#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vya h GLN 35 N 0.00 -0.01 -0.90 -0.14 4.20 -2.00 -2.75 115.11 113.51 2vya h GLN 35 Ca 0.00 0.00 0.18 0.00 0.06 0.00 0.00 58.65 58.89 2vya h GLN 35 Cb 0.00 0.00 -0.11 0.00 0.30 0.00 0.00 27.48 27.68 2vya h GLN 35 CO 0.00 0.50 0.47 -0.22 -0.67 0.00 0.00 178.83 178.91 2vya h LYS 36 N -0.52 0.57 -0.35 1.46 3.11 -1.99 0.23 116.57 119.09 2vya h LYS 36 Ca -0.00 -0.03 -0.12 0.00 -2.81 0.00 0.00 60.65 57.68 2vya h LYS 36 Cb 0.51 -0.13 -0.01 0.00 -1.00 0.00 0.00 32.23 31.60 2vya h LYS 36 CO 0.00 0.38 -0.29 0.00 -2.81 0.00 0.00 179.45 176.73 2vya h ALA 37 N 1.63 0.84 -0.33 5.00 0.00 -1.79 -0.73 119.26 123.88 2vya h ALA 37 Ca 0.52 -0.40 -0.16 0.00 0.00 0.00 0.00 54.91 54.87 2vya h ALA 37 Cb 0.84 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 2vya h ALA 37 CO -0.42 0.64 -0.43 0.00 0.00 0.00 0.00 179.25 179.04 2vya h ARG 38 N 0.62 0.87 -0.12 0.00 3.08 -0.96 -2.56 114.38 115.31 2vya h ARG 38 Ca 0.07 -0.50 0.00 0.00 0.07 0.00 0.00 59.98 59.63 2vya h ARG 38 Cb 0.81 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 2vya h ARG 38 CO 0.07 1.14 0.07 0.78 -1.07 0.00 0.00 179.97 180.96 2vya h GLY 39 N 0.66 0.17 1.04 0.04 0.00 -0.48 -1.53 103.07 102.97 2vya h GLY 39 Ca 0.04 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.31 2vya h GLY 39 CO 0.10 0.06 0.62 0.00 0.00 0.00 0.00 176.54 177.32 2vya h ALA 40 N 1.02 1.27 -0.31 3.60 0.00 -1.19 -0.52 119.26 123.13 2vya h ALA 40 Ca 0.04 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2vya h ALA 40 Cb 0.00 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 2vya h ALA 40 CO -0.01 0.66 0.19 0.00 0.00 0.00 0.00 179.25 180.09 2vya h ALA 41 N 1.36 0.39 -0.34 0.00 0.00 -1.29 0.32 119.26 119.70 2vya h ALA 41 Ca 0.35 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 2vya h ALA 41 Cb -0.12 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2vya h ALA 41 CO -0.07 -0.11 0.11 1.15 0.00 0.00 0.00 179.25 180.33 2vya h THR 42 N 0.40 1.20 0.41 0.00 2.02 -0.61 0.12 112.91 116.45 2vya h THR 42 Ca 0.11 -0.66 -0.02 0.00 0.77 0.00 0.00 66.41 66.62 2vya h THR 42 Cb 0.00 1.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.41 2vya h THR 42 CO -0.02 0.22 -0.23 0.03 0.37 0.00 0.00 175.52 175.89 2vya h ARG 43 N 0.39 -0.58 -0.70 6.66 3.08 -1.00 -2.08 114.38 120.15 2vya h ARG 43 Ca 0.11 0.04 0.15 0.00 0.07 0.00 0.00 59.98 60.35 2vya h ARG 43 Cb 0.24 0.13 -0.11 0.00 0.08 0.00 0.00 29.97 30.31 2vya h ARG 43 CO -0.00 -0.38 0.07 0.00 -1.07 0.00 0.00 179.97 178.58 2vya h ALA 44 N -0.02 0.79 -0.35 0.04 0.00 -0.15 -1.05 119.26 118.52 2vya h ALA 44 Ca -0.05 0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 2vya h ALA 44 Cb 0.48 0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2vya h ALA 44 CO 0.06 -0.38 -0.13 0.00 0.00 0.00 0.00 179.25 178.80 2vya h ARG 45 N 0.17 0.62 0.01 0.00 -0.00 -0.68 -1.66 114.38 112.84 2vya h ARG 45 Ca 0.38 -0.19 -0.20 0.00 -0.50 0.00 0.00 59.98 59.47 2vya h ARG 45 Cb 0.65 -0.06 -0.01 0.00 0.00 0.00 0.00 29.97 30.56 2vya h ARG 45 CO -0.56 0.73 -0.91 -0.56 0.00 0.00 0.00 179.97 178.68 2vya h GLN 46 N 0.56 0.19 -0.14 0.04 3.07 -0.60 -1.85 115.11 116.38 2vya h GLN 46 Ca 0.10 -0.22 0.00 0.00 0.09 0.00 0.00 58.65 58.62 2vya h GLN 46 Cb 0.55 0.07 -0.01 0.00 0.08 0.00 0.00 27.48 28.17 2vya h GLN 46 CO 0.03 0.97 0.09 0.87 0.09 0.00 0.00 178.83 180.89 2vya h LYS 47 N 0.10 0.19 -0.57 0.06 1.57 -0.90 -1.77 116.57 115.26 2vya h LYS 47 Ca -0.05 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 2vya h LYS 47 Cb 1.55 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.78 2vya h LYS 47 CO 0.14 0.15 0.35 0.37 -0.57 0.00 0.00 179.45 179.89 2vya h GLN 48 N 0.17 0.68 -0.57 3.15 4.15 -1.29 -2.11 115.11 119.29 2vya h GLN 48 Ca 0.05 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.43 2vya h GLN 48 Cb 0.01 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 27.51 2vya h GLN 48 CO -0.01 0.45 0.36 -0.09 -1.93 0.00 0.00 178.83 177.61 2vya h ARG 49 N 0.70 0.76 -0.47 1.69 2.43 -1.20 -2.26 114.38 116.04 2vya h ARG 49 Ca 0.22 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.29 2vya h ARG 49 Cb -0.01 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.36 2vya h ARG 49 CO -0.08 0.53 0.13 0.00 -1.51 0.00 0.00 179.97 179.03 2vya h ALA 50 N 1.19 0.61 0.01 2.80 0.00 -1.15 -1.76 119.26 120.97 2vya h ALA 50 Ca 0.21 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.95 2vya h ALA 50 Cb -0.05 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.51 2vya h ALA 50 CO -0.04 0.29 -0.26 0.77 0.00 0.00 0.00 179.25 180.01 2vya h SER 51 N 0.62 -0.76 -0.77 0.00 0.02 -1.16 0.18 113.55 111.68 2vya h SER 51 Ca 0.15 0.10 0.15 0.00 -0.84 0.00 0.00 61.79 61.35 2vya h SER 51 Cb 0.30 0.31 -0.10 0.00 0.14 0.00 0.00 62.40 63.06 2vya h SER 51 CO -0.00 -0.33 0.32 -0.07 -1.14 0.00 0.00 176.83 175.61 2vya h LEU 52 N -0.40 0.31 0.04 5.07 4.07 -1.33 0.15 115.31 123.22 2vya h LEU 52 Ca 0.06 0.11 0.02 0.00 0.08 0.00 0.00 57.88 58.14 2vya h LEU 52 Cb 0.48 0.08 -0.02 0.00 1.08 0.00 0.00 40.66 42.28 2vya h LEU 52 CO -0.22 0.11 -0.13 -0.33 -1.08 0.00 0.00 178.44 176.79 2vya h GLU 53 N 0.46 -0.23 -0.47 1.13 4.39 -0.37 0.44 114.58 119.93 2vya h GLU 53 Ca 0.43 0.02 0.07 0.00 0.34 0.00 0.00 59.36 60.21 2vya h GLU 53 Cb 0.65 0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 29.29 2vya h GLU 53 CO -0.41 -0.15 0.12 1.15 -1.16 0.00 0.00 179.01 178.56 2vya h THR 54 N -0.24 0.77 -0.22 1.13 2.02 0.19 0.71 112.91 117.28 2vya h THR 54 Ca 0.03 -0.09 0.03 0.00 0.77 0.00 0.00 66.41 67.15 2vya h THR 54 Cb 0.27 0.49 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 2vya h THR 54 CO -0.09 0.05 0.02 0.24 0.37 0.00 0.00 175.52 176.11 2vya h MET 55 N 0.26 0.10 0.54 6.66 2.86 -0.23 -0.28 114.93 124.85 2vya h MET 55 Ca 0.23 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.85 2vya h MET 55 Cb 0.28 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 2vya h MET 55 CO -0.28 0.07 -0.38 0.22 1.06 0.00 0.00 176.91 177.60 2vya h ASP 56 N 0.10 -0.97 -0.73 1.22 3.58 0.74 -1.27 116.42 119.10 2vya h ASP 56 Ca 0.10 0.06 0.15 0.00 0.42 0.00 0.00 57.03 57.77 2vya h ASP 56 Cb 0.12 0.30 -0.13 0.00 1.72 0.00 0.00 39.33 41.33 2vya h ASP 56 CO -0.16 -0.57 -0.12 0.11 -2.88 0.00 0.00 179.24 175.63 2vya h LYS 57 N -0.89 0.03 0.20 0.28 1.57 -0.65 -0.20 116.57 116.91 2vya h LYS 57 Ca -0.06 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2vya h LYS 57 Cb 0.74 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.03 2vya h LYS 57 CO 0.04 0.02 -0.21 0.00 -0.57 0.00 0.00 179.45 178.73 2vya h ALA 58 N 1.71 -0.42 -0.05 3.86 0.00 -0.77 -2.11 119.26 121.48 2vya h ALA 58 Ca 0.37 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.12 2vya h ALA 58 Cb 0.59 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2vya h ALA 58 CO -0.71 -0.76 -0.39 -0.39 0.00 0.00 0.00 179.25 177.00 2vya h VAL 59 N -0.45 1.29 -0.05 0.00 -1.51 -0.21 -2.21 116.25 113.12 2vya h VAL 59 Ca 0.00 -1.40 -0.14 0.00 -1.23 0.00 0.00 66.70 63.93 2vya h VAL 59 Cb 0.42 1.69 -0.01 0.00 -2.13 0.00 0.00 31.29 31.26 2vya h VAL 59 CO -0.05 0.41 -0.60 -0.61 -1.23 0.00 0.00 177.57 175.48 2vya h GLN 60 N 0.09 0.17 -0.05 5.19 5.75 -0.92 -1.32 115.11 124.02 2vya h GLN 60 Ca 0.01 -0.11 -0.22 0.00 -0.15 0.00 0.00 58.65 58.17 2vya h GLN 60 Cb 0.73 0.02 0.01 0.00 1.07 0.00 0.00 27.48 29.30 2vya h GLN 60 CO 0.05 0.72 -0.87 -0.09 -2.65 0.00 0.00 178.83 175.99 2vya h ARG 61 N 0.12 0.53 -0.33 1.69 2.43 -0.98 -3.05 114.38 114.81 2vya h ARG 61 Ca -0.01 -0.50 -0.03 0.00 -0.81 0.00 0.00 59.98 58.63 2vya h ARG 61 Cb 1.09 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.75 2vya h ARG 61 CO 0.09 1.14 0.09 0.35 -1.51 0.00 0.00 179.97 180.13 2vya h PHE 62 N 0.33 0.54 -0.30 2.20 3.57 -1.21 -3.06 116.94 119.02 2vya h PHE 62 Ca -0.07 -0.06 -0.07 0.00 3.53 0.00 0.00 57.97 61.31 2vya h PHE 62 Cb 1.49 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 40.06 2vya h PHE 62 CO 0.07 0.54 -0.10 0.00 -2.23 0.00 0.00 178.31 176.59 2vya h ARG 63 N 0.37 0.49 -0.66 1.11 3.08 -1.28 -1.30 114.38 116.20 2vya h ARG 63 Ca 0.10 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2vya h ARG 63 Cb 0.27 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.23 2vya h ARG 63 CO -0.00 0.60 0.42 -0.07 -1.07 0.00 0.00 179.97 179.84 2vya h LEU 64 N 0.46 0.77 -1.01 3.04 4.07 -1.54 -2.63 115.31 118.48 2vya h LEU 64 Ca 0.09 -0.04 -0.01 0.00 0.08 0.00 0.00 57.88 58.00 2vya h LEU 64 Cb 0.46 -0.19 -0.00 0.00 1.08 0.00 0.00 40.66 42.00 2vya h LEU 64 CO 0.02 0.59 -0.05 1.56 -1.08 0.00 0.00 178.44 179.48 2vya h GLN 65 N 0.89 0.00 -2.08 1.13 7.50 -1.20 -3.35 115.11 118.00 2vya h GLN 65 Ca 0.24 0.00 -0.54 0.00 0.50 0.00 0.00 58.65 58.85 2vya h GLN 65 Cb -0.06 0.00 -0.40 0.00 0.05 0.00 0.00 27.48 27.06 2vya h GLN 65 CO -0.05 0.05 -0.99 0.09 -1.50 0.00 0.00 178.83 176.43 2vya n ASN 66 N -3.15 1.73 0.02 1.46 3.02 -0.58 -4.95 115.26 112.81 2vya n ASN 66 Ca 0.01 -3.11 0.10 0.00 -0.03 0.00 0.00 54.58 51.55 2vya n ASN 66 Cb 0.39 -0.62 0.42 0.00 -0.61 0.00 0.00 39.78 39.36 2vya n ASN 66 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2vya n PRO 67 N 0.55 0.03 -0.05 3.52 -0.04 -1.07 -3.28 135.00 134.66 2vya n PRO 67 Ca 0.26 0.20 0.02 0.00 -0.04 0.00 0.00 63.50 63.93 2vya n PRO 67 Cb 0.54 -1.55 0.04 0.00 -0.04 0.00 0.00 33.50 32.49 2vya n PRO 67 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2vya n ASP 68 N -1.61 2.26 -4.75 3.54 3.85 -1.26 -4.99 116.55 113.59 2vya n ASP 68 Ca 0.04 -2.00 -0.41 0.00 -0.71 0.00 0.00 54.79 51.72 2vya n ASP 68 Cb 0.24 -0.07 -0.04 0.00 -1.35 0.00 0.00 41.12 39.90 2vya n ASP 68 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.20 175.97 2vya s LEU 69 N -1.00 4.52 -0.91 -2.12 2.96 -1.21 -5.00 118.68 115.93 2vya s LEU 69 Ca 0.07 2.17 -0.19 0.00 -0.22 0.00 0.00 54.13 55.95 2vya s LEU 69 Cb 0.03 -3.61 0.12 0.00 0.50 0.00 0.00 46.19 43.23 2vya s LEU 69 CO 0.04 -0.19 1.12 -0.62 -1.32 0.00 0.00 176.35 175.39 2vya s ASP 70 N -0.44 6.59 0.32 3.68 3.68 -1.26 -4.86 116.67 124.37 2vya s ASP 70 Ca 0.47 -1.94 0.14 0.00 2.13 0.00 0.00 52.55 53.36 2vya s ASP 70 Cb -0.31 -2.41 0.48 0.00 -1.45 0.00 0.00 42.92 39.24 2vya s ASP 70 CO 0.37 -1.11 1.66 0.77 0.13 0.00 0.00 175.17 176.99 2vya h SER 71 N 8.93 0.00 -0.45 -0.34 4.64 -1.98 -2.07 113.55 122.28 2vya h SER 71 Ca 0.12 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.45 2vya h SER 71 Cb 1.03 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.09 2vya h SER 71 CO 1.13 0.51 0.29 -0.33 -0.87 0.00 0.00 176.83 177.55 2vya h GLU 72 N 0.00 0.57 -0.45 4.77 5.08 -1.99 -1.23 114.58 121.32 2vya h GLU 72 Ca -0.01 -0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.21 2vya h GLU 72 Cb 1.03 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 2vya h GLU 72 CO 0.07 0.37 -0.16 0.00 -1.00 0.00 0.00 179.01 178.29 2vya h ALA 73 N 1.17 0.62 -0.01 3.43 0.00 -1.94 -2.89 119.26 119.63 2vya h ALA 73 Ca 0.17 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2vya h ALA 73 Cb -0.05 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 2vya h ALA 73 CO -0.05 0.55 0.01 1.25 0.00 0.00 0.00 179.25 181.01 2vya h LEU 74 N 0.73 0.01 -1.26 0.00 7.12 -1.28 -2.70 115.31 117.94 2vya h LEU 74 Ca 0.11 -0.12 -0.06 0.00 0.13 0.00 0.00 57.88 57.93 2vya h LEU 74 Cb 0.71 -0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.83 2vya h LEU 74 CO 0.05 0.14 -0.31 -0.07 -0.13 0.00 0.00 178.44 178.12 2vya h LEU 75 N -0.11 0.00 -0.45 2.25 3.38 -1.27 -3.15 115.31 115.97 2vya h LEU 75 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2vya h LEU 75 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2vya h LEU 75 CO -0.00 0.31 -0.62 0.35 0.09 0.00 0.00 178.44 178.57 2vya n THR 76 N -3.69 0.00 -1.77 0.22 -2.24 -1.09 -4.90 114.28 100.80 2vya n THR 76 Ca -0.01 -0.12 -0.41 0.00 -2.27 0.00 0.00 64.05 61.24 2vya n THR 76 Cb 0.42 0.90 -0.00 0.00 -2.10 0.00 0.00 70.33 69.54 2vya n THR 76 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2vya n LEU 77 N -0.82 4.71 -4.77 3.22 4.77 -1.02 -4.98 117.00 118.11 2vya n LEU 77 Ca 0.07 1.23 -0.36 0.00 -0.03 0.00 0.00 56.01 56.92 2vya n LEU 77 Cb 0.38 -1.61 0.01 0.00 -2.33 0.00 0.00 43.42 39.87 2vya n LEU 77 CO 0.34 0.12 0.82 -2.84 -1.33 0.00 0.00 177.39 174.50 2vya s PRO 78 N -2.07 3.32 0.27 3.23 0.02 -1.26 -4.76 135.00 133.75 2vya s PRO 78 Ca 0.53 1.74 -0.00 0.00 0.02 0.00 0.00 61.00 63.29 2vya s PRO 78 Cb -0.48 -2.09 0.59 0.00 0.02 0.00 0.00 34.50 32.54 2vya s PRO 78 CO 0.64 -0.90 1.71 1.25 -0.33 0.00 0.00 177.00 179.37 2vya h LEU 79 N 1.31 0.29 -1.02 -5.54 5.85 -1.93 0.16 115.31 114.44 2vya h LEU 79 Ca -0.50 0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.40 2vya h LEU 79 Cb 1.27 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 42.36 2vya h LEU 79 CO 0.57 0.05 0.66 0.25 -0.34 0.00 0.00 178.44 179.63 2vya h LEU 80 N 0.42 1.08 0.03 2.25 6.46 -1.93 0.28 115.31 123.90 2vya h LEU 80 Ca 0.49 -0.01 -0.25 0.00 -0.12 0.00 0.00 57.88 57.99 2vya h LEU 80 Cb 0.83 -0.24 -0.00 0.00 -0.73 0.00 0.00 40.66 40.52 2vya h LEU 80 CO -0.47 0.73 -1.14 1.56 -0.62 0.00 0.00 178.44 178.50 2vya h GLN 81 N 1.25 0.26 -0.10 1.25 4.20 -1.16 -2.28 115.11 118.52 2vya h GLN 81 Ca 0.41 -0.39 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 2vya h GLN 81 Cb 0.05 0.14 -0.00 0.00 0.30 0.00 0.00 27.48 27.96 2vya h GLN 81 CO -0.14 1.16 0.06 1.25 -0.67 0.00 0.00 178.83 180.49 2vya h LEU 82 N 0.09 0.12 -0.83 1.46 5.85 -0.47 -1.21 115.31 120.32 2vya h LEU 82 Ca -0.11 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.57 2vya h LEU 82 Cb 1.84 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 42.80 2vya h LEU 82 CO 0.18 0.13 0.50 0.58 -0.34 0.00 0.00 178.44 179.49 2vya h VAL 83 N 0.11 1.23 -0.47 1.05 2.07 -0.48 0.99 116.25 120.75 2vya h VAL 83 Ca 0.04 -0.51 -0.13 0.00 0.82 0.00 0.00 66.70 66.91 2vya h VAL 83 Cb 0.02 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 29.86 2vya h VAL 83 CO -0.01 0.24 -0.24 0.06 0.02 0.00 0.00 177.57 177.65 2vya h GLN 84 N 1.14 0.98 -0.61 1.57 -0.00 -1.29 -0.16 115.11 116.74 2vya h GLN 84 Ca 0.30 -0.43 -0.08 0.00 -0.00 0.00 0.00 58.65 58.43 2vya h GLN 84 Cb -0.04 -0.03 -0.02 0.00 -0.00 0.00 0.00 27.48 27.39 2vya h GLN 84 CO -0.06 1.11 0.07 0.87 -0.00 0.00 0.00 178.83 180.82 2vya h LYS 85 N 0.83 1.02 -0.67 0.06 1.57 -0.61 0.20 116.57 118.97 2vya h LYS 85 Ca 0.10 -0.28 -0.00 0.00 -1.87 0.00 0.00 60.65 58.60 2vya h LYS 85 Cb 0.82 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.98 2vya h LYS 85 CO 0.07 0.96 0.40 -0.07 -0.57 0.00 0.00 179.45 180.24 2vya h LEU 86 N 0.95 0.81 -0.59 2.94 4.07 -0.59 -1.56 115.31 121.34 2vya h LEU 86 Ca 0.18 -0.06 -0.15 0.00 0.08 0.00 0.00 57.88 57.93 2vya h LEU 86 Cb 0.46 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 41.98 2vya h LEU 86 CO 0.02 0.64 -0.65 -0.61 -1.08 0.00 0.00 178.44 176.75 2vya h GLN 87 N 0.91 0.22 0.00 1.13 5.75 -0.30 -2.75 115.11 120.08 2vya h GLN 87 Ca 0.24 -0.17 -0.11 0.00 -0.15 0.00 0.00 58.65 58.46 2vya h GLN 87 Cb -0.02 0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.54 2vya h GLN 87 CO -0.04 0.80 -0.52 0.66 -2.65 0.00 0.00 178.83 177.07 2vya h SER 88 N 0.16 0.00 0.00 -0.69 4.64 -0.54 -3.47 113.55 113.65 2vya h SER 88 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2vya h SER 88 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2vya h SER 88 CO 0.10 0.52 0.00 0.61 -0.87 0.00 0.00 176.83 177.19 2vya n GLY 89 N 0.08 0.63 0.43 -0.77 0.00 -0.67 -4.96 105.19 99.93 2vya n GLY 89 Ca -0.01 0.00 0.26 0.00 0.00 0.00 0.00 46.02 46.27 2vya n GLY 89 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2vya h GLU 90 N 3.73 0.30 -6.39 1.61 4.81 -1.63 -3.38 114.58 113.64 2vya h GLU 90 Ca 0.00 -0.02 -0.69 0.00 -0.13 0.00 0.00 59.36 58.52 2vya h GLU 90 Cb 0.00 -0.07 -0.27 0.00 0.63 0.00 0.00 28.75 29.04 2vya h GLU 90 CO 0.00 0.20 -0.84 -0.51 -0.73 0.00 0.00 179.01 177.13 2vya s LEU 91 N -9.45 2.35 0.38 1.64 1.43 -1.02 -5.02 118.68 108.99 2vya s LEU 91 Ca -0.08 -0.36 -0.24 0.00 -1.03 0.00 0.00 54.13 52.42 2vya s LEU 91 Cb 0.25 -1.44 -0.10 0.00 0.03 0.00 0.00 46.19 44.94 2vya s LEU 91 CO 0.80 0.32 0.99 -0.94 0.23 0.00 0.00 176.35 177.75 2vya s SER 92 N -0.58 6.99 0.49 2.29 1.04 -1.26 -4.41 113.70 118.26 2vya s SER 92 Ca 0.08 1.89 0.15 0.00 0.48 0.00 0.00 55.95 58.56 2vya s SER 92 Cb -0.11 -2.57 1.17 0.00 0.10 0.00 0.00 66.02 64.61 2vya s SER 92 CO 0.00 -0.32 2.10 -0.65 0.98 0.00 0.00 173.24 175.35 2vya h PRO 93 N 2.60 0.15 -0.49 4.02 0.11 -1.92 -2.48 132.00 133.99 2vya h PRO 93 Ca -0.48 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 2vya h PRO 93 Cb 1.20 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 2vya h PRO 93 CO 0.63 0.10 0.14 0.93 -0.21 0.00 0.00 178.00 179.59 2vya h GLU 94 N 0.16 0.78 -0.19 1.05 3.07 -1.93 0.39 114.58 117.90 2vya h GLU 94 Ca 0.08 -0.18 0.04 0.00 -0.50 0.00 0.00 59.36 58.81 2vya h GLU 94 Cb 0.15 -0.11 -0.04 0.00 -0.84 0.00 0.00 28.75 27.91 2vya h GLU 94 CO -0.01 0.74 -0.08 0.00 -1.40 0.00 0.00 179.01 178.26 2vya h ALA 95 N 1.00 0.08 0.03 3.43 0.00 -1.84 -0.97 119.26 120.99 2vya h ALA 95 Ca 0.16 0.07 -0.24 0.00 0.00 0.00 0.00 54.91 54.91 2vya h ALA 95 Cb 0.29 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2vya h ALA 95 CO -0.00 -0.51 -1.00 -0.24 0.00 0.00 0.00 179.25 177.50 2vya h VAL 96 N -0.05 1.41 0.36 0.00 3.04 -1.45 -2.13 116.25 117.43 2vya h VAL 96 Ca 0.10 -2.53 -0.01 0.00 -1.01 0.00 0.00 66.70 63.24 2vya h VAL 96 Cb 0.20 2.51 -0.00 0.00 -2.01 0.00 0.00 31.29 31.99 2vya h VAL 96 CO -0.22 0.75 -0.21 0.15 -1.01 0.00 0.00 177.57 177.04 2vya h PHE 97 N 0.21 -0.54 0.00 3.17 3.04 -0.68 -1.79 116.94 120.36 2vya h PHE 97 Ca -0.09 -0.01 -0.18 0.00 3.98 0.00 0.00 57.97 61.67 2vya h PHE 97 Cb 1.65 0.19 -0.03 0.00 2.56 0.00 0.00 35.95 40.32 2vya h PHE 97 CO 0.06 -0.32 -0.84 0.74 -2.02 0.00 0.00 178.31 175.93 2vya h PHE 98 N -0.54 0.00 -0.31 0.41 0.05 -1.25 -0.42 116.94 114.89 2vya h PHE 98 Ca -0.04 0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.73 2vya h PHE 98 Cb 0.43 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.37 2vya h PHE 98 CO -0.08 0.84 0.11 1.15 -0.18 0.00 0.00 178.31 180.15 2vya h THR 99 N 0.00 1.20 -0.10 -1.55 2.02 -1.39 -0.41 112.91 112.67 2vya h THR 99 Ca -0.01 -0.62 -0.11 0.00 0.77 0.00 0.00 66.41 66.44 2vya h THR 99 Cb 1.52 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 68.95 2vya h THR 99 CO 0.11 0.21 -0.44 1.88 0.37 0.00 0.00 175.52 177.65 2vya h TYR 100 N 0.34 0.27 -0.45 3.16 0.05 -1.28 -2.49 116.97 116.58 2vya h TYR 100 Ca 0.10 -0.08 -0.03 0.00 0.05 0.00 0.00 58.73 58.77 2vya h TYR 100 Cb 0.23 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 37.89 2vya h TYR 100 CO 0.00 0.64 0.15 1.25 -1.05 0.00 0.00 178.16 179.15 2vya h LEU 101 N 0.19 0.65 -0.61 3.88 6.46 -0.80 -1.14 115.31 123.94 2vya h LEU 101 Ca 0.01 -0.20 -0.01 0.00 -0.12 0.00 0.00 57.88 57.57 2vya h LEU 101 Cb 0.86 -0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 40.60 2vya h LEU 101 CO 0.07 0.67 0.35 1.23 -0.62 0.00 0.00 178.44 180.15 2vya h GLY 102 N 0.58 0.90 1.19 3.75 0.00 -0.97 -2.20 103.07 106.32 2vya h GLY 102 Ca 0.15 -0.39 -0.07 0.00 0.00 0.00 0.00 47.33 47.02 2vya h GLY 102 CO -0.01 0.38 0.13 1.70 0.00 0.00 0.00 176.54 178.74 2vya h LYS 103 N 0.83 1.01 -0.76 4.80 1.63 -1.24 -2.31 116.57 120.52 2vya h LYS 103 Ca 0.22 -0.24 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 2vya h LYS 103 Cb 0.01 -0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 31.47 2vya h LYS 103 CO -0.04 0.91 0.47 0.00 -3.45 0.00 0.00 179.45 177.34 2vya h ALA 104 N 1.18 1.41 -0.29 5.00 0.00 -0.89 -1.21 119.26 124.46 2vya h ALA 104 Ca 0.20 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2vya h ALA 104 Cb 0.37 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2vya h ALA 104 CO 0.00 0.52 -0.18 2.35 0.00 0.00 0.00 179.25 181.94 2vya h TRP 105 N 1.04 0.75 0.45 0.00 7.01 -0.88 -1.65 115.95 122.66 2vya h TRP 105 Ca 0.27 -0.20 -0.02 0.00 2.11 0.00 0.00 58.89 61.05 2vya h TRP 105 Cb -0.07 -0.17 0.00 0.00 -2.10 0.00 0.00 29.16 26.82 2vya h TRP 105 CO 0.00 0.89 -0.22 0.93 -2.79 0.00 0.00 178.44 177.26 2vya h GLU 106 N 0.38 -0.58 0.00 2.65 5.08 -1.12 -2.89 114.58 118.11 2vya h GLU 106 Ca 0.06 0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 2vya h GLU 106 Cb 0.72 0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.10 2vya h GLU 106 CO 0.05 -0.32 -0.05 -0.39 -1.00 0.00 0.00 179.01 177.30 2vya h VAL 107 N -0.74 0.67 -0.06 3.13 -1.51 -1.29 -1.47 116.25 114.98 2vya h VAL 107 Ca -0.06 -0.19 -0.09 0.00 -1.23 0.00 0.00 66.70 65.13 2vya h VAL 107 Cb 0.53 1.11 -0.01 0.00 -2.13 0.00 0.00 31.29 30.79 2vya h VAL 107 CO 0.10 0.05 -0.37 -1.13 -1.23 0.00 0.00 177.57 174.99 2vya h ASN 108 N 0.00 0.12 -0.82 4.19 -1.24 -1.09 -2.26 115.58 114.48 2vya h ASN 108 Ca -0.00 -0.04 0.07 0.00 0.71 0.00 0.00 56.30 57.04 2vya h ASN 108 Cb 0.11 -0.03 -0.05 0.00 0.73 0.00 0.00 38.32 39.07 2vya h ASN 108 CO 0.01 0.49 0.53 0.11 -1.29 0.00 0.00 177.43 177.27 2vya h LYS 109 N 0.10 0.84 0.00 6.67 1.57 -1.13 0.24 116.57 124.86 2vya h LYS 109 Ca 0.01 -0.05 -0.23 0.00 -1.87 0.00 0.00 60.65 58.51 2vya h LYS 109 Cb 0.71 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.79 2vya h LYS 109 CO 0.05 0.56 -1.44 0.78 -0.57 0.00 0.00 179.45 178.83 2vya h GLY 110 N 0.87 0.00 0.00 3.86 0.00 -1.64 -3.41 103.07 102.75 2vya h GLY 110 Ca 0.36 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 47.32 2vya h GLY 110 CO -0.13 0.00 -2.39 -1.30 0.00 0.00 0.00 176.54 172.72 2vya n THR 111 N -3.05 1.39 -3.43 4.70 -2.24 -0.86 -4.74 114.28 106.05 2vya n THR 111 Ca -0.11 -0.80 -0.17 0.00 -2.27 0.00 0.00 64.05 60.69 2vya n THR 111 Cb 0.95 -0.63 0.09 0.00 -2.10 0.00 0.00 70.33 68.64 2vya n THR 111 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2vya n ASN 112 N -2.83 -2.35 0.02 3.42 5.15 0.82 -0.06 115.26 119.42 2vya n ASN 112 Ca -0.35 -0.61 0.07 0.00 -0.60 0.00 0.00 54.58 53.09 2vya n ASN 112 Cb 1.12 -5.08 -0.10 0.00 -0.53 0.00 0.00 39.78 35.19 2vya n ASN 112 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2vya s VAL 114 N -3.25 5.09 -0.12 0.00 1.01 -1.26 -0.56 120.40 121.31 2vya s VAL 114 Ca -0.05 1.02 0.16 0.00 0.00 0.00 0.00 61.98 63.11 2vya s VAL 114 Cb 0.11 -3.87 -0.23 0.00 0.00 0.00 0.00 36.38 32.39 2vya s VAL 114 CO 0.85 0.17 0.45 0.35 0.00 0.00 0.00 175.10 176.91 2vya n THR 115 N 4.54 1.33 -3.61 3.92 -2.24 0.52 -4.87 114.28 113.88 2vya n THR 115 Ca -0.04 -0.78 -0.14 0.00 -2.27 0.00 0.00 64.05 60.82 2vya n THR 115 Cb 0.50 -0.68 -0.07 0.00 -2.10 0.00 0.00 70.33 67.99 2vya n THR 115 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2vya s SER 116 N -5.68 -0.69 -0.19 3.42 0.15 -1.08 -4.27 113.70 105.35 2vya s SER 116 Ca -0.07 1.22 -0.19 0.00 0.70 0.00 0.00 55.95 57.61 2vya s SER 116 Cb 0.08 1.19 -0.03 0.00 -1.71 0.00 0.00 66.02 65.55 2vya s SER 116 CO 0.83 -0.32 0.54 -0.47 1.20 0.00 0.00 173.24 175.02 2vya s TYR 117 N -0.00 3.39 -0.78 3.44 6.04 -1.26 -0.59 117.35 127.58 2vya s TYR 117 Ca -0.02 0.81 -0.26 0.00 0.04 0.00 0.00 57.07 57.64 2vya s TYR 117 Cb -0.04 -2.68 0.02 0.00 -1.04 0.00 0.00 41.96 38.22 2vya s TYR 117 CO 0.02 -0.09 1.47 -0.51 -1.54 0.00 0.00 175.55 174.90 2vya s LEU 118 N 1.59 3.25 0.22 6.97 1.43 -0.08 -4.84 118.68 127.22 2vya s LEU 118 Ca 0.25 -0.50 0.24 0.00 -1.03 0.00 0.00 54.13 53.09 2vya s LEU 118 Cb -0.15 -2.56 0.92 0.00 0.03 0.00 0.00 46.19 44.43 2vya s LEU 118 CO 0.10 -1.95 1.72 0.35 0.23 0.00 0.00 176.35 176.80 2vya n THR 119 N 6.74 0.75 -0.68 5.49 -2.24 -1.26 -2.72 114.28 120.37 2vya n THR 119 Ca 0.14 0.10 0.09 0.00 -2.27 0.00 0.00 64.05 62.11 2vya n THR 119 Cb 0.50 -0.98 0.37 0.00 -2.10 0.00 0.00 70.33 68.12 2vya n THR 119 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2vya n ASP 120 N -2.16 5.02 -0.01 3.42 5.75 -1.26 -4.49 116.55 122.81 2vya n ASP 120 Ca 0.03 -2.55 0.14 0.00 -0.01 0.00 0.00 54.79 52.40 2vya n ASP 120 Cb 0.28 -0.61 0.54 0.00 -1.03 0.00 0.00 41.12 40.30 2vya n ASP 120 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2vya h GLU 122 N 0.06 0.21 0.30 0.00 5.08 -1.86 0.29 114.58 118.65 2vya h GLU 122 Ca 0.00 -0.29 -0.00 0.00 -1.00 0.00 0.00 59.36 58.06 2vya h GLU 122 Cb 0.47 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 2vya h GLU 122 CO 0.00 1.08 -0.22 1.15 -1.00 0.00 0.00 179.01 180.02 2vya h THR 123 N 0.08 0.53 -0.80 1.13 2.02 -1.89 -2.72 112.91 111.26 2vya h THR 123 Ca -0.08 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.22 2vya h THR 123 Cb 1.75 0.53 -0.08 0.00 -1.74 0.00 0.00 68.15 68.60 2vya h THR 123 CO 0.16 0.00 0.42 -0.61 0.37 0.00 0.00 175.52 175.86 2vya h GLN 124 N -0.52 0.65 -0.78 6.66 5.75 -1.53 -2.07 115.11 123.26 2vya h GLN 124 Ca -0.02 -0.04 0.12 0.00 -0.15 0.00 0.00 58.65 58.56 2vya h GLN 124 Cb 0.46 -0.15 -0.13 0.00 1.07 0.00 0.00 27.48 28.73 2vya h GLN 124 CO -0.00 0.43 -0.39 1.25 -2.65 0.00 0.00 178.83 177.46 2vya h LEU 125 N 0.66 -1.39 -0.13 -2.39 6.46 -0.10 0.13 115.31 118.56 2vya h LEU 125 Ca 0.41 0.27 0.00 0.00 -0.12 0.00 0.00 57.88 58.44 2vya h LEU 125 Cb 0.49 0.69 0.00 0.00 -0.73 0.00 0.00 40.66 41.11 2vya h LEU 125 CO -0.30 -0.30 0.00 -1.54 -0.62 0.00 0.00 178.44 175.68 2vya n SER 126 N -5.43 0.47 0.01 1.25 3.41 -0.81 -3.39 113.62 109.13 2vya n SER 126 Ca 0.06 0.56 0.11 0.00 -0.26 0.00 0.00 58.87 59.34 2vya n SER 126 Cb 0.37 -0.68 -0.13 0.00 -0.26 0.00 0.00 64.21 63.50 2vya n SER 126 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2vya n GLN 127 N -1.96 0.61 -1.64 4.33 -0.06 0.12 -4.98 117.38 113.79 2vya n GLN 127 Ca 0.05 -0.13 -0.51 0.00 -2.00 0.00 0.00 57.00 54.41 2vya n GLN 127 Cb 0.34 -1.57 -0.06 0.00 -4.06 0.00 0.00 30.24 24.89 2vya n GLN 127 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2vya n ALA 128 N -2.20 0.63 -1.78 1.69 0.00 0.23 -4.85 120.51 114.24 2vya n ALA 128 Ca -0.03 0.23 -0.41 0.00 0.00 0.00 0.00 53.44 53.23 2vya n ALA 128 Cb 0.55 -2.44 -0.01 0.00 0.00 0.00 0.00 19.45 17.55 2vya n ALA 128 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2vya s PRO 129 N 4.46 4.14 0.20 0.00 0.02 -1.26 -4.91 135.00 137.64 2vya s PRO 129 Ca 0.98 2.54 -0.01 0.00 0.02 0.00 0.00 61.00 64.53 2vya s PRO 129 Cb -0.83 -2.99 0.13 0.00 0.02 0.00 0.00 34.50 30.83 2vya s PRO 129 CO 0.55 -0.53 1.50 0.00 -0.33 0.00 0.00 177.00 178.19 2vya h ARG 130 N 3.55 0.46 0.00 5.54 3.08 -1.97 -2.68 114.38 122.36 2vya h ARG 130 Ca -0.50 -0.31 0.00 0.00 0.07 0.00 0.00 59.98 59.24 2vya h ARG 130 Cb 1.23 0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.33 2vya h ARG 130 CO 0.68 0.92 0.00 1.96 -1.07 0.00 0.00 179.97 182.47 2vya h GLN 131 N 0.34 0.00 -6.31 0.04 7.50 -1.96 -3.46 115.11 111.26 2vya h GLN 131 Ca -0.01 0.00 -0.66 0.00 0.50 0.00 0.00 58.65 58.49 2vya h GLN 131 Cb 1.15 0.00 0.08 0.00 0.05 0.00 0.00 27.48 28.75 2vya h GLN 131 CO 0.11 0.00 0.28 0.41 -1.50 0.00 0.00 178.83 178.12 2vya n GLY 132 N 0.17 0.07 0.16 3.46 0.00 -1.01 -4.86 105.19 103.18 2vya n GLY 132 Ca 0.02 0.56 0.12 0.00 0.00 0.00 0.00 46.02 46.72 2vya n GLY 132 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2vya h LEU 133 N 3.49 0.00 -3.07 0.99 4.07 -1.86 -1.94 115.31 116.98 2vya h LEU 133 Ca -0.44 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.49 2vya h LEU 133 Cb 1.35 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 43.07 2vya h LEU 133 CO 0.71 0.00 -0.28 0.18 -1.08 0.00 0.00 178.44 177.97 2vya n LEU 134 N -2.33 2.90 -4.51 1.67 4.77 0.08 -5.03 117.00 114.56 2vya n LEU 134 Ca 0.01 -3.63 -0.54 0.00 -0.03 0.00 0.00 56.01 51.82 2vya n LEU 134 Cb 0.16 -0.52 -0.08 0.00 -2.33 0.00 0.00 43.42 40.66 2vya n LEU 134 CO 0.17 1.16 1.65 0.00 -1.33 0.00 0.00 177.39 179.04 2vya n TYR 135 N -1.17 1.71 -0.88 -1.77 4.19 -0.73 -1.20 117.16 117.30 2vya n TYR 135 Ca 0.21 0.40 0.00 0.00 3.31 0.00 0.00 57.90 61.81 2vya n TYR 135 Cb 0.74 -2.49 0.00 0.00 0.49 0.00 0.00 39.34 38.08 2vya n TYR 135 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 2vya n GLY 136 N 5.92 0.66 3.65 2.98 0.00 0.00 -4.76 105.19 113.65 2vya n GLY 136 Ca 0.38 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.98 2vya n GLY 136 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vya s VAL 137 N -2.46 4.84 0.23 1.61 1.01 -0.34 -4.65 120.40 120.63 2vya s VAL 137 Ca 0.00 1.64 -0.30 0.00 0.00 0.00 0.00 61.98 63.32 2vya s VAL 137 Cb 0.00 -4.14 -0.09 0.00 0.00 0.00 0.00 36.38 32.15 2vya s VAL 137 CO 0.00 -0.05 1.09 -2.84 0.00 0.00 0.00 175.10 173.30 2vya s PRO 138 N 2.63 4.63 -0.03 2.72 0.02 -1.26 0.09 135.00 143.80 2vya s PRO 138 Ca 0.37 1.74 0.05 0.00 0.02 0.00 0.00 61.00 63.18 2vya s PRO 138 Cb -0.16 -3.24 -0.01 0.00 0.02 0.00 0.00 34.50 31.12 2vya s PRO 138 CO 0.09 0.16 -0.18 0.08 -0.33 0.00 0.00 177.00 176.83 2vya s VAL 139 N -0.71 1.42 0.09 3.83 1.01 -0.54 -4.38 120.40 121.11 2vya s VAL 139 Ca 0.47 -0.74 -0.11 0.00 0.00 0.00 0.00 61.98 61.59 2vya s VAL 139 Cb -0.30 -1.19 -0.06 0.00 0.00 0.00 0.00 36.38 34.82 2vya s VAL 139 CO 0.37 0.40 0.43 -0.94 0.00 0.00 0.00 175.10 175.37 2vya s SER 140 N -0.23 6.70 -0.12 3.32 1.04 -0.79 -1.34 113.70 122.28 2vya s SER 140 Ca 0.02 0.87 0.03 0.00 0.48 0.00 0.00 55.95 57.35 2vya s SER 140 Cb -0.09 -2.21 0.00 0.00 0.10 0.00 0.00 66.02 63.83 2vya s SER 140 CO 0.00 0.17 -0.22 -0.76 0.98 0.00 0.00 173.24 173.42 2vya s LEU 141 N -1.83 2.18 0.44 2.42 1.43 -0.09 -1.88 118.68 121.36 2vya s LEU 141 Ca 0.33 -0.55 -0.22 0.00 -1.03 0.00 0.00 54.13 52.66 2vya s LEU 141 Cb -0.14 -1.45 -0.12 0.00 0.03 0.00 0.00 46.19 44.51 2vya s LEU 141 CO 0.18 0.13 0.64 1.17 0.23 0.00 0.00 176.35 178.69 2vya n LYS 142 N 3.76 0.71 0.25 1.70 4.81 -0.81 -0.75 118.16 127.83 2vya n LYS 142 Ca -0.19 0.26 0.16 0.00 -0.87 0.00 0.00 58.31 57.66 2vya n LYS 142 Cb 0.52 -1.64 0.86 0.00 0.02 0.00 0.00 35.03 34.79 2vya n LYS 142 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 2vya h GLU 143 N 0.86 0.00 -0.00 1.64 4.81 -1.72 -2.74 114.58 117.42 2vya h GLU 143 Ca -0.42 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 2vya h GLU 143 Cb 1.39 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.77 2vya h GLU 143 CO 0.52 0.00 -0.07 0.00 -0.73 0.00 0.00 179.01 178.73 2vya s PHE 145 N -2.68 2.61 0.17 0.00 0.40 -1.04 -0.71 117.98 116.73 2vya s PHE 145 Ca 0.24 0.69 -0.33 0.00 -0.60 0.00 0.00 56.93 56.93 2vya s PHE 145 Cb 0.20 -4.38 -0.15 0.00 0.51 0.00 0.00 43.02 39.20 2vya s PHE 145 CO 0.50 -1.62 1.25 0.43 0.70 0.00 0.00 175.22 176.48 2vya n SER 146 N 8.33 1.73 -3.79 1.36 7.64 -1.09 -4.88 113.62 122.92 2vya n SER 146 Ca 0.14 1.14 -0.27 0.00 1.01 0.00 0.00 58.87 60.89 2vya n SER 146 Cb 0.48 -1.26 -0.17 0.00 -1.01 0.00 0.00 64.21 62.26 2vya n SER 146 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2vya s TYR 147 N -0.02 1.12 -0.30 1.43 5.04 -1.26 -2.42 117.35 120.94 2vya s TYR 147 Ca 0.74 -0.74 -0.27 0.00 -2.44 0.00 0.00 57.07 54.36 2vya s TYR 147 Cb -0.82 -1.05 -0.12 0.00 0.35 0.00 0.00 41.96 40.33 2vya s TYR 147 CO 0.50 -0.54 1.21 1.17 -1.34 0.00 0.00 175.55 176.55 2vya n LYS 148 N 5.03 0.00 -0.09 4.97 4.81 -1.23 -0.82 118.16 130.83 2vya n LYS 148 Ca -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.35 2vya n LYS 148 Cb 0.48 -0.90 0.00 0.00 0.02 0.00 0.00 35.03 34.63 2vya n LYS 148 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2vya n GLY 149 N 4.00 0.70 3.45 3.14 0.00 0.13 -4.96 105.19 111.66 2vya n GLY 149 Ca 0.30 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.04 2vya n GLY 149 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2vya s HIS 150 N -2.34 2.40 0.66 1.61 3.76 0.00 -4.72 115.29 116.66 2vya s HIS 150 Ca 0.00 -0.32 -0.14 0.00 -0.15 0.00 0.00 55.06 54.45 2vya s HIS 150 Cb 0.00 -1.21 -0.01 0.00 1.11 0.00 0.00 32.58 32.47 2vya s HIS 150 CO 0.00 0.46 1.07 -0.51 -0.85 0.00 0.00 174.74 174.92 2vya s ASP 151 N -2.54 5.38 -0.69 1.40 -0.00 -1.26 -1.02 116.67 117.94 2vya s ASP 151 Ca 0.20 1.80 0.05 0.00 -0.00 0.00 0.00 52.55 54.61 2vya s ASP 151 Cb -0.09 -2.53 0.19 0.00 -0.00 0.00 0.00 42.92 40.49 2vya s ASP 151 CO 0.10 -1.44 0.55 -1.20 -0.00 0.00 0.00 175.17 173.18 2vya n SER 152 N -2.58 3.15 -0.01 0.27 7.64 -1.26 -4.87 113.62 115.96 2vya n SER 152 Ca 0.09 -3.25 0.01 0.00 1.01 0.00 0.00 58.87 56.73 2vya n SER 152 Cb 0.53 -0.74 0.34 0.00 -1.01 0.00 0.00 64.21 63.33 2vya n SER 152 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2vya h THR 153 N 4.13 1.16 -1.23 0.44 1.35 -1.85 -3.46 112.91 113.45 2vya h THR 153 Ca 0.16 -0.54 -0.30 0.00 -0.55 0.00 0.00 66.41 65.18 2vya h THR 153 Cb 0.73 0.74 -0.12 0.00 -1.73 0.00 0.00 68.15 67.78 2vya h THR 153 CO 0.74 0.20 -0.27 0.18 -0.25 0.00 0.00 175.52 176.12 2vya n LEU 154 N -4.36 -1.05 0.00 3.87 4.77 -1.26 -0.62 117.00 118.35 2vya n LEU 154 Ca 0.02 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 2vya n LEU 154 Cb 0.16 -2.22 0.00 0.00 -2.33 0.00 0.00 43.42 39.03 2vya n LEU 154 CO 0.37 -0.80 0.00 0.61 -1.33 0.00 0.00 177.39 176.25 2vya n GLY 155 N -0.25 2.19 3.73 -0.72 0.00 -1.26 0.34 105.19 109.21 2vya n GLY 155 Ca -0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.49 2vya n GLY 155 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vya s LEU 156 N 0.00 4.31 0.42 0.99 2.01 0.21 -4.41 118.68 122.21 2vya s LEU 156 Ca 0.00 0.98 0.10 0.00 0.01 0.00 0.00 54.13 55.22 2vya s LEU 156 Cb 0.00 -2.85 0.92 0.00 0.01 0.00 0.00 46.19 44.27 2vya s LEU 156 CO 0.00 -0.02 2.02 0.77 1.01 0.00 0.00 176.35 180.13 2vya h SER 157 N 6.58 0.44 0.83 2.29 4.64 -1.87 -1.83 113.55 124.63 2vya h SER 157 Ca -0.42 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 2vya h SER 157 Cb 1.19 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2vya h SER 157 CO 0.75 0.30 0.00 0.17 -0.87 0.00 0.00 176.83 177.17 2vya h LEU 158 N 0.51 0.00 0.00 5.97 -0.00 -1.91 -2.13 115.31 117.74 2vya h LEU 158 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.09 2vya h LEU 158 Cb 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.85 2vya h LEU 158 CO -0.05 0.00 -0.78 0.59 -0.00 0.00 0.00 178.44 178.19 2vya n ASN 159 N -2.62 0.70 -4.77 0.17 3.02 -0.69 -4.92 115.26 106.15 2vya n ASN 159 Ca 0.01 -0.52 -0.38 0.00 -0.03 0.00 0.00 54.58 53.66 2vya n ASN 159 Cb 0.26 0.63 -0.02 0.00 -0.61 0.00 0.00 39.78 40.03 2vya n ASN 159 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2vya s GLU 160 N -3.04 4.07 -1.45 3.52 -6.30 -0.80 -3.00 118.70 111.70 2vya s GLU 160 Ca 0.09 1.75 -0.04 0.00 -2.50 0.00 0.00 54.97 54.27 2vya s GLU 160 Cb 0.16 -2.64 0.00 0.00 0.00 0.00 0.00 34.13 31.66 2vya s GLU 160 CO 0.78 -0.28 0.53 0.41 0.02 0.00 0.00 175.26 176.72 2vya n GLY 161 N 0.57 -0.42 2.37 -1.50 0.00 -1.26 -4.96 105.19 99.98 2vya n GLY 161 Ca 0.05 0.05 -0.24 0.00 0.00 0.00 0.00 46.02 45.87 2vya n GLY 161 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2vya n MET 162 N -3.72 1.69 -1.99 1.61 2.81 -1.16 -5.11 117.12 111.24 2vya n MET 162 Ca -0.11 -3.95 -0.38 0.00 -1.81 0.00 0.00 57.70 51.45 2vya n MET 162 Cb 0.62 -1.77 0.02 0.00 -0.71 0.00 0.00 33.22 31.37 2vya n MET 162 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 2vya s PRO 163 N -2.12 3.45 0.64 0.03 0.04 -1.26 -4.65 135.00 131.12 2vya s PRO 163 Ca 0.39 2.05 -0.18 0.00 0.04 0.00 0.00 61.00 63.30 2vya s PRO 163 Cb 0.21 -2.35 -0.02 0.00 0.04 0.00 0.00 34.50 32.37 2vya s PRO 163 CO -0.08 -0.89 1.17 0.45 0.04 0.00 0.00 177.00 177.70 2vya n SER 164 N -0.73 1.57 -0.15 6.66 2.88 -0.19 -4.79 113.62 118.87 2vya n SER 164 Ca 0.09 0.81 0.04 0.00 -1.33 0.00 0.00 58.87 58.48 2vya n SER 164 Cb 0.46 -1.49 -0.01 0.00 -0.75 0.00 0.00 64.21 62.42 2vya n SER 164 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2vya n GLU 165 N -1.61 2.53 -3.84 -1.46 1.02 -1.26 0.19 120.64 116.20 2vya n GLU 165 Ca 0.15 -0.46 -0.08 0.00 -0.02 0.00 0.00 57.16 56.75 2vya n GLU 165 Cb 0.48 -0.99 0.00 0.00 -0.02 0.00 0.00 31.44 30.91 2vya n GLU 165 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2vya s SER 166 N -1.20 -0.10 0.22 1.62 1.04 -1.26 -4.83 113.70 109.20 2vya s SER 166 Ca 0.06 -0.91 -0.24 0.00 0.48 0.00 0.00 55.95 55.34 2vya s SER 166 Cb 0.06 0.79 -0.09 0.00 0.10 0.00 0.00 66.02 66.88 2vya s SER 166 CO 0.20 -1.51 0.81 -1.81 0.98 0.00 0.00 173.24 171.90 2vya s ASP 167 N -3.00 7.28 0.80 7.02 -0.00 -1.26 -3.51 116.67 124.00 2vya s ASP 167 Ca 0.14 1.63 -0.12 0.00 -0.00 0.00 0.00 52.55 54.20 2vya s ASP 167 Cb -0.05 -2.50 0.08 0.00 -0.00 0.00 0.00 42.92 40.45 2vya s ASP 167 CO 0.10 0.09 1.16 0.00 -0.00 0.00 0.00 175.17 176.52 2vya h VAL 169 N -0.99 0.43 -0.31 0.00 2.07 -1.78 -0.52 116.25 115.15 2vya h VAL 169 Ca -0.45 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.13 2vya h VAL 169 Cb 1.27 0.43 -0.06 0.00 -1.52 0.00 0.00 31.29 31.42 2vya h VAL 169 CO 0.47 0.00 -0.05 0.58 0.02 0.00 0.00 177.57 178.60 2vya h VAL 170 N -0.11 0.72 -0.82 2.57 2.07 -1.80 0.43 116.25 119.31 2vya h VAL 170 Ca 0.20 -0.01 0.03 0.00 0.82 0.00 0.00 66.70 67.73 2vya h VAL 170 Cb 0.42 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 2vya h VAL 170 CO -0.48 0.01 0.54 0.58 0.02 0.00 0.00 177.57 178.24 2vya h VAL 171 N 0.04 1.16 -0.62 2.57 2.07 -1.78 -1.13 116.25 118.56 2vya h VAL 171 Ca 0.15 -0.36 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 2vya h VAL 171 Cb 0.22 0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 29.98 2vya h VAL 171 CO -0.29 0.19 0.38 1.56 0.02 0.00 0.00 177.57 179.42 2vya h GLN 172 N 1.05 0.84 -0.15 1.57 4.20 0.62 -2.54 115.11 120.70 2vya h GLN 172 Ca 0.32 -0.07 -0.17 0.00 0.06 0.00 0.00 58.65 58.79 2vya h GLN 172 Cb -0.02 -0.18 0.01 0.00 0.30 0.00 0.00 27.48 27.59 2vya h GLN 172 CO -0.09 0.60 -0.56 -0.24 -0.67 0.00 0.00 178.83 177.87 2vya h VAL 173 N 0.84 1.32 -0.92 -0.54 3.04 -0.52 -0.07 116.25 119.40 2vya h VAL 173 Ca 0.22 -1.82 0.26 0.00 -1.01 0.00 0.00 66.70 64.36 2vya h VAL 173 Cb -0.03 2.02 -0.14 0.00 -2.01 0.00 0.00 31.29 31.13 2vya h VAL 173 CO -0.04 0.56 0.35 -0.07 -1.01 0.00 0.00 177.57 177.36 2vya h LEU 174 N 0.32 0.17 -0.09 3.16 3.38 -1.24 0.16 115.31 121.17 2vya h LEU 174 Ca -0.03 0.19 -0.06 0.00 0.09 0.00 0.00 57.88 58.08 2vya h LEU 174 Cb 1.19 0.22 0.00 0.00 0.09 0.00 0.00 40.66 42.16 2vya h LEU 174 CO 0.12 -0.14 -0.17 0.11 0.09 0.00 0.00 178.44 178.45 2vya h LYS 175 N 0.25 0.28 0.00 1.13 1.57 -1.05 -0.32 116.57 118.43 2vya h LYS 175 Ca 0.61 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 59.21 2vya h LYS 175 Cb 1.28 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.62 2vya h LYS 175 CO -0.64 0.76 0.00 1.28 -0.57 0.00 0.00 179.45 180.28 2vya n LEU 176 N -4.57 0.27 -0.99 2.94 4.77 -0.07 -1.07 117.00 118.28 2vya n LEU 176 Ca -0.07 0.61 0.10 0.00 -0.03 0.00 0.00 56.01 56.61 2vya n LEU 176 Cb 0.39 -0.62 0.19 0.00 -2.33 0.00 0.00 43.42 41.05 2vya n LEU 176 CO 0.39 -0.62 0.66 1.67 -1.33 0.00 0.00 177.39 178.16 2vya n GLN 177 N -1.85 2.35 -0.16 3.23 -0.06 0.49 -4.79 117.38 116.59 2vya n GLN 177 Ca 0.00 -2.15 0.00 0.00 -2.00 0.00 0.00 57.00 52.86 2vya n GLN 177 Cb 0.07 -1.44 0.00 0.00 -4.06 0.00 0.00 30.24 24.81 2vya n GLN 177 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2vya n GLY 178 N 1.22 0.90 3.65 1.69 0.00 -0.23 -0.74 105.19 111.69 2vya n GLY 178 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2vya n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vya s ALA 179 N -2.53 0.90 -0.45 4.61 0.00 -0.16 -0.82 121.76 123.31 2vya s ALA 179 Ca 0.00 -0.17 0.03 0.00 0.00 0.00 0.00 51.96 51.81 2vya s ALA 179 Cb 0.00 -3.18 0.15 0.00 0.00 0.00 0.00 23.12 20.09 2vya s ALA 179 CO 0.00 -2.87 0.29 0.08 0.00 0.00 0.00 175.76 173.26 2vya s VAL 180 N -2.84 1.14 0.11 0.00 1.01 0.11 -4.46 120.40 115.47 2vya s VAL 180 Ca 0.65 -2.65 -0.31 0.00 0.00 0.00 0.00 61.98 59.67 2vya s VAL 180 Cb -0.20 -1.79 -0.11 0.00 0.00 0.00 0.00 36.38 34.28 2vya s VAL 180 CO 0.59 -1.00 1.85 -2.65 0.00 0.00 0.00 175.10 173.89 2vya n PRO 181 N 3.28 2.77 0.00 2.72 -0.02 -1.26 -1.47 135.00 141.02 2vya n PRO 181 Ca 0.15 1.01 0.00 0.00 -2.02 0.00 0.00 63.50 62.64 2vya n PRO 181 Cb 0.38 -2.91 0.00 0.00 -0.02 0.00 0.00 33.50 30.95 2vya n PRO 181 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 2vya n PHE 182 N 5.83 0.00 -3.88 6.00 -1.74 -0.45 -4.79 117.46 118.43 2vya n PHE 182 Ca 0.18 0.00 -0.11 0.00 -0.56 0.00 0.00 57.45 56.96 2vya n PHE 182 Cb 0.37 0.00 -0.12 0.00 1.52 0.00 0.00 39.48 41.25 2vya n PHE 182 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 2vya s VAL 183 N -1.53 0.04 -0.00 1.97 -7.23 -1.26 -0.90 120.40 111.49 2vya s VAL 183 Ca 0.00 -0.32 -0.26 0.00 -1.81 0.00 0.00 61.98 59.59 2vya s VAL 183 Cb 0.00 -0.21 -0.04 0.00 0.56 0.00 0.00 36.38 36.69 2vya s VAL 183 CO 0.00 -0.18 0.80 -1.00 -0.31 0.00 0.00 175.10 174.41 2vya s HIS 184 N -0.54 3.66 0.16 2.82 3.76 0.24 -0.91 115.29 124.47 2vya s HIS 184 Ca -0.06 1.45 0.07 0.00 -0.15 0.00 0.00 55.06 56.37 2vya s HIS 184 Cb -0.04 -2.89 -0.04 0.00 1.11 0.00 0.00 32.58 30.72 2vya s HIS 184 CO 0.00 0.14 -0.02 0.95 -0.85 0.00 0.00 174.74 174.96 2vya s THR 185 N 0.50 3.67 0.73 1.30 -4.23 0.07 -0.35 115.64 117.33 2vya s THR 185 Ca 0.41 -1.37 -0.14 0.00 -1.18 0.00 0.00 61.69 59.41 2vya s THR 185 Cb -0.20 -2.82 0.04 0.00 1.34 0.00 0.00 72.50 70.87 2vya s THR 185 CO 0.23 -0.05 1.16 0.21 -0.54 0.00 0.00 174.62 175.62 2vya s ASN 186 N -2.76 4.40 0.08 3.99 2.47 0.27 -2.10 114.94 121.30 2vya s ASN 186 Ca 0.26 2.17 0.01 0.00 0.42 0.00 0.00 52.86 55.72 2vya s ASN 186 Cb -0.10 -2.57 -0.04 0.00 -1.45 0.00 0.00 41.25 37.10 2vya s ASN 186 CO 0.18 -2.11 -0.06 0.68 -3.72 0.00 0.00 177.10 172.06 2vya s VAL 187 N -2.26 0.56 0.70 -5.21 -7.23 -1.26 -1.97 120.40 103.72 2vya s VAL 187 Ca 0.70 -1.81 -0.14 0.00 -1.81 0.00 0.00 61.98 58.92 2vya s VAL 187 Cb -0.24 -1.52 0.02 0.00 0.56 0.00 0.00 36.38 35.20 2vya s VAL 187 CO 0.46 -0.85 1.12 -2.16 -0.31 0.00 0.00 175.10 173.36 2vya s PRO 188 N -3.61 2.51 -0.13 4.82 0.04 -1.26 -4.27 135.00 133.10 2vya s PRO 188 Ca 0.08 1.41 -0.33 0.00 0.04 0.00 0.00 61.00 62.21 2vya s PRO 188 Cb 0.04 -1.91 -0.10 0.00 0.04 0.00 0.00 34.50 32.57 2vya s PRO 188 CO -0.05 -1.48 2.01 0.94 0.04 0.00 0.00 177.00 178.45 2vya n GLN 189 N -2.76 2.08 -0.96 4.56 7.27 -0.52 -1.00 117.38 126.06 2vya n GLN 189 Ca 0.11 0.71 0.00 0.00 0.07 0.00 0.00 57.00 57.89 2vya n GLN 189 Cb 0.52 -2.78 0.00 0.00 2.41 0.00 0.00 30.24 30.39 2vya n GLN 189 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 2vya n SER 190 N 8.21 -1.82 0.00 1.69 3.41 0.15 -3.96 113.62 121.30 2vya n SER 190 Ca 0.26 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 2vya n SER 190 Cb 0.33 -0.30 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 2vya n SER 190 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 2vya n MET 191 N -2.61 -0.09 -1.68 4.33 2.81 -0.17 -4.78 117.12 114.95 2vya n MET 191 Ca 0.00 0.02 -0.34 0.00 -1.81 0.00 0.00 57.70 55.57 2vya n MET 191 Cb 0.00 -4.49 0.00 0.00 -0.71 0.00 0.00 33.22 28.02 2vya n MET 191 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2vya n PHE 192 N -2.00 2.39 -3.79 2.03 7.35 -1.25 -4.48 117.46 117.70 2vya n PHE 192 Ca 0.00 -2.19 -0.10 0.00 -0.76 0.00 0.00 57.45 54.39 2vya n PHE 192 Cb 0.02 -1.27 -0.07 0.00 0.35 0.00 0.00 39.48 38.51 2vya n PHE 192 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2vya s SER 193 N -0.50 -0.02 -0.29 -2.13 0.15 -1.26 -4.99 113.70 104.66 2vya s SER 193 Ca 0.55 -0.41 0.11 0.00 0.70 0.00 0.00 55.95 56.90 2vya s SER 193 Cb 0.41 0.35 0.64 0.00 -1.71 0.00 0.00 66.02 65.72 2vya s SER 193 CO -0.30 -0.68 1.65 0.00 1.20 0.00 0.00 173.24 175.11 2vya n TYR 194 N 0.27 1.82 -3.27 3.44 4.11 -1.26 -2.28 117.16 119.99 2vya n TYR 194 Ca -0.17 -1.24 -0.03 0.00 -0.00 0.00 0.00 57.90 56.46 2vya n TYR 194 Cb 0.61 -0.57 0.00 0.00 -0.00 0.00 0.00 39.34 39.39 2vya n TYR 194 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.86 173.39 2vya n ASP 195 N -0.51 0.72 -3.00 9.48 4.64 -1.26 -2.36 116.55 124.27 2vya n ASP 195 Ca 0.35 -1.20 -0.16 0.00 -1.38 0.00 0.00 54.79 52.41 2vya n ASP 195 Cb 1.21 -0.03 -0.02 0.00 -1.04 0.00 0.00 41.12 41.24 2vya n ASP 195 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2vya s SER 197 N -1.03 0.18 0.07 0.00 0.15 -1.26 -0.69 113.70 111.12 2vya s SER 197 Ca 0.33 -0.42 -0.17 0.00 0.70 0.00 0.00 55.95 56.39 2vya s SER 197 Cb 0.16 0.14 0.03 0.00 -1.71 0.00 0.00 66.02 64.64 2vya s SER 197 CO -0.17 -0.33 0.40 0.54 1.20 0.00 0.00 173.24 174.88 2vya s ASN 198 N -1.47 -0.25 0.42 5.45 2.20 -0.12 -1.44 114.94 119.73 2vya s ASN 198 Ca -0.15 -0.12 0.29 0.00 -0.94 0.00 0.00 52.86 51.94 2vya s ASN 198 Cb -0.09 0.44 1.48 0.00 -2.00 0.00 0.00 41.25 41.07 2vya s ASN 198 CO -0.00 -0.72 1.88 -0.65 -2.94 0.00 0.00 177.10 174.66 2vya h PRO 199 N 2.81 0.00 0.00 3.55 0.11 -1.86 -1.32 132.00 135.29 2vya h PRO 199 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2vya h PRO 199 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2vya h PRO 199 CO 0.45 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.52 2vya n LEU 200 N -2.53 0.18 -0.90 2.35 4.32 -1.26 -4.59 117.00 114.56 2vya n LEU 200 Ca -0.01 0.44 0.12 0.00 -0.02 0.00 0.00 56.01 56.54 2vya n LEU 200 Cb 0.10 -0.47 0.21 0.00 -1.62 0.00 0.00 43.42 41.64 2vya n LEU 200 CO 0.15 -0.47 0.69 0.49 -1.22 0.00 0.00 177.39 177.04 2vya n PHE 201 N -1.94 0.11 -2.90 -1.77 3.01 -1.24 -4.39 117.46 108.34 2vya n PHE 201 Ca 0.00 -0.06 0.00 0.00 1.01 0.00 0.00 57.45 58.40 2vya n PHE 201 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 2vya n PHE 201 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2vya n GLY 202 N 1.34 -0.14 3.15 1.37 0.00 -0.50 -4.91 105.19 105.50 2vya n GLY 202 Ca 0.16 -1.28 -0.33 0.00 0.00 0.00 0.00 46.02 44.58 2vya n GLY 202 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2vya s GLN 203 N 0.00 3.02 0.25 1.61 0.74 -1.26 -0.94 119.66 123.08 2vya s GLN 203 Ca 0.00 -0.83 -0.17 0.00 0.05 0.00 0.00 55.36 54.41 2vya s GLN 203 Cb 0.00 -2.54 -0.08 0.00 1.10 0.00 0.00 33.01 31.48 2vya s GLN 203 CO 0.00 -0.14 0.71 0.99 -0.55 0.00 0.00 175.29 176.30 2vya s THR 204 N 1.12 4.64 0.17 -0.34 2.01 0.14 -4.71 115.64 118.67 2vya s THR 204 Ca 0.01 1.10 0.11 0.00 0.31 0.00 0.00 61.69 63.22 2vya s THR 204 Cb -0.14 -3.76 -0.04 0.00 0.01 0.00 0.00 72.50 68.57 2vya s THR 204 CO -0.08 0.07 -0.24 -0.04 -0.69 0.00 0.00 174.62 173.64 2vya s MET 205 N -2.33 1.45 0.01 4.92 -1.94 0.91 -4.40 119.30 117.92 2vya s MET 205 Ca 0.46 -1.46 -0.30 0.00 -1.71 0.00 0.00 55.69 52.69 2vya s MET 205 Cb -0.14 -1.79 -0.07 0.00 2.01 0.00 0.00 34.83 34.84 2vya s MET 205 CO 0.20 0.40 1.59 1.21 -0.01 0.00 0.00 175.02 178.40 2vya s ASN 206 N -2.48 6.69 0.29 3.03 3.84 -0.92 -4.61 114.94 120.77 2vya s ASN 206 Ca 0.18 2.31 0.24 0.00 0.21 0.00 0.00 52.86 55.80 2vya s ASN 206 Cb -0.08 -2.55 1.06 0.00 -0.55 0.00 0.00 41.25 39.13 2vya s ASN 206 CO 0.08 -0.86 1.71 -0.81 -2.79 0.00 0.00 177.10 174.44 2vya n PRO 207 N 6.03 0.19 0.07 0.43 -0.04 -1.26 -2.01 135.00 138.40 2vya n PRO 207 Ca 0.16 0.50 -0.12 0.00 -0.04 0.00 0.00 63.50 63.99 2vya n PRO 207 Cb 0.42 -1.92 -0.13 0.00 -0.04 0.00 0.00 33.50 31.83 2vya n PRO 207 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2vya h TRP 208 N 0.00 0.24 -2.04 0.54 4.06 -1.93 -3.46 115.95 113.35 2vya h TRP 208 Ca 0.00 -0.17 0.06 0.00 2.06 0.00 0.00 58.89 60.84 2vya h TRP 208 Cb 0.26 -0.01 -0.21 0.00 -1.00 0.00 0.00 29.16 28.21 2vya h TRP 208 CO 0.00 1.16 -0.13 0.21 -3.56 0.00 0.00 178.44 176.12 2vya s LYS 209 N -2.67 0.58 0.52 0.49 2.20 -0.85 -5.05 119.74 114.96 2vya s LYS 209 Ca -0.03 1.40 0.31 0.00 -0.36 0.00 0.00 55.97 57.30 2vya s LYS 209 Cb 0.08 0.75 1.16 0.00 -1.51 0.00 0.00 37.83 38.32 2vya s LYS 209 CO 0.85 -0.20 1.91 0.66 -0.36 0.00 0.00 175.35 178.21 2vya h SER 210 N 7.89 0.00 1.27 1.43 4.64 -1.90 -0.03 113.55 126.84 2vya h SER 210 Ca -0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2vya h SER 210 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 2vya h SER 210 CO 0.11 0.00 0.00 0.77 -0.87 0.00 0.00 176.83 176.84 2vya h SER 211 N 0.00 0.00 -3.19 4.97 4.64 -1.97 -3.44 113.55 114.56 2vya h SER 211 Ca 0.00 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.76 2vya h SER 211 Cb 0.60 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.66 2vya h SER 211 CO 0.00 0.00 -0.27 -0.54 -0.87 0.00 0.00 176.83 175.15 2vya s LYS 212 N -3.24 3.64 0.40 4.77 -0.14 -0.03 -1.39 119.74 123.75 2vya s LYS 212 Ca 0.07 -0.04 -0.25 0.00 -1.36 0.00 0.00 55.97 54.39 2vya s LYS 212 Cb 0.10 -2.80 -0.09 0.00 -1.68 0.00 0.00 37.83 33.37 2vya s LYS 212 CO 0.54 0.42 1.12 0.45 -0.76 0.00 0.00 175.35 177.12 2vya s SER 213 N -2.53 6.62 0.00 2.83 0.15 -0.15 -2.16 113.70 118.46 2vya s SER 213 Ca 0.42 2.23 0.31 0.00 0.70 0.00 0.00 55.95 59.60 2vya s SER 213 Cb -0.12 -2.60 1.60 0.00 -1.71 0.00 0.00 66.02 63.18 2vya s SER 213 CO 0.25 -0.60 2.06 -0.81 1.20 0.00 0.00 173.24 175.34 2vya n PRO 214 N 0.04 0.89 0.00 5.44 -0.04 -1.26 -4.39 135.00 135.68 2vya n PRO 214 Ca 0.04 -0.16 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 2vya n PRO 214 Cb 0.48 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 2vya n PRO 214 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2vya n GLY 215 N 1.13 -2.25 0.00 0.55 0.00 -1.25 -4.29 105.19 99.09 2vya n GLY 215 Ca 0.19 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.70 2vya n GLY 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vya n GLY 216 N -0.58 -1.28 0.11 -0.02 0.00 -0.99 -3.55 105.19 98.88 2vya n GLY 216 Ca 0.00 -0.95 0.11 0.00 0.00 0.00 0.00 46.02 45.18 2vya n GLY 216 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2vya n SER 217 N 0.34 0.56 -1.67 1.61 3.41 -0.96 -4.34 113.62 112.58 2vya n SER 217 Ca 0.00 0.64 -0.06 0.00 -0.26 0.00 0.00 58.87 59.19 2vya n SER 217 Cb 0.00 -0.76 -0.01 0.00 -0.26 0.00 0.00 64.21 63.18 2vya n SER 217 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2vya n SER 218 N -2.13 5.63 0.01 4.04 7.64 -0.96 -4.25 113.62 123.60 2vya n SER 218 Ca 0.02 -2.59 -0.12 0.00 1.01 0.00 0.00 58.87 57.19 2vya n SER 218 Cb 0.22 -1.14 -0.08 0.00 -1.01 0.00 0.00 64.21 62.20 2vya n SER 218 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2vya h GLY 219 N 3.11 0.04 -0.59 0.23 0.00 -1.71 -2.38 103.07 101.77 2vya h GLY 219 Ca 0.10 -0.02 0.13 0.00 0.00 0.00 0.00 47.33 47.53 2vya h GLY 219 CO 0.22 0.02 -0.32 -1.33 0.00 0.00 0.00 176.54 175.13 2vya h GLY 220 N -0.13 0.07 1.36 4.60 0.00 -1.64 0.52 103.07 107.84 2vya h GLY 220 Ca 0.01 0.42 0.01 0.00 0.00 0.00 0.00 47.33 47.77 2vya h GLY 220 CO -0.00 -0.22 0.43 0.83 0.00 0.00 0.00 176.54 177.57 2vya h GLU 221 N -0.09 0.84 0.29 4.80 4.39 -1.75 0.11 114.58 123.17 2vya h GLU 221 Ca 0.29 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.92 2vya h GLU 221 Cb 0.57 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 29.03 2vya h GLU 221 CO -0.78 0.56 -0.14 0.78 -1.16 0.00 0.00 179.01 178.27 2vya h GLY 222 N 0.87 -0.41 1.00 -3.84 0.00 -0.46 -1.09 103.07 99.14 2vya h GLY 222 Ca 0.24 0.15 -0.00 0.00 0.00 0.00 0.00 47.33 47.72 2vya h GLY 222 CO -0.05 -0.15 0.36 0.00 0.00 0.00 0.00 176.54 176.70 2vya h ALA 223 N 0.29 0.74 0.09 3.60 0.00 -0.64 -1.14 119.26 122.19 2vya h ALA 223 Ca -0.04 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2vya h ALA 223 Cb 0.32 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2vya h ALA 223 CO 0.07 0.21 -0.04 1.25 0.00 0.00 0.00 179.25 180.73 2vya h LEU 224 N 0.79 -0.10 -0.64 0.00 5.85 -0.73 -2.79 115.31 117.69 2vya h LEU 224 Ca 0.21 -0.43 -0.03 0.00 0.84 0.00 0.00 57.88 58.46 2vya h LEU 224 Cb -0.04 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 2vya h LEU 224 CO -0.04 0.41 0.27 0.40 -0.34 0.00 0.00 178.44 179.14 2vya h ILE 225 N -0.65 1.23 0.00 4.05 2.04 -1.25 -0.90 117.51 122.03 2vya h ILE 225 Ca -0.01 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 65.13 2vya h ILE 225 Cb 0.53 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 2vya h ILE 225 CO 0.02 0.28 0.00 1.23 0.00 0.00 0.00 178.15 179.68 2vya h GLY 226 N 0.90 0.00 -1.28 5.37 0.00 -1.20 -2.08 103.07 104.78 2vya h GLY 226 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 2vya h GLY 226 CO -0.02 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.38 2vya n SER 227 N -2.39 2.89 0.00 0.19 3.41 -1.06 -4.98 113.62 111.68 2vya n SER 227 Ca 0.01 -1.97 0.00 0.00 -0.26 0.00 0.00 58.87 56.65 2vya n SER 227 Cb 0.22 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 2vya n SER 227 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vya n GLY 228 N 0.54 0.82 0.48 5.00 0.00 -0.78 -4.97 105.19 106.28 2vya n GLY 228 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.26 2vya n GLY 228 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vya n GLY 229 N -2.28 -0.04 3.46 -0.02 0.00 -0.36 -4.81 105.19 101.14 2vya n GLY 229 Ca 0.00 -0.49 -0.12 0.00 0.00 0.00 0.00 46.02 45.41 2vya n GLY 229 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2vya s SER 230 N -2.22 -0.65 0.12 1.61 0.15 -1.24 -4.37 113.70 107.10 2vya s SER 230 Ca 0.30 1.17 0.27 0.00 0.70 0.00 0.00 55.95 58.38 2vya s SER 230 Cb 0.20 1.13 1.00 0.00 -1.71 0.00 0.00 66.02 66.63 2vya s SER 230 CO 0.42 -0.20 1.84 -0.81 1.20 0.00 0.00 173.24 175.69 2vya n PRO 231 N 3.37 0.14 -3.64 5.44 -0.04 -1.26 -4.47 135.00 134.55 2vya n PRO 231 Ca -0.17 0.12 -0.08 0.00 -0.04 0.00 0.00 63.50 63.33 2vya n PRO 231 Cb 0.56 -1.67 -0.07 0.00 -0.04 0.00 0.00 33.50 32.29 2vya n PRO 231 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2vya s LEU 232 N -3.84 -0.58 0.15 1.53 2.96 -1.26 -4.26 118.68 113.37 2vya s LEU 232 Ca 0.12 1.05 -0.04 0.00 -0.22 0.00 0.00 54.13 55.03 2vya s LEU 232 Cb 0.15 2.02 -0.03 0.00 0.50 0.00 0.00 46.19 48.84 2vya s LEU 232 CO 0.56 -0.17 0.16 -0.83 -1.32 0.00 0.00 176.35 174.75 2vya s GLY 233 N 0.68 0.78 -0.05 7.98 0.00 -0.57 -1.89 107.32 114.25 2vya s GLY 233 Ca -0.02 -1.22 0.06 0.00 0.00 0.00 0.00 44.72 43.54 2vya s GLY 233 CO -0.09 -1.13 -0.25 1.08 0.00 0.00 0.00 173.10 172.71 2vya s LEU 234 N -3.02 2.06 0.35 0.66 1.02 -0.79 -0.88 118.68 118.09 2vya s LEU 234 Ca 0.21 -0.50 0.07 0.00 0.02 0.00 0.00 54.13 53.94 2vya s LEU 234 Cb 0.06 -1.35 -0.03 0.00 0.02 0.00 0.00 46.19 44.89 2vya s LEU 234 CO 0.01 0.25 0.26 -0.83 0.02 0.00 0.00 176.35 176.06 2vya s GLY 235 N -0.23 2.45 0.12 -3.19 0.00 -0.42 -1.93 107.32 104.12 2vya s GLY 235 Ca -0.01 -1.91 0.04 0.00 0.00 0.00 0.00 44.72 42.84 2vya s GLY 235 CO 0.03 -1.55 -0.10 -0.51 0.00 0.00 0.00 173.10 170.97 2vya s THR 236 N -3.37 1.03 -0.19 0.90 -4.23 -1.26 -0.69 115.64 107.83 2vya s THR 236 Ca 0.37 -1.90 -0.04 0.00 -1.18 0.00 0.00 61.69 58.94 2vya s THR 236 Cb 0.02 -1.66 0.10 0.00 1.34 0.00 0.00 72.50 72.30 2vya s THR 236 CO 0.26 -0.69 0.31 -0.62 -0.54 0.00 0.00 174.62 173.34 2vya s ASP 237 N -2.90 0.46 -0.00 3.99 3.68 0.19 -2.63 116.67 119.46 2vya s ASP 237 Ca 0.12 0.35 0.03 0.00 2.13 0.00 0.00 52.55 55.18 2vya s ASP 237 Cb 0.01 0.86 -0.04 0.00 -1.45 0.00 0.00 42.92 42.30 2vya s ASP 237 CO -0.00 -0.28 0.06 0.00 0.13 0.00 0.00 175.17 175.08 2vya n ILE 238 N 5.35 0.00 -2.09 4.11 3.06 -1.26 -1.40 119.36 127.13 2vya n ILE 238 Ca -0.06 -0.06 -0.01 0.00 -2.50 0.00 0.00 62.75 60.12 2vya n ILE 238 Cb 0.50 0.45 -0.01 0.00 0.54 0.00 0.00 39.64 41.11 2vya n ILE 238 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2vya n GLY 239 N 2.34 0.76 0.00 4.50 0.00 -1.26 -4.76 105.19 106.76 2vya n GLY 239 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2vya n GLY 239 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vya n GLY 240 N 0.09 0.31 0.00 -0.02 0.00 -1.26 -3.62 105.19 100.69 2vya n GLY 240 Ca -0.06 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.05 2vya n GLY 240 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2vya n SER 241 N 0.00 0.00 0.05 1.61 7.64 -1.26 0.33 113.62 121.99 2vya n SER 241 Ca 0.00 0.49 -0.23 0.00 1.01 0.00 0.00 58.87 60.14 2vya n SER 241 Cb 0.00 -0.49 -0.15 0.00 -1.01 0.00 0.00 64.21 62.56 2vya n SER 241 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 2vya h ILE 242 N 0.00 0.84 0.05 0.44 2.04 -1.81 -2.55 117.51 116.52 2vya h ILE 242 Ca 0.00 -2.45 -0.24 0.00 1.00 0.00 0.00 64.86 63.16 2vya h ILE 242 Cb 0.31 2.68 0.02 0.00 -0.74 0.00 0.00 36.82 39.10 2vya h ILE 242 CO 0.00 0.87 -0.98 0.03 0.00 0.00 0.00 178.15 178.07 2vya h ARG 243 N 0.09 0.58 0.37 2.37 3.08 -0.88 -3.09 114.38 116.89 2vya h ARG 243 Ca -0.37 -0.69 -0.00 0.00 0.07 0.00 0.00 59.98 58.99 2vya h ARG 243 Cb 2.07 0.21 -0.03 0.00 0.08 0.00 0.00 29.97 32.31 2vya h ARG 243 CO 0.15 1.28 -0.43 0.74 -1.07 0.00 0.00 179.97 180.64 2vya h PHE 244 N 0.17 -1.19 0.00 3.04 0.04 -0.39 -1.95 116.94 116.67 2vya h PHE 244 Ca -0.14 0.01 -0.05 0.00 2.80 0.00 0.00 57.97 60.59 2vya h PHE 244 Cb 1.67 0.47 -0.01 0.00 2.20 0.00 0.00 35.95 40.28 2vya h PHE 244 CO 0.13 -0.58 -0.25 -1.00 -0.60 0.00 0.00 178.31 176.01 2vya h PRO 245 N -0.84 0.00 -0.30 1.51 0.13 -1.75 0.79 132.00 131.55 2vya h PRO 245 Ca -0.03 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.01 2vya h PRO 245 Cb 0.76 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.88 2vya h PRO 245 CO -0.10 0.25 -0.15 0.77 -0.23 0.00 0.00 178.00 178.54 2vya h SER 246 N 0.00 0.65 0.11 1.44 0.02 -1.45 -0.88 113.55 113.45 2vya h SER 246 Ca -0.00 -0.41 -0.01 0.00 -0.84 0.00 0.00 61.79 60.53 2vya h SER 246 Cb 0.60 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.96 2vya h SER 246 CO 0.03 0.92 -0.05 0.00 -1.14 0.00 0.00 176.83 176.59 2vya h ALA 247 N 0.75 -0.14 -0.10 3.77 0.00 -0.88 0.75 119.26 123.41 2vya h ALA 247 Ca 0.06 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 2vya h ALA 247 Cb 0.68 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2vya h ALA 247 CO 0.05 -0.41 -0.14 0.74 0.00 0.00 0.00 179.25 179.49 2vya h PHE 248 N -0.48 0.16 -0.02 0.00 -1.00 -0.84 -2.82 116.94 111.93 2vya h PHE 248 Ca -0.01 -0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.75 2vya h PHE 248 Cb 0.40 -0.05 0.00 0.00 3.61 0.00 0.00 35.95 39.91 2vya h PHE 248 CO 0.04 0.29 -0.08 0.00 -1.61 0.00 0.00 178.31 176.95 2vya n GLY 250 N 1.24 0.56 2.44 0.00 0.00 -0.30 -4.67 105.19 104.45 2vya n GLY 250 Ca 0.12 -0.79 -0.21 0.00 0.00 0.00 0.00 46.02 45.13 2vya n GLY 250 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2vya n ILE 251 N -3.61 0.00 -4.05 -0.61 -5.35 0.10 -4.81 119.36 101.04 2vya n ILE 251 Ca 0.00 -1.63 -0.32 0.00 -0.27 0.00 0.00 62.75 60.53 2vya n ILE 251 Cb 0.42 0.39 -0.06 0.00 -1.74 0.00 0.00 39.64 38.64 2vya n ILE 251 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2vya s GLY 253 N -2.13 -0.13 -0.03 0.00 0.00 -1.05 -0.68 107.32 103.29 2vya s GLY 253 Ca 0.27 -0.23 0.01 0.00 0.00 0.00 0.00 44.72 44.78 2vya s GLY 253 CO 0.19 -0.46 -0.04 -2.27 0.00 0.00 0.00 173.10 170.53 2vya s LEU 254 N -2.72 1.45 -0.43 0.66 2.96 -0.81 -0.68 118.68 119.11 2vya s LEU 254 Ca 0.03 -0.11 -0.12 0.00 -0.22 0.00 0.00 54.13 53.71 2vya s LEU 254 Cb 0.03 -0.39 0.07 0.00 0.50 0.00 0.00 46.19 46.40 2vya s LEU 254 CO -0.11 -0.03 0.29 -0.75 -1.32 0.00 0.00 176.35 174.43 2vya s LYS 255 N 0.70 2.77 1.09 1.98 2.20 0.14 -3.72 119.74 124.90 2vya s LYS 255 Ca -0.09 -1.34 -0.18 0.00 -0.36 0.00 0.00 55.97 54.00 2vya s LYS 255 Cb -0.12 -3.89 0.24 0.00 -1.51 0.00 0.00 37.83 32.56 2vya s LYS 255 CO -0.00 -0.92 1.20 -2.14 -0.36 0.00 0.00 175.35 173.13 2vya s PRO 256 N 1.52 -0.35 0.16 4.03 0.02 -1.26 -0.72 135.00 138.40 2vya s PRO 256 Ca 0.03 -0.21 -0.34 0.00 0.02 0.00 0.00 61.00 60.51 2vya s PRO 256 Cb -0.23 -1.71 -0.15 0.00 0.02 0.00 0.00 34.50 32.43 2vya s PRO 256 CO 0.05 -3.11 1.35 2.41 -0.33 0.00 0.00 177.00 177.37 2vya n THR 257 N -4.30 0.48 -0.40 0.99 -1.04 -1.26 -4.63 114.28 104.12 2vya n THR 257 Ca 0.14 -0.12 0.33 0.00 -2.04 0.00 0.00 64.05 62.35 2vya n THR 257 Cb 0.59 -1.12 0.62 0.00 -1.82 0.00 0.00 70.33 68.61 2vya n THR 257 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2vya h GLY 258 N 4.40 1.03 -1.86 3.41 0.00 -1.84 -0.68 103.07 107.52 2vya h GLY 258 Ca -0.45 -0.13 -0.07 0.00 0.00 0.00 0.00 47.33 46.69 2vya h GLY 258 CO 0.77 -0.23 0.01 -2.01 0.00 0.00 0.00 176.54 175.08 2vya n ASN 259 N -4.56 3.58 0.03 0.19 5.15 -1.26 -4.48 115.26 113.91 2vya n ASN 259 Ca 0.32 -3.23 -0.13 0.00 -0.60 0.00 0.00 54.58 50.94 2vya n ASN 259 Cb 1.24 -0.59 -0.02 0.00 -0.53 0.00 0.00 39.78 39.89 2vya n ASN 259 CO 0.00 0.00 0.00 -0.09 1.40 0.00 0.00 177.26 178.57 2vya h ARG 260 N 1.62 0.54 -5.82 1.20 9.65 -1.48 -3.37 114.38 116.72 2vya h ARG 260 Ca 0.08 -0.46 -0.59 0.00 -1.10 0.00 0.00 59.98 57.91 2vya h ARG 260 Cb 1.58 0.10 -0.10 0.00 -1.39 0.00 0.00 29.97 30.16 2vya h ARG 260 CO 0.31 1.09 -0.53 -0.51 2.80 0.00 0.00 179.97 183.13 2vya s LEU 261 N -8.07 3.03 -0.18 3.80 1.43 -1.26 -4.83 118.68 112.61 2vya s LEU 261 Ca -0.07 -1.18 -0.13 0.00 -1.03 0.00 0.00 54.13 51.72 2vya s LEU 261 Cb 0.09 -1.26 -0.05 0.00 0.03 0.00 0.00 46.19 45.01 2vya s LEU 261 CO 0.87 -0.52 0.25 -0.55 0.23 0.00 0.00 176.35 176.63 2vya s SER 262 N -3.84 6.36 -0.06 2.29 0.15 -1.26 -4.94 113.70 112.40 2vya s SER 262 Ca 0.39 0.42 0.18 0.00 0.70 0.00 0.00 55.95 57.64 2vya s SER 262 Cb 0.06 -2.16 0.60 0.00 -1.71 0.00 0.00 66.02 62.81 2vya s SER 262 CO 0.21 0.11 1.51 0.29 1.20 0.00 0.00 173.24 176.56 2vya n LYS 263 N 3.66 3.21 -1.92 5.44 5.02 -1.26 -4.52 118.16 127.77 2vya n LYS 263 Ca -0.13 -2.65 -0.43 0.00 -2.02 0.00 0.00 58.31 53.08 2vya n LYS 263 Cb 0.52 -1.67 -0.03 0.00 -0.02 0.00 0.00 35.03 33.83 2vya n LYS 263 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2vya s SER 264 N -1.04 6.14 0.00 4.39 0.15 -1.26 -2.51 113.70 119.57 2vya s SER 264 Ca 0.44 1.81 0.00 0.00 0.70 0.00 0.00 55.95 58.90 2vya s SER 264 Cb 0.27 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 62.05 2vya s SER 264 CO 0.24 -1.43 0.00 0.61 1.20 0.00 0.00 173.24 173.86 2vya n GLY 265 N 4.97 0.90 3.79 9.45 0.00 -1.26 -2.23 105.19 120.80 2vya n GLY 265 Ca 0.22 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.85 2vya n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vya s LEU 266 N 0.00 4.55 0.12 0.99 1.02 -1.05 -2.67 118.68 121.65 2vya s LEU 266 Ca 0.00 1.45 -0.24 0.00 0.02 0.00 0.00 54.13 55.36 2vya s LEU 266 Cb 0.00 -3.11 -0.07 0.00 0.02 0.00 0.00 46.19 43.03 2vya s LEU 266 CO 0.00 0.23 0.73 -0.75 0.02 0.00 0.00 176.35 176.58 2vya s LYS 267 N -1.05 4.48 0.28 1.70 2.36 0.11 -4.97 119.74 122.65 2vya s LYS 267 Ca 0.33 1.06 -0.07 0.00 -2.55 0.00 0.00 55.97 54.73 2vya s LYS 267 Cb -0.21 -3.28 -0.01 0.00 -1.05 0.00 0.00 37.83 33.28 2vya s LYS 267 CO 0.23 0.53 0.43 0.20 1.55 0.00 0.00 175.35 178.28 2vya s GLY 268 N -0.91 1.01 -0.13 5.54 0.00 -1.26 -4.87 107.32 106.70 2vya s GLY 268 Ca 0.35 -1.23 0.15 0.00 0.00 0.00 0.00 44.72 43.99 2vya s GLY 268 CO 0.24 -0.87 0.34 0.00 0.00 0.00 0.00 173.10 172.81 2vya s VAL 270 N -2.54 0.94 0.04 0.00 -7.23 -1.26 -4.55 120.40 105.79 2vya s VAL 270 Ca -0.08 -0.83 0.05 0.00 -1.81 0.00 0.00 61.98 59.31 2vya s VAL 270 Cb 0.07 -0.85 -0.02 0.00 0.56 0.00 0.00 36.38 36.14 2vya s VAL 270 CO 0.83 0.03 -0.15 -0.31 -0.31 0.00 0.00 175.10 175.18 2vya s TYR 271 N -0.72 1.29 0.00 2.82 2.02 -1.26 -4.80 117.35 116.70 2vya s TYR 271 Ca 0.01 -0.36 0.00 0.00 -0.37 0.00 0.00 57.07 56.35 2vya s TYR 271 Cb -0.07 -0.76 0.00 0.00 -0.40 0.00 0.00 41.96 40.73 2vya s TYR 271 CO 0.01 0.04 0.00 0.41 -1.57 0.00 0.00 175.55 174.44 2vya n GLY 272 N 1.89 0.47 3.66 0.71 0.00 -1.26 -5.02 105.19 105.64 2vya n GLY 272 Ca -0.18 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.92 2vya n GLY 272 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2vya s GLN 273 N -0.95 4.24 0.00 1.61 -0.44 -1.26 -4.93 119.66 117.93 2vya s GLN 273 Ca 0.00 1.01 0.00 0.00 -2.50 0.00 0.00 55.36 53.87 2vya s GLN 273 Cb 0.00 -3.61 0.00 0.00 -1.64 0.00 0.00 33.01 27.76 2vya s GLN 273 CO 0.00 -0.44 0.39 0.25 0.50 0.00 0.00 175.29 175.99 2vya n THR 274 N 5.03 0.15 -0.08 -0.34 -2.24 -1.26 -4.81 114.28 110.73 2vya n THR 274 Ca 0.06 -0.31 -0.12 0.00 -2.27 0.00 0.00 64.05 61.40 2vya n THR 274 Cb 0.48 1.29 -0.05 0.00 -2.10 0.00 0.00 70.33 69.95 2vya n THR 274 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2vya h ALA 275 N 0.00 0.32 -3.07 6.98 0.00 -1.92 -3.39 119.26 118.18 2vya h ALA 275 Ca 0.00 -0.31 -0.66 0.00 0.00 0.00 0.00 54.91 53.94 2vya h ALA 275 Cb 0.42 -0.08 -0.29 0.00 0.00 0.00 0.00 17.79 17.84 2vya h ALA 275 CO 0.00 0.18 -0.72 0.08 0.00 0.00 0.00 179.25 178.78 2vya s VAL 276 N -4.55 3.25 0.19 0.00 1.01 -1.26 -4.94 120.40 114.10 2vya s VAL 276 Ca -0.14 -0.67 -0.27 0.00 0.00 0.00 0.00 61.98 60.91 2vya s VAL 276 Cb 0.07 -2.54 -0.08 0.00 0.00 0.00 0.00 36.38 33.82 2vya s VAL 276 CO 0.77 0.33 0.83 -1.10 0.00 0.00 0.00 175.10 175.93 2vya s GLN 277 N 1.43 4.64 0.33 2.72 -1.52 -1.26 -4.98 119.66 121.03 2vya s GLN 277 Ca 0.04 1.25 -0.27 0.00 -1.95 0.00 0.00 55.36 54.43 2vya s GLN 277 Cb -0.15 -3.24 -0.09 0.00 -0.22 0.00 0.00 33.01 29.30 2vya s GLN 277 CO -0.03 0.54 1.11 -1.17 -0.25 0.00 0.00 175.29 175.49 2vya s LEU 278 N -1.21 4.39 -0.00 2.90 2.96 -1.26 -4.63 118.68 121.83 2vya s LEU 278 Ca 0.38 2.26 0.03 0.00 -0.22 0.00 0.00 54.13 56.58 2vya s LEU 278 Cb -0.24 -3.83 -0.01 0.00 0.50 0.00 0.00 46.19 42.62 2vya s LEU 278 CO 0.28 -0.35 -0.09 -0.55 -1.32 0.00 0.00 176.35 174.32 2vya s SER 279 N -1.05 1.02 0.17 3.68 0.15 -0.49 -4.64 113.70 112.53 2vya s SER 279 Ca 0.50 -0.18 0.08 0.00 0.70 0.00 0.00 55.95 57.05 2vya s SER 279 Cb -0.30 -0.11 -0.04 0.00 -1.71 0.00 0.00 66.02 63.86 2vya s SER 279 CO 0.38 0.09 -0.07 -1.48 1.20 0.00 0.00 173.24 173.37 2vya s LEU 280 N -0.29 3.08 -0.02 3.45 0.05 -1.26 0.56 118.68 124.26 2vya s LEU 280 Ca 0.03 -0.50 -0.30 0.00 0.05 0.00 0.00 54.13 53.40 2vya s LEU 280 Cb -0.04 -1.77 0.12 0.00 -2.05 0.00 0.00 46.19 42.46 2vya s LEU 280 CO -0.00 0.11 1.29 -0.83 -0.55 0.00 0.00 176.35 176.37 2vya s GLY 281 N -2.80 -0.41 0.42 -3.48 0.00 0.14 -4.33 107.32 96.87 2vya s GLY 281 Ca 0.25 0.68 -0.18 0.00 0.00 0.00 0.00 44.72 45.47 2vya s GLY 281 CO 0.16 0.30 0.89 2.56 0.00 0.00 0.00 173.10 177.01 2vya s PRO 282 N -2.40 4.07 0.04 2.90 0.04 -1.24 -1.30 135.00 137.11 2vya s PRO 282 Ca 0.15 0.91 0.04 0.00 0.04 0.00 0.00 61.00 62.14 2vya s PRO 282 Cb 0.05 -2.25 -0.02 0.00 0.04 0.00 0.00 34.50 32.32 2vya s PRO 282 CO -0.04 -0.04 -0.13 -1.64 0.04 0.00 0.00 177.00 175.19 2vya s MET 283 N -3.39 0.83 0.07 4.56 -1.94 -0.06 -1.91 119.30 117.46 2vya s MET 283 Ca 0.58 -0.77 -0.26 0.00 -1.71 0.00 0.00 55.69 53.54 2vya s MET 283 Cb -0.10 -0.81 0.09 0.00 2.01 0.00 0.00 34.83 36.02 2vya s MET 283 CO 0.20 0.19 1.17 0.00 -0.01 0.00 0.00 175.02 176.57 2vya s ALA 284 N -0.96 -2.04 -0.50 3.03 0.00 0.14 -1.51 121.76 119.93 2vya s ALA 284 Ca -0.01 0.01 0.24 0.00 0.00 0.00 0.00 51.96 52.20 2vya s ALA 284 Cb -0.08 0.74 0.36 0.00 0.00 0.00 0.00 23.12 24.13 2vya s ALA 284 CO 0.01 -1.09 1.44 0.00 0.00 0.00 0.00 175.76 176.12 2vya h ARG 285 N 2.00 0.00 -3.97 0.00 3.08 -1.84 0.29 114.38 113.93 2vya h ARG 285 Ca -0.26 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.63 2vya h ARG 285 Cb 1.20 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 31.16 2vya h ARG 285 CO 0.32 0.00 -0.24 0.16 -1.07 0.00 0.00 179.97 179.15 2vya s ASP 286 N -5.21 0.26 0.10 7.04 3.84 -1.26 -4.55 116.67 116.89 2vya s ASP 286 Ca 0.06 -1.19 -0.11 0.00 -0.00 0.00 0.00 52.55 51.31 2vya s ASP 286 Cb 0.09 0.57 -0.17 0.00 -1.38 0.00 0.00 42.92 42.04 2vya s ASP 286 CO 0.69 -1.13 1.26 0.58 -0.00 0.00 0.00 175.17 176.57 2vya h VAL 287 N 2.28 1.31 -0.51 2.11 2.07 -1.93 -3.10 116.25 118.48 2vya h VAL 287 Ca -0.29 -2.23 0.08 0.00 0.82 0.00 0.00 66.70 65.09 2vya h VAL 287 Cb 1.25 2.29 -0.03 0.00 -1.52 0.00 0.00 31.29 33.27 2vya h VAL 287 CO 0.40 0.69 0.35 -0.08 0.02 0.00 0.00 177.57 178.94 2vya h GLU 288 N 0.38 0.36 -0.25 1.57 4.57 -1.98 0.19 114.58 119.42 2vya h GLU 288 Ca -0.10 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.05 2vya h GLU 288 Cb 1.59 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 30.08 2vya h GLU 288 CO 0.18 0.24 0.11 0.77 -1.18 0.00 0.00 179.01 179.13 2vya h SER 289 N 0.37 0.34 -0.51 1.04 0.02 -1.94 0.01 113.55 112.88 2vya h SER 289 Ca 0.23 -0.14 0.01 0.00 -0.84 0.00 0.00 61.79 61.05 2vya h SER 289 Cb 0.44 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.86 2vya h SER 289 CO -0.06 0.39 0.33 -0.07 -1.14 0.00 0.00 176.83 176.28 2vya h LEU 290 N 0.26 0.57 -0.33 5.07 3.38 -1.06 -1.01 115.31 122.20 2vya h LEU 290 Ca 0.08 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2vya h LEU 290 Cb 0.15 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 2vya h LEU 290 CO -0.01 0.41 0.17 0.00 0.09 0.00 0.00 178.44 179.10 2vya h ALA 291 N 1.19 0.42 0.05 1.53 0.00 -0.86 -1.20 119.26 120.39 2vya h ALA 291 Ca 0.19 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2vya h ALA 291 Cb -0.06 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.60 2vya h ALA 291 CO -0.05 -0.03 -0.02 1.25 0.00 0.00 0.00 179.25 180.39 2vya h LEU 292 N 0.40 -0.06 -0.37 0.00 5.85 -0.83 -0.05 115.31 120.26 2vya h LEU 292 Ca 0.11 -0.06 0.08 0.00 0.84 0.00 0.00 57.88 58.85 2vya h LEU 292 Cb 0.09 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.06 2vya h LEU 292 CO -0.02 0.02 -0.19 0.00 -0.34 0.00 0.00 178.44 177.91 2vya h LEU 294 N -0.13 1.03 -1.29 0.00 3.38 -0.97 0.02 115.31 117.34 2vya h LEU 294 Ca 0.18 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 2vya h LEU 294 Cb 0.41 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2vya h LEU 294 CO -0.45 0.71 0.23 0.50 0.09 0.00 0.00 178.44 179.51 2vya h LYS 295 N 1.19 0.72 -0.32 1.13 3.64 0.53 -0.69 116.57 122.77 2vya h LYS 295 Ca 0.37 -0.09 -0.11 0.00 -1.27 0.00 0.00 60.65 59.55 2vya h LYS 295 Cb -0.01 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 2vya h LYS 295 CO -0.12 0.57 -0.24 0.00 -2.27 0.00 0.00 179.45 177.40 2vya h ALA 296 N 1.54 0.45 -0.04 5.00 0.00 0.39 -3.31 119.26 123.29 2vya h ALA 296 Ca 0.18 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 2vya h ALA 296 Cb 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2vya h ALA 296 CO -0.02 0.43 -0.17 -0.07 0.00 0.00 0.00 179.25 179.42 2vya h LEU 297 N 0.48 0.21 -7.95 0.00 -0.00 -0.79 -3.39 115.31 103.87 2vya h LEU 297 Ca 0.06 -0.65 -0.48 0.00 -0.00 0.00 0.00 57.88 56.82 2vya h LEU 297 Cb 0.79 -0.06 -0.06 0.00 -0.00 0.00 0.00 40.66 41.33 2vya h LEU 297 CO 0.06 0.83 1.52 -0.76 -0.00 0.00 0.00 178.44 180.08 2vya s LEU 298 N -8.80 3.38 0.36 1.67 1.43 -0.29 -4.38 118.68 112.05 2vya s LEU 298 Ca -0.15 -1.92 -0.04 0.00 -1.03 0.00 0.00 54.13 50.98 2vya s LEU 298 Cb 0.02 -2.58 0.01 0.00 0.03 0.00 0.00 46.19 43.67 2vya s LEU 298 CO 0.73 -2.27 0.53 0.00 0.23 0.00 0.00 176.35 175.57 2vya h GLU 300 N 2.08 0.00 -0.60 0.00 4.39 -1.94 -1.67 114.58 116.84 2vya h GLU 300 Ca -0.29 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.34 2vya h GLU 300 Cb 1.24 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.87 2vya h GLU 300 CO 0.39 0.17 0.10 0.45 -1.16 0.00 0.00 179.01 178.96 2vya h HIS 301 N 0.00 1.03 -0.05 4.33 3.86 -1.96 -0.99 115.15 121.38 2vya h HIS 301 Ca -0.00 -0.13 -0.02 0.00 -1.16 0.00 0.00 60.37 59.06 2vya h HIS 301 Cb 0.36 -0.29 -0.00 0.00 1.06 0.00 0.00 27.41 28.54 2vya h HIS 301 CO 0.00 0.88 -0.03 1.25 0.86 0.00 0.00 177.93 180.89 2vya h LEU 302 N 0.92 0.11 -1.52 2.43 5.85 -1.51 -2.32 115.31 119.27 2vya h LEU 302 Ca 0.19 -0.44 -0.05 0.00 0.84 0.00 0.00 57.88 58.42 2vya h LEU 302 Cb 0.40 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 2vya h LEU 302 CO 0.01 0.52 -0.25 -0.26 -0.34 0.00 0.00 178.44 178.12 2vya h PHE 303 N -0.30 0.00 0.10 1.25 0.04 -1.36 0.79 116.94 117.46 2vya h PHE 303 Ca 0.01 0.00 -0.26 0.00 2.80 0.00 0.00 57.97 60.52 2vya h PHE 303 Cb 0.48 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.64 2vya h PHE 303 CO 0.08 0.25 -1.17 1.15 -0.60 0.00 0.00 178.31 178.01 2vya h THR 304 N 0.00 1.47 0.11 -1.55 2.02 -1.20 -2.90 112.91 110.86 2vya h THR 304 Ca -0.00 -2.89 -0.27 0.00 0.77 0.00 0.00 66.41 64.02 2vya h THR 304 Cb 0.46 2.81 0.00 0.00 -1.74 0.00 0.00 68.15 69.68 2vya h THR 304 CO 0.03 0.85 -1.21 -0.07 0.37 0.00 0.00 175.52 175.49 2vya h LEU 305 N 0.12 0.41 -6.70 2.58 3.38 -0.89 -3.38 115.31 110.82 2vya h LEU 305 Ca -0.12 -0.43 -0.60 0.00 0.09 0.00 0.00 57.88 56.82 2vya h LEU 305 Cb 1.87 -0.13 -0.40 0.00 0.09 0.00 0.00 40.66 42.09 2vya h LEU 305 CO 0.20 1.33 -0.79 -0.62 0.09 0.00 0.00 178.44 178.64 2vya s ASP 306 N -7.12 3.00 0.66 -0.43 3.68 0.23 -4.97 116.67 111.72 2vya s ASP 306 Ca -0.04 -3.40 0.20 0.00 2.13 0.00 0.00 52.55 51.44 2vya s ASP 306 Cb 0.07 -0.98 1.05 0.00 -1.45 0.00 0.00 42.92 41.61 2vya s ASP 306 CO 0.88 -0.14 1.59 -0.65 0.13 0.00 0.00 175.17 176.98 2vya h PRO 307 N 5.57 0.00 0.00 4.34 0.11 -1.71 -1.66 132.00 138.65 2vya h PRO 307 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 2vya h PRO 307 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 2vya h PRO 307 CO 0.53 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.57 2vya n THR 308 N -2.84 0.74 -3.06 -1.15 -2.24 -1.26 -4.68 114.28 99.80 2vya n THR 308 Ca 0.01 0.09 -0.40 0.00 -2.27 0.00 0.00 64.05 61.48 2vya n THR 308 Cb 0.66 -0.97 -0.05 0.00 -2.10 0.00 0.00 70.33 67.88 2vya n THR 308 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2vya s VAL 309 N -3.21 5.05 0.14 2.28 1.01 -0.63 -5.02 120.40 120.01 2vya s VAL 309 Ca 0.07 1.40 -0.31 0.00 0.00 0.00 0.00 61.98 63.13 2vya s VAL 309 Cb 0.11 -4.02 -0.09 0.00 0.00 0.00 0.00 36.38 32.37 2vya s VAL 309 CO 0.44 0.23 1.48 -2.16 0.00 0.00 0.00 175.10 175.09 2vya s PRO 310 N 0.96 4.27 -1.15 2.72 0.04 -1.26 -4.84 135.00 135.74 2vya s PRO 310 Ca 0.36 2.21 -0.15 0.00 0.04 0.00 0.00 61.00 63.47 2vya s PRO 310 Cb -0.17 -3.21 -0.06 0.00 0.04 0.00 0.00 34.50 31.10 2vya s PRO 310 CO 0.17 -0.52 2.21 -0.35 0.04 0.00 0.00 177.00 178.54 2vya n PRO 311 N 3.98 2.36 -3.08 0.56 -0.04 -1.26 -4.87 135.00 132.64 2vya n PRO 311 Ca 0.13 -2.08 -0.42 0.00 -0.04 0.00 0.00 63.50 61.09 2vya n PRO 311 Cb 0.40 -2.94 -0.06 0.00 -0.04 0.00 0.00 33.50 30.86 2vya n PRO 311 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2vya s LEU 312 N 1.18 4.28 0.81 1.53 1.43 -1.26 -5.06 118.68 121.58 2vya s LEU 312 Ca 0.53 0.07 -0.11 0.00 -1.03 0.00 0.00 54.13 53.58 2vya s LEU 312 Cb 0.14 -2.82 0.08 0.00 0.03 0.00 0.00 46.19 43.62 2vya s LEU 312 CO -0.00 -0.66 1.09 -2.16 0.23 0.00 0.00 176.35 174.84 2vya s PRO 313 N 2.81 1.97 -0.21 1.29 0.04 -1.26 -4.90 135.00 134.74 2vya s PRO 313 Ca 0.25 0.88 -0.29 0.00 0.04 0.00 0.00 61.00 61.89 2vya s PRO 313 Cb -0.14 -1.89 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 2vya s PRO 313 CO 0.16 -1.76 1.94 0.12 0.04 0.00 0.00 177.00 177.51 2vya s PHE 314 N -3.00 1.55 -1.01 0.56 5.36 -1.26 -4.91 117.98 115.26 2vya s PHE 314 Ca 0.61 0.41 -0.23 0.00 -0.96 0.00 0.00 56.93 56.77 2vya s PHE 314 Cb -0.16 -4.04 0.04 0.00 -0.34 0.00 0.00 43.02 38.52 2vya s PHE 314 CO 0.56 -3.77 1.49 1.03 -1.46 0.00 0.00 175.22 173.06 2vya s ARG 315 N 5.53 3.52 0.48 10.12 0.52 -1.26 -4.83 118.95 133.03 2vya s ARG 315 Ca 0.87 -1.07 0.17 0.00 -0.52 0.00 0.00 55.73 55.18 2vya s ARG 315 Cb -0.30 -5.34 1.18 0.00 0.52 0.00 0.00 34.95 31.01 2vya s ARG 315 CO 0.34 -2.29 2.03 1.49 0.02 0.00 0.00 175.30 176.89 2vya h GLU 316 N 9.88 0.20 -0.18 3.54 4.57 -2.00 -2.01 114.58 128.59 2vya h GLU 316 Ca 0.20 -0.01 -0.13 0.00 -1.18 0.00 0.00 59.36 58.24 2vya h GLU 316 Cb 1.01 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.54 2vya h GLU 316 CO 1.42 0.13 -0.43 1.05 -1.18 0.00 0.00 179.01 180.00 2vya h GLU 317 N 0.21 0.43 -0.23 1.92 9.09 -1.98 -1.16 114.58 122.86 2vya h GLU 317 Ca 0.20 -0.22 -0.10 0.00 0.05 0.00 0.00 59.36 59.29 2vya h GLU 317 Cb 0.53 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.63 2vya h GLU 317 CO -0.04 0.78 -0.27 0.28 0.05 0.00 0.00 179.01 179.81 2vya h VAL 318 N 0.35 1.32 -0.60 -1.06 2.07 -1.73 -2.00 116.25 114.60 2vya h VAL 318 Ca 0.03 -1.45 -0.05 0.00 0.82 0.00 0.00 66.70 66.05 2vya h VAL 318 Cb 0.90 1.73 -0.03 0.00 -1.52 0.00 0.00 31.29 32.37 2vya h VAL 318 CO 0.08 0.45 0.19 0.22 0.02 0.00 0.00 177.57 178.53 2vya h TYR 319 N 0.28 0.96 0.00 1.57 3.20 -1.44 -3.18 116.97 118.35 2vya h TYR 319 Ca 0.03 -0.10 -0.05 0.00 3.14 0.00 0.00 58.73 61.76 2vya h TYR 319 Cb 0.84 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.82 2vya h TYR 319 CO 0.08 0.79 -0.22 0.00 -1.64 0.00 0.00 178.16 177.18 2vya h ARG 320 N 0.85 0.00 -6.53 1.82 2.47 -1.25 -3.40 114.38 108.34 2vya h ARG 320 Ca 0.19 0.00 -0.59 0.00 -1.26 0.00 0.00 59.98 58.33 2vya h ARG 320 Cb 0.28 0.00 0.16 0.00 -1.65 0.00 0.00 29.97 28.76 2vya h ARG 320 CO -0.01 0.22 -0.22 0.45 0.56 0.00 0.00 179.97 180.97 2vya n SER 321 N -3.20 -0.30 -0.82 7.04 2.88 -0.75 -4.95 113.62 113.51 2vya n SER 321 Ca 0.02 0.85 0.05 0.00 -1.33 0.00 0.00 58.87 58.47 2vya n SER 321 Cb 0.56 -1.22 0.11 0.00 -0.75 0.00 0.00 64.21 62.92 2vya n SER 321 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2vya n SER 322 N 0.54 1.38 -4.77 -3.46 3.41 -1.26 -5.03 113.62 104.43 2vya n SER 322 Ca 0.11 -2.96 -0.40 0.00 -0.26 0.00 0.00 58.87 55.36 2vya n SER 322 Cb 0.44 -0.40 -0.02 0.00 -0.26 0.00 0.00 64.21 63.96 2vya n SER 322 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2vya s ARG 323 N -1.77 4.38 0.40 4.33 0.52 -1.26 -4.98 118.95 120.57 2vya s ARG 323 Ca 0.32 2.09 -0.25 0.00 -0.52 0.00 0.00 55.73 57.38 2vya s ARG 323 Cb 0.33 -3.06 -0.11 0.00 0.52 0.00 0.00 34.95 32.63 2vya s ARG 323 CO -0.08 -0.12 0.96 -2.30 0.02 0.00 0.00 175.30 173.78 2vya n PRO 324 N 0.80 1.27 -4.48 3.54 -0.02 -1.26 -5.00 135.00 129.85 2vya n PRO 324 Ca 0.00 0.45 -0.31 0.00 -2.02 0.00 0.00 63.50 61.62 2vya n PRO 324 Cb 0.43 -1.95 -0.11 0.00 -0.02 0.00 0.00 33.50 31.85 2vya n PRO 324 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2vya s LEU 325 N -0.13 2.93 -0.51 2.45 1.43 -1.26 -4.99 118.68 118.61 2vya s LEU 325 Ca 0.62 -0.30 -0.19 0.00 -1.03 0.00 0.00 54.13 53.24 2vya s LEU 325 Cb -0.59 -1.71 0.07 0.00 0.03 0.00 0.00 46.19 43.99 2vya s LEU 325 CO 0.57 0.25 0.60 -0.13 0.23 0.00 0.00 176.35 177.87 2vya s ARG 326 N -1.60 3.09 -0.41 1.70 0.52 -1.26 -1.68 118.95 119.31 2vya s ARG 326 Ca 0.17 -1.01 -0.14 0.00 -0.52 0.00 0.00 55.73 54.23 2vya s ARG 326 Cb -0.11 -4.12 0.03 0.00 0.52 0.00 0.00 34.95 31.27 2vya s ARG 326 CO 0.08 -1.23 0.28 0.08 0.02 0.00 0.00 175.30 174.53 2vya s VAL 327 N 2.49 5.03 0.50 3.52 1.01 0.13 -1.22 120.40 131.85 2vya s VAL 327 Ca 0.13 -0.79 -0.22 0.00 0.00 0.00 0.00 61.98 61.11 2vya s VAL 327 Cb -0.21 -3.84 -0.06 0.00 0.00 0.00 0.00 36.38 32.28 2vya s VAL 327 CO 0.10 -0.33 1.20 -0.83 0.00 0.00 0.00 175.10 175.25 2vya s GLY 328 N 1.75 2.77 0.01 4.51 0.00 0.44 -0.03 107.32 116.78 2vya s GLY 328 Ca 0.04 0.99 -0.18 0.00 0.00 0.00 0.00 44.72 45.58 2vya s GLY 328 CO 0.08 1.44 0.38 -2.52 0.00 0.00 0.00 173.10 172.49 2vya s TYR 329 N -1.54 -0.25 0.04 1.90 -0.85 0.15 0.91 117.35 117.71 2vya s TYR 329 Ca 0.68 0.30 -0.06 0.00 -0.52 0.00 0.00 57.07 57.46 2vya s TYR 329 Cb -0.30 0.17 -0.01 0.00 0.38 0.00 0.00 41.96 42.20 2vya s TYR 329 CO 0.36 -0.50 0.11 1.52 -1.52 0.00 0.00 175.55 175.52 2vya s TYR 330 N -1.92 0.18 -0.33 -3.49 1.13 -0.91 -1.09 117.35 110.92 2vya s TYR 330 Ca -0.09 -0.46 0.21 0.00 -1.41 0.00 0.00 57.07 55.32 2vya s TYR 330 Cb -0.02 -0.13 -0.29 0.00 -1.10 0.00 0.00 41.96 40.42 2vya s TYR 330 CO 0.01 -0.36 0.59 -1.91 -2.51 0.00 0.00 175.55 171.37 2vya n GLU 331 N 0.81 0.53 -3.60 -3.49 2.13 -1.26 -3.93 120.64 111.83 2vya n GLU 331 Ca -0.19 -0.13 -0.13 0.00 0.66 0.00 0.00 57.16 57.37 2vya n GLU 331 Cb 0.58 -1.48 -0.07 0.00 0.27 0.00 0.00 31.44 30.74 2vya n GLU 331 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 2vya s THR 332 N -3.27 0.00 -0.98 6.31 -1.32 -1.26 -4.82 115.64 110.29 2vya s THR 332 Ca -0.03 0.00 0.07 0.00 -1.21 0.00 0.00 61.69 60.53 2vya s THR 332 Cb 0.14 -1.00 0.36 0.00 -1.51 0.00 0.00 72.50 70.49 2vya s THR 332 CO 0.86 0.00 1.12 -0.90 -2.21 0.00 0.00 174.62 173.48 2vya n ASP 333 N 1.98 2.85 -3.03 8.08 3.85 -1.26 -4.90 116.55 124.12 2vya n ASP 333 Ca -0.14 -2.32 -0.14 0.00 -0.71 0.00 0.00 54.79 51.48 2vya n ASP 333 Cb 0.56 -0.50 -0.02 0.00 -1.35 0.00 0.00 41.12 39.81 2vya n ASP 333 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 2vya n ASN 334 N 0.34 -1.99 0.12 -1.12 3.02 -1.26 -4.68 115.26 109.68 2vya n ASN 334 Ca 0.12 -0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 2vya n ASN 334 Cb 0.59 -1.77 0.00 0.00 -0.61 0.00 0.00 39.78 37.99 2vya n ASN 334 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vya n TYR 335 N -3.16 -1.79 -3.36 3.10 4.19 -1.26 -4.98 117.16 109.91 2vya n TYR 335 Ca 0.00 0.32 -0.44 0.00 3.31 0.00 0.00 57.90 61.09 2vya n TYR 335 Cb 0.51 0.41 -0.08 0.00 0.49 0.00 0.00 39.34 40.68 2vya n TYR 335 CO 0.00 0.00 0.00 0.99 0.91 0.00 0.00 176.86 178.76 2vya s THR 336 N -1.97 5.18 0.09 2.97 2.01 -1.26 -4.56 115.64 118.09 2vya s THR 336 Ca 0.00 -0.89 -0.35 0.00 0.31 0.00 0.00 61.69 60.75 2vya s THR 336 Cb 0.00 -4.12 -0.15 0.00 0.01 0.00 0.00 72.50 68.24 2vya s THR 336 CO 0.00 -0.57 1.52 0.80 -0.69 0.00 0.00 174.62 175.68 2vya n MET 337 N 5.36 1.72 -2.00 4.92 1.56 -1.26 -4.58 117.12 122.84 2vya n MET 337 Ca -0.11 0.62 -0.32 0.00 -0.27 0.00 0.00 57.70 57.63 2vya n MET 337 Cb 0.45 -2.35 0.00 0.00 2.15 0.00 0.00 33.22 33.47 2vya n MET 337 CO 0.00 0.00 0.00 -1.25 -0.73 0.00 0.00 175.97 173.99 2vya s PRO 338 N 1.16 3.56 0.49 2.12 0.04 -1.26 -4.96 135.00 136.15 2vya s PRO 338 Ca 0.83 0.91 -0.21 0.00 0.04 0.00 0.00 61.00 62.57 2vya s PRO 338 Cb -0.80 -2.08 -0.08 0.00 0.04 0.00 0.00 34.50 31.58 2vya s PRO 338 CO 0.44 -0.60 1.08 -1.54 0.04 0.00 0.00 177.00 176.42 2vya s SER 339 N -3.60 6.18 0.25 6.66 1.04 -1.26 -4.85 113.70 118.12 2vya s SER 339 Ca 0.58 2.04 -0.07 0.00 0.48 0.00 0.00 55.95 58.98 2vya s SER 339 Cb -0.12 -2.57 0.44 0.00 0.10 0.00 0.00 66.02 63.87 2vya s SER 339 CO 0.45 -0.89 1.61 -0.65 0.98 0.00 0.00 173.24 174.74 2vya h PRO 340 N 1.58 0.05 -0.85 4.02 0.11 -1.92 -0.91 132.00 134.09 2vya h PRO 340 Ca -0.50 -0.00 0.10 0.00 0.11 0.00 0.00 66.00 65.71 2vya h PRO 340 Cb 1.23 -0.01 -0.07 0.00 0.11 0.00 0.00 31.00 32.26 2vya h PRO 340 CO 0.59 0.04 0.49 0.00 -0.21 0.00 0.00 178.00 178.91 2vya h ALA 341 N 1.77 1.22 -0.15 -0.75 0.00 -1.89 -1.77 119.26 117.69 2vya h ALA 341 Ca 0.42 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.38 2vya h ALA 341 Cb 0.73 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2vya h ALA 341 CO -0.75 0.11 0.03 0.52 0.00 0.00 0.00 179.25 179.17 2vya h MET 342 N 0.82 0.09 -0.37 0.00 2.86 -1.43 -1.62 114.93 115.27 2vya h MET 342 Ca 0.41 -0.01 0.04 0.00 -2.06 0.00 0.00 59.70 58.09 2vya h MET 342 Cb 0.38 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.98 2vya h MET 342 CO -0.25 0.06 0.13 0.00 1.06 0.00 0.00 176.91 177.91 2vya h ARG 343 N 0.09 0.27 -0.36 1.72 3.08 -0.71 -2.05 114.38 116.43 2vya h ARG 343 Ca 0.07 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 60.04 2vya h ARG 343 Cb 0.06 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 2vya h ARG 343 CO -0.09 0.18 -0.03 -0.09 -1.07 0.00 0.00 179.97 178.88 2vya h ARG 344 N 0.28 0.65 -0.15 0.04 2.43 -1.30 -1.33 114.38 114.99 2vya h ARG 344 Ca 0.17 -0.22 0.05 0.00 -0.81 0.00 0.00 59.98 59.17 2vya h ARG 344 Cb 0.14 -0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.58 2vya h ARG 344 CO -0.17 0.78 -0.24 0.00 -1.51 0.00 0.00 179.97 178.83 2vya h ALA 345 N 0.85 -0.19 -0.50 2.80 0.00 -1.20 0.31 119.26 121.32 2vya h ALA 345 Ca 0.10 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2vya h ALA 345 Cb 0.50 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 2vya h ALA 345 CO 0.02 -0.69 0.25 1.25 0.00 0.00 0.00 179.25 180.08 2vya h LEU 346 N -0.29 0.65 -0.11 0.00 7.12 -1.24 -1.27 115.31 120.18 2vya h LEU 346 Ca 0.11 -0.12 -0.17 0.00 0.13 0.00 0.00 57.88 57.82 2vya h LEU 346 Cb 0.45 -0.17 0.01 0.00 -0.53 0.00 0.00 40.66 40.42 2vya h LEU 346 CO -0.32 0.59 -0.61 0.40 -0.13 0.00 0.00 178.44 178.38 2vya h ILE 347 N 0.67 1.34 -0.61 4.05 2.04 -0.88 -1.67 117.51 122.44 2vya h ILE 347 Ca 0.17 -1.90 0.07 0.00 1.00 0.00 0.00 64.86 64.21 2vya h ILE 347 Cb 0.11 2.17 -0.06 0.00 -0.74 0.00 0.00 36.82 38.30 2vya h ILE 347 CO -0.02 0.58 0.29 -0.33 0.00 0.00 0.00 178.15 178.66 2vya h GLU 348 N 0.23 0.51 0.79 2.37 5.08 -0.33 -1.23 114.58 122.00 2vya h GLU 348 Ca -0.05 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 2vya h GLU 348 Cb 1.25 -0.11 0.01 0.00 0.50 0.00 0.00 28.75 30.39 2vya h GLU 348 CO 0.12 0.33 -0.38 1.15 -1.00 0.00 0.00 179.01 179.24 2vya h THR 349 N 0.52 0.19 -0.88 1.13 2.02 -1.16 -2.29 112.91 112.44 2vya h THR 349 Ca 0.29 -0.06 0.10 0.00 0.77 0.00 0.00 66.41 67.51 2vya h THR 349 Cb 0.27 0.20 -0.12 0.00 -1.74 0.00 0.00 68.15 66.76 2vya h THR 349 CO -0.23 0.01 -0.45 1.17 0.37 0.00 0.00 175.52 176.38 2vya n LYS 350 N -5.53 -0.32 -0.18 6.66 4.81 -0.64 -1.24 118.16 121.72 2vya n LYS 350 Ca -0.15 1.34 0.09 0.00 -0.87 0.00 0.00 58.31 58.72 2vya n LYS 350 Cb 0.43 -1.97 0.39 0.00 0.02 0.00 0.00 35.03 33.90 2vya n LYS 350 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 2vya h GLN 351 N 0.00 0.64 -0.07 1.64 4.20 -1.08 -1.07 115.11 119.37 2vya h GLN 351 Ca 0.20 -0.04 -0.24 0.00 0.06 0.00 0.00 58.65 58.64 2vya h GLN 351 Cb 0.42 -0.14 0.01 0.00 0.30 0.00 0.00 27.48 28.07 2vya h GLN 351 CO -0.84 0.42 -0.90 0.00 -0.67 0.00 0.00 178.83 176.84 2vya h ARG 352 N 0.66 0.69 -0.74 1.46 2.47 -0.58 -1.74 114.38 116.60 2vya h ARG 352 Ca 0.33 -0.65 -0.04 0.00 -1.26 0.00 0.00 59.98 58.36 2vya h ARG 352 Cb 0.43 0.16 -0.03 0.00 -1.65 0.00 0.00 29.97 28.88 2vya h ARG 352 CO -0.12 1.25 0.28 -0.07 0.56 0.00 0.00 179.97 181.88 2vya h LEU 353 N 0.43 1.02 0.33 3.04 3.38 -0.70 0.16 115.31 122.97 2vya h LEU 353 Ca -0.08 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 2vya h LEU 353 Cb 1.53 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 42.02 2vya h LEU 353 CO 0.18 0.91 -0.18 -0.33 0.09 0.00 0.00 178.44 179.11 2vya h GLU 354 N 1.08 -0.45 -1.00 1.13 5.08 -1.22 -0.81 114.58 118.38 2vya h GLU 354 Ca 0.25 0.03 0.23 0.00 -1.00 0.00 0.00 59.36 58.87 2vya h GLU 354 Cb 0.22 0.10 -0.10 0.00 0.50 0.00 0.00 28.75 29.48 2vya h GLU 354 CO -0.02 -0.30 0.63 0.00 -1.00 0.00 0.00 179.01 178.32 2vya h ALA 355 N 0.19 2.01 -0.16 3.43 0.00 -0.71 0.92 119.26 124.94 2vya h ALA 355 Ca -0.04 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2vya h ALA 355 Cb 0.37 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2vya h ALA 355 CO 0.06 -0.39 0.00 0.00 0.00 0.00 0.00 179.25 178.92 2vya n ALA 356 N -2.42 2.51 -0.79 0.00 0.00 0.50 -4.93 120.51 115.38 2vya n ALA 356 Ca 0.24 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2vya n ALA 356 Cb 0.74 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 19.12 2vya n ALA 356 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2vya n GLY 357 N 0.93 0.58 3.84 0.00 0.00 0.32 -5.03 105.19 105.82 2vya n GLY 357 Ca 0.11 -0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 2vya n GLY 357 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2vya s HIS 358 N -2.00 3.43 -0.14 1.61 3.76 -0.40 -4.80 115.29 116.75 2vya s HIS 358 Ca 0.00 1.47 -0.19 0.00 -0.15 0.00 0.00 55.06 56.18 2vya s HIS 358 Cb 0.00 -2.80 -0.04 0.00 1.11 0.00 0.00 32.58 30.85 2vya s HIS 358 CO 0.00 -0.41 0.55 0.99 -0.85 0.00 0.00 174.74 175.02 2vya s THR 359 N -2.62 5.12 -0.25 1.30 2.01 -0.68 -4.27 115.64 116.25 2vya s THR 359 Ca 0.59 1.07 -0.06 0.00 0.31 0.00 0.00 61.69 63.60 2vya s THR 359 Cb -0.10 -3.88 -0.01 0.00 0.01 0.00 0.00 72.50 68.52 2vya s THR 359 CO 0.32 0.25 0.03 -0.76 -0.69 0.00 0.00 174.62 173.77 2vya s LEU 360 N 1.06 3.37 -0.12 4.42 2.01 -1.26 0.20 118.68 128.36 2vya s LEU 360 Ca 0.28 -0.42 0.02 0.00 0.01 0.00 0.00 54.13 54.01 2vya s LEU 360 Cb -0.16 -1.85 0.01 0.00 0.01 0.00 0.00 46.19 44.21 2vya s LEU 360 CO 0.11 -0.08 -0.16 -0.63 1.01 0.00 0.00 176.35 176.60 2vya s ILE 361 N 1.53 1.63 0.36 -0.59 1.01 0.96 -4.98 121.20 121.12 2vya s ILE 361 Ca 0.05 -0.71 -0.28 0.00 0.00 0.00 0.00 60.65 59.71 2vya s ILE 361 Cb -0.15 -1.48 -0.11 0.00 0.01 0.00 0.00 42.46 40.72 2vya s ILE 361 CO 0.01 0.47 1.43 -2.65 0.00 0.00 0.00 174.94 174.20 2vya n PRO 362 N 4.26 2.51 -3.64 2.79 -0.02 -1.26 -0.67 135.00 138.96 2vya n PRO 362 Ca -0.19 0.88 -0.07 0.00 -2.02 0.00 0.00 63.50 62.10 2vya n PRO 362 Cb 0.51 -2.57 -0.07 0.00 -0.02 0.00 0.00 33.50 31.36 2vya n PRO 362 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2vya s PHE 363 N -1.06 -0.88 -0.09 6.00 2.19 -0.25 -4.72 117.98 119.16 2vya s PHE 363 Ca 0.54 1.82 -0.03 0.00 0.33 0.00 0.00 56.93 59.59 2vya s PHE 363 Cb -0.51 0.50 0.05 0.00 -1.31 0.00 0.00 43.02 41.76 2vya s PHE 363 CO 0.63 -0.43 0.14 -1.17 1.83 0.00 0.00 175.22 176.21 2vya s LEU 364 N 1.30 0.01 0.27 6.12 2.96 -1.26 -3.94 118.68 124.14 2vya s LEU 364 Ca -0.07 0.14 -0.30 0.00 -0.22 0.00 0.00 54.13 53.67 2vya s LEU 364 Cb -0.05 0.14 -0.13 0.00 0.50 0.00 0.00 46.19 46.66 2vya s LEU 364 CO -0.15 -0.26 1.38 -2.65 -1.32 0.00 0.00 176.35 173.35 2vya n PRO 365 N 5.31 2.08 -1.36 0.98 -0.02 -1.26 -4.92 135.00 135.82 2vya n PRO 365 Ca -0.04 0.74 -0.33 0.00 -2.02 0.00 0.00 63.50 61.84 2vya n PRO 365 Cb 0.50 -2.38 0.10 0.00 -0.02 0.00 0.00 33.50 31.70 2vya n PRO 365 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2vya s ASN 366 N 0.14 4.14 -1.45 2.55 2.20 -1.26 -4.01 114.94 117.25 2vya s ASN 366 Ca 0.65 2.27 -0.12 0.00 -0.94 0.00 0.00 52.86 54.71 2vya s ASN 366 Cb -0.62 -2.58 0.09 0.00 -2.00 0.00 0.00 41.25 36.14 2vya s ASN 366 CO 0.53 -2.30 0.69 0.59 -2.94 0.00 0.00 177.10 173.67 2vya n ASN 367 N -2.93 -4.09 -0.18 3.54 3.02 -1.26 -4.89 115.26 108.47 2vya n ASN 367 Ca 0.13 -0.60 -0.03 0.00 -0.03 0.00 0.00 54.58 54.04 2vya n ASN 367 Cb 0.51 -3.33 0.03 0.00 -0.61 0.00 0.00 39.78 36.38 2vya n ASN 367 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2vya h ILE 368 N -1.39 0.31 -0.92 2.41 2.04 -1.95 0.91 117.51 118.92 2vya h ILE 368 Ca -0.50 0.00 0.15 0.00 1.00 0.00 0.00 64.86 65.50 2vya h ILE 368 Cb 1.33 0.31 -0.09 0.00 -0.74 0.00 0.00 36.82 37.63 2vya h ILE 368 CO 0.62 0.00 0.53 -0.65 0.00 0.00 0.00 178.15 178.65 2vya h PRO 369 N -0.10 0.74 -0.39 2.37 0.11 -1.92 0.31 132.00 133.12 2vya h PRO 369 Ca 0.25 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 66.18 2vya h PRO 369 Cb 0.49 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.42 2vya h PRO 369 CO -0.62 0.49 -0.31 -0.92 -0.21 0.00 0.00 178.00 176.43 2vya h TYR 370 N 0.76 1.02 -0.67 0.65 3.20 -1.77 0.30 116.97 120.47 2vya h TYR 370 Ca 0.49 -0.27 -0.05 0.00 3.14 0.00 0.00 58.73 62.04 2vya h TYR 370 Cb 0.65 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.66 2vya h TYR 370 CO -0.05 1.06 0.23 0.00 -1.64 0.00 0.00 178.16 177.77 2vya h ALA 371 N 0.91 1.15 0.04 1.82 0.00 0.20 -1.48 119.26 121.89 2vya h ALA 371 Ca 0.08 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 2vya h ALA 371 Cb 0.87 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 2vya h ALA 371 CO 0.08 0.60 -0.57 -0.07 0.00 0.00 0.00 179.25 179.29 2vya h LEU 372 N 0.98 0.13 0.01 0.00 3.38 -0.62 -0.00 115.31 119.18 2vya h LEU 372 Ca 0.22 -0.88 -0.19 0.00 0.09 0.00 0.00 57.88 57.12 2vya h LEU 372 Cb 0.24 -0.04 0.02 0.00 0.09 0.00 0.00 40.66 40.96 2vya h LEU 372 CO -0.01 1.24 -0.74 -0.33 0.09 0.00 0.00 178.44 178.69 2vya h GLU 373 N -0.80 0.48 0.00 1.13 5.08 -0.93 -2.11 114.58 117.43 2vya h GLU 373 Ca -0.13 -0.53 -0.35 0.00 -1.00 0.00 0.00 59.36 57.34 2vya h GLU 373 Cb 1.27 0.15 -0.05 0.00 0.50 0.00 0.00 28.75 30.62 2vya h GLU 373 CO -0.01 1.17 -2.01 1.55 -1.00 0.00 0.00 179.01 178.71 2vya n VAL 374 N -4.11 1.53 0.05 3.13 3.14 -0.61 -4.34 118.33 117.12 2vya n VAL 374 Ca -0.11 -0.23 -0.09 0.00 -2.96 0.00 0.00 64.34 60.95 2vya n VAL 374 Cb 0.74 -1.98 -0.06 0.00 -1.06 0.00 0.00 33.84 31.48 2vya n VAL 374 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2vya h LEU 375 N -1.00 -0.19 -0.16 6.55 3.38 -1.44 -2.45 115.31 120.00 2vya h LEU 375 Ca -0.53 -0.30 -0.20 0.00 0.09 0.00 0.00 57.88 56.94 2vya h LEU 375 Cb 1.45 0.05 0.01 0.00 0.09 0.00 0.00 40.66 42.26 2vya h LEU 375 CO -0.32 0.37 -0.68 0.28 0.09 0.00 0.00 178.44 178.18 2vya h SER 376 N -0.94 0.87 -0.21 -0.43 0.02 -1.03 -0.38 113.55 111.46 2vya h SER 376 Ca -0.02 -0.62 -0.16 0.00 -0.84 0.00 0.00 61.79 60.15 2vya h SER 376 Cb 0.48 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.76 2vya h SER 376 CO 0.04 1.34 -0.50 0.74 -1.14 0.00 0.00 176.83 177.32 2vya h THR 377 N 0.45 1.31 -0.70 -2.27 2.02 -1.55 -2.12 112.91 110.05 2vya h THR 377 Ca -0.04 -1.72 -0.02 0.00 0.77 0.00 0.00 66.41 65.40 2vya h THR 377 Cb 1.31 1.85 -0.03 0.00 -1.74 0.00 0.00 68.15 69.53 2vya h THR 377 CO 0.14 0.54 0.36 1.23 0.37 0.00 0.00 175.52 178.16 2vya h GLY 378 N 0.41 1.06 0.93 2.16 0.00 -1.47 -0.64 103.07 105.52 2vya h GLY 378 Ca -0.00 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 46.81 2vya h GLY 378 CO 0.11 0.48 0.13 -1.33 0.00 0.00 0.00 176.54 175.94 2vya h GLY 379 N 0.97 0.46 2.00 4.60 0.00 -1.01 0.11 103.07 110.19 2vya h GLY 379 Ca 0.24 -0.24 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 2vya h GLY 379 CO -0.03 0.22 -0.30 1.41 0.00 0.00 0.00 176.54 177.83 2vya h LEU 380 N 0.34 0.00 -3.63 3.11 3.38 -1.21 -3.34 115.31 113.95 2vya h LEU 380 Ca 0.10 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.87 2vya h LEU 380 Cb 0.14 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 40.60 2vya h LEU 380 CO -0.01 0.30 -0.87 0.49 0.09 0.00 0.00 178.44 178.44 2vya n PHE 381 N -3.38 0.70 -0.06 1.13 3.72 -0.26 -4.84 117.46 114.46 2vya n PHE 381 Ca 0.00 -1.39 0.21 0.00 -0.05 0.00 0.00 57.45 56.22 2vya n PHE 381 Cb 0.51 -0.22 0.66 0.00 -0.94 0.00 0.00 39.48 39.48 2vya n PHE 381 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 2vya h SER 382 N 1.53 0.08 -0.63 4.37 0.02 -0.92 0.20 113.55 118.19 2vya h SER 382 Ca -0.05 0.01 -0.14 0.00 -0.84 0.00 0.00 61.79 60.76 2vya h SER 382 Cb 1.46 -0.01 -0.08 0.00 0.14 0.00 0.00 62.40 63.91 2vya h SER 382 CO 0.20 0.04 0.18 -0.90 -1.14 0.00 0.00 176.83 175.21 2vya n ASP 383 N -4.38 4.81 0.00 3.07 5.75 -1.26 -1.16 116.55 123.37 2vya n ASP 383 Ca 0.12 -3.03 0.00 0.00 -0.01 0.00 0.00 54.79 51.87 2vya n ASP 383 Cb 0.65 -0.71 0.00 0.00 -1.03 0.00 0.00 41.12 40.03 2vya n ASP 383 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2vya n GLY 384 N 0.10 0.51 1.78 6.12 0.00 0.06 -2.61 105.19 111.15 2vya n GLY 384 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.36 2vya n GLY 384 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vya n GLY 385 N -1.85 0.51 0.18 -0.02 0.00 -1.25 -4.82 105.19 97.94 2vya n GLY 385 Ca 0.00 -0.42 -0.14 0.00 0.00 0.00 0.00 46.02 45.45 2vya n GLY 385 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2vya h ARG 386 N 0.75 0.58 0.22 1.61 9.65 -1.87 0.28 114.38 125.60 2vya h ARG 386 Ca 0.00 -0.36 -0.01 0.00 -1.10 0.00 0.00 59.98 58.51 2vya h ARG 386 Cb 0.00 0.04 0.00 0.00 -1.39 0.00 0.00 29.97 28.62 2vya h ARG 386 CO 0.00 0.97 -0.10 0.77 2.80 0.00 0.00 179.97 184.40 2vya h SER 387 N 0.25 -0.25 -0.57 -3.80 0.02 -1.94 -2.73 113.55 104.54 2vya h SER 387 Ca 0.01 0.00 0.06 0.00 -0.84 0.00 0.00 61.79 61.03 2vya h SER 387 Cb 0.93 0.06 -0.09 0.00 0.14 0.00 0.00 62.40 63.44 2vya h SER 387 CO 0.08 -0.17 -0.55 0.15 -1.14 0.00 0.00 176.83 175.20 2vya h PHE 388 N -0.30 -1.70 -0.77 3.45 3.57 -1.77 -2.33 116.94 117.08 2vya h PHE 388 Ca -0.03 0.09 0.19 0.00 3.53 0.00 0.00 57.97 61.76 2vya h PHE 388 Cb 0.23 0.82 -0.04 0.00 2.79 0.00 0.00 35.95 39.75 2vya h PHE 388 CO -0.06 -0.46 0.53 -0.07 -2.23 0.00 0.00 178.31 176.02 2vya h LEU 389 N -0.28 0.19 -0.70 0.59 3.38 -0.79 -1.63 115.31 116.06 2vya h LEU 389 Ca 0.11 0.02 0.15 0.00 0.09 0.00 0.00 57.88 58.24 2vya h LEU 389 Cb 0.55 -0.02 -0.11 0.00 0.09 0.00 0.00 40.66 41.17 2vya h LEU 389 CO -0.69 0.09 0.14 -0.61 0.09 0.00 0.00 178.44 177.45 2vya h GLN 390 N 0.20 0.23 -0.14 1.13 5.75 -1.10 -1.18 115.11 120.00 2vya h GLN 390 Ca 0.38 -0.01 0.04 0.00 -0.15 0.00 0.00 58.65 58.90 2vya h GLN 390 Cb 1.19 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 29.68 2vya h GLN 390 CO -0.07 0.15 0.32 -0.91 -2.65 0.00 0.00 178.83 175.67 2vya h ASN 391 N 0.24 0.00 0.10 -0.69 2.35 -1.42 -0.93 115.58 115.22 2vya h ASN 391 Ca 0.39 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.14 2vya h ASN 391 Cb 0.65 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.02 2vya h ASN 391 CO -0.51 0.00 -0.29 0.49 -1.65 0.00 0.00 177.43 175.47 2vya n PHE 392 N -3.25 0.00 -1.55 1.19 3.72 -0.45 -4.76 117.46 112.37 2vya n PHE 392 Ca 0.01 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.05 2vya n PHE 392 Cb 0.42 -0.06 -0.04 0.00 -0.94 0.00 0.00 39.48 38.86 2vya n PHE 392 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2vya n LYS 393 N -0.20 0.97 0.00 -1.08 5.02 -0.36 -1.97 118.16 120.54 2vya n LYS 393 Ca 0.12 -0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 2vya n LYS 393 Cb 0.41 -3.34 0.00 0.00 -0.02 0.00 0.00 35.03 32.08 2vya n LYS 393 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2vya n GLY 394 N 6.05 2.54 3.88 0.72 0.00 -1.26 -5.01 105.19 112.11 2vya n GLY 394 Ca 0.39 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.11 2vya n GLY 394 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2vya s ASP 395 N -1.40 6.27 0.63 1.61 -1.08 -0.83 -4.56 116.67 117.31 2vya s ASP 395 Ca 0.00 1.20 -0.17 0.00 -0.52 0.00 0.00 52.55 53.06 2vya s ASP 395 Cb 0.00 -2.37 -0.02 0.00 -1.46 0.00 0.00 42.92 39.07 2vya s ASP 395 CO 0.00 -0.72 1.18 -0.36 0.52 0.00 0.00 175.17 175.80 2vya s PHE 396 N -2.94 2.39 -0.31 -5.34 0.40 -1.26 -5.03 117.98 105.89 2vya s PHE 396 Ca 0.52 1.54 -0.12 0.00 -0.60 0.00 0.00 56.93 58.27 2vya s PHE 396 Cb -0.11 -3.40 -0.03 0.00 0.51 0.00 0.00 43.02 39.99 2vya s PHE 396 CO 0.48 -2.13 0.23 0.54 0.70 0.00 0.00 175.22 175.04 2vya s VAL 397 N -1.83 5.28 0.46 -0.44 0.11 -1.26 -4.93 120.40 117.79 2vya s VAL 397 Ca 0.74 0.04 -0.24 0.00 -2.93 0.00 0.00 61.98 59.59 2vya s VAL 397 Cb -0.28 -3.63 -0.09 0.00 -1.53 0.00 0.00 36.38 30.86 2vya s VAL 397 CO 0.36 0.12 1.24 -0.67 -3.33 0.00 0.00 175.10 172.82 2vya n ASP 398 N 5.12 2.31 0.12 3.54 -0.08 -1.26 -4.89 116.55 121.41 2vya n ASP 398 Ca -0.13 1.05 0.18 0.00 -1.51 0.00 0.00 54.79 54.39 2vya n ASP 398 Cb 0.51 -1.49 0.76 0.00 2.34 0.00 0.00 41.12 43.24 2vya n ASP 398 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2vya h PRO 399 N 1.79 0.00 -0.00 -0.67 0.11 -1.93 -2.91 132.00 128.38 2vya h PRO 399 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2vya h PRO 399 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 2vya h PRO 399 CO 0.58 0.00 -0.07 0.00 -0.21 0.00 0.00 178.00 178.30 2vya h LEU 401 N 0.24 0.00 0.00 0.00 4.07 -1.84 -3.29 115.31 114.50 2vya h LEU 401 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2vya h LEU 401 Cb 0.35 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.09 2vya h LEU 401 CO 0.00 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.97 2vya n GLY 402 N 0.60 2.41 0.30 0.83 0.00 -0.89 -2.80 105.19 105.64 2vya n GLY 402 Ca 0.03 -0.38 0.09 0.00 0.00 0.00 0.00 46.02 45.75 2vya n GLY 402 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2vya n ASP 403 N 8.68 2.77 -0.20 1.61 8.00 -1.26 -4.74 116.55 131.41 2vya n ASP 403 Ca 0.00 -2.99 0.01 0.00 0.71 0.00 0.00 54.79 52.53 2vya n ASP 403 Cb 0.00 -0.43 0.11 0.00 -0.02 0.00 0.00 41.12 40.78 2vya n ASP 403 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2vya h LEU 404 N 0.54 -0.05 0.00 0.64 5.85 -1.83 0.61 115.31 121.08 2vya h LEU 404 Ca 0.00 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 2vya h LEU 404 Cb 1.09 0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.30 2vya h LEU 404 CO 0.06 -0.02 -0.00 0.40 -0.34 0.00 0.00 178.44 178.54 2vya h ILE 405 N 0.23 1.31 -0.65 4.05 1.08 -1.85 -1.73 117.51 119.96 2vya h ILE 405 Ca 0.32 -0.93 0.07 0.00 -0.39 0.00 0.00 64.86 63.94 2vya h ILE 405 Cb 0.49 1.94 -0.04 0.00 -3.07 0.00 0.00 36.82 36.14 2vya h ILE 405 CO -0.43 0.24 0.43 0.25 -0.69 0.00 0.00 178.15 177.95 2vya h LEU 406 N -0.40 0.52 -0.35 1.44 5.85 -1.84 -0.57 115.31 119.96 2vya h LEU 406 Ca -0.00 0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.62 2vya h LEU 406 Cb 0.40 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 2vya h LEU 406 CO 0.00 0.33 -0.21 0.40 -0.34 0.00 0.00 178.44 178.63 2vya h ILE 407 N 0.59 1.29 0.00 4.05 2.04 -0.56 -3.27 117.51 121.65 2vya h ILE 407 Ca 0.29 -1.34 -0.22 0.00 1.00 0.00 0.00 64.86 64.58 2vya h ILE 407 Cb 0.36 1.40 0.00 0.00 -0.74 0.00 0.00 36.82 37.84 2vya h ILE 407 CO -0.09 0.44 -0.93 -0.07 0.00 0.00 0.00 178.15 177.50 2vya h LEU 408 N 0.54 0.50 -1.27 1.44 3.38 -0.73 -2.71 115.31 116.47 2vya h LEU 408 Ca 0.07 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.64 2vya h LEU 408 Cb 0.76 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2vya h LEU 408 CO 0.06 1.20 0.12 0.03 0.09 0.00 0.00 178.44 179.94 2vya h ARG 409 N 0.22 0.00 -6.61 1.13 3.08 -1.18 -3.43 114.38 107.58 2vya h ARG 409 Ca -0.07 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.45 2vya h ARG 409 Cb 1.57 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.64 2vya h ARG 409 CO 0.16 0.00 0.64 -0.51 -1.07 0.00 0.00 179.97 179.19 2vya s LEU 410 N -4.41 4.40 0.19 3.04 1.43 -1.02 -4.99 118.68 117.32 2vya s LEU 410 Ca -0.02 2.30 -0.30 0.00 -1.03 0.00 0.00 54.13 55.07 2vya s LEU 410 Cb 0.05 -3.60 -0.09 0.00 0.03 0.00 0.00 46.19 42.59 2vya s LEU 410 CO 0.17 -0.53 1.37 -2.16 0.23 0.00 0.00 176.35 175.43 2vya s PRO 411 N 0.36 4.34 0.13 1.29 0.04 -1.26 -4.71 135.00 135.19 2vya s PRO 411 Ca 0.58 2.13 -0.07 0.00 0.04 0.00 0.00 61.00 63.69 2vya s PRO 411 Cb -0.35 -3.18 0.18 0.00 0.04 0.00 0.00 34.50 31.19 2vya s PRO 411 CO 0.34 -0.34 0.82 0.45 0.04 0.00 0.00 177.00 178.31 2vya n SER 412 N 2.85 -0.27 0.13 6.66 2.88 -1.26 0.39 113.62 125.00 2vya n SER 412 Ca 0.08 0.91 0.06 0.00 -1.33 0.00 0.00 58.87 58.58 2vya n SER 412 Cb 0.42 -0.24 0.52 0.00 -0.75 0.00 0.00 64.21 64.16 2vya n SER 412 CO 0.00 0.00 0.00 4.11 -1.23 0.00 0.00 175.04 177.92 2vya h TRP 413 N 0.00 0.26 0.06 0.66 5.08 -1.99 0.27 115.95 120.29 2vya h TRP 413 Ca 0.21 0.00 -0.25 0.00 1.08 0.00 0.00 58.89 59.94 2vya h TRP 413 Cb 0.35 -0.09 -0.02 0.00 -3.00 0.00 0.00 29.16 26.40 2vya h TRP 413 CO -0.44 0.17 -1.24 0.35 -1.28 0.00 0.00 178.44 176.01 2vya h PHE 414 N 0.28 0.22 -0.98 0.12 3.57 -0.42 -0.92 116.94 118.81 2vya h PHE 414 Ca 0.08 -0.16 0.02 0.00 3.53 0.00 0.00 57.97 61.44 2vya h PHE 414 Cb -0.02 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.66 2vya h PHE 414 CO 0.00 1.15 0.65 0.87 -2.23 0.00 0.00 178.31 178.74 2vya h LYS 415 N 0.03 1.25 -0.04 1.11 1.57 -0.88 0.22 116.57 119.84 2vya h LYS 415 Ca -0.12 -0.08 -0.21 0.00 -1.87 0.00 0.00 60.65 58.38 2vya h LYS 415 Cb 1.90 -0.28 0.02 0.00 0.08 0.00 0.00 32.23 33.94 2vya h LYS 415 CO 0.15 0.83 -0.80 -0.09 -0.57 0.00 0.00 179.45 178.96 2vya h ARG 416 N 1.29 0.61 -0.04 3.15 1.12 -0.94 -1.53 114.38 118.04 2vya h ARG 416 Ca 0.37 -0.61 -0.00 0.00 -1.11 0.00 0.00 59.98 58.63 2vya h ARG 416 Cb -0.09 0.16 -0.00 0.00 -0.01 0.00 0.00 29.97 30.03 2vya h ARG 416 CO -0.10 1.22 0.02 1.25 -3.11 0.00 0.00 179.97 179.25 2vya h LEU 417 N 0.24 0.06 -0.97 3.80 6.46 -1.08 -1.65 115.31 122.17 2vya h LEU 417 Ca -0.09 -0.16 0.01 0.00 -0.12 0.00 0.00 57.88 57.52 2vya h LEU 417 Cb 1.47 -0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 41.34 2vya h LEU 417 CO 0.16 0.20 0.64 0.25 -0.62 0.00 0.00 178.44 179.07 2vya h LEU 418 N -0.08 1.12 -0.99 2.25 6.46 -0.63 -2.12 115.31 121.31 2vya h LEU 418 Ca 0.01 -0.03 0.02 0.00 -0.12 0.00 0.00 57.88 57.76 2vya h LEU 418 Cb 0.16 -0.28 -0.05 0.00 -0.73 0.00 0.00 40.66 39.75 2vya h LEU 418 CO -0.00 0.82 0.65 -1.28 -0.62 0.00 0.00 178.44 178.01 2vya h SER 419 N 1.32 1.11 -0.07 1.25 0.87 -1.14 -1.48 113.55 115.41 2vya h SER 419 Ca 0.35 -0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.89 2vya h SER 419 Cb -0.14 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 61.55 2vya h SER 419 CO -0.08 0.78 0.03 -0.07 -0.53 0.00 0.00 176.83 176.97 2vya h LEU 420 N 1.30 0.10 -0.28 2.23 3.38 -0.68 -1.64 115.31 119.73 2vya h LEU 420 Ca 0.38 -0.15 0.07 0.00 0.09 0.00 0.00 57.88 58.26 2vya h LEU 420 Cb -0.08 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 40.57 2vya h LEU 420 CO -0.10 0.23 -0.25 -0.07 0.09 0.00 0.00 178.44 178.34 2vya h LEU 421 N -0.03 -0.80 -1.21 1.67 4.07 -1.17 -2.92 115.31 114.92 2vya h LEU 421 Ca 0.02 0.15 -0.01 0.00 0.08 0.00 0.00 57.88 58.12 2vya h LEU 421 Cb 0.16 0.38 -0.03 0.00 1.08 0.00 0.00 40.66 42.24 2vya h LEU 421 CO -0.00 -0.28 0.39 -0.07 -1.08 0.00 0.00 178.44 177.40 2vya h LEU 422 N -0.23 0.82 -0.87 1.67 -0.00 -1.12 -3.36 115.31 112.21 2vya h LEU 422 Ca 0.15 -0.06 0.21 0.00 -0.00 0.00 0.00 57.88 58.19 2vya h LEU 422 Cb 0.47 -0.21 -0.12 0.00 -0.00 0.00 0.00 40.66 40.79 2vya h LEU 422 CO -0.41 0.65 0.35 0.50 -0.00 0.00 0.00 178.44 179.53 2vya h LYS 423 N 0.94 0.36 -0.20 1.13 3.64 -1.09 0.07 116.57 121.41 2vya h LYS 423 Ca 0.24 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.57 2vya h LYS 423 Cb 0.00 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 2vya h LYS 423 CO -0.04 0.23 0.01 -1.35 -2.27 0.00 0.00 179.45 176.03 2vya h PRO 424 N 0.37 0.35 0.00 1.90 0.11 -1.77 -3.17 132.00 129.78 2vya h PRO 424 Ca 0.54 -0.11 -0.24 0.00 0.11 0.00 0.00 66.00 66.30 2vya h PRO 424 Cb 1.02 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.06 2vya h PRO 424 CO -0.54 0.54 -1.58 1.28 -0.21 0.00 0.00 178.00 177.49 2vya n LEU 425 N -4.70 0.88 -3.33 2.35 7.99 -1.08 -4.75 117.00 114.36 2vya n LEU 425 Ca -0.04 0.41 -0.26 0.00 -0.01 0.00 0.00 56.01 56.10 2vya n LEU 425 Cb 0.22 0.13 -0.09 0.00 -0.11 0.00 0.00 43.42 43.57 2vya n LEU 425 CO 0.37 0.29 -0.28 0.49 -1.51 0.00 0.00 177.39 176.74 2vya n PHE 426 N -2.98 -0.31 -0.20 -1.77 3.01 -0.01 -4.93 117.46 110.27 2vya n PHE 426 Ca -0.14 -3.49 -0.09 0.00 1.01 0.00 0.00 57.45 54.74 2vya n PHE 426 Cb 0.96 -0.07 0.02 0.00 -0.01 0.00 0.00 39.48 40.38 2vya n PHE 426 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 2vya h PRO 427 N 4.86 0.92 -0.59 -1.08 0.11 -1.73 -2.54 132.00 131.95 2vya h PRO 427 Ca 0.18 -0.25 0.12 0.00 0.11 0.00 0.00 66.00 66.16 2vya h PRO 427 Cb 0.88 -0.11 -0.12 0.00 0.11 0.00 0.00 31.00 31.77 2vya h PRO 427 CO 0.44 0.89 -0.22 0.00 -0.21 0.00 0.00 178.00 178.90 2vya h ARG 428 N 0.81 -0.07 0.92 1.05 3.08 -1.95 0.95 114.38 119.18 2vya h ARG 428 Ca 0.17 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.18 2vya h ARG 428 Cb 0.41 0.02 0.01 0.00 0.08 0.00 0.00 29.97 30.49 2vya h ARG 428 CO 0.01 -0.05 -0.45 -0.07 -1.07 0.00 0.00 179.97 178.35 2vya h LEU 429 N -0.07 -1.06 -0.91 3.04 4.07 -1.90 -1.02 115.31 117.46 2vya h LEU 429 Ca 0.27 0.04 0.25 0.00 0.08 0.00 0.00 57.88 58.52 2vya h LEU 429 Cb 0.50 0.28 -0.14 0.00 1.08 0.00 0.00 40.66 42.37 2vya h LEU 429 CO -0.64 -0.75 0.34 0.00 -1.08 0.00 0.00 178.44 176.30 2vya h ALA 430 N -1.42 1.44 -0.13 1.53 0.00 -1.11 -1.42 119.26 118.15 2vya h ALA 430 Ca -0.13 0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2vya h ALA 430 Cb 0.95 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2vya h ALA 430 CO 0.21 -0.45 0.04 0.00 0.00 0.00 0.00 179.25 179.05 2vya h ALA 431 N 1.78 0.18 0.17 0.00 0.00 0.14 -1.10 119.26 120.41 2vya h ALA 431 Ca 0.59 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.37 2vya h ALA 431 Cb 1.20 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2vya h ALA 431 CO -0.61 -0.21 -0.08 0.74 0.00 0.00 0.00 179.25 179.08 2vya h PHE 432 N 0.04 -0.21 -0.37 0.00 -1.00 -0.65 -2.86 116.94 111.89 2vya h PHE 432 Ca 0.04 -0.00 0.04 0.00 2.81 0.00 0.00 57.97 60.86 2vya h PHE 432 Cb 0.21 0.07 -0.04 0.00 3.61 0.00 0.00 35.95 39.80 2vya h PHE 432 CO -0.00 -0.08 0.13 1.25 -1.61 0.00 0.00 178.31 178.00 2vya h LEU 433 N -0.29 0.15 -1.67 1.54 6.46 -1.24 -1.01 115.31 119.25 2vya h LEU 433 Ca -0.02 0.04 -0.03 0.00 -0.12 0.00 0.00 57.88 57.74 2vya h LEU 433 Cb 0.23 0.02 -0.00 0.00 -0.73 0.00 0.00 40.66 40.17 2vya h LEU 433 CO 0.04 0.12 -0.16 -1.13 -0.62 0.00 0.00 178.44 176.68 2vya h ASN 434 N 0.29 0.00 -0.10 1.25 -1.24 -1.21 -2.39 115.58 112.17 2vya h ASN 434 Ca 0.17 -0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.18 2vya h ASN 434 Cb 0.14 -0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.19 2vya h ASN 434 CO -0.17 0.17 0.00 0.59 -1.29 0.00 0.00 177.43 176.73 2vya n ASN 435 N -4.34 1.32 -2.08 1.15 3.02 -0.43 -3.83 115.26 110.06 2vya n ASN 435 Ca -0.03 -1.59 -0.25 0.00 -0.03 0.00 0.00 54.58 52.69 2vya n ASN 435 Cb 0.23 -0.06 0.13 0.00 -0.61 0.00 0.00 39.78 39.47 2vya n ASN 435 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 2vya n MET 436 N 0.07 2.48 -4.19 3.52 2.81 -0.89 -3.79 117.12 117.13 2vya n MET 436 Ca 0.17 -3.26 -0.32 0.00 -1.81 0.00 0.00 57.70 52.48 2vya n MET 436 Cb 0.29 -2.17 -0.08 0.00 -0.71 0.00 0.00 33.22 30.55 2vya n MET 436 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2vya s ARG 437 N -3.52 2.80 0.31 0.03 0.52 -1.25 -4.23 118.95 113.61 2vya s ARG 437 Ca 0.58 -0.65 -0.29 0.00 -0.52 0.00 0.00 55.73 54.85 2vya s ARG 437 Cb 0.47 -2.68 -0.10 0.00 0.52 0.00 0.00 34.95 33.16 2vya s ARG 437 CO 0.04 0.60 1.22 -1.25 0.02 0.00 0.00 175.30 175.94 2vya s PRO 438 N -1.86 4.46 0.44 3.54 0.04 -1.26 -3.99 135.00 136.37 2vya s PRO 438 Ca 0.23 2.05 0.03 0.00 0.04 0.00 0.00 61.00 63.35 2vya s PRO 438 Cb -0.12 -3.11 -0.04 0.00 0.04 0.00 0.00 34.50 31.27 2vya s PRO 438 CO 0.14 -0.03 0.04 1.03 0.04 0.00 0.00 177.00 178.22 2vya s ARG 439 N -1.67 2.01 0.75 4.56 0.52 -0.31 -4.84 118.95 119.97 2vya s ARG 439 Ca 0.47 -2.22 -0.11 0.00 -0.52 0.00 0.00 55.73 53.35 2vya s ARG 439 Cb -0.37 -1.25 0.05 0.00 0.52 0.00 0.00 34.95 33.91 2vya s ARG 439 CO 0.48 -0.30 1.12 -1.54 0.02 0.00 0.00 175.30 175.09 2vya s SER 440 N -3.72 4.94 0.23 0.23 1.04 -1.26 -4.90 113.70 110.26 2vya s SER 440 Ca 0.21 0.89 -0.07 0.00 0.48 0.00 0.00 55.95 57.45 2vya s SER 440 Cb 0.05 -1.53 0.20 0.00 0.10 0.00 0.00 66.02 64.83 2vya s SER 440 CO 0.11 -1.63 1.84 0.00 0.98 0.00 0.00 173.24 174.54 2vya h ALA 441 N -0.83 1.13 -0.55 5.32 0.00 -1.99 -1.01 119.26 121.33 2vya h ALA 441 Ca -0.45 -0.15 0.09 0.00 0.00 0.00 0.00 54.91 54.40 2vya h ALA 441 Cb 1.30 -0.35 -0.07 0.00 0.00 0.00 0.00 17.79 18.66 2vya h ALA 441 CO 0.64 0.66 0.15 1.49 0.00 0.00 0.00 179.25 182.20 2vya h GLU 442 N 1.24 0.29 -0.30 0.00 4.81 -2.00 -0.31 114.58 118.31 2vya h GLU 442 Ca 0.31 -0.02 -0.14 0.00 -0.13 0.00 0.00 59.36 59.38 2vya h GLU 442 Cb 0.07 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 2vya h GLU 442 CO -0.04 0.19 -0.38 0.87 -0.73 0.00 0.00 179.01 178.92 2vya h LYS 443 N 0.30 0.69 -0.56 1.92 1.79 -1.86 -2.51 116.57 116.34 2vya h LYS 443 Ca 0.28 -0.35 -0.06 0.00 -2.18 0.00 0.00 60.65 58.35 2vya h LYS 443 Cb 0.38 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.01 2vya h LYS 443 CO -0.33 0.95 0.11 1.25 -1.08 0.00 0.00 179.45 180.35 2vya h LEU 444 N 0.57 0.83 -0.62 2.94 6.46 -0.63 -1.23 115.31 123.62 2vya h LEU 444 Ca 0.05 -0.17 0.02 0.00 -0.12 0.00 0.00 57.88 57.67 2vya h LEU 444 Cb 0.91 -0.22 -0.04 0.00 -0.73 0.00 0.00 40.66 40.58 2vya h LEU 444 CO 0.08 0.83 0.40 -0.50 -0.62 0.00 0.00 178.44 178.63 2vya h TRP 445 N 0.84 0.75 -0.57 1.25 6.55 -0.83 0.21 115.95 124.15 2vya h TRP 445 Ca 0.18 0.02 -0.00 0.00 0.95 0.00 0.00 58.89 60.04 2vya h TRP 445 Cb 0.35 -0.25 -0.03 0.00 -0.86 0.00 0.00 29.16 28.37 2vya h TRP 445 CO 0.02 0.45 0.36 -0.22 -1.05 0.00 0.00 178.44 177.99 2vya h LYS 446 N 0.79 0.77 -0.43 0.49 3.64 -1.08 0.11 116.57 120.86 2vya h LYS 446 Ca 0.24 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 59.44 2vya h LYS 446 Cb -0.03 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 2vya h LYS 446 CO -0.08 0.54 -0.21 1.25 -2.27 0.00 0.00 179.45 178.68 2vya h LEU 447 N 0.77 0.87 -0.81 5.20 5.85 -0.76 -1.68 115.31 124.76 2vya h LEU 447 Ca 0.21 -0.31 -0.06 0.00 0.84 0.00 0.00 57.88 58.55 2vya h LEU 447 Cb -0.04 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.72 2vya h LEU 447 CO -0.04 1.05 0.21 -0.61 -0.34 0.00 0.00 178.44 178.71 2vya h GLN 448 N 0.74 1.10 -0.25 1.25 5.75 -0.15 -1.67 115.11 121.88 2vya h GLN 448 Ca 0.10 -0.23 -0.13 0.00 -0.15 0.00 0.00 58.65 58.23 2vya h GLN 448 Cb 0.74 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 29.12 2vya h GLN 448 CO 0.06 0.94 -0.40 1.25 -2.65 0.00 0.00 178.83 178.03 2vya h HIS 449 N 1.06 0.70 -0.52 3.99 2.76 -0.67 -2.66 115.15 119.81 2vya h HIS 449 Ca 0.23 -0.20 -0.07 0.00 -2.20 0.00 0.00 60.37 58.12 2vya h HIS 449 Cb 0.31 -0.15 -0.02 0.00 1.55 0.00 0.00 27.41 29.10 2vya h HIS 449 CO 0.02 0.90 0.04 0.93 -1.30 0.00 0.00 177.93 178.52 2vya h GLU 450 N 0.49 0.89 -0.78 5.26 5.08 -1.05 -1.01 114.58 123.46 2vya h GLU 450 Ca 0.04 -0.27 0.04 0.00 -1.00 0.00 0.00 59.36 58.18 2vya h GLU 450 Cb 0.91 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 30.02 2vya h GLU 450 CO 0.08 0.90 0.51 0.82 -1.00 0.00 0.00 179.01 180.32 2vya h ILE 451 N 0.77 1.10 -0.05 3.13 2.04 -1.16 0.18 117.51 123.53 2vya h ILE 451 Ca 0.15 -0.32 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 2vya h ILE 451 Cb 0.47 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.64 2vya h ILE 451 CO 0.02 0.17 -0.08 -0.08 0.00 0.00 0.00 178.15 178.18 2vya h GLU 452 N 0.94 0.14 -0.91 2.37 4.81 -1.16 -1.24 114.58 119.52 2vya h GLU 452 Ca 0.32 -0.08 0.04 0.00 -0.13 0.00 0.00 59.36 59.50 2vya h GLU 452 Cb 0.09 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.42 2vya h GLU 452 CO -0.10 0.65 0.59 0.52 -0.73 0.00 0.00 179.01 179.94 2vya h MET 453 N -0.36 1.09 -0.50 1.92 2.86 -0.98 -2.28 114.93 116.68 2vya h MET 453 Ca 0.00 -0.07 -0.05 0.00 -2.06 0.00 0.00 59.70 57.53 2vya h MET 453 Cb 0.64 -0.25 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 2vya h MET 453 CO 0.02 0.72 0.12 -0.92 1.06 0.00 0.00 176.91 177.91 2vya h TYR 454 N 1.12 0.83 -0.83 -0.22 5.03 -0.47 -0.27 116.97 122.17 2vya h TYR 454 Ca 0.37 -0.10 0.05 0.00 2.58 0.00 0.00 58.73 61.63 2vya h TYR 454 Cb 0.04 -0.24 -0.05 0.00 1.55 0.00 0.00 36.73 38.03 2vya h TYR 454 CO -0.02 0.74 0.52 -0.09 -1.32 0.00 0.00 178.16 178.00 2vya h ARG 455 N 0.68 0.95 -0.10 1.82 2.43 -1.05 -2.32 114.38 116.79 2vya h ARG 455 Ca 0.16 -0.06 -0.16 0.00 -0.81 0.00 0.00 59.98 59.11 2vya h ARG 455 Cb 0.33 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 2vya h ARG 455 CO 0.00 0.63 -0.63 0.37 -1.51 0.00 0.00 179.97 178.83 2vya h GLN 456 N 0.98 0.38 -0.97 0.20 5.75 -1.09 -2.40 115.11 117.96 2vya h GLN 456 Ca 0.35 -0.27 0.02 0.00 -0.15 0.00 0.00 58.65 58.60 2vya h GLN 456 Cb 0.09 0.04 -0.05 0.00 1.07 0.00 0.00 27.48 28.63 2vya h GLN 456 CO -0.14 0.89 0.64 0.66 -2.65 0.00 0.00 178.83 178.22 2vya h SER 457 N 0.28 1.09 0.23 -0.69 4.64 -0.56 0.29 113.55 118.83 2vya h SER 457 Ca -0.01 -0.02 -0.22 0.00 -0.47 0.00 0.00 61.79 61.07 2vya h SER 457 Cb 1.17 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 2vya h SER 457 CO 0.11 0.78 -0.89 0.58 -0.87 0.00 0.00 176.83 176.53 2vya h VAL 458 N 1.28 1.37 -0.75 0.95 2.07 -1.41 -1.59 116.25 118.17 2vya h VAL 458 Ca 0.37 -2.31 0.02 0.00 0.82 0.00 0.00 66.70 65.59 2vya h VAL 458 Cb -0.10 2.31 -0.04 0.00 -1.52 0.00 0.00 31.29 31.94 2vya h VAL 458 CO -0.09 0.70 0.50 0.40 0.02 0.00 0.00 177.57 179.09 2vya h ILE 459 N 0.29 1.17 -0.42 4.57 2.04 -1.07 0.55 117.51 124.64 2vya h ILE 459 Ca -0.07 -0.34 -0.13 0.00 1.00 0.00 0.00 64.86 65.32 2vya h ILE 459 Cb 1.52 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.68 2vya h ILE 459 CO 0.16 0.18 -0.23 0.00 0.00 0.00 0.00 178.15 178.26 2vya h ALA 460 N 1.54 0.60 0.00 1.87 0.00 -0.81 -1.67 119.26 120.79 2vya h ALA 460 Ca 0.28 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.81 2vya h ALA 460 Cb -0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2vya h ALA 460 CO -0.07 0.59 -0.05 1.96 0.00 0.00 0.00 179.25 181.68 2vya h GLN 461 N 0.73 -0.09 -0.38 0.00 4.20 -0.61 -1.69 115.11 117.26 2vya h GLN 461 Ca 0.09 0.01 0.08 0.00 0.06 0.00 0.00 58.65 58.88 2vya h GLN 461 Cb 0.80 0.02 -0.07 0.00 0.30 0.00 0.00 27.48 28.53 2vya h GLN 461 CO 0.07 -0.06 -0.10 2.35 -0.67 0.00 0.00 178.83 180.42 2vya h TRP 462 N -0.10 -0.21 0.00 2.96 2.91 -0.78 -2.12 115.95 118.62 2vya h TRP 462 Ca 0.02 0.03 -0.13 0.00 1.13 0.00 0.00 58.89 59.95 2vya h TRP 462 Cb 0.12 0.15 -0.02 0.00 -0.51 0.00 0.00 29.16 28.91 2vya h TRP 462 CO -0.12 -0.17 -0.62 0.87 -1.03 0.00 0.00 178.44 177.37 2vya h LYS 463 N -0.01 0.00 -0.29 2.65 1.57 -1.25 -1.50 116.57 117.75 2vya h LYS 463 Ca 0.18 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.91 2vya h LYS 463 Cb 0.29 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 2vya h LYS 463 CO -0.40 0.62 -0.05 0.00 -0.57 0.00 0.00 179.45 179.05 2vya h ALA 464 N 1.38 1.38 -0.67 3.86 0.00 -0.66 -1.33 119.26 123.22 2vya h ALA 464 Ca -0.01 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2vya h ALA 464 Cb 1.13 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2vya h ALA 464 CO 0.08 0.43 0.00 -1.33 0.00 0.00 0.00 179.25 178.43 2vya n MET 465 N -4.27 2.60 -4.20 0.00 2.81 -0.94 -4.98 117.12 108.15 2vya n MET 465 Ca 0.01 -2.43 -0.33 0.00 -1.81 0.00 0.00 57.70 53.14 2vya n MET 465 Cb 0.26 -1.54 -0.04 0.00 -0.71 0.00 0.00 33.22 31.19 2vya n MET 465 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2vya n ASN 466 N 1.44 -1.63 -4.80 7.83 5.15 -0.50 -4.93 115.26 117.83 2vya n ASN 466 Ca 0.23 -1.08 -0.33 0.00 -0.60 0.00 0.00 54.58 52.79 2vya n ASN 466 Cb 0.58 -2.53 0.01 0.00 -0.53 0.00 0.00 39.78 37.31 2vya n ASN 466 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2vya s LEU 467 N -7.20 3.56 -0.23 1.20 1.43 -0.74 -4.85 118.68 111.84 2vya s LEU 467 Ca 0.43 1.89 -0.12 0.00 -1.03 0.00 0.00 54.13 55.30 2vya s LEU 467 Cb -0.24 -4.54 -0.17 0.00 0.03 0.00 0.00 46.19 41.27 2vya s LEU 467 CO 0.94 -1.17 -0.06 0.47 0.23 0.00 0.00 176.35 176.76 2vya n ASP 468 N -1.85 1.96 -3.87 2.29 10.43 -0.36 -4.86 116.55 120.29 2vya n ASP 468 Ca 0.09 0.24 -0.09 0.00 2.57 0.00 0.00 54.79 57.61 2vya n ASP 468 Cb 0.52 -0.78 -0.07 0.00 1.84 0.00 0.00 41.12 42.63 2vya n ASP 468 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2vya s VAL 469 N -2.48 0.13 -0.08 2.53 0.11 -1.12 -4.53 120.40 114.97 2vya s VAL 469 Ca -0.33 -1.21 0.01 0.00 -2.93 0.00 0.00 61.98 57.53 2vya s VAL 469 Cb 0.10 -1.40 0.02 0.00 -1.53 0.00 0.00 36.38 33.56 2vya s VAL 469 CO 0.59 -0.61 -0.11 -0.22 -3.33 0.00 0.00 175.10 171.42 2vya s LEU 470 N -2.88 1.51 -0.24 2.54 2.96 -0.65 -0.42 118.68 121.51 2vya s LEU 470 Ca 0.07 -0.30 -0.10 0.00 -0.22 0.00 0.00 54.13 53.58 2vya s LEU 470 Cb 0.05 -0.84 -0.05 0.00 0.50 0.00 0.00 46.19 45.86 2vya s LEU 470 CO -0.10 -0.01 0.13 -0.22 -1.32 0.00 0.00 176.35 174.83 2vya s LEU 471 N 0.99 3.95 0.26 -0.68 2.96 0.26 -0.95 118.68 125.47 2vya s LEU 471 Ca -0.08 0.04 0.03 0.00 -0.22 0.00 0.00 54.13 53.90 2vya s LEU 471 Cb -0.15 -2.06 -0.05 0.00 0.50 0.00 0.00 46.19 44.43 2vya s LEU 471 CO -0.00 0.05 0.04 0.42 -1.32 0.00 0.00 176.35 175.55 2vya s THR 472 N 1.11 0.89 0.93 3.68 -4.23 0.15 -2.13 115.64 116.04 2vya s THR 472 Ca 0.06 -2.01 -0.12 0.00 -1.18 0.00 0.00 61.69 58.44 2vya s THR 472 Cb -0.14 -2.53 0.15 0.00 1.34 0.00 0.00 72.50 71.32 2vya s THR 472 CO 0.05 -0.16 1.09 -2.84 -0.54 0.00 0.00 174.62 172.22 2vya s PRO 473 N -3.93 1.02 -0.00 3.99 0.02 -1.25 -0.21 135.00 134.63 2vya s PRO 473 Ca 0.33 0.69 0.03 0.00 0.02 0.00 0.00 61.00 62.07 2vya s PRO 473 Cb 0.07 -1.79 -0.01 0.00 0.02 0.00 0.00 34.50 32.79 2vya s PRO 473 CO 0.12 -2.37 -0.08 1.41 -0.33 0.00 0.00 177.00 175.74 2vya s MET 474 N -4.97 0.65 0.34 5.54 1.75 -1.26 -4.24 119.30 117.12 2vya s MET 474 Ca 0.64 -0.32 -0.28 0.00 -1.25 0.00 0.00 55.69 54.48 2vya s MET 474 Cb -0.18 -0.62 -0.12 0.00 2.84 0.00 0.00 34.83 36.75 2vya s MET 474 CO 0.57 0.17 1.29 -0.11 -0.65 0.00 0.00 175.02 176.29 2vya n LEU 475 N 2.80 3.56 0.00 4.11 7.94 -1.26 -4.68 117.00 129.48 2vya n LEU 475 Ca -0.14 1.21 0.00 0.00 -1.11 0.00 0.00 56.01 55.97 2vya n LEU 475 Cb 0.57 -1.49 0.00 0.00 0.53 0.00 0.00 43.42 43.04 2vya n LEU 475 CO 0.25 -0.47 0.00 0.61 -1.11 0.00 0.00 177.39 176.66 2vya n GLY 476 N 0.78 2.49 3.28 -3.96 0.00 -1.26 -4.73 105.19 101.79 2vya n GLY 476 Ca 0.05 -0.89 -0.27 0.00 0.00 0.00 0.00 46.02 44.91 2vya n GLY 476 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2vya n PRO 477 N -0.82 -2.13 -1.69 1.61 -0.04 -1.26 -4.44 135.00 126.22 2vya n PRO 477 Ca 0.00 -1.69 -0.42 0.00 -0.04 0.00 0.00 63.50 61.34 2vya n PRO 477 Cb 0.00 -1.36 -0.00 0.00 -0.04 0.00 0.00 33.50 32.10 2vya n PRO 477 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2vya n ALA 478 N -4.27 1.14 -1.82 0.55 0.00 -1.26 -4.81 120.51 110.04 2vya n ALA 478 Ca -0.19 0.34 -0.32 0.00 0.00 0.00 0.00 53.44 53.28 2vya n ALA 478 Cb 0.52 -2.23 -0.01 0.00 0.00 0.00 0.00 19.45 17.74 2vya n ALA 478 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2vya s LEU 479 N -0.98 3.41 0.77 0.00 1.02 -1.26 -4.58 118.68 117.07 2vya s LEU 479 Ca 0.57 1.53 -0.13 0.00 0.02 0.00 0.00 54.13 56.12 2vya s LEU 479 Cb -0.57 -4.49 0.06 0.00 0.02 0.00 0.00 46.19 41.21 2vya s LEU 479 CO 0.61 -0.82 1.15 -1.81 0.02 0.00 0.00 176.35 175.50 2vya s ASP 480 N -3.56 4.10 0.44 2.29 1.01 -0.92 -0.98 116.67 119.06 2vya s ASP 480 Ca 0.58 2.13 -0.23 0.00 0.71 0.00 0.00 52.55 55.74 2vya s ASP 480 Cb -0.11 -2.56 -0.11 0.00 1.01 0.00 0.00 42.92 41.15 2vya s ASP 480 CO 0.43 -2.31 0.74 0.18 0.21 0.00 0.00 175.17 174.41 2vya n LEU 481 N -3.23 1.20 -0.55 1.23 7.99 -0.49 -2.25 117.00 120.90 2vya n LEU 481 Ca 0.11 0.94 -0.06 0.00 -0.01 0.00 0.00 56.01 56.99 2vya n LEU 481 Cb 0.52 -1.22 -0.03 0.00 -0.11 0.00 0.00 43.42 42.58 2vya n LEU 481 CO 0.49 -2.33 -0.06 0.59 -1.51 0.00 0.00 177.39 174.57 2vya n ASN 482 N 0.82 -4.80 -0.07 -1.43 3.02 -1.26 -4.86 115.26 106.69 2vya n ASN 482 Ca 0.11 0.16 -0.04 0.00 -0.03 0.00 0.00 54.58 54.77 2vya n ASN 482 Cb 0.40 -3.39 -0.16 0.00 -0.61 0.00 0.00 39.78 36.03 2vya n ASN 482 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2vya n THR 483 N -1.83 1.06 -0.35 3.41 -2.24 -0.95 -4.52 114.28 108.85 2vya n THR 483 Ca -0.06 -0.76 0.05 0.00 -2.27 0.00 0.00 64.05 61.01 2vya n THR 483 Cb 0.47 -0.39 0.22 0.00 -2.10 0.00 0.00 70.33 68.54 2vya n THR 483 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2vya h PRO 484 N 0.00 1.02 0.00 -0.78 0.11 -1.89 -1.69 132.00 128.77 2vya h PRO 484 Ca -0.39 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2vya h PRO 484 Cb 1.91 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.79 2vya h PRO 484 CO 0.03 0.68 0.00 0.41 -0.21 0.00 0.00 178.00 178.90 2vya n GLY 485 N -1.37 -0.34 0.00 -0.55 0.00 -1.24 -1.33 105.19 100.37 2vya n GLY 485 Ca 0.17 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2vya n GLY 485 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vya n ARG 486 N -0.97 0.95 -3.11 1.61 1.74 -0.65 -4.12 116.66 112.10 2vya n ARG 486 Ca 0.08 -0.86 -0.24 0.00 -0.77 0.00 0.00 57.85 56.06 2vya n ARG 486 Cb 0.04 -0.86 -0.05 0.00 -1.02 0.00 0.00 32.46 30.57 2vya n ARG 486 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2vya n ALA 487 N -0.21 3.59 0.14 7.54 0.00 -0.44 -4.45 120.51 126.68 2vya n ALA 487 Ca 0.00 -4.21 -0.01 0.00 0.00 0.00 0.00 53.44 49.22 2vya n ALA 487 Cb 0.22 -0.82 0.20 0.00 0.00 0.00 0.00 19.45 19.05 2vya n ALA 487 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2vya h THR 488 N 2.33 1.40 -0.85 0.00 2.02 -1.87 -3.05 112.91 112.88 2vya h THR 488 Ca 0.13 -1.91 0.18 0.00 0.77 0.00 0.00 66.41 65.58 2vya h THR 488 Cb 0.70 2.02 -0.06 0.00 -1.74 0.00 0.00 68.15 69.06 2vya h THR 488 CO 0.69 0.55 0.56 1.23 0.37 0.00 0.00 175.52 178.93 2vya h GLY 489 N 1.63 0.80 2.00 2.16 0.00 -1.92 -1.59 103.07 106.15 2vya h GLY 489 Ca -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.14 2vya h GLY 489 CO 0.07 0.02 0.00 0.00 0.00 0.00 0.00 176.54 176.64 2vya n ALA 490 N -2.52 1.11 0.31 3.60 0.00 -1.15 -2.11 120.51 119.75 2vya n ALA 490 Ca 0.17 0.06 0.15 0.00 0.00 0.00 0.00 53.44 53.82 2vya n ALA 490 Cb 0.64 -1.13 0.66 0.00 0.00 0.00 0.00 19.45 19.61 2vya n ALA 490 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2vya h VAL 491 N 0.00 0.00 -0.82 0.00 2.07 -1.50 -3.33 116.25 112.67 2vya h VAL 491 Ca 0.00 -0.23 0.12 0.00 0.82 0.00 0.00 66.70 67.41 2vya h VAL 491 Cb 0.04 1.01 -0.08 0.00 -1.52 0.00 0.00 31.29 30.74 2vya h VAL 491 CO 0.00 0.00 0.44 0.77 0.02 0.00 0.00 177.57 178.80 2vya h SER 492 N 0.00 0.57 -0.67 0.57 4.64 -1.66 -0.54 113.55 116.46 2vya h SER 492 Ca 0.00 0.07 -0.03 0.00 -0.47 0.00 0.00 61.79 61.36 2vya h SER 492 Cb 0.28 -0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 62.31 2vya h SER 492 CO 0.00 0.29 0.32 1.88 -0.87 0.00 0.00 176.83 178.45 2vya h TYR 493 N 0.68 0.98 0.00 4.77 0.05 -1.87 -3.06 116.97 118.53 2vya h TYR 493 Ca 0.42 -0.04 -0.18 0.00 0.05 0.00 0.00 58.73 58.98 2vya h TYR 493 Cb 0.51 -0.31 -0.03 0.00 1.01 0.00 0.00 36.73 37.91 2vya h TYR 493 CO -0.08 0.72 -1.14 0.25 -1.05 0.00 0.00 178.16 176.86 2vya n THR 494 N -4.33 1.50 0.21 -2.88 -2.24 -0.95 -4.44 114.28 101.15 2vya n THR 494 Ca 0.06 0.02 0.10 0.00 -2.27 0.00 0.00 64.05 61.97 2vya n THR 494 Cb 0.14 -2.14 0.64 0.00 -2.10 0.00 0.00 70.33 66.87 2vya n THR 494 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 2vya h MET 495 N -1.00 0.02 -0.96 -0.78 1.85 -1.17 -1.62 114.93 111.26 2vya h MET 495 Ca -0.27 -0.00 0.31 0.00 -0.61 0.00 0.00 59.70 59.13 2vya h MET 495 Cb 1.09 -0.00 -0.17 0.00 0.43 0.00 0.00 31.60 32.95 2vya h MET 495 CO -0.16 0.01 0.29 1.25 -0.40 0.00 0.00 176.91 177.90 2vya h LEU 496 N 0.02 -0.01 -0.42 3.39 5.85 -1.75 0.45 115.31 122.85 2vya h LEU 496 Ca 0.05 0.24 0.00 0.00 0.84 0.00 0.00 57.88 59.01 2vya h LEU 496 Cb 0.18 0.32 0.00 0.00 0.37 0.00 0.00 40.66 41.53 2vya h LEU 496 CO -0.00 -0.29 -0.30 -1.22 -0.34 0.00 0.00 178.44 176.29 2vya n TYR 497 N -5.30 0.00 -0.04 1.25 4.01 -0.61 -2.05 117.16 114.42 2vya n TYR 497 Ca 0.28 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.89 2vya n TYR 497 Cb 0.91 -0.14 -0.11 0.00 -0.31 0.00 0.00 39.34 39.69 2vya n TYR 497 CO 0.00 0.00 0.00 -0.91 -0.46 0.00 0.00 176.86 175.49 2vya h ASN 498 N 1.02 -0.02 -0.90 7.72 4.21 -1.01 -1.41 115.58 125.19 2vya h ASN 498 Ca 0.00 -0.76 0.18 0.00 1.21 0.00 0.00 56.30 56.93 2vya h ASN 498 Cb 0.51 0.00 -0.17 0.00 -1.12 0.00 0.00 38.32 37.54 2vya h ASN 498 CO 0.00 0.79 -0.23 0.00 -1.29 0.00 0.00 177.43 176.70 2vya n LEU 500 N -5.57 0.75 -3.74 0.00 4.77 -0.87 -4.92 117.00 107.43 2vya n LEU 500 Ca 0.14 0.41 -0.24 0.00 -0.03 0.00 0.00 56.01 56.29 2vya n LEU 500 Cb 0.45 -0.26 0.04 0.00 -2.33 0.00 0.00 43.42 41.32 2vya n LEU 500 CO -0.07 -0.12 0.02 -0.67 -1.33 0.00 0.00 177.39 175.22 2vya n ASP 501 N -2.18 -2.66 -4.90 -1.43 4.64 -0.18 -4.95 116.55 104.89 2vya n ASP 501 Ca 0.05 -0.77 -0.33 0.00 -1.38 0.00 0.00 54.79 52.35 2vya n ASP 501 Cb 0.43 -4.16 -0.05 0.00 -1.04 0.00 0.00 41.12 36.31 2vya n ASP 501 CO 0.00 0.00 0.00 -0.36 -0.82 0.00 0.00 177.20 176.02 2vya s PHE 502 N -3.51 3.53 0.22 -0.67 2.99 -1.03 -4.52 117.98 114.99 2vya s PHE 502 Ca 0.24 0.49 -0.31 0.00 0.00 0.00 0.00 56.93 57.35 2vya s PHE 502 Cb -0.12 -1.94 -0.11 0.00 0.00 0.00 0.00 43.02 40.86 2vya s PHE 502 CO 0.81 0.55 1.58 -1.25 -0.00 0.00 0.00 175.22 176.91 2vya s PRO 503 N -2.20 4.19 -0.03 0.24 0.04 -1.20 -4.62 135.00 131.42 2vya s PRO 503 Ca 0.33 2.45 0.01 0.00 0.04 0.00 0.00 61.00 63.82 2vya s PRO 503 Cb -0.13 -3.10 0.02 0.00 0.04 0.00 0.00 34.50 31.33 2vya s PRO 503 CO 0.21 -0.61 -0.01 0.00 0.04 0.00 0.00 177.00 176.64 2vya s ALA 504 N 0.69 0.33 0.26 8.56 0.00 0.10 -2.04 121.76 129.67 2vya s ALA 504 Ca 0.68 0.12 0.03 0.00 0.00 0.00 0.00 51.96 52.79 2vya s ALA 504 Cb -0.45 -0.29 -0.05 0.00 0.00 0.00 0.00 23.12 22.32 2vya s ALA 504 CO 0.37 -0.05 0.04 0.20 0.00 0.00 0.00 175.76 176.32 2vya s GLY 505 N 0.88 1.74 -0.02 0.00 0.00 -0.20 0.23 107.32 109.95 2vya s GLY 505 Ca -0.09 -1.87 0.02 0.00 0.00 0.00 0.00 44.72 42.78 2vya s GLY 505 CO -0.01 -1.69 -0.06 0.54 0.00 0.00 0.00 173.10 171.88 2vya s VAL 506 N -3.46 0.54 -0.05 1.40 0.11 0.14 -0.89 120.40 118.19 2vya s VAL 506 Ca 0.33 -0.22 0.02 0.00 -2.93 0.00 0.00 61.98 59.18 2vya s VAL 506 Cb 0.07 -0.50 0.02 0.00 -1.53 0.00 0.00 36.38 34.44 2vya s VAL 506 CO 0.12 0.18 -0.07 0.54 -3.33 0.00 0.00 175.10 172.54 2vya s VAL 507 N 0.30 0.74 0.15 2.04 0.11 -0.99 -2.52 120.40 120.23 2vya s VAL 507 Ca -0.04 -0.26 -0.31 0.00 -2.93 0.00 0.00 61.98 58.44 2vya s VAL 507 Cb -0.08 -0.72 -0.09 0.00 -1.53 0.00 0.00 36.38 33.97 2vya s VAL 507 CO -0.00 0.26 1.40 -2.84 -3.33 0.00 0.00 175.10 170.59 2vya s PRO 508 N 0.72 4.32 0.00 1.54 0.02 -1.26 -2.47 135.00 137.88 2vya s PRO 508 Ca -0.12 2.12 0.00 0.00 0.02 0.00 0.00 61.00 63.03 2vya s PRO 508 Cb -0.14 -3.21 0.00 0.00 0.02 0.00 0.00 34.50 31.17 2vya s PRO 508 CO 0.01 -0.41 0.00 1.33 -0.33 0.00 0.00 177.00 177.60 2vya n VAL 509 N 3.50 0.00 -3.83 3.83 0.24 -0.73 -4.81 118.33 116.53 2vya n VAL 509 Ca 0.10 -0.01 -0.07 0.00 -2.04 0.00 0.00 64.34 62.33 2vya n VAL 509 Cb 0.42 0.42 0.02 0.00 -1.47 0.00 0.00 33.84 33.22 2vya n VAL 509 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2vya s THR 510 N -1.63 0.00 0.08 3.34 -1.32 -1.10 -4.70 115.64 110.31 2vya s THR 510 Ca 0.00 -0.87 0.05 0.00 -1.21 0.00 0.00 61.69 59.66 2vya s THR 510 Cb 0.00 -2.78 -0.03 0.00 -1.51 0.00 0.00 72.50 68.18 2vya s THR 510 CO 0.00 0.00 -0.12 0.42 -2.21 0.00 0.00 174.62 172.71 2vya s THR 511 N -2.43 1.04 0.05 5.08 -4.23 -1.26 -1.33 115.64 112.56 2vya s THR 511 Ca 0.17 -1.42 -0.31 0.00 -1.18 0.00 0.00 61.69 58.95 2vya s THR 511 Cb -0.04 -1.16 -0.07 0.00 1.34 0.00 0.00 72.50 72.56 2vya s THR 511 CO 0.09 -0.35 1.54 -0.69 -0.54 0.00 0.00 174.62 174.66 2vya s VAL 512 N -1.70 3.29 0.58 2.29 1.01 0.35 -4.85 120.40 121.37 2vya s VAL 512 Ca 0.01 0.74 -0.02 0.00 0.00 0.00 0.00 61.98 62.71 2vya s VAL 512 Cb -0.07 -3.48 0.03 0.00 0.00 0.00 0.00 36.38 32.86 2vya s VAL 512 CO 0.02 0.00 0.84 0.42 0.00 0.00 0.00 175.10 176.38 2vya s THR 513 N 2.37 2.88 0.33 3.92 -4.23 -1.26 -0.87 115.64 118.78 2vya s THR 513 Ca 0.69 -0.45 0.08 0.00 -1.18 0.00 0.00 61.69 60.83 2vya s THR 513 Cb -0.37 -3.13 0.08 0.00 1.34 0.00 0.00 72.50 70.43 2vya s THR 513 CO 0.30 -0.11 1.78 0.00 -0.54 0.00 0.00 174.62 176.05 2vya h ALA 514 N -0.09 1.26 0.20 3.99 0.00 -1.97 -1.88 119.26 120.76 2vya h ALA 514 Ca -0.44 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.13 2vya h ALA 514 Cb 1.29 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2vya h ALA 514 CO 0.56 0.50 -0.09 1.49 0.00 0.00 0.00 179.25 181.71 2vya h GLU 515 N 0.21 -0.25 -0.79 0.00 4.81 -2.00 -0.83 114.58 115.73 2vya h GLU 515 Ca 0.03 0.02 0.19 0.00 -0.13 0.00 0.00 59.36 59.46 2vya h GLU 515 Cb 0.65 0.06 -0.13 0.00 0.63 0.00 0.00 28.75 29.96 2vya h GLU 515 CO 0.05 -0.09 0.09 -0.44 -0.73 0.00 0.00 179.01 177.88 2vya h ASP 516 N -0.36 -0.21 0.35 1.04 3.45 -1.90 -2.61 116.42 116.18 2vya h ASP 516 Ca -0.03 0.19 -0.24 0.00 0.43 0.00 0.00 57.03 57.38 2vya h ASP 516 Cb 0.28 0.31 0.01 0.00 -0.56 0.00 0.00 39.33 39.36 2vya h ASP 516 CO 0.04 -0.16 -1.03 -0.78 -1.57 0.00 0.00 179.24 175.75 2vya h ASP 517 N 0.15 0.57 -0.28 6.45 3.58 -0.98 -2.90 116.42 123.01 2vya h ASP 517 Ca 0.45 -0.49 -0.06 0.00 0.42 0.00 0.00 57.03 57.35 2vya h ASP 517 Cb 0.83 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.69 2vya h ASP 517 CO -0.65 1.30 -0.02 0.00 -2.88 0.00 0.00 179.24 176.99 2vya h ALA 518 N 0.65 1.23 0.00 -0.78 0.00 -0.98 -2.78 119.26 116.59 2vya h ALA 518 Ca -0.10 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 2vya h ALA 518 Cb 1.69 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 19.31 2vya h ALA 518 CO 0.18 0.51 -0.15 1.96 0.00 0.00 0.00 179.25 181.75 2vya h GLN 519 N 0.60 0.00 -0.14 0.00 4.20 -1.26 -1.60 115.11 116.91 2vya h GLN 519 Ca 0.12 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.87 2vya h GLN 519 Cb 0.41 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 2vya h GLN 519 CO 0.02 0.15 0.33 0.52 -0.67 0.00 0.00 178.83 179.18 2vya h MET 520 N 0.00 0.00 0.00 1.46 2.86 -1.45 0.46 114.93 118.26 2vya h MET 520 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2vya h MET 520 Cb 0.37 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.03 2vya h MET 520 CO 0.02 0.00 0.00 -1.91 1.06 0.00 0.00 176.91 176.08 2vya n GLU 521 N -3.26 0.09 0.00 1.72 4.07 -0.60 -1.96 120.64 120.70 2vya n GLU 521 Ca 0.01 0.35 0.08 0.00 -0.06 0.00 0.00 57.16 57.55 2vya n GLU 521 Cb 0.42 -1.68 -0.01 0.00 -0.06 0.00 0.00 31.44 30.12 2vya n GLU 521 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 2vya n LEU 522 N -1.84 1.64 -4.73 4.31 4.77 0.16 -4.99 117.00 116.32 2vya n LEU 522 Ca 0.03 -0.75 -0.42 0.00 -0.03 0.00 0.00 56.01 54.84 2vya n LEU 522 Cb 0.18 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.24 2vya n LEU 522 CO 0.15 0.32 1.18 -0.47 -1.33 0.00 0.00 177.39 177.24 2vya s TYR 523 N -2.01 3.02 0.00 -1.77 6.14 -0.83 -4.93 117.35 116.99 2vya s TYR 523 Ca 0.14 0.80 0.00 0.00 0.64 0.00 0.00 57.07 58.64 2vya s TYR 523 Cb 0.14 -3.89 0.00 0.00 0.42 0.00 0.00 41.96 38.62 2vya s TYR 523 CO 0.44 -3.13 0.00 1.63 0.64 0.00 0.00 175.55 175.13 2vya n LYS 524 N 3.20 1.60 0.00 4.97 5.02 -1.26 -5.02 118.16 126.67 2vya n LYS 524 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 2vya n LYS 524 Cb 0.39 -0.97 0.00 0.00 -0.02 0.00 0.00 35.03 34.44 2vya n LYS 524 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2vya n GLY 525 N 2.51 -0.75 0.09 0.72 0.00 -1.26 -4.37 105.19 102.12 2vya n GLY 525 Ca 0.00 -1.64 -0.11 0.00 0.00 0.00 0.00 46.02 44.28 2vya n GLY 525 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2vya h TYR 526 N 0.00 0.11 0.00 1.61 0.05 -1.95 -3.40 116.97 113.38 2vya h TYR 526 Ca 0.00 -0.08 -0.11 0.00 0.05 0.00 0.00 58.73 58.60 2vya h TYR 526 Cb 0.00 -0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.72 2vya h TYR 526 CO 0.00 1.13 -1.98 1.19 -1.05 0.00 0.00 178.16 177.45 2vya n PHE 527 N -3.19 0.14 -0.80 4.88 3.01 -1.26 -4.98 117.46 115.27 2vya n PHE 527 Ca -0.16 0.04 0.00 0.00 1.01 0.00 0.00 57.45 58.34 2vya n PHE 527 Cb 1.03 -0.70 0.00 0.00 -0.01 0.00 0.00 39.48 39.80 2vya n PHE 527 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2vya n GLY 528 N 1.39 0.39 3.43 1.37 0.00 -1.26 -5.00 105.19 105.52 2vya n GLY 528 Ca -0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 2vya n GLY 528 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2vya n ASP 529 N -0.14 -2.15 0.24 1.61 3.85 -1.26 -4.76 116.55 113.95 2vya n ASP 529 Ca 0.00 -1.15 0.11 0.00 -0.71 0.00 0.00 54.79 53.04 2vya n ASP 529 Cb 0.07 -0.99 0.62 0.00 -1.35 0.00 0.00 41.12 39.47 2vya n ASP 529 CO 0.00 0.00 0.00 -0.29 -1.01 0.00 0.00 177.20 175.90 2vya h ILE 530 N -2.75 0.62 -0.45 2.12 2.10 -1.96 -1.82 117.51 115.37 2vya h ILE 530 Ca -0.40 -0.78 -0.02 0.00 1.08 0.00 0.00 64.86 64.73 2vya h ILE 530 Cb 1.24 1.50 -0.02 0.00 -1.09 0.00 0.00 36.82 38.45 2vya h ILE 530 CO 0.26 0.17 0.19 -0.50 -1.08 0.00 0.00 178.15 177.19 2vya h TRP 531 N 0.00 0.68 -0.24 2.19 6.55 -1.92 -1.30 115.95 121.91 2vya h TRP 531 Ca -0.00 -0.05 -0.07 0.00 0.95 0.00 0.00 58.89 59.72 2vya h TRP 531 Cb 0.49 -0.21 -0.01 0.00 -0.86 0.00 0.00 29.16 28.57 2vya h TRP 531 CO 0.00 0.58 -0.13 -0.44 -1.05 0.00 0.00 178.44 177.40 2vya h ASP 532 N 0.59 0.39 -0.08 -3.49 3.45 -1.67 -0.80 116.42 114.80 2vya h ASP 532 Ca 0.15 -0.10 -0.10 0.00 0.43 0.00 0.00 57.03 57.41 2vya h ASP 532 Cb 0.18 -0.10 0.00 0.00 -0.56 0.00 0.00 39.33 38.85 2vya h ASP 532 CO -0.01 0.56 -0.34 0.40 -1.57 0.00 0.00 179.24 178.27 2vya h ILE 533 N 0.38 1.41 -0.62 0.35 2.04 -1.29 -1.55 117.51 118.23 2vya h ILE 533 Ca 0.07 -1.72 -0.03 0.00 1.00 0.00 0.00 64.86 64.19 2vya h ILE 533 Cb 0.47 2.27 -0.03 0.00 -0.74 0.00 0.00 36.82 38.79 2vya h ILE 533 CO 0.03 0.50 0.29 0.40 0.00 0.00 0.00 178.15 179.37 2vya h ILE 534 N -0.09 1.22 -0.26 -0.67 5.03 -1.18 -2.90 117.51 118.66 2vya h ILE 534 Ca -0.02 -0.63 -0.01 0.00 -0.12 0.00 0.00 64.86 64.07 2vya h ILE 534 Cb 0.99 0.48 -0.01 0.00 -3.03 0.00 0.00 36.82 35.25 2vya h ILE 534 CO 0.07 0.26 0.11 0.25 -0.68 0.00 0.00 178.15 178.16 2vya h LEU 535 N 0.86 0.35 -0.20 1.44 5.85 -1.12 -0.93 115.31 121.56 2vya h LEU 535 Ca 0.21 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.80 2vya h LEU 535 Cb 0.13 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.02 2vya h LEU 535 CO -0.03 0.42 -0.43 0.50 -0.34 0.00 0.00 178.44 178.56 2vya h LYS 536 N 0.27 -0.38 -0.82 1.25 3.64 -1.17 -1.54 116.57 117.83 2vya h LYS 536 Ca 0.09 0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.56 2vya h LYS 536 Cb 0.17 0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 32.01 2vya h LYS 536 CO -0.01 -0.25 0.49 -0.22 -2.27 0.00 0.00 179.45 177.19 2vya h LYS 537 N -0.39 0.86 -0.23 1.90 3.64 -1.40 -2.93 116.57 118.02 2vya h LYS 537 Ca 0.04 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.29 2vya h LYS 537 Cb 0.51 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 2vya h LYS 537 CO -0.40 0.57 -0.19 0.00 -2.27 0.00 0.00 179.45 177.16 2vya h ALA 538 N 1.40 1.26 -0.00 5.00 0.00 -0.20 -2.34 119.26 124.38 2vya h ALA 538 Ca 0.37 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2vya h ALA 538 Cb 0.21 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2vya h ALA 538 CO -0.19 0.49 -0.10 -1.33 0.00 0.00 0.00 179.25 178.12 2vya n MET 539 N -4.18 0.19 -1.49 0.00 2.81 -0.79 -2.16 117.12 111.51 2vya n MET 539 Ca -0.00 -0.04 -0.30 0.00 -1.81 0.00 0.00 57.70 55.55 2vya n MET 539 Cb 0.35 -1.50 0.10 0.00 -0.71 0.00 0.00 33.22 31.46 2vya n MET 539 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2vya s LYS 540 N -2.83 1.82 -0.84 0.03 1.02 -0.88 -4.33 119.74 113.73 2vya s LYS 540 Ca 0.19 0.63 -0.03 0.00 0.02 0.00 0.00 55.97 56.78 2vya s LYS 540 Cb 0.19 -1.89 0.00 0.00 -0.52 0.00 0.00 37.83 35.61 2vya s LYS 540 CO 0.53 -1.80 0.65 -1.71 -0.92 0.00 0.00 175.35 172.11 2vya n ASN 541 N -3.55 -5.84 -0.37 2.83 2.85 -1.26 -4.91 115.26 105.01 2vya n ASN 541 Ca 0.07 -0.69 0.01 0.00 -0.11 0.00 0.00 54.58 53.86 2vya n ASN 541 Cb 0.56 -3.01 0.02 0.00 1.24 0.00 0.00 39.78 38.59 2vya n ASN 541 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 2vya n SER 542 N -2.34 0.39 -4.64 1.20 7.64 -1.26 -5.04 113.62 109.57 2vya n SER 542 Ca -0.19 -2.04 -0.48 0.00 1.01 0.00 0.00 58.87 57.17 2vya n SER 542 Cb 0.62 -0.20 -0.05 0.00 -1.01 0.00 0.00 64.21 63.57 2vya n SER 542 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2vya n VAL 543 N -0.22 0.02 -0.25 0.44 0.31 -1.26 -1.96 118.33 115.40 2vya n VAL 543 Ca 0.02 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 2vya n VAL 543 Cb 0.66 -1.24 0.00 0.00 -0.91 0.00 0.00 33.84 32.35 2vya n VAL 543 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2vya n GLY 544 N 3.02 0.90 3.85 2.92 0.00 -0.04 -4.95 105.19 110.89 2vya n GLY 544 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 2vya n GLY 544 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vya s LEU 545 N 0.00 4.22 0.69 0.99 1.43 -0.83 -4.70 118.68 120.49 2vya s LEU 545 Ca 0.00 1.18 -0.15 0.00 -1.03 0.00 0.00 54.13 54.13 2vya s LEU 545 Cb 0.00 -3.66 0.02 0.00 0.03 0.00 0.00 46.19 42.58 2vya s LEU 545 CO 0.00 -0.04 1.14 -2.16 0.23 0.00 0.00 176.35 175.52 2vya s PRO 546 N -2.44 2.53 -0.08 1.29 0.04 -1.26 -0.50 135.00 134.58 2vya s PRO 546 Ca 0.46 1.50 -0.04 0.00 0.04 0.00 0.00 61.00 62.96 2vya s PRO 546 Cb -0.13 -1.91 0.04 0.00 0.04 0.00 0.00 34.50 32.54 2vya s PRO 546 CO 0.19 -1.48 0.18 0.08 0.04 0.00 0.00 177.00 176.01 2vya s VAL 547 N -2.25 -0.04 0.36 -0.36 1.01 -0.44 -4.60 120.40 114.08 2vya s VAL 547 Ca 0.69 0.16 0.05 0.00 0.00 0.00 0.00 61.98 62.88 2vya s VAL 547 Cb -0.23 -0.28 0.05 0.00 0.00 0.00 0.00 36.38 35.91 2vya s VAL 547 CO 0.43 0.07 0.39 0.00 0.00 0.00 0.00 175.10 175.99 2vya n ALA 548 N 4.15 0.67 -2.70 5.51 0.00 -1.26 -1.77 120.51 125.11 2vya n ALA 548 Ca -0.25 -1.37 -0.10 0.00 0.00 0.00 0.00 53.44 51.71 2vya n ALA 548 Cb 0.52 0.47 -0.11 0.00 0.00 0.00 0.00 19.45 20.33 2vya n ALA 548 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2vya s VAL 549 N -1.51 0.36 -0.07 0.00 1.01 -1.03 -4.22 120.40 114.95 2vya s VAL 549 Ca 0.30 -1.24 0.02 0.00 0.00 0.00 0.00 61.98 61.06 2vya s VAL 549 Cb -0.02 -0.77 -0.03 0.00 0.00 0.00 0.00 36.38 35.57 2vya s VAL 549 CO 0.19 -0.58 -0.12 -1.58 0.00 0.00 0.00 175.10 173.01 2vya s GLN 550 N -2.19 2.69 -0.08 2.72 0.74 0.71 -2.35 119.66 121.90 2vya s GLN 550 Ca -0.07 -0.66 0.03 0.00 0.05 0.00 0.00 55.36 54.71 2vya s GLN 550 Cb -0.05 -2.47 -0.02 0.00 1.10 0.00 0.00 33.01 31.57 2vya s GLN 550 CO -0.02 0.57 -0.17 0.00 -0.55 0.00 0.00 175.29 175.12 2vya s VAL 552 N -0.22 1.38 0.18 0.00 1.01 -0.13 -1.04 120.40 121.58 2vya s VAL 552 Ca 0.00 -1.63 -0.09 0.00 0.00 0.00 0.00 61.98 60.26 2vya s VAL 552 Cb -0.13 -1.47 -0.01 0.00 0.00 0.00 0.00 36.38 34.77 2vya s VAL 552 CO 0.03 -0.32 0.30 0.00 0.00 0.00 0.00 175.10 175.11 2vya s ALA 553 N -1.83 0.02 0.72 5.51 0.00 -0.86 -1.64 121.76 123.68 2vya s ALA 553 Ca 0.07 -0.92 -0.14 0.00 0.00 0.00 0.00 51.96 50.98 2vya s ALA 553 Cb -0.07 0.92 0.03 0.00 0.00 0.00 0.00 23.12 24.00 2vya s ALA 553 CO 0.03 -0.67 1.13 -0.51 0.00 0.00 0.00 175.76 175.74 2vya s LEU 554 N -2.98 3.26 0.22 0.00 1.43 -1.26 -3.22 118.68 116.13 2vya s LEU 554 Ca 0.19 2.06 -0.30 0.00 -1.03 0.00 0.00 54.13 55.05 2vya s LEU 554 Cb 0.03 -4.55 -0.16 0.00 0.03 0.00 0.00 46.19 41.54 2vya s LEU 554 CO 0.02 -1.97 0.88 -2.65 0.23 0.00 0.00 176.35 172.86 2vya n PRO 555 N -2.85 0.81 -0.90 1.29 -0.02 -1.26 -0.77 135.00 131.31 2vya n PRO 555 Ca 0.11 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 2vya n PRO 555 Cb 0.52 -1.56 0.00 0.00 -0.02 0.00 0.00 33.50 32.43 2vya n PRO 555 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 2vya n TRP 556 N 0.47 0.00 -1.61 6.00 7.02 -1.26 -4.91 117.44 123.15 2vya n TRP 556 Ca 0.14 0.00 -0.37 0.00 -1.02 0.00 0.00 57.50 56.25 2vya n TRP 556 Cb 0.27 -0.57 0.06 0.00 -2.42 0.00 0.00 31.31 28.65 2vya n TRP 556 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 2vya n GLN 557 N -1.86 2.76 0.13 -0.99 1.13 0.05 -4.70 117.38 113.90 2vya n GLN 557 Ca 0.00 -3.43 -0.01 0.00 -1.94 0.00 0.00 57.00 51.61 2vya n GLN 557 Cb 0.07 -2.28 0.19 0.00 0.11 0.00 0.00 30.24 28.32 2vya n GLN 557 CO 0.00 0.00 0.00 1.05 -1.44 0.00 0.00 177.06 176.67 2vya h GLU 558 N 2.43 0.05 -0.16 -1.09 9.09 -1.91 -1.93 114.58 121.05 2vya h GLU 558 Ca 0.58 -0.03 -0.09 0.00 0.05 0.00 0.00 59.36 59.87 2vya h GLU 558 Cb 0.51 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.60 2vya h GLU 558 CO 1.50 0.61 -0.31 1.05 0.05 0.00 0.00 179.01 181.91 2vya h GLU 559 N 0.04 0.32 -0.23 1.06 9.09 -1.92 0.17 114.58 123.10 2vya h GLU 559 Ca -0.01 -0.12 -0.19 0.00 0.05 0.00 0.00 59.36 59.10 2vya h GLU 559 Cb 1.03 -0.02 -0.00 0.00 -1.65 0.00 0.00 28.75 28.11 2vya h GLU 559 CO 0.08 0.60 -0.60 1.25 0.05 0.00 0.00 179.01 180.39 2vya h LEU 560 N 0.28 0.85 -0.07 3.06 6.46 -1.77 -0.25 115.31 123.86 2vya h LEU 560 Ca 0.04 -0.47 -0.01 0.00 -0.12 0.00 0.00 57.88 57.32 2vya h LEU 560 Cb 0.69 -0.24 -0.00 0.00 -0.73 0.00 0.00 40.66 40.37 2vya h LEU 560 CO 0.05 1.25 0.02 0.00 -0.62 0.00 0.00 178.44 179.14 2vya h LEU 562 N -0.08 0.79 -1.11 0.00 3.38 -0.66 0.29 115.31 117.92 2vya h LEU 562 Ca 0.02 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 2vya h LEU 562 Cb 0.22 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 2vya h LEU 562 CO -0.00 0.52 0.19 -0.09 0.09 0.00 0.00 178.44 179.15 2vya h ARG 563 N 0.90 0.82 -0.09 1.13 1.12 -0.39 0.08 114.38 117.95 2vya h ARG 563 Ca 0.34 -0.14 -0.15 0.00 -1.11 0.00 0.00 59.98 58.92 2vya h ARG 563 Cb 0.19 -0.14 0.01 0.00 -0.01 0.00 0.00 29.97 30.02 2vya h ARG 563 CO -0.12 0.70 -0.53 0.35 -3.11 0.00 0.00 179.97 177.26 2vya h PHE 564 N 0.80 0.71 -0.79 2.20 -0.00 0.04 -2.80 116.94 117.10 2vya h PHE 564 Ca 0.19 -0.32 0.05 0.00 -0.00 0.00 0.00 57.97 57.89 2vya h PHE 564 Cb 0.21 -0.11 -0.06 0.00 -0.00 0.00 0.00 35.95 35.99 2vya h PHE 564 CO 0.01 1.11 0.48 0.52 -0.00 0.00 0.00 178.31 180.43 2vya h MET 565 N 0.12 0.87 -0.58 1.11 2.86 -0.20 -1.66 114.93 117.45 2vya h MET 565 Ca -0.04 -0.05 0.05 0.00 -2.06 0.00 0.00 59.70 57.60 2vya h MET 565 Cb 1.18 -0.20 -0.05 0.00 0.06 0.00 0.00 31.60 32.60 2vya h MET 565 CO 0.11 0.58 0.30 -0.09 1.06 0.00 0.00 176.91 178.87 2vya h ARG 566 N 0.90 0.56 -0.67 1.72 2.43 -0.95 -0.24 114.38 118.12 2vya h ARG 566 Ca 0.34 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.43 2vya h ARG 566 Cb 0.14 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.53 2vya h ARG 566 CO -0.16 0.37 0.22 1.49 -1.51 0.00 0.00 179.97 180.38 2vya h GLU 567 N 0.58 1.04 -0.32 0.20 4.57 -1.13 0.73 114.58 120.24 2vya h GLU 567 Ca 0.26 -0.22 -0.13 0.00 -1.18 0.00 0.00 59.36 58.09 2vya h GLU 567 Cb 0.16 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 2vya h GLU 567 CO -0.17 0.90 -0.34 0.28 -1.18 0.00 0.00 179.01 178.50 2vya h VAL 568 N 0.98 1.28 -0.10 0.32 2.07 -0.88 -1.42 116.25 118.50 2vya h VAL 568 Ca 0.22 -1.48 -0.00 0.00 0.82 0.00 0.00 66.70 66.25 2vya h VAL 568 Cb 0.28 1.40 -0.00 0.00 -1.52 0.00 0.00 31.29 31.44 2vya h VAL 568 CO -0.01 0.48 0.05 -0.08 0.02 0.00 0.00 177.57 178.03 2vya h GLU 569 N 0.60 0.14 -0.18 1.57 4.81 -0.73 -1.86 114.58 118.93 2vya h GLU 569 Ca 0.06 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 2vya h GLU 569 Cb 0.86 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 2vya h GLU 569 CO 0.07 0.21 0.11 0.37 -0.73 0.00 0.00 179.01 179.05 2vya h GLN 570 N 0.03 0.23 -0.27 1.92 -0.00 -0.58 -0.47 115.11 115.98 2vya h GLN 570 Ca 0.03 -0.01 -0.10 0.00 -0.00 0.00 0.00 58.65 58.57 2vya h GLN 570 Cb 0.12 -0.05 -0.00 0.00 0.00 0.00 0.00 27.48 27.54 2vya h GLN 570 CO -0.00 0.15 -0.24 -0.07 0.00 0.00 0.00 178.83 178.67 2vya h LEU 571 N 0.23 0.67 0.10 -2.39 3.38 -1.28 -3.24 115.31 112.79 2vya h LEU 571 Ca 0.07 -0.46 -0.34 0.00 0.09 0.00 0.00 57.88 57.24 2vya h LEU 571 Cb -0.02 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 2vya h LEU 571 CO -0.02 1.00 -1.83 0.24 0.09 0.00 0.00 178.44 177.92 2vya h MET 572 N 0.36 0.21 -2.64 1.13 2.86 -1.24 -3.42 114.93 112.18 2vya h MET 572 Ca 0.05 -0.35 -0.60 0.00 -2.06 0.00 0.00 59.70 56.73 2vya h MET 572 Cb 0.80 0.13 -0.39 0.00 0.06 0.00 0.00 31.60 32.19 2vya h MET 572 CO 0.06 1.03 -0.83 0.95 1.06 0.00 0.00 176.91 179.18 2vya s THR 573 N -2.58 1.23 -2.35 2.22 -4.23 -0.19 -4.94 115.64 104.79 2vya s THR 573 Ca -0.15 -3.14 0.29 0.00 -1.18 0.00 0.00 61.69 57.51 2vya s THR 573 Cb 0.07 -1.83 0.66 0.00 1.34 0.00 0.00 72.50 72.74 2vya s THR 573 CO 0.80 -1.13 1.89 -0.81 -0.54 0.00 0.00 174.62 174.83