GLU 635 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 2qtv s ASP 636 N -1.50 0.03 0.45 1.62 1.01 -1.26 -5.16 116.67 111.86 2qtv s ASP 636 Ca 0.25 -0.99 -0.07 0.00 0.71 0.00 0.00 52.55 52.45 2qtv s ASP 636 Cb 0.12 0.46 -0.05 0.00 1.01 0.00 0.00 42.92 44.46 2qtv s ASP 636 CO 0.19 -0.95 0.76 -1.81 0.21 0.00 0.00 175.17 173.58 2qtv s ASP 637 N -3.02 6.35 0.36 0.27 -0.00 -1.26 -3.86 116.67 115.51 2qtv s ASP 637 Ca 0.23 0.97 -0.25 0.00 -0.00 0.00 0.00 52.55 53.49 2qtv s ASP 637 Cb 0.03 -2.26 -0.13 0.00 -0.00 0.00 0.00 42.92 40.56 2qtv s ASP 637 CO 0.05 -0.50 0.86 -2.65 -0.00 0.00 0.00 175.17 172.93 2qtv n PRO 638 N -1.89 1.07 -3.77 8.23 -0.02 -1.26 -4.70 135.00 132.65 2qtv n PRO 638 Ca 0.01 0.38 -0.13 0.00 -2.02 0.00 0.00 63.50 61.74 2qtv n PRO 638 Cb 0.55 -1.78 -0.11 0.00 -0.02 0.00 0.00 33.50 32.15 2qtv n PRO 638 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 2qtv s GLN 639 N -1.69 0.42 0.11 -0.52 0.74 -0.49 -4.97 119.66 113.26 2qtv s GLN 639 Ca 0.62 0.27 -0.31 0.00 0.05 0.00 0.00 55.36 55.99 2qtv s GLN 639 Cb -0.64 0.20 -0.07 0.00 1.10 0.00 0.00 33.01 33.60 2qtv s GLN 639 CO 0.58 -0.07 1.31 -2.14 -0.55 0.00 0.00 175.29 174.42 2qtv s PRO 640 N -0.19 4.37 0.21 1.67 0.02 -1.26 -0.29 135.00 139.53 2qtv s PRO 640 Ca -0.03 1.96 0.09 0.00 0.02 0.00 0.00 61.00 63.03 2qtv s PRO 640 Cb -0.03 -3.28 -0.05 0.00 0.02 0.00 0.00 34.50 31.17 2qtv s PRO 640 CO 0.01 -0.35 -0.17 0.14 -0.33 0.00 0.00 177.00 176.31 2qtv s VAL 641 N 0.96 1.92 0.29 3.83 -7.23 -0.09 -4.89 120.40 115.20 2qtv s VAL 641 Ca 0.61 -2.15 -0.30 0.00 -1.81 0.00 0.00 61.98 58.34 2qtv s VAL 641 Cb -0.34 -2.03 -0.11 0.00 0.56 0.00 0.00 36.38 34.46 2qtv s VAL 641 CO 0.31 -0.45 1.57 -0.76 -0.31 0.00 0.00 175.10 175.45 2qtv s LEU 642 N -3.12 4.35 -0.94 1.32 1.02 -1.26 -4.39 118.68 115.66 2qtv s LEU 642 Ca 0.22 2.91 -0.16 0.00 0.02 0.00 0.00 54.13 57.12 2qtv s LEU 642 Cb -0.03 -3.63 -0.10 0.00 0.02 0.00 0.00 46.19 42.44 2qtv s LEU 642 CO 0.08 -0.88 2.06 -0.11 0.02 0.00 0.00 176.35 177.52 2qtv n LEU 643 N 2.14 4.88 -4.33 1.79 7.94 -1.26 -4.63 117.00 123.54 2qtv n LEU 643 Ca 0.08 -3.12 -0.17 0.00 -1.11 0.00 0.00 56.01 51.69 2qtv n LEU 643 Cb 0.38 -1.20 -0.10 0.00 0.53 0.00 0.00 43.42 43.03 2qtv n LEU 643 CO 0.63 0.20 -0.34 -0.62 -1.11 0.00 0.00 177.39 176.15 2qtv s ASP 644 N 4.21 1.89 0.33 1.96 -1.08 -1.26 -2.46 116.67 120.26 2qtv s ASP 644 Ca 0.52 -1.19 0.17 0.00 -0.52 0.00 0.00 52.55 51.53 2qtv s ASP 644 Cb 0.13 -0.01 0.42 0.00 -1.46 0.00 0.00 42.92 42.01 2qtv s ASP 644 CO 0.04 -0.48 1.61 0.77 0.52 0.00 0.00 175.17 177.63 2qtv h SER 645 N 2.50 0.00 0.15 -0.34 4.64 -1.68 -3.11 113.55 115.70 2qtv h SER 645 Ca -0.38 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.92 2qtv h SER 645 Cb 1.22 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2qtv h SER 645 CO 0.65 0.44 -0.08 -0.29 -0.87 0.00 0.00 176.83 176.67 2qtv h ILE 646 N 0.00 0.79 0.00 0.95 2.10 -1.84 -2.12 117.51 117.39 2qtv h ILE 646 Ca -0.00 -0.32 0.00 0.00 1.08 0.00 0.00 64.86 65.62 2qtv h ILE 646 Cb 1.11 1.19 0.00 0.00 -1.09 0.00 0.00 36.82 38.03 2qtv h ILE 646 CO 0.06 0.08 0.00 -1.20 -1.08 0.00 0.00 178.15 176.01 2qtv n SER 647 N -4.05 0.45 -4.66 2.19 7.64 -1.17 -4.70 113.62 109.31 2qtv n SER 647 Ca -0.03 0.59 -0.43 0.00 1.01 0.00 0.00 58.87 60.02 2qtv n SER 647 Cb 0.17 -0.69 -0.02 0.00 -1.01 0.00 0.00 64.21 62.65 2qtv n SER 647 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2qtv s VAL 648 N -3.17 4.54 -0.01 0.44 1.01 -0.80 -5.02 120.40 117.39 2qtv s VAL 648 Ca 0.07 1.86 0.02 0.00 0.00 0.00 0.00 61.98 63.93 2qtv s VAL 648 Cb 0.11 -4.20 -0.00 0.00 0.00 0.00 0.00 36.38 32.28 2qtv s VAL 648 CO 0.40 -0.16 -0.06 -0.54 0.00 0.00 0.00 175.10 174.74 2qtv s LYS 649 N 3.28 0.51 0.61 2.72 1.02 -1.26 -4.48 119.74 122.13 2qtv s LYS 649 Ca 0.48 -0.21 0.31 0.00 0.02 0.00 0.00 55.97 56.56 2qtv s LYS 649 Cb -0.17 -0.49 1.76 0.00 -0.52 0.00 0.00 37.83 38.41 2qtv s LYS 649 CO 0.09 0.12 2.13 -1.00 -0.92 0.00 0.00 175.35 175.78 2qtv h PRO 650 N 6.04 0.00 -0.51 -1.68 0.13 -1.95 -2.34 132.00 131.69 2qtv h PRO 650 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2qtv h PRO 650 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2qtv h PRO 650 CO 0.50 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.54 2qtv n ASN 651 N -3.64 4.36 -4.02 1.44 2.04 -1.26 -1.00 115.26 113.19 2qtv n ASN 651 Ca 0.00 -2.54 -0.08 0.00 -0.44 0.00 0.00 54.58 51.52 2qtv n ASN 651 Cb 0.28 -0.52 -0.11 0.00 -2.53 0.00 0.00 39.78 36.90 2qtv n ASN 651 CO 0.00 0.00 0.00 0.42 -0.44 0.00 0.00 177.26 177.24 2qtv s THR 652 N -2.00 0.15 -0.02 5.53 -4.23 -0.88 -4.62 115.64 109.57 2qtv s THR 652 Ca 0.45 -1.25 -0.01 0.00 -1.18 0.00 0.00 61.69 59.69 2qtv s THR 652 Cb 0.30 -0.77 -0.04 0.00 1.34 0.00 0.00 72.50 73.34 2qtv s THR 652 CO 0.19 -0.69 0.10 -0.63 -0.54 0.00 0.00 174.62 173.05 2qtv s ILE 653 N -2.44 4.89 0.01 2.99 1.01 -0.82 -2.13 121.20 124.71 2qtv s ILE 653 Ca -0.07 -0.31 0.08 0.00 0.00 0.00 0.00 60.65 60.35 2qtv s ILE 653 Cb -0.03 -3.23 -0.02 0.00 0.01 0.00 0.00 42.46 39.19 2qtv s ILE 653 CO -0.05 0.38 -0.24 -0.76 0.00 0.00 0.00 174.94 174.27 2qtv s LEU 654 N -1.68 2.11 -0.26 2.97 1.43 0.56 -0.98 118.68 122.83 2qtv s LEU 654 Ca 0.23 -0.50 -0.01 0.00 -1.03 0.00 0.00 54.13 52.82 2qtv s LEU 654 Cb -0.12 -1.22 0.04 0.00 0.03 0.00 0.00 46.19 44.92 2qtv s LEU 654 CO 0.13 0.26 -0.06 -0.22 0.23 0.00 0.00 176.35 176.70 2qtv s LEU 655 N -0.89 3.42 -0.18 1.79 2.96 -0.16 -0.27 118.68 125.33 2qtv s LEU 655 Ca 0.10 -1.10 -0.05 0.00 -0.22 0.00 0.00 54.13 52.86 2qtv s LEU 655 Cb -0.09 -1.65 -0.03 0.00 0.50 0.00 0.00 46.19 44.92 2qtv s LEU 655 CO 0.01 -0.18 -0.00 -0.22 -1.32 0.00 0.00 176.35 174.64 2qtv s LEU 656 N 1.25 3.34 -0.26 -0.68 2.96 0.91 -1.37 118.68 124.83 2qtv s LEU 656 Ca -0.03 -0.14 0.03 0.00 -0.22 0.00 0.00 54.13 53.77 2qtv s LEU 656 Cb -0.18 -1.84 0.06 0.00 0.50 0.00 0.00 46.19 44.73 2qtv s LEU 656 CO -0.04 0.11 -0.10 -0.62 -1.32 0.00 0.00 176.35 174.38 2qtv s ASP 657 N 0.72 4.48 0.00 3.68 2.15 -0.29 -0.22 116.67 127.20 2qtv s ASP 657 Ca 0.00 -1.40 0.18 0.00 0.43 0.00 0.00 52.55 51.77 2qtv s ASP 657 Cb -0.14 -1.56 0.52 0.00 -0.30 0.00 0.00 42.92 41.43 2qtv s ASP 657 CO 0.02 -0.20 1.43 0.35 -0.17 0.00 0.00 175.17 176.60 2qtv n THR 658 N 4.44 0.97 0.00 1.71 -2.24 -0.86 -1.49 114.28 116.81 2qtv n THR 658 Ca -0.14 -0.99 0.00 0.00 -2.27 0.00 0.00 64.05 60.66 2qtv n THR 658 Cb 0.42 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 2qtv n THR 658 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2qtv n PHE 659 N 1.24 0.00 0.13 4.78 7.35 -1.26 -4.41 117.46 125.30 2qtv n PHE 659 Ca 0.20 0.00 -0.00 0.00 -0.76 0.00 0.00 57.45 56.89 2qtv n PHE 659 Cb 0.55 0.00 0.11 0.00 0.35 0.00 0.00 39.48 40.49 2qtv n PHE 659 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 2qtv h PHE 660 N 0.00 0.00 -2.75 -5.13 -1.00 -1.95 -3.41 116.94 102.70 2qtv h PHE 660 Ca 0.00 0.00 -0.09 0.00 2.81 0.00 0.00 57.97 60.69 2qtv h PHE 660 Cb 0.00 0.00 -0.19 0.00 3.61 0.00 0.00 35.95 39.37 2qtv h PHE 660 CO 0.00 0.63 -0.11 -0.59 -1.61 0.00 0.00 178.31 176.63 2qtv s PHE 661 N -3.25 -0.33 -0.11 -0.55 -0.12 -1.26 -2.02 117.98 110.34 2qtv s PHE 661 Ca 0.01 0.49 0.00 0.00 -0.05 0.00 0.00 56.93 57.38 2qtv s PHE 661 Cb 0.10 0.21 -0.02 0.00 -0.63 0.00 0.00 43.02 42.69 2qtv s PHE 661 CO 0.75 -0.49 -0.10 0.42 -0.05 0.00 0.00 175.22 175.74 2qtv s ILE 662 N -1.56 3.33 -0.02 -4.49 1.01 -0.50 -2.02 121.20 116.94 2qtv s ILE 662 Ca -0.11 -0.58 0.04 0.00 0.00 0.00 0.00 60.65 60.00 2qtv s ILE 662 Cb -0.03 -2.39 -0.01 0.00 0.01 0.00 0.00 42.46 40.05 2qtv s ILE 662 CO 0.04 0.54 -0.14 -0.22 0.00 0.00 0.00 174.94 175.17 2qtv s LEU 663 N -0.04 1.98 -0.15 2.97 0.20 0.70 -0.41 118.68 123.93 2qtv s LEU 663 Ca -0.02 -0.26 -0.01 0.00 0.69 0.00 0.00 54.13 54.54 2qtv s LEU 663 Cb -0.14 -0.74 -0.01 0.00 -0.43 0.00 0.00 46.19 44.87 2qtv s LEU 663 CO 0.03 0.16 -0.12 -0.63 -0.29 0.00 0.00 176.35 175.50 2qtv s ILE 664 N -0.21 3.04 -0.17 6.68 1.01 0.13 -0.06 121.20 131.62 2qtv s ILE 664 Ca 0.03 -0.65 0.01 0.00 0.00 0.00 0.00 60.65 60.04 2qtv s ILE 664 Cb -0.07 -2.29 0.02 0.00 0.01 0.00 0.00 42.46 40.13 2qtv s ILE 664 CO -0.00 0.51 -0.20 -0.47 0.00 0.00 0.00 174.94 174.78 2qtv s TYR 665 N 0.58 2.68 -0.29 3.97 5.04 0.62 -1.19 117.35 128.77 2qtv s TYR 665 Ca -0.07 -1.52 -0.13 0.00 -2.44 0.00 0.00 57.07 52.90 2qtv s TYR 665 Cb -0.15 -1.86 -0.04 0.00 0.35 0.00 0.00 41.96 40.26 2qtv s TYR 665 CO 0.03 -0.74 0.29 -1.01 -1.34 0.00 0.00 175.55 172.78 2qtv s HIS 666 N 1.17 3.23 1.05 4.97 3.76 -0.36 -0.32 115.29 128.79 2qtv s HIS 666 Ca 0.02 0.18 -0.11 0.00 -0.15 0.00 0.00 55.06 54.99 2qtv s HIS 666 Cb -0.14 -2.51 0.22 0.00 1.11 0.00 0.00 32.58 31.27 2qtv s HIS 666 CO -0.10 -0.25 1.08 0.20 -0.85 0.00 0.00 174.74 174.83 2qtv s GLY 667 N 1.71 1.61 0.05 -2.22 0.00 -0.91 -1.12 107.32 106.44 2qtv s GLY 667 Ca 0.11 0.23 -0.10 0.00 0.00 0.00 0.00 44.72 44.96 2qtv s GLY 667 CO 0.11 0.81 1.16 0.83 0.00 0.00 0.00 173.10 176.01 2qtv h GLU 668 N -2.30 -0.03 -0.87 2.90 5.08 -1.75 0.30 114.58 117.90 2qtv h GLU 668 Ca -0.53 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 57.87 2qtv h GLU 668 Cb 1.30 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.50 2qtv h GLU 668 CO 0.46 -0.02 0.56 0.37 -1.00 0.00 0.00 179.01 179.38 2qtv h GLN 669 N -0.03 1.04 -0.62 2.33 4.15 -1.42 0.83 115.11 121.40 2qtv h GLN 669 Ca 0.04 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.37 2qtv h GLN 669 Cb 0.14 -0.23 -0.03 0.00 0.21 0.00 0.00 27.48 27.56 2qtv h GLN 669 CO -0.26 0.69 0.24 0.82 -1.93 0.00 0.00 178.83 178.39 2qtv h ILE 670 N 1.07 1.22 -0.49 2.39 2.04 -1.01 -1.27 117.51 121.46 2qtv h ILE 670 Ca 0.36 -0.69 -0.13 0.00 1.00 0.00 0.00 64.86 65.40 2qtv h ILE 670 Cb 0.05 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.60 2qtv h ILE 670 CO -0.13 0.27 -0.21 0.00 0.00 0.00 0.00 178.15 178.09 2qtv h ALA 671 N 1.38 0.71 0.21 1.87 0.00 -0.04 -2.06 119.26 121.33 2qtv h ALA 671 Ca 0.21 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.74 2qtv h ALA 671 Cb 0.18 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2qtv h ALA 671 CO -0.02 0.67 -0.30 1.96 0.00 0.00 0.00 179.25 181.56 2qtv h GLN 672 N 0.86 -0.56 0.00 0.00 4.20 -0.01 -0.60 115.11 119.00 2qtv h GLN 672 Ca 0.11 0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.84 2qtv h GLN 672 Cb 0.78 0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.69 2qtv h GLN 672 CO 0.06 -0.37 -0.08 -1.49 -0.67 0.00 0.00 178.83 176.28 2qtv h TRP 673 N -0.58 0.00 -0.18 2.96 6.55 -1.22 0.59 115.95 124.07 2qtv h TRP 673 Ca 0.01 0.00 -0.08 0.00 0.95 0.00 0.00 58.89 59.76 2qtv h TRP 673 Cb 0.57 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 28.86 2qtv h TRP 673 CO -0.23 0.08 -0.22 -0.09 -1.05 0.00 0.00 178.44 176.94 2qtv h ARG 674 N 0.00 0.46 -0.25 0.49 2.43 -0.79 -0.42 114.38 116.30 2qtv h ARG 674 Ca -0.00 -0.26 -0.10 0.00 -0.81 0.00 0.00 59.98 58.81 2qtv h ARG 674 Cb 0.15 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 2qtv h ARG 674 CO 0.01 0.84 -0.29 -0.22 -1.51 0.00 0.00 179.97 178.80 2qtv h LYS 675 N 0.11 0.50 0.35 0.20 3.64 -0.62 -3.09 116.57 117.65 2qtv h LYS 675 Ca 0.02 -0.21 -0.02 0.00 -1.27 0.00 0.00 60.65 59.18 2qtv h LYS 675 Cb 0.77 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.58 2qtv h LYS 675 CO 0.05 0.74 -0.17 0.00 -2.27 0.00 0.00 179.45 177.81 2qtv h ALA 676 N 1.26 -0.46 0.00 5.00 0.00 -0.76 -3.48 119.26 120.81 2qtv h ALA 676 Ca 0.06 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2qtv h ALA 676 Cb 0.73 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2qtv h ALA 676 CO 0.06 -0.71 0.00 0.41 0.00 0.00 0.00 179.25 179.01 2qtv n GLY 677 N -0.99 0.96 0.47 0.00 0.00 -0.18 -5.01 105.19 100.44 2qtv n GLY 677 Ca -0.10 0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.20 2qtv n GLY 677 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2qtv n TYR 678 N 0.00 0.00 0.22 1.61 4.02 -1.12 0.81 117.16 122.70 2qtv n TYR 678 Ca 0.00 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 57.99 2qtv n TYR 678 Cb 0.00 -0.26 0.43 0.00 -0.02 0.00 0.00 39.34 39.49 2qtv n TYR 678 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 2qtv h GLN 679 N 0.00 0.00 0.00 -0.72 7.50 -1.82 -3.26 115.11 116.81 2qtv h GLN 679 Ca 0.50 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.65 2qtv h GLN 679 Cb 2.55 0.00 0.00 0.00 0.05 0.00 0.00 27.48 30.08 2qtv h GLN 679 CO -0.01 0.20 0.00 -0.25 -1.50 0.00 0.00 178.83 177.28 2qtv n ASP 680 N -3.32 0.00 -4.32 1.46 8.00 0.24 -4.77 116.55 113.85 2qtv n ASP 680 Ca 0.01 0.30 -0.19 0.00 0.71 0.00 0.00 54.79 55.62 2qtv n ASP 680 Cb 0.45 -0.43 -0.11 0.00 -0.02 0.00 0.00 41.12 41.01 2qtv n ASP 680 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 2qtv s ASP 681 N -2.85 2.46 1.12 -2.24 1.47 -1.23 -5.14 116.67 110.26 2qtv s ASP 681 Ca 0.16 -0.92 -0.15 0.00 1.18 0.00 0.00 52.55 52.82 2qtv s ASP 681 Cb 0.16 -0.12 0.19 0.00 -0.34 0.00 0.00 42.92 42.81 2qtv s ASP 681 CO 0.41 -0.12 0.59 -0.81 0.68 0.00 0.00 175.17 175.92 2qtv n PRO 682 N 0.05 -1.86 0.00 2.11 -0.04 -1.26 -3.11 135.00 130.89 2qtv n PRO 682 Ca -0.11 -0.52 0.00 0.00 -0.04 0.00 0.00 63.50 62.83 2qtv n PRO 682 Cb 0.59 -1.98 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 2qtv n PRO 682 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2qtv n GLN 683 N -3.57 0.00 -2.49 0.54 7.27 -1.26 -4.70 117.38 113.16 2qtv n GLN 683 Ca 0.03 0.00 -0.42 0.00 0.07 0.00 0.00 57.00 56.68 2qtv n GLN 683 Cb 0.57 -0.05 0.01 0.00 2.41 0.00 0.00 30.24 33.17 2qtv n GLN 683 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 2qtv n TYR 684 N 0.00 2.67 -0.01 3.69 0.53 -1.18 -4.15 117.16 118.71 2qtv n TYR 684 Ca 0.00 -2.71 0.05 0.00 -1.02 0.00 0.00 57.90 54.21 2qtv n TYR 684 Cb 0.00 -1.69 -0.07 0.00 -1.03 0.00 0.00 39.34 36.54 2qtv n TYR 684 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2qtv n ALA 685 N 2.66 2.34 -0.02 -0.72 0.00 -1.26 -3.81 120.51 119.69 2qtv n ALA 685 Ca 0.39 -0.24 -0.12 0.00 0.00 0.00 0.00 53.44 53.48 2qtv n ALA 685 Cb 0.33 -0.32 0.01 0.00 0.00 0.00 0.00 19.45 19.48 2qtv n ALA 685 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2qtv h ASP 686 N 0.00 0.75 0.06 0.00 5.19 -1.97 -0.68 116.42 119.77 2qtv h ASP 686 Ca -0.01 -0.42 -0.20 0.00 -0.62 0.00 0.00 57.03 55.79 2qtv h ASP 686 Cb 0.46 -0.22 0.02 0.00 0.18 0.00 0.00 39.33 39.77 2qtv h ASP 686 CO 0.00 1.17 -0.80 0.15 -3.12 0.00 0.00 179.24 176.63 2qtv h PHE 687 N 0.51 0.69 -0.70 4.55 3.57 -1.89 -1.75 116.94 121.92 2qtv h PHE 687 Ca 0.00 -0.42 0.01 0.00 3.53 0.00 0.00 57.97 61.09 2qtv h PHE 687 Cb 1.15 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.79 2qtv h PHE 687 CO 0.06 1.27 0.46 -0.22 -2.23 0.00 0.00 178.31 177.65 2qtv h LYS 688 N -0.08 0.93 0.27 1.11 3.64 -1.65 -2.17 116.57 118.62 2qtv h LYS 688 Ca -0.12 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.19 2qtv h LYS 688 Cb 1.54 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 33.15 2qtv h LYS 688 CO 0.16 0.62 -0.13 0.00 -2.27 0.00 0.00 179.45 177.82 2qtv h ALA 689 N 1.56 -0.37 -0.94 5.00 0.00 -1.14 -3.05 119.26 120.32 2qtv h ALA 689 Ca 0.26 -0.18 0.22 0.00 0.00 0.00 0.00 54.91 55.21 2qtv h ALA 689 Cb -0.11 0.14 -0.17 0.00 0.00 0.00 0.00 17.79 17.65 2qtv h ALA 689 CO -0.06 -0.55 -0.10 1.25 0.00 0.00 0.00 179.25 179.79 2qtv h LEU 690 N -0.68 -0.65 -1.45 0.00 5.85 -0.83 0.34 115.31 117.89 2qtv h LEU 690 Ca -0.04 0.27 -0.04 0.00 0.84 0.00 0.00 57.88 58.91 2qtv h LEU 690 Cb 0.47 0.51 -0.01 0.00 0.37 0.00 0.00 40.66 42.00 2qtv h LEU 690 CO 0.06 -0.31 -0.11 -0.07 -0.34 0.00 0.00 178.44 177.67 2qtv h LEU 691 N 0.02 0.21 0.00 2.25 3.38 -1.33 -3.19 115.31 116.65 2qtv h LEU 691 Ca 0.51 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.44 2qtv h LEU 691 Cb 0.91 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.60 2qtv h LEU 691 CO -0.91 0.35 -1.12 -0.62 0.09 0.00 0.00 178.44 176.23 2qtv n GLU 692 N -4.30 0.60 0.25 1.13 -0.58 0.04 -4.31 120.64 113.47 2qtv n GLU 692 Ca -0.01 0.08 -0.16 0.00 -0.42 0.00 0.00 57.16 56.65 2qtv n GLU 692 Cb 0.25 -1.78 -0.08 0.00 -0.57 0.00 0.00 31.44 29.26 2qtv n GLU 692 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 2qtv h GLU 693 N 0.00 -0.65 -0.55 3.49 4.57 -1.36 -1.44 114.58 118.64 2qtv h GLU 693 Ca 0.00 0.04 0.09 0.00 -1.18 0.00 0.00 59.36 58.31 2qtv h GLU 693 Cb 0.99 0.15 -0.07 0.00 -0.16 0.00 0.00 28.75 29.66 2qtv h GLU 693 CO 0.00 -0.43 0.17 -1.00 -1.18 0.00 0.00 179.01 176.56 2qtv h PRO 694 N -0.68 0.32 0.00 0.92 0.13 -1.76 0.28 132.00 131.21 2qtv h PRO 694 Ca -0.04 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2qtv h PRO 694 Cb 0.57 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.62 2qtv h PRO 694 CO 0.03 0.21 0.00 1.17 -0.23 0.00 0.00 178.00 179.18 2qtv n LYS 695 N -5.04 0.15 -0.01 0.86 4.81 -1.08 -1.40 118.16 116.45 2qtv n LYS 695 Ca 0.07 0.56 -0.16 0.00 -0.87 0.00 0.00 58.31 57.91 2qtv n LYS 695 Cb 0.25 -1.91 -0.14 0.00 0.02 0.00 0.00 35.03 33.25 2qtv n LYS 695 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 2qtv n LEU 696 N -2.22 1.87 0.16 3.14 7.94 0.86 -3.47 117.00 125.29 2qtv n LEU 696 Ca -0.00 0.28 0.03 0.00 -1.11 0.00 0.00 56.01 55.21 2qtv n LEU 696 Cb 0.10 -0.56 0.25 0.00 0.53 0.00 0.00 43.42 43.74 2qtv n LEU 696 CO 0.13 0.66 0.59 -0.08 -1.11 0.00 0.00 177.39 177.58 2qtv h GLU 697 N 0.04 0.00 -0.36 1.96 4.81 -0.61 -2.70 114.58 117.72 2qtv h GLU 697 Ca -0.37 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 58.79 2qtv h GLU 697 Cb 2.03 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 31.39 2qtv h GLU 697 CO 0.08 0.48 -0.06 0.00 -0.73 0.00 0.00 179.01 178.77 2qtv h ALA 698 N 1.52 1.22 -0.13 2.92 0.00 -1.34 -2.61 119.26 120.84 2qtv h ALA 698 Ca -0.00 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.55 2qtv h ALA 698 Cb 1.03 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 2qtv h ALA 698 CO 0.06 0.51 -0.36 0.00 0.00 0.00 0.00 179.25 179.46 2qtv h ALA 699 N 1.38 1.16 0.00 0.00 0.00 -1.51 -2.97 119.26 117.31 2qtv h ALA 699 Ca 0.11 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 2qtv h ALA 699 Cb 0.45 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 2qtv h ALA 699 CO 0.02 0.56 -0.00 0.93 0.00 0.00 0.00 179.25 180.76 2qtv h GLU 700 N 0.23 0.00 0.00 0.00 3.07 -1.43 -3.14 114.58 113.32 2qtv h GLU 700 Ca 0.03 0.00 -0.11 0.00 -0.50 0.00 0.00 59.36 58.78 2qtv h GLU 700 Cb 0.74 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.64 2qtv h GLU 700 CO 0.06 0.00 -0.52 -0.07 -1.40 0.00 0.00 179.01 177.07 2qtv h LEU 701 N 0.00 0.00 -0.60 1.33 3.38 -1.45 -3.30 115.31 114.68 2qtv h LEU 701 Ca -0.00 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 2qtv h LEU 701 Cb 0.60 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 2qtv h LEU 701 CO 0.00 0.52 -0.68 -0.07 0.09 0.00 0.00 178.44 178.30 2qtv h LEU 702 N 0.00 0.14 0.00 1.67 3.38 -1.64 -3.39 115.31 115.46 2qtv h LEU 702 Ca -0.01 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2qtv h LEU 702 Cb 1.24 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.95 2qtv h LEU 702 CO 0.07 0.77 0.00 0.52 0.09 0.00 0.00 178.44 179.89 2qtv n VAL 703 N -3.77 0.00 -0.10 1.22 0.31 -1.24 -0.43 118.33 114.32 2qtv n VAL 703 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 2qtv n VAL 703 Cb 0.67 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.60 2qtv n VAL 703 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2qtv n ASP 704 N -1.89 0.61 -4.66 4.52 8.00 -1.26 -5.07 116.55 116.80 2qtv n ASP 704 Ca 0.00 -0.83 -0.47 0.00 0.71 0.00 0.00 54.79 54.20 2qtv n ASP 704 Cb 0.00 0.25 -0.05 0.00 -0.02 0.00 0.00 41.12 41.31 2qtv n ASP 704 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 2qtv n ARG 705 N -0.25 1.99 -3.73 -1.24 0.63 0.43 -5.00 116.66 109.49 2qtv n ARG 705 Ca 0.00 0.72 -0.16 0.00 -0.92 0.00 0.00 57.85 57.49 2qtv n ARG 705 Cb 0.02 -2.47 -0.16 0.00 0.45 0.00 0.00 32.46 30.30 2qtv n ARG 705 CO 0.00 0.00 0.00 0.12 -2.51 0.00 0.00 177.63 175.24 2qtv s PHE 706 N 1.11 -0.04 0.61 -0.14 5.36 -1.26 -4.19 117.98 119.44 2qtv s PHE 706 Ca 0.81 0.31 -0.10 0.00 -0.96 0.00 0.00 56.93 56.99 2qtv s PHE 706 Cb -0.73 -0.26 0.15 0.00 -0.34 0.00 0.00 43.02 41.84 2qtv s PHE 706 CO 0.41 -0.16 0.64 -0.35 -1.46 0.00 0.00 175.22 174.30 2qtv n PRO 707 N 4.60 -1.61 -3.16 10.12 -0.04 -1.26 -5.11 135.00 138.54 2qtv n PRO 707 Ca -0.19 -1.01 -0.36 0.00 -0.04 0.00 0.00 63.50 61.89 2qtv n PRO 707 Cb 0.50 -0.83 -0.06 0.00 -0.04 0.00 0.00 33.50 33.07 2qtv n PRO 707 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2qtv s LEU 708 N 0.00 4.38 0.51 1.53 1.02 -1.26 -5.05 118.68 119.81 2qtv s LEU 708 Ca 0.39 1.36 -0.12 0.00 0.02 0.00 0.00 54.13 55.78 2qtv s LEU 708 Cb -0.03 -3.44 -0.06 0.00 0.02 0.00 0.00 46.19 42.68 2qtv s LEU 708 CO 0.29 0.08 0.91 -2.16 0.02 0.00 0.00 176.35 175.49 2qtv s PRO 709 N -1.83 3.74 0.60 1.29 0.04 -1.26 -4.93 135.00 132.65 2qtv s PRO 709 Ca 0.40 0.65 -0.16 0.00 0.04 0.00 0.00 61.00 61.93 2qtv s PRO 709 Cb -0.17 -2.22 -0.03 0.00 0.04 0.00 0.00 34.50 32.12 2qtv s PRO 709 CO 0.21 -0.29 1.09 1.03 0.04 0.00 0.00 177.00 179.08 2qtv s ARG 710 N -4.46 3.14 -0.12 4.56 1.81 -0.86 -4.82 118.95 118.21 2qtv s ARG 710 Ca 0.54 1.37 0.01 0.00 -1.72 0.00 0.00 55.73 55.93 2qtv s ARG 710 Cb -0.10 -2.00 -0.01 0.00 -0.45 0.00 0.00 34.95 32.38 2qtv s ARG 710 CO 0.40 -0.98 -0.15 0.12 -0.68 0.00 0.00 175.30 174.02 2qtv s PHE 711 N -2.24 2.76 -0.12 -0.53 5.36 -1.26 -1.41 117.98 120.53 2qtv s PHE 711 Ca 0.67 -0.63 0.01 0.00 -0.96 0.00 0.00 56.93 56.02 2qtv s PHE 711 Cb -0.19 -1.80 0.02 0.00 -0.34 0.00 0.00 43.02 40.71 2qtv s PHE 711 CO 0.36 -0.19 -0.14 0.42 -1.46 0.00 0.00 175.22 174.21 2qtv s ILE 712 N 0.21 1.46 -0.24 3.12 1.01 0.45 -4.97 121.20 122.24 2qtv s ILE 712 Ca -0.09 -0.59 -0.02 0.00 0.00 0.00 0.00 60.65 59.94 2qtv s ILE 712 Cb -0.15 -1.35 0.02 0.00 0.01 0.00 0.00 42.46 40.98 2qtv s ILE 712 CO 0.05 0.44 -0.06 -0.62 0.00 0.00 0.00 174.94 174.75 2qtv s ASP 713 N 1.21 4.28 0.31 3.58 -1.08 -1.26 0.20 116.67 123.90 2qtv s ASP 713 Ca -0.02 -0.80 -0.01 0.00 -0.52 0.00 0.00 52.55 51.20 2qtv s ASP 713 Cb -0.14 -1.67 0.00 0.00 -1.46 0.00 0.00 42.92 39.65 2qtv s ASP 713 CO -0.05 -0.11 0.42 1.07 0.52 0.00 0.00 175.17 177.02 2qtv n THR 714 N 4.69 0.00 -4.07 1.71 5.66 -0.33 -4.99 114.28 116.95 2qtv n THR 714 Ca -0.17 -1.64 -0.11 0.00 -3.05 0.00 0.00 64.05 59.09 2qtv n THR 714 Cb 0.48 0.99 -0.06 0.00 -1.55 0.00 0.00 70.33 70.18 2qtv n THR 714 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 2qtv s GLU 715 N -2.75 1.50 -0.23 1.09 -1.05 -1.26 -1.22 118.70 114.78 2qtv s GLU 715 Ca 0.27 -1.44 -0.35 0.00 -0.15 0.00 0.00 54.97 53.29 2qtv s GLU 715 Cb -0.01 0.41 -0.12 0.00 -0.44 0.00 0.00 34.13 33.97 2qtv s GLU 715 CO 0.19 -0.59 1.99 0.00 0.95 0.00 0.00 175.26 177.80 2qtv n ALA 716 N -0.38 0.80 0.00 -0.84 0.00 -0.27 -0.01 120.51 119.81 2qtv n ALA 716 Ca -0.00 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.58 2qtv n ALA 716 Cb 0.63 -2.49 0.00 0.00 0.00 0.00 0.00 19.45 17.59 2qtv n ALA 716 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qtv n GLY 717 N 5.21 3.40 3.68 0.00 0.00 -1.26 -4.83 105.19 111.40 2qtv n GLY 717 Ca 0.30 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.97 2qtv n GLY 717 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qtv n GLY 718 N -1.62 0.06 0.09 -0.02 0.00 0.98 -4.93 105.19 99.75 2qtv n GLY 718 Ca 0.00 -0.34 -0.11 0.00 0.00 0.00 0.00 46.02 45.57 2qtv n GLY 718 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2qtv h SER 719 N -0.27 0.15 0.09 1.61 0.87 -1.97 -2.59 113.55 111.44 2qtv h SER 719 Ca -0.48 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 2qtv h SER 719 Cb 1.32 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.24 2qtv h SER 719 CO 0.48 0.13 0.00 0.00 -0.53 0.00 0.00 176.83 176.92 2qtv n GLN 720 N -4.98 0.49 0.11 2.24 1.13 -1.26 -2.97 117.38 112.14 2qtv n GLN 720 Ca -0.05 0.03 0.11 0.00 -1.94 0.00 0.00 57.00 55.16 2qtv n GLN 720 Cb 0.04 -1.50 0.47 0.00 0.11 0.00 0.00 30.24 29.36 2qtv n GLN 720 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2qtv n ALA 721 N -1.08 1.61 0.29 -1.58 0.00 -0.98 -2.34 120.51 116.43 2qtv n ALA 721 Ca 0.12 0.08 0.15 0.00 0.00 0.00 0.00 53.44 53.79 2qtv n ALA 721 Cb 0.08 -1.36 0.85 0.00 0.00 0.00 0.00 19.45 19.03 2qtv n ALA 721 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qtv h ARG 722 N 0.00 0.00 0.00 0.00 3.08 -1.74 -0.93 114.38 114.79 2qtv h ARG 722 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 2qtv h ARG 722 Cb 0.32 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.36 2qtv h ARG 722 CO 0.00 0.06 -0.16 0.74 -1.07 0.00 0.00 179.97 179.54 2qtv h PHE 723 N 0.00 0.00 0.00 3.04 -1.00 -1.75 -1.80 116.94 115.42 2qtv h PHE 723 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2qtv h PHE 723 Cb 0.20 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.76 2qtv h PHE 723 CO 0.00 0.16 -0.36 1.25 -1.61 0.00 0.00 178.31 177.75 2qtv h LEU 724 N 0.00 0.00 -0.99 1.54 5.85 -1.41 -3.37 115.31 116.93 2qtv h LEU 724 Ca -0.00 0.00 0.32 0.00 0.84 0.00 0.00 57.88 59.04 2qtv h LEU 724 Cb 0.38 0.00 -0.18 0.00 0.37 0.00 0.00 40.66 41.23 2qtv h LEU 724 CO 0.02 0.60 0.23 -0.07 -0.34 0.00 0.00 178.44 178.88 2qtv h LEU 725 N -0.84 -0.16 -1.29 2.25 3.38 -1.30 0.46 115.31 117.81 2qtv h LEU 725 Ca 0.00 0.27 -0.03 0.00 0.09 0.00 0.00 57.88 58.21 2qtv h LEU 725 Cb 0.36 0.39 -0.00 0.00 0.09 0.00 0.00 40.66 41.50 2qtv h LEU 725 CO 0.00 -0.37 -0.15 0.77 0.09 0.00 0.00 178.44 178.78 2qtv h SER 726 N 0.02 0.00 1.44 -0.43 4.64 -1.54 -2.95 113.55 114.74 2qtv h SER 726 Ca 0.69 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 62.00 2qtv h SER 726 Cb 1.59 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.68 2qtv h SER 726 CO -0.85 0.15 -0.57 0.11 -0.87 0.00 0.00 176.83 174.80 2qtv h LYS 727 N 0.00 0.00 -7.31 4.77 1.79 -0.24 -3.47 116.57 112.11 2qtv h LYS 727 Ca -0.00 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 57.96 2qtv h LYS 727 Cb 0.64 0.00 0.09 0.00 -1.58 0.00 0.00 32.23 31.38 2qtv h LYS 727 CO 0.02 0.04 0.37 -0.51 -1.08 0.00 0.00 179.45 178.29 2qtv s LEU 728 N -5.80 3.21 -0.27 2.94 1.43 -1.04 -4.96 118.68 114.20 2qtv s LEU 728 Ca 0.03 1.65 -0.19 0.00 -1.03 0.00 0.00 54.13 54.58 2qtv s LEU 728 Cb 0.07 -4.50 -0.02 0.00 0.03 0.00 0.00 46.19 41.77 2qtv s LEU 728 CO 0.74 -1.36 0.57 0.21 0.23 0.00 0.00 176.35 176.74 2qtv s ASN 729 N -3.60 6.48 -0.99 2.29 2.47 -1.03 -4.90 114.94 115.66 2qtv s ASN 729 Ca 0.59 0.53 -0.14 0.00 0.42 0.00 0.00 52.86 54.26 2qtv s ASN 729 Cb -0.14 -2.31 -0.09 0.00 -1.45 0.00 0.00 41.25 37.27 2qtv s ASN 729 CO 0.51 -0.36 2.12 -0.81 -3.72 0.00 0.00 177.10 174.84 2qtv n PRO 730 N 5.66 2.08 -0.34 0.43 -0.04 -1.26 -1.92 135.00 139.61 2qtv n PRO 730 Ca -0.02 -1.86 0.27 0.00 -0.04 0.00 0.00 63.50 61.84 2qtv n PRO 730 Cb 0.49 -2.81 0.57 0.00 -0.04 0.00 0.00 33.50 31.71 2qtv n PRO 730 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2qtv h SER 731 N 6.85 0.34 -3.29 3.54 4.64 -1.95 -3.37 113.55 120.32 2qtv h SER 731 Ca 0.51 0.08 -0.61 0.00 -0.47 0.00 0.00 61.79 61.30 2qtv h SER 731 Cb 0.47 0.03 -0.13 0.00 -0.31 0.00 0.00 62.40 62.45 2qtv h SER 731 CO 1.77 0.03 -0.51 -1.81 -0.87 0.00 0.00 176.83 175.44 2qtv s ASP 732 N -5.14 6.03 0.07 4.97 1.01 -1.26 -5.01 116.67 117.34 2qtv s ASP 732 Ca -0.08 0.18 -0.25 0.00 0.71 0.00 0.00 52.55 53.11 2qtv s ASP 732 Cb 0.26 -2.05 -0.06 0.00 1.01 0.00 0.00 42.92 42.07 2qtv s ASP 732 CO 0.80 0.17 0.76 0.21 0.21 0.00 0.00 175.17 177.33 2qtv s ASN 733 N 0.39 7.25 0.02 0.27 3.84 -1.26 -4.55 114.94 120.89 2qtv s ASN 733 Ca 0.06 1.49 0.07 0.00 0.21 0.00 0.00 52.86 54.69 2qtv s ASN 733 Cb -0.12 -2.47 0.30 0.00 -0.55 0.00 0.00 41.25 38.41 2qtv s ASN 733 CO -0.01 0.06 1.22 0.00 -2.79 0.00 0.00 177.10 175.58 2qtv n TYR 734 N 2.52 0.05 -0.06 0.43 0.18 -1.26 -2.62 117.16 116.39 2qtv n TYR 734 Ca -0.03 0.02 -0.18 0.00 1.88 0.00 0.00 57.90 59.59 2qtv n TYR 734 Cb 0.50 -0.54 -0.13 0.00 -0.38 0.00 0.00 39.34 38.79 2qtv n TYR 734 CO 0.00 0.00 0.00 1.04 -2.08 0.00 0.00 176.86 175.82 2qtv n GLN 735 N -1.55 0.70 -1.77 -3.48 6.02 -1.26 -4.94 117.38 111.10 2qtv n GLN 735 Ca 0.01 0.20 -0.39 0.00 -0.01 0.00 0.00 57.00 56.81 2qtv n GLN 735 Cb 0.07 -1.62 0.03 0.00 1.02 0.00 0.00 30.24 29.75 2qtv n GLN 735 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2qtv s ASP 736 N -6.64 5.43 0.06 1.08 1.01 -1.08 -4.91 116.67 111.62 2qtv s ASP 736 Ca -0.26 2.83 -0.15 0.00 0.71 0.00 0.00 52.55 55.68 2qtv s ASP 736 Cb 0.08 -2.64 -0.23 0.00 1.01 0.00 0.00 42.92 41.13 2qtv s ASP 736 CO 0.70 -1.47 1.17 0.24 0.21 0.00 0.00 175.17 176.03 2qtv h MET 737 N 1.72 0.64 -6.54 8.23 2.86 -1.92 -3.45 114.93 116.47 2qtv h MET 737 Ca -0.51 -0.68 -0.53 0.00 -2.06 0.00 0.00 59.70 55.93 2qtv h MET 737 Cb 1.29 0.19 0.04 0.00 0.06 0.00 0.00 31.60 33.18 2qtv h MET 737 CO 0.58 1.27 1.06 0.00 1.06 0.00 0.00 176.91 180.89 2qtv s ALA 738 N -3.31 3.80 -0.02 6.32 0.00 -1.26 -5.00 121.76 122.29 2qtv s ALA 738 Ca -0.11 1.45 0.07 0.00 0.00 0.00 0.00 51.96 53.37 2qtv s ALA 738 Cb 0.06 -3.73 -0.02 0.00 0.00 0.00 0.00 23.12 19.43 2qtv s ALA 738 CO 0.90 -1.11 -0.22 1.03 0.00 0.00 0.00 175.76 176.36 2qtv s ARG 739 N 2.26 1.78 0.00 0.00 0.52 -1.26 -4.80 118.95 117.45 2qtv s ARG 739 Ca 0.78 -0.77 0.14 0.00 -0.52 0.00 0.00 55.73 55.36 2qtv s ARG 739 Cb -0.46 -1.71 -0.03 0.00 0.52 0.00 0.00 34.95 33.28 2qtv s ARG 739 CO 0.35 0.45 0.75 0.41 0.02 0.00 0.00 175.30 177.27 2qtv n GLY 740 N 2.59 -0.11 1.62 -3.53 0.00 -1.26 -5.03 105.19 99.47 2qtv n GLY 740 Ca -0.16 -0.40 -0.07 0.00 0.00 0.00 0.00 46.02 45.40 2qtv n GLY 740 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qtv n GLY 741 N 1.11 2.47 0.00 -0.02 0.00 -1.26 -4.96 105.19 102.53 2qtv n GLY 741 Ca 0.05 -1.43 0.08 0.00 0.00 0.00 0.00 46.02 44.72 2qtv n GLY 741 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qtv n SER 742 N -1.79 0.97 -4.36 1.61 3.41 -1.26 -4.89 113.62 107.31 2qtv n SER 742 Ca -0.00 -0.37 -0.36 0.00 -0.26 0.00 0.00 58.87 57.88 2qtv n SER 742 Cb 0.28 1.46 -0.13 0.00 -0.26 0.00 0.00 64.21 65.55 2qtv n SER 742 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2qtv s THR 743 N -2.93 3.84 -0.25 6.66 2.01 -1.26 -5.08 115.64 118.64 2qtv s THR 743 Ca -0.01 -0.45 -0.03 0.00 0.31 0.00 0.00 61.69 61.50 2qtv s THR 743 Cb 0.12 -2.84 0.01 0.00 0.01 0.00 0.00 72.50 69.80 2qtv s THR 743 CO 0.70 0.29 -0.02 -0.63 -0.69 0.00 0.00 174.62 174.27 2qtv s ILE 744 N 1.53 3.27 -0.07 1.82 1.01 -1.26 -4.57 121.20 122.93 2qtv s ILE 744 Ca 0.05 -0.79 -0.30 0.00 0.00 0.00 0.00 60.65 59.61 2qtv s ILE 744 Cb -0.15 -2.62 -0.04 0.00 0.01 0.00 0.00 42.46 39.66 2qtv s ILE 744 CO 0.01 0.24 1.41 -0.69 0.00 0.00 0.00 174.94 175.90 2qtv s VAL 745 N 1.41 3.90 -1.11 2.92 1.01 -1.26 -4.92 120.40 122.34 2qtv s VAL 745 Ca 0.02 1.17 -0.21 0.00 0.00 0.00 0.00 61.98 62.96 2qtv s VAL 745 Cb -0.16 -3.76 0.05 0.00 0.00 0.00 0.00 36.38 32.52 2qtv s VAL 745 CO -0.03 -0.06 1.56 -0.76 0.00 0.00 0.00 175.10 175.81 2qtv s LEU 746 N 3.15 3.60 0.12 3.92 1.43 -1.26 -4.50 118.68 125.14 2qtv s LEU 746 Ca 0.63 -1.77 -0.18 0.00 -1.03 0.00 0.00 54.13 51.78 2qtv s LEU 746 Cb -0.28 -2.57 0.04 0.00 0.03 0.00 0.00 46.19 43.41 2qtv s LEU 746 CO 0.23 -1.43 0.44 0.28 0.23 0.00 0.00 176.35 176.10 2qtv s THR 747 N 4.88 0.05 -2.06 5.49 -1.32 -1.26 -5.02 115.64 116.41 2qtv s THR 747 Ca 0.49 -0.44 0.19 0.00 -1.21 0.00 0.00 61.69 60.73 2qtv s THR 747 Cb 0.01 -1.11 0.36 0.00 -1.51 0.00 0.00 72.50 70.25 2qtv s THR 747 CO -0.04 -0.24 1.30 0.47 -2.21 0.00 0.00 174.62 173.90 2qtv n ASP 748 N -0.18 3.17 -4.76 8.08 8.00 -1.26 -4.70 116.55 124.90 2qtv n ASP 748 Ca -0.16 -1.92 -0.40 0.00 0.71 0.00 0.00 54.79 53.02 2qtv n ASP 748 Cb 0.64 -0.21 0.02 0.00 -0.02 0.00 0.00 41.12 41.54 2qtv n ASP 748 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2qtv s ASP 749 N -1.32 5.72 0.27 -2.24 1.11 -1.26 -4.93 116.67 114.01 2qtv s ASP 749 Ca 0.33 2.91 -0.29 0.00 0.18 0.00 0.00 52.55 55.67 2qtv s ASP 749 Cb 0.19 -2.65 -0.10 0.00 1.07 0.00 0.00 42.92 41.43 2qtv s ASP 749 CO 0.27 -1.28 1.32 0.54 1.18 0.00 0.00 175.17 177.19 2qtv s VAL 750 N -1.22 2.94 0.60 -1.27 0.11 -1.26 -4.90 120.40 115.40 2qtv s VAL 750 Ca 0.63 0.85 -0.11 0.00 -2.93 0.00 0.00 61.98 60.42 2qtv s VAL 750 Cb -0.43 -3.54 -0.05 0.00 -1.53 0.00 0.00 36.38 30.83 2qtv s VAL 750 CO 0.55 0.16 1.01 -0.94 -3.33 0.00 0.00 175.10 172.55 2qtv s SER 751 N -0.08 6.29 0.35 3.54 1.04 -1.26 -4.83 113.70 118.75 2qtv s SER 751 Ca 0.53 1.41 0.05 0.00 0.48 0.00 0.00 55.95 58.42 2qtv s SER 751 Cb -0.38 -2.46 0.70 0.00 0.10 0.00 0.00 66.02 63.97 2qtv s SER 751 CO 0.45 -0.81 1.95 0.25 0.98 0.00 0.00 173.24 176.06 2qtv h LEU 752 N -0.11 0.71 0.57 2.42 5.85 -1.93 -0.09 115.31 122.73 2qtv h LEU 752 Ca -0.45 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.25 2qtv h LEU 752 Cb 1.19 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.07 2qtv h LEU 752 CO 0.62 0.46 -0.28 1.56 -0.34 0.00 0.00 178.44 180.46 2qtv h GLN 753 N 0.81 -0.75 -0.49 1.25 7.50 -1.95 0.43 115.11 121.91 2qtv h GLN 753 Ca 0.32 0.05 0.04 0.00 0.50 0.00 0.00 58.65 59.56 2qtv h GLN 753 Cb 0.23 0.17 -0.04 0.00 0.05 0.00 0.00 27.48 27.89 2qtv h GLN 753 CO -0.11 -0.50 0.25 -0.91 -1.50 0.00 0.00 178.83 176.06 2qtv h ASN 754 N -0.78 0.36 -0.38 1.46 2.35 -1.82 -1.07 115.58 115.70 2qtv h ASN 754 Ca -0.08 0.03 0.08 0.00 -0.55 0.00 0.00 56.30 55.78 2qtv h ASN 754 Cb 0.60 -0.04 -0.08 0.00 0.05 0.00 0.00 38.32 38.85 2qtv h ASN 754 CO 0.12 0.25 -0.19 0.15 -1.65 0.00 0.00 177.43 176.11 2qtv h PHE 755 N 0.49 -0.49 -0.96 1.19 3.57 -0.75 -1.09 116.94 118.90 2qtv h PHE 755 Ca 0.21 0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.78 2qtv h PHE 755 Cb 0.12 0.28 -0.05 0.00 2.79 0.00 0.00 35.95 39.08 2qtv h PHE 755 CO -0.10 -0.27 0.63 0.52 -2.23 0.00 0.00 178.31 176.86 2qtv h MET 756 N -0.13 1.23 0.54 1.11 2.86 -0.24 -1.15 114.93 119.15 2qtv h MET 756 Ca 0.19 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.73 2qtv h MET 756 Cb 0.42 -0.28 -0.00 0.00 0.06 0.00 0.00 31.60 31.80 2qtv h MET 756 CO -0.46 0.82 -0.31 1.15 1.06 0.00 0.00 176.91 179.16 2qtv h THR 757 N 1.27 0.36 -0.77 2.22 2.02 0.03 0.24 112.91 118.28 2qtv h THR 757 Ca 0.36 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.64 2qtv h THR 757 Cb -0.10 0.36 -0.07 0.00 -1.74 0.00 0.00 68.15 66.60 2qtv h THR 757 CO -0.09 0.00 0.40 0.45 0.37 0.00 0.00 175.52 176.66 2qtv h HIS 758 N -0.80 0.73 -0.23 3.16 -0.00 -1.20 0.29 115.15 117.09 2qtv h HIS 758 Ca -0.07 0.03 0.03 0.00 -0.00 0.00 0.00 60.37 60.36 2qtv h HIS 758 Cb 0.64 -0.21 -0.03 0.00 -0.00 0.00 0.00 27.41 27.81 2qtv h HIS 758 CO -0.08 0.26 0.05 1.25 -0.00 0.00 0.00 177.93 179.42 2qtv h LEU 759 N 0.67 0.03 -1.03 2.43 5.85 -0.80 -2.33 115.31 120.13 2qtv h LEU 759 Ca 0.38 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 59.05 2qtv h LEU 759 Cb 0.40 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2qtv h LEU 759 CO -0.27 0.05 -0.16 1.56 -0.34 0.00 0.00 178.44 179.27 2qtv h GLN 760 N 0.15 0.51 -0.65 1.25 4.20 0.95 -1.58 115.11 119.94 2qtv h GLN 760 Ca 0.11 -0.16 -0.07 0.00 0.06 0.00 0.00 58.65 58.58 2qtv h GLN 760 Cb 0.10 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.80 2qtv h GLN 760 CO -0.13 0.66 0.13 1.96 -0.67 0.00 0.00 178.83 180.78 2qtv h GLN 761 N 0.46 1.05 0.08 1.46 4.20 -0.07 -2.48 115.11 119.80 2qtv h GLN 761 Ca 0.08 -0.26 -0.23 0.00 0.06 0.00 0.00 58.65 58.31 2qtv h GLN 761 Cb 0.55 -0.14 0.02 0.00 0.30 0.00 0.00 27.48 28.22 2qtv h GLN 761 CO 0.04 0.95 -0.93 0.28 -0.67 0.00 0.00 178.83 178.49 2qtv h VAL 762 N 0.99 1.38 -0.82 -0.54 2.07 -1.27 -3.26 116.25 114.80 2qtv h VAL 762 Ca 0.20 -2.33 0.02 0.00 0.82 0.00 0.00 66.70 65.41 2qtv h VAL 762 Cb 0.39 2.75 -0.04 0.00 -1.52 0.00 0.00 31.29 32.86 2qtv h VAL 762 CO 0.01 0.69 0.54 0.00 0.02 0.00 0.00 177.57 178.83 2qtv h ALA 763 N 0.26 1.45 -0.44 1.67 0.00 -1.24 -1.98 119.26 118.98 2qtv h ALA 763 Ca -0.14 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2qtv h ALA 763 Cb 1.64 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2qtv h ALA 763 CO 0.18 0.49 0.00 1.33 0.00 0.00 0.00 179.25 181.25 2qtv n VAL 764 N -4.43 0.83 0.46 0.00 0.24 -0.94 -4.08 118.33 110.42 2qtv n VAL 764 Ca 0.10 -0.66 0.05 0.00 -2.04 0.00 0.00 64.34 61.78 2qtv n VAL 764 Cb 0.06 0.18 -0.03 0.00 -1.47 0.00 0.00 33.84 32.57 2qtv n VAL 764 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 2qtv n SER 765 N 0.76 0.80 -4.32 -1.34 2.88 -0.75 0.41 113.62 112.06 2qtv n SER 765 Ca 0.16 -0.90 -0.29 0.00 -1.33 0.00 0.00 58.87 56.51 2qtv n SER 765 Cb 0.48 0.77 0.20 0.00 -0.75 0.00 0.00 64.21 64.90 2qtv n SER 765 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2qtv s GLY 766 N -1.69 1.58 0.11 0.46 0.00 -1.22 -4.91 107.32 101.65 2qtv s GLY 766 Ca 0.06 -0.68 0.04 0.00 0.00 0.00 0.00 44.72 44.14 2qtv s GLY 766 CO 0.34 0.05 0.09 1.62 0.00 0.00 0.00 173.10 175.20 2qtv s GLN 767 N -5.24 2.85 0.00 2.90 0.74 -1.26 -5.00 119.66 114.66 2qtv s GLN 767 Ca 0.68 -0.77 0.00 0.00 0.05 0.00 0.00 55.36 55.32 2qtv s GLN 767 Cb -0.14 -2.68 0.00 0.00 1.10 0.00 0.00 33.01 31.29 2qtv s GLN 767 CO 0.56 0.53 0.00 0.00 -0.55 0.00 0.00 175.29 175.83