#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ito s PHE 4 N 0.00 0.59 0.52 -0.32 0.08 -1.26 -4.90 117.98 112.68 3ito s PHE 4 Ca 0.00 -1.16 0.25 0.00 0.12 0.00 0.00 56.93 56.14 3ito s PHE 4 Cb 0.00 -1.01 1.36 0.00 -0.57 0.00 0.00 43.02 42.80 3ito s PHE 4 CO 0.00 -0.83 1.97 0.00 -0.10 0.00 0.00 175.22 176.26 3ito h ARG 5 N 8.05 0.06 -5.07 0.44 2.47 -1.92 -3.37 114.38 115.03 3ito h ARG 5 Ca -0.13 -0.00 -0.66 0.00 -1.26 0.00 0.00 59.98 57.92 3ito h ARG 5 Cb 1.00 -0.01 -0.30 0.00 -1.65 0.00 0.00 29.97 29.00 3ito h ARG 5 CO 0.41 0.04 -0.78 0.42 0.56 0.00 0.00 179.97 180.61 3ito s ILE 6 N -5.06 2.81 0.09 2.04 -1.09 -1.26 -5.01 121.20 113.72 3ito s ILE 6 Ca -0.05 -0.69 -0.37 0.00 -2.23 0.00 0.00 60.65 57.31 3ito s ILE 6 Cb 0.20 -2.24 -0.17 0.00 -1.58 0.00 0.00 42.46 38.68 3ito s ILE 6 CO 0.74 0.48 1.36 0.00 -1.23 0.00 0.00 174.94 176.29 3ito n ALA 7 N 4.55 -0.84 0.05 9.38 0.00 -1.26 -4.85 120.51 127.54 3ito n ALA 7 Ca -0.19 0.51 0.06 0.00 0.00 0.00 0.00 53.44 53.82 3ito n ALA 7 Cb 0.51 -2.09 0.48 0.00 0.00 0.00 0.00 19.45 18.35 3ito n ALA 7 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3ito h GLN 8 N 4.65 0.40 -0.45 0.00 4.20 -1.98 -2.07 115.11 119.87 3ito h GLN 8 Ca -0.48 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.14 3ito h GLN 8 Cb 1.33 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 29.00 3ito h GLN 8 CO 0.78 0.27 0.00 0.38 -0.67 0.00 0.00 178.83 179.59 3ito h ASP 9 N 0.42 0.69 -0.31 1.46 2.03 -1.99 0.13 116.42 118.85 3ito h ASP 9 Ca 0.13 -0.16 -0.06 0.00 -0.73 0.00 0.00 57.03 56.21 3ito h ASP 9 Cb 0.01 -0.18 -0.01 0.00 -0.83 0.00 0.00 39.33 38.32 3ito h ASP 9 CO -0.03 0.76 -0.04 0.58 -1.03 0.00 0.00 179.24 179.49 3ito h VAL 10 N 0.69 1.27 -0.29 4.15 2.07 -1.75 0.17 116.25 122.56 3ito h VAL 10 Ca 0.14 -1.03 0.00 0.00 0.82 0.00 0.00 66.70 66.63 3ito h VAL 10 Cb 0.42 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 3ito h VAL 10 CO 0.02 0.33 0.19 0.58 0.02 0.00 0.00 177.57 178.71 3ito h VAL 11 N 0.34 1.07 -0.22 2.57 2.07 -1.17 0.47 116.25 121.39 3ito h VAL 11 Ca 0.08 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 3ito h VAL 11 Cb 0.50 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 3ito h VAL 11 CO 0.02 0.07 0.07 0.00 0.02 0.00 0.00 177.57 177.76 3ito h ALA 12 N 1.11 0.28 -0.11 1.67 0.00 -0.87 -1.19 119.26 120.15 3ito h ALA 12 Ca 0.11 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.93 3ito h ALA 12 Cb -0.04 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.62 3ito h ALA 12 CO -0.03 -0.11 -0.18 -0.09 0.00 0.00 0.00 179.25 178.84 3ito h ARG 13 N 0.18 -0.23 0.00 0.00 2.43 -0.36 -0.22 114.38 116.18 3ito h ARG 13 Ca 0.07 0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.24 3ito h ARG 13 Cb 0.21 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.81 3ito h ARG 13 CO -0.00 -0.16 -0.10 0.93 -1.51 0.00 0.00 179.97 179.13 3ito h GLU 14 N -0.24 0.00 0.09 0.20 4.39 -0.84 -2.45 114.58 115.73 3ito h GLU 14 Ca 0.09 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.65 3ito h GLU 14 Cb 0.38 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.04 3ito h GLU 14 CO -0.25 0.10 -0.61 -0.91 -1.16 0.00 0.00 179.01 176.18 3ito h ASN 15 N 0.00 0.37 -0.31 1.42 -0.26 -0.50 -3.27 115.58 113.03 3ito h ASN 15 Ca -0.00 -0.93 -0.01 0.00 -0.56 0.00 0.00 56.30 54.79 3ito h ASN 15 Cb 0.54 -0.12 -0.02 0.00 -1.06 0.00 0.00 38.32 37.66 3ito h ASN 15 CO 0.01 1.28 0.16 0.44 -1.06 0.00 0.00 177.43 178.26 3ito h ASP 16 N -0.47 0.43 0.27 5.81 3.32 -0.98 0.15 116.42 124.95 3ito h ASP 16 Ca -0.10 -0.03 -0.03 0.00 0.02 0.00 0.00 57.03 56.89 3ito h ASP 16 Cb 1.45 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.89 3ito h ASP 16 CO 0.11 0.37 -0.12 -0.09 -1.72 0.00 0.00 179.24 177.80 3ito h ARG 17 N 0.48 0.00 -0.01 3.56 2.43 -1.51 -2.92 114.38 116.42 3ito h ARG 17 Ca 0.12 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 3ito h ARG 17 Cb 0.06 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 3ito h ARG 17 CO -0.02 0.12 -0.08 0.54 -1.51 0.00 0.00 179.97 179.02 3ito n ARG 18 N -3.84 1.35 -0.17 0.20 1.74 -0.73 -4.74 116.66 110.48 3ito n ARG 18 Ca -0.02 -0.66 -0.02 0.00 -0.77 0.00 0.00 57.85 56.38 3ito n ARG 18 Cb 0.22 -1.04 0.07 0.00 -1.02 0.00 0.00 32.46 30.69 3ito n ARG 18 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3ito h ALA 19 N 1.22 0.58 0.04 7.54 0.00 -0.53 -0.89 119.26 127.23 3ito h ALA 19 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3ito h ALA 19 Cb 0.25 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 3ito h ALA 19 CO 0.00 -0.31 -0.04 1.03 0.00 0.00 0.00 179.25 179.94 3ito h SER 20 N 0.24 -0.10 -0.88 0.00 0.87 -1.85 -0.50 113.55 111.34 3ito h SER 20 Ca 0.26 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.82 3ito h SER 20 Cb 0.35 0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 62.31 3ito h SER 20 CO -0.34 -0.06 0.52 0.00 -0.53 0.00 0.00 176.83 176.42 3ito h ALA 21 N 0.87 1.12 -0.19 6.23 0.00 -1.84 -2.43 119.26 123.03 3ito h ALA 21 Ca 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3ito h ALA 21 Cb 0.08 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3ito h ALA 21 CO -0.01 0.59 0.10 1.25 0.00 0.00 0.00 179.25 181.18 3ito h LEU 22 N 1.21 0.24 -1.08 0.00 5.85 -0.84 -1.45 115.31 119.24 3ito h LEU 22 Ca 0.31 -0.10 0.08 0.00 0.84 0.00 0.00 57.88 59.01 3ito h LEU 22 Cb -0.03 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 40.87 3ito h LEU 22 CO -0.06 0.28 0.62 0.50 -0.34 0.00 0.00 178.44 179.44 3ito h LYS 23 N 0.19 1.02 -0.18 1.25 3.64 -0.88 0.37 116.57 121.98 3ito h LYS 23 Ca 0.07 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 3ito h LYS 23 Cb 0.09 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 3ito h LYS 23 CO -0.01 0.67 -0.00 0.93 -2.27 0.00 0.00 179.45 178.77 3ito h GLU 24 N 1.05 0.32 -0.29 1.90 4.39 -1.08 -1.57 114.58 119.30 3ito h GLU 24 Ca 0.43 -0.10 -0.15 0.00 0.34 0.00 0.00 59.36 59.88 3ito h GLU 24 Cb 0.30 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 3ito h GLU 24 CO -0.19 0.54 -0.40 -0.44 -1.16 0.00 0.00 179.01 177.35 3ito h ASP 25 N 0.07 0.76 -0.40 1.42 3.32 -0.66 -1.77 116.42 119.15 3ito h ASP 25 Ca 0.05 -0.35 -0.06 0.00 0.02 0.00 0.00 57.03 56.69 3ito h ASP 25 Cb 0.40 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 3ito h ASP 25 CO 0.01 1.07 0.01 0.22 -1.72 0.00 0.00 179.24 178.83 3ito h TYR 26 N 0.58 0.77 -0.56 4.55 3.20 -0.28 -1.56 116.97 123.68 3ito h TYR 26 Ca 0.05 -0.13 -0.09 0.00 3.14 0.00 0.00 58.73 61.69 3ito h TYR 26 Cb 0.95 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.99 3ito h TYR 26 CO 0.05 0.77 -0.02 0.93 -1.64 0.00 0.00 178.16 178.25 3ito h GLU 27 N 0.54 0.98 0.16 1.82 5.08 -1.24 0.13 114.58 122.06 3ito h GLU 27 Ca 0.12 -0.31 -0.01 0.00 -1.00 0.00 0.00 59.36 58.16 3ito h GLU 27 Cb 0.46 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.62 3ito h GLU 27 CO 0.02 0.98 -0.08 0.00 -1.00 0.00 0.00 179.01 178.93 3ito h ALA 28 N 1.06 -0.22 -0.92 3.43 0.00 -1.19 -1.07 119.26 120.36 3ito h ALA 28 Ca 0.16 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3ito h ALA 28 Cb 0.56 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 3ito h ALA 28 CO 0.03 -0.58 0.57 1.25 0.00 0.00 0.00 179.25 180.52 3ito h LEU 29 N -0.31 1.10 -0.96 0.00 5.85 -1.17 -1.43 115.31 118.39 3ito h LEU 29 Ca -0.02 -0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.68 3ito h LEU 29 Cb 0.24 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 40.94 3ito h LEU 29 CO 0.04 0.83 0.62 1.23 -0.34 0.00 0.00 178.44 180.82 3ito h GLY 30 N 1.26 1.41 0.94 3.75 0.00 -0.45 0.76 103.07 110.74 3ito h GLY 30 Ca 0.33 -0.47 -0.09 0.00 0.00 0.00 0.00 47.33 47.10 3ito h GLY 30 CO -0.06 0.40 -0.15 0.00 0.00 0.00 0.00 176.54 176.73 3ito h ALA 31 N 1.40 0.45 -0.36 3.60 0.00 -0.51 -1.27 119.26 122.57 3ito h ALA 31 Ca 0.39 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3ito h ALA 31 Cb 0.02 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3ito h ALA 31 CO -0.13 0.35 0.20 -0.97 0.00 0.00 0.00 179.25 178.71 3ito h ASN 32 N 0.44 0.45 -0.32 0.00 -0.73 -0.81 -1.34 115.58 113.27 3ito h ASN 32 Ca 0.07 -0.08 -0.04 0.00 1.87 0.00 0.00 56.30 58.12 3ito h ASN 32 Cb 0.67 -0.11 -0.02 0.00 0.27 0.00 0.00 38.32 39.13 3ito h ASN 32 CO 0.05 0.40 0.06 -0.07 -0.37 0.00 0.00 177.43 177.50 3ito h LEU 33 N 0.46 0.57 -0.53 0.34 3.38 -0.80 -2.06 115.31 116.67 3ito h LEU 33 Ca 0.13 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 3ito h LEU 33 Cb 0.05 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 3ito h LEU 33 CO -0.02 0.60 0.15 0.00 0.09 0.00 0.00 178.44 179.26 3ito h ALA 34 N 1.48 0.70 0.00 1.53 0.00 -0.75 0.55 119.26 122.76 3ito h ALA 34 Ca 0.13 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3ito h ALA 34 Cb 0.28 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 3ito h ALA 34 CO 0.00 0.38 -0.02 0.00 0.00 0.00 0.00 179.25 179.61 3ito h ARG 35 N 0.74 0.00 -0.67 0.00 3.08 -0.66 0.12 114.38 116.99 3ito h ARG 35 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 3ito h ARG 35 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 3ito h ARG 35 CO -0.00 0.02 0.00 0.54 -1.07 0.00 0.00 179.97 179.45 3ito n ARG 36 N -3.20 3.06 -2.27 0.04 1.74 -0.30 -4.93 116.66 110.80 3ito n ARG 36 Ca -0.02 -2.56 -0.13 0.00 -0.77 0.00 0.00 57.85 54.37 3ito n ARG 36 Cb 0.16 -1.69 -0.01 0.00 -1.02 0.00 0.00 32.46 29.90 3ito n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ito n GLY 37 N 1.34 -0.18 3.21 -0.13 0.00 0.43 -5.02 105.19 104.84 3ito n GLY 37 Ca 0.23 -0.32 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 3ito n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ito s VAL 38 N -2.68 1.82 -0.57 1.61 1.01 0.18 -4.98 120.40 116.79 3ito s VAL 38 Ca 0.01 -0.92 -0.20 0.00 0.00 0.00 0.00 61.98 60.86 3ito s VAL 38 Cb -0.00 -1.55 0.08 0.00 0.00 0.00 0.00 36.38 34.90 3ito s VAL 38 CO 0.01 0.51 0.74 -0.62 0.00 0.00 0.00 175.10 175.74 3ito s ASP 39 N 0.01 6.20 0.43 3.32 2.15 -1.26 -2.81 116.67 124.71 3ito s ASP 39 Ca -0.06 -1.12 0.23 0.00 0.43 0.00 0.00 52.55 52.02 3ito s ASP 39 Cb -0.14 -2.33 1.21 0.00 -0.30 0.00 0.00 42.92 41.37 3ito s ASP 39 CO 0.04 -1.11 1.76 -0.29 -0.17 0.00 0.00 175.17 175.40 3ito h ILE 40 N 5.92 0.47 -0.87 4.11 2.10 -1.92 0.84 117.51 128.16 3ito h ILE 40 Ca -0.28 -0.10 -0.00 0.00 1.08 0.00 0.00 64.86 65.55 3ito h ILE 40 Cb 1.09 0.15 -0.04 0.00 -1.09 0.00 0.00 36.82 36.92 3ito h ILE 40 CO 1.07 0.05 0.52 -0.08 -1.08 0.00 0.00 178.15 178.64 3ito h GLU 41 N 0.29 1.18 -0.31 2.19 4.57 -1.98 -0.64 114.58 119.89 3ito h GLU 41 Ca 0.61 -0.11 -0.05 0.00 -1.18 0.00 0.00 59.36 58.63 3ito h GLU 41 Cb 1.74 -0.25 -0.02 0.00 -0.16 0.00 0.00 28.75 30.06 3ito h GLU 41 CO -0.26 0.83 -0.04 0.00 -1.18 0.00 0.00 179.01 178.36 3ito h ALA 42 N 1.28 1.36 -0.06 2.92 0.00 -1.25 -0.72 119.26 122.79 3ito h ALA 42 Ca 0.31 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 3ito h ALA 42 Cb -0.05 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 3ito h ALA 42 CO -0.06 0.44 -0.11 0.28 0.00 0.00 0.00 179.25 179.80 3ito h VAL 43 N 0.46 1.41 -0.94 0.00 2.07 -1.26 -2.92 116.25 115.07 3ito h VAL 43 Ca 0.10 -1.38 0.03 0.00 0.82 0.00 0.00 66.70 66.26 3ito h VAL 43 Cb 0.37 2.17 -0.05 0.00 -1.52 0.00 0.00 31.29 32.26 3ito h VAL 43 CO 0.02 0.38 0.62 0.74 0.02 0.00 0.00 177.57 179.35 3ito h THR 44 N -0.29 1.18 -0.89 2.57 2.02 -0.94 -1.24 112.91 115.31 3ito h THR 44 Ca 0.00 -0.41 -0.00 0.00 0.77 0.00 0.00 66.41 66.77 3ito h THR 44 Cb 0.68 -0.13 -0.04 0.00 -1.74 0.00 0.00 68.15 66.91 3ito h THR 44 CO 0.02 0.22 0.55 0.00 0.37 0.00 0.00 175.52 176.69 3ito h ALA 45 N 1.44 1.29 -0.03 6.16 0.00 -1.11 -1.56 119.26 125.44 3ito h ALA 45 Ca 0.37 -0.09 -0.25 0.00 0.00 0.00 0.00 54.91 54.93 3ito h ALA 45 Cb -0.03 -0.36 0.02 0.00 0.00 0.00 0.00 17.79 17.42 3ito h ALA 45 CO -0.10 0.62 -0.97 0.87 0.00 0.00 0.00 179.25 179.67 3ito h LYS 46 N 1.23 0.67 -0.58 0.00 1.57 -1.21 -3.27 116.57 114.98 3ito h LYS 46 Ca 0.32 -0.68 0.03 0.00 -1.87 0.00 0.00 60.65 58.45 3ito h LYS 46 Cb -0.07 0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.39 3ito h LYS 46 CO -0.06 1.27 0.35 0.28 -0.57 0.00 0.00 179.45 180.73 3ito h VAL 47 N 0.40 1.07 -0.20 0.50 2.07 -0.93 -1.29 116.25 117.86 3ito h VAL 47 Ca -0.11 -0.24 0.06 0.00 0.82 0.00 0.00 66.70 67.23 3ito h VAL 47 Cb 1.62 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 3ito h VAL 47 CO 0.19 0.13 0.20 -0.33 0.02 0.00 0.00 177.57 177.78 3ito h GLU 48 N 0.70 0.00 -0.20 1.57 5.08 -1.34 -1.39 114.58 119.00 3ito h GLU 48 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 3ito h GLU 48 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3ito h GLU 48 CO -0.10 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.54 3ito n LYS 49 N -3.90 2.28 -3.19 2.33 5.02 -0.52 -4.90 118.16 115.27 3ito n LYS 49 Ca 0.02 -1.90 -0.39 0.00 -2.02 0.00 0.00 58.31 54.01 3ito n LYS 49 Cb 0.33 -1.48 -0.06 0.00 -0.02 0.00 0.00 35.03 33.80 3ito n LYS 49 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 3ito s PHE 50 N -1.76 3.39 0.08 2.13 2.19 -0.53 -5.05 117.98 118.43 3ito s PHE 50 Ca 0.34 0.86 0.08 0.00 0.33 0.00 0.00 56.93 58.54 3ito s PHE 50 Cb 0.21 -2.71 -0.03 0.00 -1.31 0.00 0.00 43.02 39.17 3ito s PHE 50 CO 0.31 -0.10 -0.21 -0.06 1.83 0.00 0.00 175.22 176.99 3ito s PHE 51 N 1.62 1.81 -0.04 10.12 0.08 -1.26 -4.75 117.98 125.56 3ito s PHE 51 Ca 0.27 -0.40 0.01 0.00 0.12 0.00 0.00 56.93 56.93 3ito s PHE 51 Cb -0.16 -1.02 0.02 0.00 -0.57 0.00 0.00 43.02 41.29 3ito s PHE 51 CO 0.10 0.16 -0.05 0.54 -0.10 0.00 0.00 175.22 175.88 3ito s VAL 52 N -1.02 0.52 0.49 -0.44 0.11 -0.37 -4.78 120.40 114.91 3ito s VAL 52 Ca 0.07 -0.13 -0.22 0.00 -2.93 0.00 0.00 61.98 58.77 3ito s VAL 52 Cb -0.10 -0.54 -0.07 0.00 -1.53 0.00 0.00 36.38 34.15 3ito s VAL 52 CO 0.03 0.22 1.17 0.00 -3.33 0.00 0.00 175.10 173.19 3ito s ALA 53 N 0.81 2.88 -0.11 1.54 0.00 -0.03 -4.25 121.76 122.61 3ito s ALA 53 Ca -0.11 0.94 -0.02 0.00 0.00 0.00 0.00 51.96 52.77 3ito s ALA 53 Cb -0.14 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.56 3ito s ALA 53 CO 0.00 -0.75 -0.02 0.54 0.00 0.00 0.00 175.76 175.53 3ito s VAL 54 N -1.59 4.07 -0.00 0.00 0.11 -0.58 -0.84 120.40 121.57 3ito s VAL 54 Ca 0.67 -0.32 -0.30 0.00 -2.93 0.00 0.00 61.98 59.10 3ito s VAL 54 Cb -0.28 -2.73 -0.03 0.00 -1.53 0.00 0.00 36.38 31.80 3ito s VAL 54 CO 0.34 0.56 1.05 -2.16 -3.33 0.00 0.00 175.10 171.56 3ito s PRO 55 N -0.41 4.50 0.42 1.54 0.04 -1.25 -0.57 135.00 139.26 3ito s PRO 55 Ca 0.07 1.51 0.11 0.00 0.04 0.00 0.00 61.00 62.73 3ito s PRO 55 Cb -0.12 -3.45 0.94 0.00 0.04 0.00 0.00 34.50 31.90 3ito s PRO 55 CO 0.02 -0.16 2.00 0.66 0.04 0.00 0.00 177.00 179.56 3ito h SER 56 N 6.89 0.44 0.10 6.66 4.64 -1.69 0.38 113.55 130.97 3ito h SER 56 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 3ito h SER 56 Cb 1.20 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 3ito h SER 56 CO 0.79 0.29 -0.00 -2.67 -0.87 0.00 0.00 176.83 174.36 3ito n TRP 57 N -4.47 0.00 0.39 4.77 2.14 -1.26 -3.59 117.44 115.41 3ito n TRP 57 Ca 0.08 0.00 0.12 0.00 2.07 0.00 0.00 57.50 59.77 3ito n TRP 57 Cb 0.26 -0.05 0.16 0.00 -0.81 0.00 0.00 31.31 30.87 3ito n TRP 57 CO 0.00 0.00 0.00 0.78 2.07 0.00 0.00 177.69 180.54 3ito h GLY 58 N 4.99 0.00 0.16 -1.67 0.00 -1.21 -3.31 103.07 102.04 3ito h GLY 58 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3ito h GLY 58 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 176.54 179.87 3ito n VAL 59 N -2.48 0.02 -4.01 4.60 0.24 -1.24 -4.75 118.33 110.72 3ito n VAL 59 Ca 0.03 -0.14 -0.27 0.00 -2.04 0.00 0.00 64.34 61.92 3ito n VAL 59 Cb 0.49 0.03 -0.04 0.00 -1.47 0.00 0.00 33.84 32.84 3ito n VAL 59 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3ito s GLY 60 N -1.92 1.79 0.11 7.63 0.00 -1.25 -4.67 107.32 109.01 3ito s GLY 60 Ca 0.40 -1.08 -0.30 0.00 0.00 0.00 0.00 44.72 43.74 3ito s GLY 60 CO 0.33 -1.08 1.23 -1.59 0.00 0.00 0.00 173.10 171.98 3ito s THR 61 N -1.69 3.75 0.71 0.90 2.01 -1.26 -4.61 115.64 115.45 3ito s THR 61 Ca 0.33 1.33 0.02 0.00 0.31 0.00 0.00 61.69 63.68 3ito s THR 61 Cb -0.11 -3.85 0.14 0.00 0.01 0.00 0.00 72.50 68.68 3ito s THR 61 CO 0.26 0.14 0.98 -0.83 -0.69 0.00 0.00 174.62 174.48 3ito s GLY 62 N 0.72 1.73 0.19 4.40 0.00 -0.39 -4.92 107.32 109.05 3ito s GLY 62 Ca 0.57 -1.98 -0.04 0.00 0.00 0.00 0.00 44.72 43.27 3ito s GLY 62 CO 0.32 -1.38 0.33 0.61 0.00 0.00 0.00 173.10 172.98 3ito n GLY 63 N -2.74 2.01 3.44 0.20 0.00 -1.26 -4.37 105.19 102.46 3ito n GLY 63 Ca 0.17 -1.30 -0.31 0.00 0.00 0.00 0.00 46.02 44.58 3ito n GLY 63 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ito n THR 64 N -0.28 0.00 0.37 2.61 -2.24 -0.49 -5.01 114.28 109.24 3ito n THR 64 Ca -0.02 -2.26 0.11 0.00 -2.27 0.00 0.00 64.05 59.61 3ito n THR 64 Cb 0.30 0.44 0.48 0.00 -2.10 0.00 0.00 70.33 69.44 3ito n THR 64 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 3ito n ARG 65 N -1.21 0.17 -0.00 -0.78 1.85 -1.26 -2.87 116.66 112.56 3ito n ARG 65 Ca -0.19 0.44 -0.11 0.00 -1.00 0.00 0.00 57.85 56.98 3ito n ARG 65 Cb 0.61 -1.84 -0.14 0.00 -1.05 0.00 0.00 32.46 30.03 3ito n ARG 65 CO 0.00 0.00 0.00 0.74 -0.01 0.00 0.00 177.63 178.36 3ito h PHE 66 N 0.00 0.13 -1.57 2.89 0.04 -1.92 -2.01 116.94 114.49 3ito h PHE 66 Ca 0.00 -0.09 0.29 0.00 2.80 0.00 0.00 57.97 60.96 3ito h PHE 66 Cb 0.30 -0.01 -0.14 0.00 2.20 0.00 0.00 35.95 38.31 3ito h PHE 66 CO 0.00 1.17 0.78 0.00 -0.60 0.00 0.00 178.31 179.66 3ito s ALA 67 N -2.60 -2.12 -0.03 2.45 0.00 -1.14 -2.92 121.76 115.39 3ito s ALA 67 Ca -0.08 0.89 -0.01 0.00 0.00 0.00 0.00 51.96 52.77 3ito s ALA 67 Cb 0.08 0.26 0.03 0.00 0.00 0.00 0.00 23.12 23.49 3ito s ALA 67 CO 0.82 -0.92 0.05 0.50 0.00 0.00 0.00 175.76 176.21 3ito s ARG 68 N -2.53 -0.05 -0.73 0.00 3.52 -0.00 -1.39 118.95 117.77 3ito s ARG 68 Ca 0.12 0.27 0.04 0.00 -0.13 0.00 0.00 55.73 56.03 3ito s ARG 68 Cb 0.03 -0.33 0.20 0.00 -1.56 0.00 0.00 34.95 33.29 3ito s ARG 68 CO -0.04 -0.22 0.63 1.19 -0.81 0.00 0.00 175.30 176.05 3ito n PHE 69 N 4.56 3.49 -1.59 5.12 3.72 -1.26 -2.31 117.46 129.19 3ito n PHE 69 Ca -0.20 -4.21 -0.37 0.00 -0.05 0.00 0.00 57.45 52.63 3ito n PHE 69 Cb 0.50 -0.70 0.07 0.00 -0.94 0.00 0.00 39.48 38.41 3ito n PHE 69 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 3ito n PRO 70 N 1.70 0.86 -0.00 -1.08 -0.04 -1.26 -4.99 135.00 130.19 3ito n PRO 70 Ca 0.23 0.35 0.00 0.00 -0.04 0.00 0.00 63.50 64.03 3ito n PRO 70 Cb 0.37 -2.33 0.00 0.00 -0.04 0.00 0.00 33.50 31.49 3ito n PRO 70 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ito n GLY 71 N 1.08 1.31 3.92 0.55 0.00 -1.26 -4.94 105.19 105.85 3ito n GLY 71 Ca 0.15 -1.95 -0.28 0.00 0.00 0.00 0.00 46.02 43.94 3ito n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ito s THR 72 N 1.55 5.15 -1.22 2.61 -4.23 -1.26 -4.38 115.64 113.86 3ito s THR 72 Ca 0.00 -0.23 -0.03 0.00 -1.18 0.00 0.00 61.69 60.26 3ito s THR 72 Cb 0.00 -3.73 0.00 0.00 1.34 0.00 0.00 72.50 70.11 3ito s THR 72 CO 0.00 -0.21 0.36 0.61 -0.54 0.00 0.00 174.62 174.84 3ito n GLY 73 N -0.71 -0.24 3.75 3.99 0.00 -1.26 -4.74 105.19 105.97 3ito n GLY 73 Ca -0.04 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 3ito n GLY 73 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ito s GLU 74 N -5.28 4.25 0.23 1.61 0.41 -1.26 -4.73 118.70 113.93 3ito s GLU 74 Ca 0.18 2.34 -0.30 0.00 -0.41 0.00 0.00 54.97 56.78 3ito s GLU 74 Cb -0.08 -3.09 -0.10 0.00 -1.78 0.00 0.00 34.13 29.08 3ito s GLU 74 CO 0.22 -0.44 1.46 -1.25 -0.49 0.00 0.00 175.26 174.76 3ito s PRO 75 N -0.55 4.26 0.22 0.39 0.04 -1.26 -4.81 135.00 133.29 3ito s PRO 75 Ca 0.59 2.30 0.05 0.00 0.04 0.00 0.00 61.00 63.98 3ito s PRO 75 Cb -0.43 -3.12 0.17 0.00 0.04 0.00 0.00 34.50 31.16 3ito s PRO 75 CO 0.45 -0.45 1.50 0.00 0.04 0.00 0.00 177.00 178.54 3ito h ARG 76 N 5.43 0.15 0.00 4.56 3.08 -1.93 -3.48 114.38 122.19 3ito h ARG 76 Ca -0.45 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.47 3ito h ARG 76 Cb 1.21 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.29 3ito h ARG 76 CO 0.80 0.80 0.00 0.41 -1.07 0.00 0.00 179.97 180.91 3ito n GLY 77 N 0.51 1.97 0.36 0.04 0.00 -1.26 -5.03 105.19 101.78 3ito n GLY 77 Ca -0.02 -0.80 0.08 0.00 0.00 0.00 0.00 46.02 45.27 3ito n GLY 77 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3ito h ILE 78 N 0.40 0.90 -0.49 -0.61 6.09 -1.91 -0.81 117.51 121.08 3ito h ILE 78 Ca 0.00 -0.33 -0.08 0.00 -1.37 0.00 0.00 64.86 63.08 3ito h ILE 78 Cb 0.00 -0.15 -0.02 0.00 0.47 0.00 0.00 36.82 37.12 3ito h ILE 78 CO 0.00 0.18 -0.01 -0.26 -3.07 0.00 0.00 178.15 174.98 3ito h PHE 79 N 0.96 0.96 -0.43 2.19 0.04 -1.97 0.17 116.94 118.87 3ito h PHE 79 Ca 0.50 -0.17 -0.10 0.00 2.80 0.00 0.00 57.97 61.00 3ito h PHE 79 Cb 0.53 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 38.42 3ito h PHE 79 CO -0.00 0.90 -0.13 -0.44 -0.60 0.00 0.00 178.31 178.04 3ito h ASP 80 N 0.73 0.78 -0.66 2.17 3.32 -1.84 -2.09 116.42 118.84 3ito h ASP 80 Ca 0.14 -0.24 -0.04 0.00 0.02 0.00 0.00 57.03 56.91 3ito h ASP 80 Cb 0.53 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.84 3ito h ASP 80 CO 0.03 0.93 0.26 0.11 -1.72 0.00 0.00 179.24 178.84 3ito h LYS 81 N 0.70 0.98 -0.73 3.56 1.57 -0.72 -1.85 116.57 120.08 3ito h LYS 81 Ca 0.11 -0.18 -0.06 0.00 -1.87 0.00 0.00 60.65 58.65 3ito h LYS 81 Cb 0.62 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.74 3ito h LYS 81 CO 0.04 0.83 0.22 -0.07 -0.57 0.00 0.00 179.45 179.90 3ito h LEU 82 N 0.93 1.07 -0.84 2.94 3.38 -0.44 -0.34 115.31 122.01 3ito h LEU 82 Ca 0.22 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3ito h LEU 82 Cb 0.21 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 3ito h LEU 82 CO -0.02 1.00 0.53 0.44 0.09 0.00 0.00 178.44 180.49 3ito h ASP 83 N 1.10 0.98 -0.07 -0.43 3.32 -0.93 -0.86 116.42 119.52 3ito h ASP 83 Ca 0.24 -0.04 -0.16 0.00 0.02 0.00 0.00 57.03 57.08 3ito h ASP 83 Cb 0.32 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 3ito h ASP 83 CO -0.01 0.73 -0.51 0.44 -1.72 0.00 0.00 179.24 178.17 3ito h ASP 84 N 1.14 0.71 -0.10 6.45 3.32 -1.00 -2.88 116.42 124.05 3ito h ASP 84 Ca 0.30 -0.36 -0.04 0.00 0.02 0.00 0.00 57.03 56.95 3ito h ASP 84 Cb -0.09 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.24 3ito h ASP 84 CO -0.06 1.09 -0.04 0.00 -1.72 0.00 0.00 179.24 178.51 3ito h ALA 86 N 1.64 1.73 -0.25 0.00 0.00 -0.95 -1.91 119.26 119.52 3ito h ALA 86 Ca 0.07 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3ito h ALA 86 Cb 0.29 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3ito h ALA 86 CO 0.01 0.21 -0.02 0.28 0.00 0.00 0.00 179.25 179.73 3ito h VAL 87 N 0.17 1.27 -0.42 0.00 2.07 -1.32 0.18 116.25 118.20 3ito h VAL 87 Ca 0.04 -0.96 0.02 0.00 0.82 0.00 0.00 66.70 66.62 3ito h VAL 87 Cb 0.18 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 3ito h VAL 87 CO 0.01 0.30 0.24 0.40 0.02 0.00 0.00 177.57 178.54 3ito h ILE 88 N 0.22 1.03 -0.17 4.57 2.04 -1.30 -1.31 117.51 122.60 3ito h ILE 88 Ca 0.07 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 3ito h ILE 88 Cb 0.45 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 3ito h ILE 88 CO 0.02 0.09 0.04 -0.61 0.00 0.00 0.00 178.15 177.68 3ito h GLN 89 N 0.49 0.27 -0.57 2.37 5.75 -1.27 -0.60 115.11 121.55 3ito h GLN 89 Ca 0.17 -0.07 0.06 0.00 -0.15 0.00 0.00 58.65 58.66 3ito h GLN 89 Cb 0.02 -0.03 -0.05 0.00 1.07 0.00 0.00 27.48 28.48 3ito h GLN 89 CO -0.08 0.42 0.27 0.37 -2.65 0.00 0.00 178.83 177.16 3ito h GLN 90 N 0.07 0.50 0.10 1.69 4.15 -0.72 0.67 115.11 121.57 3ito h GLN 90 Ca 0.05 -0.03 -0.26 0.00 0.77 0.00 0.00 58.65 59.18 3ito h GLN 90 Cb 0.28 -0.11 0.03 0.00 0.21 0.00 0.00 27.48 27.88 3ito h GLN 90 CO 0.00 0.33 -1.07 -0.07 -1.93 0.00 0.00 178.83 176.09 3ito h LEU 91 N 0.51 0.76 0.00 -2.39 3.38 -1.19 -3.36 115.31 113.03 3ito h LEU 91 Ca 0.26 -0.83 -0.27 0.00 0.09 0.00 0.00 57.88 57.13 3ito h LEU 91 Cb 0.22 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 3ito h LEU 91 CO -0.20 1.52 -1.93 0.35 0.09 0.00 0.00 178.44 178.27 3ito n THR 92 N -3.92 1.29 -1.48 0.22 -2.24 -0.24 -0.89 114.28 107.02 3ito n THR 92 Ca -0.13 -0.77 -0.17 0.00 -2.27 0.00 0.00 64.05 60.71 3ito n THR 92 Cb 0.91 -0.66 -0.07 0.00 -2.10 0.00 0.00 70.33 68.41 3ito n THR 92 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3ito n ARG 93 N -2.83 -1.46 0.00 -0.78 5.12 0.23 -4.75 116.66 112.20 3ito n ARG 93 Ca -0.20 1.08 0.05 0.00 -1.93 0.00 0.00 57.85 56.84 3ito n ARG 93 Cb 1.00 -5.43 0.03 0.00 -1.16 0.00 0.00 32.46 26.91 3ito n ARG 93 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3ito n ALA 94 N 1.31 2.53 -3.03 7.54 0.00 -1.26 -4.76 120.51 122.84 3ito n ALA 94 Ca -0.17 -0.55 -0.22 0.00 0.00 0.00 0.00 53.44 52.51 3ito n ALA 94 Cb 0.62 -0.32 -0.03 0.00 0.00 0.00 0.00 19.45 19.72 3ito n ALA 94 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3ito n THR 95 N 0.40 1.33 0.29 0.00 -2.24 -1.26 -1.24 114.28 111.57 3ito n THR 95 Ca 0.05 -4.93 0.14 0.00 -2.27 0.00 0.00 64.05 57.04 3ito n THR 95 Cb 0.23 -0.72 0.68 0.00 -2.10 0.00 0.00 70.33 68.42 3ito n THR 95 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3ito h PRO 96 N 2.97 0.00 -6.45 -0.78 0.13 -1.86 -3.40 132.00 122.62 3ito h PRO 96 Ca 0.11 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.58 3ito h PRO 96 Cb 0.79 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 31.63 3ito h PRO 96 CO 0.65 0.00 -0.87 -0.80 -0.23 0.00 0.00 178.00 176.74 3ito s ASN 97 N -4.59 2.87 -0.01 1.44 0.01 -1.26 -0.02 114.94 113.38 3ito s ASN 97 Ca -0.00 -0.49 0.02 0.00 -0.71 0.00 0.00 52.86 51.68 3ito s ASN 97 Cb 0.09 -0.29 -0.03 0.00 0.41 0.00 0.00 41.25 41.42 3ito s ASN 97 CO 0.36 0.26 -0.04 -0.69 -1.51 0.00 0.00 177.10 175.48 3ito s VAL 98 N -0.67 3.86 -0.25 1.60 1.01 -0.15 -1.52 120.40 124.28 3ito s VAL 98 Ca 0.10 -0.67 -0.08 0.00 0.00 0.00 0.00 61.98 61.33 3ito s VAL 98 Cb -0.09 -2.68 -0.03 0.00 0.00 0.00 0.00 36.38 33.57 3ito s VAL 98 CO 0.00 0.41 0.09 -0.55 0.00 0.00 0.00 175.10 175.06 3ito s SER 99 N -1.40 5.38 0.27 3.32 0.15 0.27 -0.34 113.70 121.34 3ito s SER 99 Ca 0.17 -0.13 -0.11 0.00 0.70 0.00 0.00 55.95 56.59 3ito s SER 99 Cb -0.11 -1.97 -0.07 0.00 -1.71 0.00 0.00 66.02 62.15 3ito s SER 99 CO 0.08 -0.01 0.61 -0.76 1.20 0.00 0.00 173.24 174.36 3ito s LEU 100 N 1.49 4.11 -0.10 3.45 1.02 -1.25 -1.65 118.68 125.75 3ito s LEU 100 Ca 0.06 1.01 0.02 0.00 0.02 0.00 0.00 54.13 55.24 3ito s LEU 100 Cb -0.15 -3.80 0.01 0.00 0.02 0.00 0.00 46.19 42.27 3ito s LEU 100 CO 0.05 -0.14 -0.15 -2.28 0.02 0.00 0.00 176.35 173.85 3ito s HIS 101 N -1.92 1.90 -0.02 0.29 2.46 -1.26 -1.09 115.29 115.64 3ito s HIS 101 Ca 0.49 -0.87 0.01 0.00 0.47 0.00 0.00 55.06 55.16 3ito s HIS 101 Cb -0.11 -1.38 -0.04 0.00 -0.13 0.00 0.00 32.58 30.93 3ito s HIS 101 CO 0.22 -0.45 0.01 0.42 -2.47 0.00 0.00 174.74 172.46 3ito s ILE 102 N 0.96 4.24 -1.53 0.89 -1.09 -0.38 0.32 121.20 124.61 3ito s ILE 102 Ca -0.07 -0.50 0.30 0.00 -2.23 0.00 0.00 60.65 58.14 3ito s ILE 102 Cb -0.15 -2.87 0.58 0.00 -1.58 0.00 0.00 42.46 38.44 3ito s ILE 102 CO -0.01 0.42 2.05 -0.81 -1.23 0.00 0.00 174.94 175.36 3ito n PRO 103 N 1.54 0.52 -0.25 2.79 -0.04 -1.26 -2.40 135.00 135.89 3ito n PRO 103 Ca -0.15 0.01 0.03 0.00 -0.04 0.00 0.00 63.50 63.34 3ito n PRO 103 Cb 0.53 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.60 3ito n PRO 103 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3ito h TRP 104 N 0.00 -0.23 -0.51 0.54 6.55 -1.91 -1.22 115.95 119.16 3ito h TRP 104 Ca 0.00 0.06 0.00 0.00 0.95 0.00 0.00 58.89 59.90 3ito h TRP 104 Cb 0.23 0.22 0.00 0.00 -0.86 0.00 0.00 29.16 28.74 3ito h TRP 104 CO 0.00 -0.28 0.00 -0.25 -1.05 0.00 0.00 178.44 176.86 3ito n ASP 105 N -5.42 4.84 -4.73 -3.49 8.00 0.15 -4.66 116.55 111.25 3ito n ASP 105 Ca 0.11 -2.69 -0.42 0.00 0.71 0.00 0.00 54.79 52.50 3ito n ASP 105 Cb 0.41 -0.63 -0.03 0.00 -0.02 0.00 0.00 41.12 40.85 3ito n ASP 105 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3ito s LYS 106 N -2.33 4.15 0.02 -1.24 2.20 -0.46 -4.92 119.74 117.15 3ito s LYS 106 Ca 0.46 2.54 -0.29 0.00 -0.36 0.00 0.00 55.97 58.32 3ito s LYS 106 Cb 0.34 -3.08 0.11 0.00 -1.51 0.00 0.00 37.83 33.69 3ito s LYS 106 CO 0.16 -0.68 1.22 0.00 -0.36 0.00 0.00 175.35 175.69 3ito s ALA 107 N 0.86 -2.13 -0.10 3.13 0.00 -1.26 -5.00 121.76 117.25 3ito s ALA 107 Ca 0.71 0.51 -0.30 0.00 0.00 0.00 0.00 51.96 52.87 3ito s ALA 107 Cb -0.48 0.46 -0.08 0.00 0.00 0.00 0.00 23.12 23.02 3ito s ALA 107 CO 0.36 -1.06 2.06 -3.47 0.00 0.00 0.00 175.76 173.65 3ito n ASP 108 N -0.56 3.60 -0.34 0.00 2.03 -1.26 -4.84 116.55 115.18 3ito n ASP 108 Ca -0.07 0.64 0.18 0.00 0.52 0.00 0.00 54.79 56.05 3ito n ASP 108 Cb 0.62 -1.49 0.40 0.00 -0.72 0.00 0.00 41.12 39.93 3ito n ASP 108 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3ito h PRO 109 N 12.04 0.57 -0.22 -0.67 0.11 -1.94 -0.29 132.00 141.60 3ito h PRO 109 Ca -0.45 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 3ito h PRO 109 Cb 1.25 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 3ito h PRO 109 CO 0.95 0.38 0.14 0.87 -0.21 0.00 0.00 178.00 180.13 3ito h LYS 110 N 0.58 0.30 -0.16 1.05 1.57 -1.88 -1.62 116.57 116.41 3ito h LYS 110 Ca 0.61 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 59.37 3ito h LYS 110 Cb 1.20 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 3ito h LYS 110 CO -0.40 0.23 0.10 0.93 -0.57 0.00 0.00 179.45 179.74 3ito h GLU 111 N 0.28 0.22 -0.06 3.15 5.08 -1.46 0.63 114.58 122.42 3ito h GLU 111 Ca 0.08 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.46 3ito h GLU 111 Cb 0.00 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.15 3ito h GLU 111 CO -0.02 0.19 -0.29 -0.07 -1.00 0.00 0.00 179.01 177.82 3ito h LEU 112 N 0.19 -0.89 -0.86 1.33 3.38 -1.18 0.33 115.31 117.61 3ito h LEU 112 Ca 0.06 0.13 0.05 0.00 0.09 0.00 0.00 57.88 58.20 3ito h LEU 112 Cb 0.02 0.37 -0.06 0.00 0.09 0.00 0.00 40.66 41.08 3ito h LEU 112 CO -0.01 -0.35 0.54 0.50 0.09 0.00 0.00 178.44 179.21 3ito h LYS 113 N -0.41 0.99 -0.39 1.13 1.63 -1.14 0.13 116.57 118.52 3ito h LYS 113 Ca 0.08 -0.06 -0.03 0.00 -0.85 0.00 0.00 60.65 59.79 3ito h LYS 113 Cb 0.52 -0.22 -0.02 0.00 -0.60 0.00 0.00 32.23 31.91 3ito h LYS 113 CO -0.29 0.66 0.12 0.00 -3.45 0.00 0.00 179.45 176.49 3ito h ALA 114 N 1.38 0.51 -0.54 5.00 0.00 0.05 -0.80 119.26 124.85 3ito h ALA 114 Ca 0.36 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 3ito h ALA 114 Cb 0.09 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3ito h ALA 114 CO -0.14 0.15 -0.10 -0.09 0.00 0.00 0.00 179.25 179.07 3ito h ARG 115 N 0.48 1.02 -0.22 0.00 9.65 0.12 -2.33 114.38 123.10 3ito h ARG 115 Ca 0.12 -0.38 -0.00 0.00 -1.10 0.00 0.00 59.98 58.63 3ito h ARG 115 Cb 0.26 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.77 3ito h ARG 115 CO -0.00 1.06 0.13 0.78 2.80 0.00 0.00 179.97 184.74 3ito h GLY 116 N 0.90 0.31 0.97 2.80 0.00 -0.55 -1.53 103.07 105.97 3ito h GLY 116 Ca 0.14 -0.12 0.02 0.00 0.00 0.00 0.00 47.33 47.36 3ito h GLY 116 CO 0.05 0.12 0.59 -0.55 0.00 0.00 0.00 176.54 176.74 3ito h ASP 117 N 0.27 1.00 0.29 0.19 3.32 -1.06 0.29 116.42 120.72 3ito h ASP 117 Ca 0.08 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.03 3ito h ASP 117 Cb 0.00 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 3ito h ASP 117 CO -0.02 0.71 -0.34 0.00 -1.72 0.00 0.00 179.24 177.88 3ito h ALA 118 N 1.34 1.37 -0.00 3.45 0.00 -1.16 -2.69 119.26 121.57 3ito h ALA 118 Ca 0.34 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3ito h ALA 118 Cb -0.09 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.63 3ito h ALA 118 CO -0.09 0.46 -0.43 1.28 0.00 0.00 0.00 179.25 180.48 3ito n LEU 119 N -4.12 0.78 -0.59 0.00 4.77 -0.60 -3.04 117.00 114.21 3ito n LEU 119 Ca -0.02 -0.15 -0.03 0.00 -0.03 0.00 0.00 56.01 55.78 3ito n LEU 119 Cb 0.39 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 3ito n LEU 119 CO 0.39 0.17 -0.00 0.61 -1.33 0.00 0.00 177.39 177.23 3ito n GLY 120 N 1.43 0.51 3.30 -0.72 0.00 0.15 -4.91 105.19 104.96 3ito n GLY 120 Ca 0.08 -0.67 -0.28 0.00 0.00 0.00 0.00 46.02 45.15 3ito n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ito s LEU 121 N -1.27 2.17 0.00 0.99 1.43 0.77 -4.89 118.68 117.88 3ito s LEU 121 Ca 0.04 -0.56 0.04 0.00 -1.03 0.00 0.00 54.13 52.62 3ito s LEU 121 Cb -0.02 -1.14 0.04 0.00 0.03 0.00 0.00 46.19 45.11 3ito s LEU 121 CO 0.05 0.21 0.31 0.61 0.23 0.00 0.00 176.35 177.76 3ito n GLY 122 N 1.81 2.70 3.01 -3.19 0.00 0.97 -3.91 105.19 106.58 3ito n GLY 122 Ca -0.17 -2.25 -0.30 0.00 0.00 0.00 0.00 46.02 43.31 3ito n GLY 122 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ito s PHE 123 N -1.72 2.13 0.00 1.61 0.08 -1.26 -0.98 117.98 117.83 3ito s PHE 123 Ca 0.24 -1.19 0.00 0.00 0.12 0.00 0.00 56.93 56.09 3ito s PHE 123 Cb -0.02 -1.57 0.00 0.00 -0.57 0.00 0.00 43.02 40.86 3ito s PHE 123 CO 0.15 -0.66 0.00 -3.47 -0.10 0.00 0.00 175.22 171.14 3ito n ASP 124 N 4.78 0.00 -4.68 1.36 -0.08 0.54 -4.06 116.55 114.41 3ito n ASP 124 Ca -0.17 0.00 -0.43 0.00 -1.51 0.00 0.00 54.79 52.68 3ito n ASP 124 Cb 0.50 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.95 3ito n ASP 124 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3ito n ALA 125 N -3.00 1.17 -1.82 -1.67 0.00 -1.26 -4.55 120.51 109.38 3ito n ALA 125 Ca 0.00 0.38 -0.33 0.00 0.00 0.00 0.00 53.44 53.49 3ito n ALA 125 Cb 0.00 -2.25 -0.07 0.00 0.00 0.00 0.00 19.45 17.14 3ito n ALA 125 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3ito s MET 126 N -1.43 4.19 -0.11 0.00 -1.94 0.13 -3.74 119.30 116.40 3ito s MET 126 Ca 0.59 1.15 0.01 0.00 -1.71 0.00 0.00 55.69 55.74 3ito s MET 126 Cb -0.60 -2.19 0.02 0.00 2.01 0.00 0.00 34.83 34.07 3ito s MET 126 CO 0.58 -0.07 -0.14 -0.80 -0.01 0.00 0.00 175.02 174.58 3ito s ASN 127 N -2.14 2.40 0.38 3.03 0.01 -0.25 0.34 114.94 118.72 3ito s ASN 127 Ca 0.62 -0.42 -0.04 0.00 -0.71 0.00 0.00 52.86 52.32 3ito s ASN 127 Cb -0.10 -1.06 -0.04 0.00 0.41 0.00 0.00 41.25 40.46 3ito s ASN 127 CO 0.14 -0.00 0.65 -0.94 -1.51 0.00 0.00 177.10 175.44 3ito s SER 128 N 1.08 6.34 -0.33 -1.22 1.04 -1.14 -1.25 113.70 118.21 3ito s SER 128 Ca -0.05 0.74 -0.00 0.00 0.48 0.00 0.00 55.95 57.12 3ito s SER 128 Cb -0.15 -2.16 0.11 0.00 0.10 0.00 0.00 66.02 63.92 3ito s SER 128 CO -0.03 -0.38 0.12 0.21 0.98 0.00 0.00 173.24 174.14 3ito s ASN 129 N -3.77 3.97 -0.20 7.02 3.84 -1.01 -4.65 114.94 120.14 3ito s ASN 129 Ca 0.44 -1.82 0.15 0.00 0.21 0.00 0.00 52.86 51.84 3ito s ASN 129 Cb -0.10 -0.90 0.45 0.00 -0.55 0.00 0.00 41.25 40.14 3ito s ASN 129 CO 0.37 -0.39 1.18 0.35 -2.79 0.00 0.00 177.10 175.83 3ito n THR 130 N 4.61 1.70 -0.07 -5.21 -2.24 -1.26 -4.64 114.28 107.17 3ito n THR 130 Ca 0.00 -3.01 0.02 0.00 -2.27 0.00 0.00 64.05 58.80 3ito n THR 130 Cb 0.41 0.01 0.06 0.00 -2.10 0.00 0.00 70.33 68.71 3ito n THR 130 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 3ito n PHE 131 N -0.59 0.18 -3.65 4.78 1.16 -1.26 -4.61 117.46 113.48 3ito n PHE 131 Ca 0.21 -0.49 -0.11 0.00 -1.87 0.00 0.00 57.45 55.19 3ito n PHE 131 Cb 0.88 -0.04 -0.05 0.00 -1.61 0.00 0.00 39.48 38.66 3ito n PHE 131 CO 0.00 0.00 0.00 -1.54 -1.87 0.00 0.00 176.76 173.35 3ito s SER 132 N -0.99 -0.25 -0.15 5.98 1.04 -1.26 -4.92 113.70 113.15 3ito s SER 132 Ca 0.09 -0.20 -0.08 0.00 0.48 0.00 0.00 55.95 56.24 3ito s SER 132 Cb 0.05 0.45 -0.04 0.00 0.10 0.00 0.00 66.02 66.58 3ito s SER 132 CO 0.06 -0.78 0.12 -1.81 0.98 0.00 0.00 173.24 171.82 3ito s ASP 133 N -2.50 6.22 0.21 7.02 1.01 -1.26 -4.83 116.67 122.54 3ito s ASP 133 Ca -0.00 0.35 0.05 0.00 0.71 0.00 0.00 52.55 53.65 3ito s ASP 133 Cb 0.01 -2.04 -0.03 0.00 1.01 0.00 0.00 42.92 41.87 3ito s ASP 133 CO -0.08 0.32 0.29 0.00 0.21 0.00 0.00 175.17 175.91 3ito s ALA 134 N -0.47 3.85 0.32 5.23 0.00 -1.26 -5.05 121.76 124.38 3ito s ALA 134 Ca 0.12 -1.21 -0.29 0.00 0.00 0.00 0.00 51.96 50.58 3ito s ALA 134 Cb -0.12 -1.64 -0.12 0.00 0.00 0.00 0.00 23.12 21.24 3ito s ALA 134 CO 0.02 0.35 1.38 -2.30 0.00 0.00 0.00 175.76 175.20 3ito n PRO 135 N -1.04 2.24 -0.94 0.00 -0.02 -1.26 -2.04 135.00 131.94 3ito n PRO 135 Ca -0.08 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 3ito n PRO 135 Cb 0.56 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 3ito n PRO 135 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ito n GLY 136 N 1.21 0.45 3.73 -1.23 0.00 -1.26 -4.98 105.19 103.10 3ito n GLY 136 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 3ito n GLY 136 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3ito s GLN 137 N -0.56 4.28 0.09 1.61 0.74 -0.87 -4.94 119.66 120.01 3ito s GLN 137 Ca 0.00 2.22 -0.16 0.00 0.05 0.00 0.00 55.36 57.47 3ito s GLN 137 Cb 0.00 -3.18 -0.09 0.00 1.10 0.00 0.00 33.01 30.85 3ito s GLN 137 CO 0.00 -0.47 1.44 0.00 -0.55 0.00 0.00 175.29 175.70 3ito h ALA 138 N 6.26 0.40 -3.71 1.58 0.00 -1.94 -3.44 119.26 118.41 3ito h ALA 138 Ca -0.43 -0.35 -0.64 0.00 0.00 0.00 0.00 54.91 53.48 3ito h ALA 138 Cb 1.21 -0.09 -0.32 0.00 0.00 0.00 0.00 17.79 18.59 3ito h ALA 138 CO 0.85 0.33 -0.87 -1.01 0.00 0.00 0.00 179.25 178.56 3ito s HIS 139 N -4.49 2.22 0.45 0.00 3.76 -1.26 -5.13 115.29 110.85 3ito s HIS 139 Ca -0.13 -0.76 -0.21 0.00 -0.15 0.00 0.00 55.06 53.81 3ito s HIS 139 Cb 0.08 -1.49 -0.10 0.00 1.11 0.00 0.00 32.58 32.19 3ito s HIS 139 CO 0.80 -0.28 0.99 0.45 -0.85 0.00 0.00 174.74 175.86 3ito s SER 140 N 0.13 6.67 -0.17 1.40 0.15 -1.26 -4.96 113.70 115.65 3ito s SER 140 Ca -0.10 1.81 0.17 0.00 0.70 0.00 0.00 55.95 58.53 3ito s SER 140 Cb -0.15 -2.55 0.77 0.00 -1.71 0.00 0.00 66.02 62.38 3ito s SER 140 CO 0.05 -0.55 1.68 -1.22 1.20 0.00 0.00 173.24 174.40 3ito n TYR 141 N -0.76 1.74 -0.32 3.44 4.01 -1.26 -4.59 117.16 119.43 3ito n TYR 141 Ca 0.08 -0.66 0.10 0.00 -0.16 0.00 0.00 57.90 57.26 3ito n TYR 141 Cb 0.53 -0.36 0.27 0.00 -0.31 0.00 0.00 39.34 39.47 3ito n TYR 141 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 3ito h LYS 142 N 4.05 0.62 -0.42 -0.72 3.64 -1.94 -1.36 116.57 120.44 3ito h LYS 142 Ca 0.00 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.30 3ito h LYS 142 Cb 1.68 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 33.34 3ito h LYS 142 CO 0.34 0.41 0.03 0.66 -2.27 0.00 0.00 179.45 178.62 3ito n TYR 143 N -4.86 1.50 0.00 1.91 4.01 -1.26 -5.06 117.16 113.40 3ito n TYR 143 Ca 0.20 -0.92 0.00 0.00 -0.16 0.00 0.00 57.90 57.02 3ito n TYR 143 Cb 0.51 -0.44 0.00 0.00 -0.31 0.00 0.00 39.34 39.11 3ito n TYR 143 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3ito n GLY 144 N -0.16 0.96 0.00 2.72 0.00 -0.51 -4.66 105.19 103.54 3ito n GLY 144 Ca 0.27 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 44.07 3ito n GLY 144 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ito n SER 145 N 0.00 0.00 0.32 1.61 3.41 -1.26 -4.24 113.62 113.45 3ito n SER 145 Ca 0.00 0.00 0.20 0.00 -0.26 0.00 0.00 58.87 58.81 3ito n SER 145 Cb 0.00 0.00 1.04 0.00 -0.26 0.00 0.00 64.21 64.99 3ito n SER 145 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3ito h LEU 146 N 0.00 0.00 -2.99 1.04 3.38 -1.86 -2.04 115.31 112.84 3ito h LEU 146 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ito h LEU 146 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3ito h LEU 146 CO 0.00 0.01 0.00 -1.54 0.09 0.00 0.00 178.44 177.00 3ito n SER 147 N -3.24 2.59 -4.74 -0.43 3.41 -1.26 -3.80 113.62 106.14 3ito n SER 147 Ca -0.02 -2.25 -0.38 0.00 -0.26 0.00 0.00 58.87 55.95 3ito n SER 147 Cb 0.13 -0.20 0.05 0.00 -0.26 0.00 0.00 64.21 63.93 3ito n SER 147 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 3ito n HIS 148 N -0.26 2.26 0.22 7.33 -0.00 -0.77 -4.79 115.22 119.22 3ito n HIS 148 Ca 0.09 0.43 0.08 0.00 -0.00 0.00 0.00 57.72 58.31 3ito n HIS 148 Cb 0.44 -2.35 0.53 0.00 -0.00 0.00 0.00 29.99 28.60 3ito n HIS 148 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.34 178.13 3ito h THR 149 N 1.27 0.83 -3.25 3.57 1.35 -1.90 -3.42 112.91 111.35 3ito h THR 149 Ca -0.51 -0.94 -0.59 0.00 -0.55 0.00 0.00 66.41 63.82 3ito h THR 149 Cb 1.31 1.57 -0.07 0.00 -1.73 0.00 0.00 68.15 69.22 3ito h THR 149 CO 0.56 0.23 0.66 0.21 -0.25 0.00 0.00 175.52 176.94 3ito s ASN 150 N -6.46 6.91 0.23 5.36 2.47 -1.26 -4.95 114.94 117.24 3ito s ASN 150 Ca -0.02 1.08 -0.07 0.00 0.42 0.00 0.00 52.86 54.27 3ito s ASN 150 Cb 0.13 -2.49 0.35 0.00 -1.45 0.00 0.00 41.25 37.79 3ito s ASN 150 CO 0.65 -0.68 1.76 0.00 -3.72 0.00 0.00 177.10 175.11 3ito h ALA 151 N 7.79 0.95 -0.47 1.71 0.00 -1.99 -1.53 119.26 125.72 3ito h ALA 151 Ca -0.21 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3ito h ALA 151 Cb 1.07 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 3ito h ALA 151 CO 0.95 -0.12 0.25 0.00 0.00 0.00 0.00 179.25 180.33 3ito h ALA 152 N 1.45 1.56 -0.39 0.00 0.00 -1.96 -0.73 119.26 119.19 3ito h ALA 152 Ca 0.35 -0.08 -0.16 0.00 0.00 0.00 0.00 54.91 55.03 3ito h ALA 152 Cb 0.43 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3ito h ALA 152 CO -0.31 0.36 -0.37 1.15 0.00 0.00 0.00 179.25 180.09 3ito h THR 153 N 0.65 1.27 -0.33 0.00 2.02 -1.65 -1.25 112.91 113.62 3ito h THR 153 Ca 0.17 -1.54 -0.04 0.00 0.77 0.00 0.00 66.41 65.77 3ito h THR 153 Cb 0.03 1.35 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 3ito h THR 153 CO -0.03 0.52 0.04 0.03 0.37 0.00 0.00 175.52 176.45 3ito h ARG 154 N 0.77 0.55 -0.59 6.66 3.08 -0.88 -1.60 114.38 122.37 3ito h ARG 154 Ca 0.07 -0.15 0.05 0.00 0.07 0.00 0.00 59.98 60.02 3ito h ARG 154 Cb 0.96 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.90 3ito h ARG 154 CO 0.09 0.64 0.31 0.00 -1.07 0.00 0.00 179.97 179.94 3ito h ALA 155 N 0.88 0.77 -0.76 0.04 0.00 -1.06 0.17 119.26 119.30 3ito h ALA 155 Ca 0.10 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3ito h ALA 155 Cb 0.37 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 3ito h ALA 155 CO 0.01 -0.03 0.47 0.37 0.00 0.00 0.00 179.25 180.07 3ito h GLN 156 N 0.58 1.02 -0.58 0.00 4.15 -1.02 0.79 115.11 120.06 3ito h GLN 156 Ca 0.26 -0.08 -0.08 0.00 0.77 0.00 0.00 58.65 59.52 3ito h GLN 156 Cb 0.17 -0.22 -0.02 0.00 0.21 0.00 0.00 27.48 27.62 3ito h GLN 156 CO -0.18 0.71 0.03 0.00 -1.93 0.00 0.00 178.83 177.47 3ito h ALA 157 N 1.26 0.77 -0.27 3.38 0.00 -0.34 -1.31 119.26 122.74 3ito h ALA 157 Ca 0.28 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3ito h ALA 157 Cb -0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 3ito h ALA 157 CO -0.05 0.57 0.13 0.28 0.00 0.00 0.00 179.25 180.18 3ito h VAL 158 N 0.88 1.15 -0.69 0.00 2.07 -0.18 -2.15 116.25 117.33 3ito h VAL 158 Ca 0.17 -0.42 0.06 0.00 0.82 0.00 0.00 66.70 67.32 3ito h VAL 158 Cb 0.50 0.92 -0.05 0.00 -1.52 0.00 0.00 31.29 31.14 3ito h VAL 158 CO 0.02 0.15 0.39 -0.08 0.02 0.00 0.00 177.57 178.07 3ito h GLU 159 N 0.31 0.70 -0.76 1.57 4.57 -0.64 -1.31 114.58 119.03 3ito h GLU 159 Ca 0.09 -0.04 0.03 0.00 -1.18 0.00 0.00 59.36 58.26 3ito h GLU 159 Cb 0.12 -0.16 -0.05 0.00 -0.16 0.00 0.00 28.75 28.50 3ito h GLU 159 CO -0.01 0.47 0.48 1.25 -1.18 0.00 0.00 179.01 180.02 3ito h HIS 160 N 0.72 0.91 -0.39 0.92 2.76 -0.92 -1.16 115.15 117.99 3ito h HIS 160 Ca 0.30 0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 58.40 3ito h HIS 160 Cb 0.17 -0.30 -0.02 0.00 1.55 0.00 0.00 27.41 28.81 3ito h HIS 160 CO -0.07 0.52 -0.15 -0.91 -1.30 0.00 0.00 177.93 176.02 3ito h ASN 161 N 0.95 0.71 -0.36 3.26 2.35 -0.71 -2.09 115.58 119.69 3ito h ASN 161 Ca 0.30 -0.22 -0.09 0.00 -0.55 0.00 0.00 56.30 55.74 3ito h ASN 161 Cb 0.00 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.16 3ito h ASN 161 CO -0.11 0.88 -0.08 -0.07 -1.65 0.00 0.00 177.43 176.40 3ito h LEU 162 N 0.64 0.77 -1.14 1.61 3.38 -0.73 -2.13 115.31 117.70 3ito h LEU 162 Ca 0.10 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.81 3ito h LEU 162 Cb 0.62 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 3ito h LEU 162 CO 0.04 0.88 0.02 -0.08 0.09 0.00 0.00 178.44 179.40 3ito h GLU 163 N 0.72 0.62 -0.54 1.13 4.81 -0.87 -1.60 114.58 118.85 3ito h GLU 163 Ca 0.13 -0.14 -0.06 0.00 -0.13 0.00 0.00 59.36 59.16 3ito h GLU 163 Cb 0.55 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.81 3ito h GLU 163 CO 0.03 0.63 0.10 0.00 -0.73 0.00 0.00 179.01 179.04 3ito h ILE 165 N 0.82 1.28 -0.58 0.00 2.04 -0.88 -1.32 117.51 118.87 3ito h ILE 165 Ca 0.17 -1.42 -0.06 0.00 1.00 0.00 0.00 64.86 64.55 3ito h ILE 165 Cb 0.35 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 3ito h ILE 165 CO 0.00 0.46 0.11 -0.33 0.00 0.00 0.00 178.15 178.40 3ito h GLU 166 N 0.58 0.94 -0.47 2.37 4.39 -0.73 -1.08 114.58 120.58 3ito h GLU 166 Ca 0.07 -0.24 -0.05 0.00 0.34 0.00 0.00 59.36 59.48 3ito h GLU 166 Cb 0.80 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.32 3ito h GLU 166 CO 0.07 0.89 0.10 0.82 -1.16 0.00 0.00 179.01 179.72 3ito h ILE 167 N 0.84 1.24 -0.76 3.13 1.08 -1.17 -2.82 117.51 119.06 3ito h ILE 167 Ca 0.18 -0.86 -0.02 0.00 -0.39 0.00 0.00 64.86 63.77 3ito h ILE 167 Cb 0.39 0.90 -0.04 0.00 -3.07 0.00 0.00 36.82 35.00 3ito h ILE 167 CO 0.01 0.30 0.37 1.23 -0.69 0.00 0.00 178.15 179.38 3ito h GLY 168 N 0.64 1.16 1.19 5.37 0.00 -0.95 -2.44 103.07 108.04 3ito h GLY 168 Ca 0.15 -0.55 -0.07 0.00 0.00 0.00 0.00 47.33 46.86 3ito h GLY 168 CO 0.00 0.53 0.11 0.50 0.00 0.00 0.00 176.54 177.68 3ito h LYS 169 N 1.07 1.00 0.00 4.80 1.57 -1.10 0.37 116.57 124.28 3ito h LYS 169 Ca 0.26 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3ito h LYS 169 Cb 0.09 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.27 3ito h LYS 169 CO -0.04 0.91 -0.03 0.00 -0.57 0.00 0.00 179.45 179.72 3ito h ALA 170 N 1.18 1.02 -0.03 3.86 0.00 -1.19 -3.19 119.26 120.90 3ito h ALA 170 Ca 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3ito h ALA 170 Cb 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3ito h ALA 170 CO 0.01 0.04 0.00 0.44 0.00 0.00 0.00 179.25 179.74 3ito n ILE 171 N -3.15 0.06 0.00 0.00 -5.35 -0.99 -4.81 119.36 105.12 3ito n ILE 171 Ca 0.00 -0.53 0.00 0.00 -0.27 0.00 0.00 62.75 61.95 3ito n ILE 171 Cb 0.30 1.14 0.00 0.00 -1.74 0.00 0.00 39.64 39.35 3ito n ILE 171 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3ito n GLY 172 N 0.49 0.81 3.79 3.28 0.00 -0.59 -4.62 105.19 108.34 3ito n GLY 172 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 3ito n GLY 172 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ito s SER 173 N -2.38 4.82 -0.02 1.61 0.15 0.12 -4.81 113.70 113.19 3ito s SER 173 Ca 0.00 1.67 0.06 0.00 0.70 0.00 0.00 55.95 58.38 3ito s SER 173 Cb 0.00 -2.45 0.10 0.00 -1.71 0.00 0.00 66.02 61.96 3ito s SER 173 CO 0.00 -1.81 1.05 0.29 1.20 0.00 0.00 173.24 173.97 3ito n LYS 174 N -3.37 0.20 -3.53 5.44 4.76 -1.26 -4.46 118.16 115.94 3ito n LYS 174 Ca 0.08 -1.39 -0.11 0.00 -2.87 0.00 0.00 58.31 54.03 3ito n LYS 174 Cb 0.54 -0.59 -0.04 0.00 -1.84 0.00 0.00 35.03 33.10 3ito n LYS 174 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3ito s ALA 175 N -0.45 -1.86 -0.09 7.82 0.00 -1.26 -2.08 121.76 123.85 3ito s ALA 175 Ca 0.09 1.28 0.04 0.00 0.00 0.00 0.00 51.96 53.37 3ito s ALA 175 Cb 0.10 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 23.12 3ito s ALA 175 CO -0.02 -0.49 -0.21 -1.17 0.00 0.00 0.00 175.76 173.87 3ito s LEU 176 N -1.75 1.98 -0.19 0.00 2.96 -0.71 0.20 118.68 121.16 3ito s LEU 176 Ca -0.00 -0.48 -0.05 0.00 -0.22 0.00 0.00 54.13 53.37 3ito s LEU 176 Cb -0.01 -1.25 -0.03 0.00 0.50 0.00 0.00 46.19 45.41 3ito s LEU 176 CO -0.02 0.14 -0.00 -0.89 -1.32 0.00 0.00 176.35 174.25 3ito s THR 177 N 0.36 4.02 -0.31 3.68 2.01 0.15 -0.27 115.64 125.29 3ito s THR 177 Ca -0.16 -0.29 -0.02 0.00 0.31 0.00 0.00 61.69 61.52 3ito s THR 177 Cb -0.17 -2.81 0.05 0.00 0.01 0.00 0.00 72.50 69.58 3ito s THR 177 CO 0.07 0.44 0.02 -0.69 -0.69 0.00 0.00 174.62 173.77 3ito s VAL 178 N 0.83 3.08 -0.11 3.82 1.01 0.19 -2.88 120.40 126.34 3ito s VAL 178 Ca 0.01 -1.39 0.01 0.00 0.00 0.00 0.00 61.98 60.61 3ito s VAL 178 Cb -0.14 -2.78 0.02 0.00 0.00 0.00 0.00 36.38 33.47 3ito s VAL 178 CO 0.02 -0.14 -0.14 0.86 0.00 0.00 0.00 175.10 175.70 3ito s TRP 179 N 1.26 1.86 0.21 5.22 -0.00 -1.26 -1.98 118.94 124.25 3ito s TRP 179 Ca -0.04 -0.87 0.08 0.00 -0.00 0.00 0.00 56.10 55.27 3ito s TRP 179 Cb -0.20 -1.37 -0.05 0.00 -0.00 0.00 0.00 33.47 31.86 3ito s TRP 179 CO -0.01 -0.47 -0.16 0.96 -0.00 0.00 0.00 176.95 177.28 3ito s ILE 180 N 1.06 1.87 -1.65 5.86 -4.36 -1.26 -4.68 121.20 118.04 3ito s ILE 180 Ca -0.06 -2.23 0.26 0.00 -0.26 0.00 0.00 60.65 58.37 3ito s ILE 180 Cb -0.15 -2.07 0.22 0.00 1.25 0.00 0.00 42.46 41.71 3ito s ILE 180 CO -0.02 -0.55 1.53 0.61 0.24 0.00 0.00 174.94 176.75 3ito n GLY 181 N -0.38 -0.69 2.91 6.27 0.00 -1.26 -4.96 105.19 107.07 3ito n GLY 181 Ca -0.08 -0.40 -0.50 0.00 0.00 0.00 0.00 46.02 45.04 3ito n GLY 181 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ito n ASP 182 N -0.76 0.19 0.00 1.61 9.92 -1.26 -4.05 116.55 122.20 3ito n ASP 182 Ca 0.11 0.96 0.00 0.00 -0.53 0.00 0.00 54.79 55.33 3ito n ASP 182 Cb 0.35 -0.75 0.00 0.00 -0.64 0.00 0.00 41.12 40.08 3ito n ASP 182 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3ito n GLY 183 N 1.64 -0.56 3.09 0.44 0.00 -1.26 -2.12 105.19 106.42 3ito n GLY 183 Ca 0.18 -0.76 -0.08 0.00 0.00 0.00 0.00 46.02 45.36 3ito n GLY 183 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ito s SER 184 N -4.00 0.34 0.00 1.61 1.04 0.15 -4.89 113.70 107.95 3ito s SER 184 Ca 0.00 -0.77 0.14 0.00 0.48 0.00 0.00 55.95 55.80 3ito s SER 184 Cb 0.00 0.20 -0.07 0.00 0.10 0.00 0.00 66.02 66.25 3ito s SER 184 CO 0.00 -0.54 0.67 0.59 0.98 0.00 0.00 173.24 174.94 3ito n ASN 185 N 0.50 1.06 -3.93 7.02 4.13 -1.26 -0.84 115.26 121.94 3ito n ASN 185 Ca -0.17 -1.03 -0.12 0.00 1.68 0.00 0.00 54.58 54.95 3ito n ASN 185 Cb 0.60 0.74 -0.13 0.00 -1.54 0.00 0.00 39.78 39.44 3ito n ASN 185 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 3ito s PHE 186 N -1.99 0.18 0.35 3.10 0.08 -1.26 -4.38 117.98 114.05 3ito s PHE 186 Ca 0.08 -0.21 -0.29 0.00 0.12 0.00 0.00 56.93 56.63 3ito s PHE 186 Cb 0.11 -0.12 -0.11 0.00 -0.57 0.00 0.00 43.02 42.33 3ito s PHE 186 CO 0.45 -0.07 1.49 -2.14 -0.10 0.00 0.00 175.22 174.86 3ito s PRO 187 N -0.59 4.14 0.00 0.24 0.02 -1.26 -1.93 135.00 135.63 3ito s PRO 187 Ca -0.06 2.53 0.00 0.00 0.02 0.00 0.00 61.00 63.50 3ito s PRO 187 Cb -0.04 -2.99 0.00 0.00 0.02 0.00 0.00 34.50 31.48 3ito s PRO 187 CO -0.00 -0.52 0.00 0.41 -0.33 0.00 0.00 177.00 176.55 3ito n GLY 188 N 0.94 2.86 0.29 0.52 0.00 -1.26 -4.87 105.19 103.68 3ito n GLY 188 Ca 0.03 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.07 3ito n GLY 188 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3ito h GLN 189 N 0.59 0.70 -6.72 1.61 4.15 -1.82 -3.42 115.11 110.21 3ito h GLN 189 Ca 0.00 -0.04 -0.66 0.00 0.77 0.00 0.00 58.65 58.72 3ito h GLN 189 Cb 0.00 -0.16 -0.22 0.00 0.21 0.00 0.00 27.48 27.31 3ito h GLN 189 CO 0.00 0.46 -0.86 -1.12 -1.93 0.00 0.00 178.83 175.38 3ito s SER 190 N -5.56 3.12 -0.39 -0.69 0.01 -1.26 -5.09 113.70 103.83 3ito s SER 190 Ca -0.12 -0.72 -0.17 0.00 1.31 0.00 0.00 55.95 56.25 3ito s SER 190 Cb 0.19 -0.21 0.01 0.00 0.21 0.00 0.00 66.02 66.22 3ito s SER 190 CO 0.78 0.16 0.42 0.21 0.41 0.00 0.00 173.24 175.21 3ito s ASN 191 N -1.96 6.20 0.20 2.44 3.84 -1.26 -4.97 114.94 119.43 3ito s ASN 191 Ca 0.12 -0.47 -0.15 0.00 0.21 0.00 0.00 52.86 52.57 3ito s ASN 191 Cb -0.10 -2.22 0.21 0.00 -0.55 0.00 0.00 41.25 38.59 3ito s ASN 191 CO 0.05 -0.49 1.62 -0.26 -2.79 0.00 0.00 177.10 175.23 3ito h PHE 192 N 8.62 -0.44 -0.08 0.43 0.04 -1.98 -1.41 116.94 122.12 3ito h PHE 192 Ca -0.28 0.06 -0.01 0.00 2.80 0.00 0.00 57.97 60.54 3ito h PHE 192 Cb 1.12 0.29 -0.00 0.00 2.20 0.00 0.00 35.95 39.56 3ito h PHE 192 CO 0.65 -0.29 0.00 1.15 -0.60 0.00 0.00 178.31 179.22 3ito h THR 193 N -0.04 1.24 -0.82 -1.55 2.02 -1.99 -2.41 112.91 109.36 3ito h THR 193 Ca 0.29 -0.76 -0.01 0.00 0.77 0.00 0.00 66.41 66.70 3ito h THR 193 Cb 0.48 1.60 -0.04 0.00 -1.74 0.00 0.00 68.15 68.45 3ito h THR 193 CO -0.65 0.21 0.46 0.03 0.37 0.00 0.00 175.52 175.94 3ito h ARG 194 N -0.14 1.14 -0.70 6.66 3.08 -1.94 0.34 114.38 122.82 3ito h ARG 194 Ca 0.02 -0.13 -0.02 0.00 0.07 0.00 0.00 59.98 59.93 3ito h ARG 194 Cb 0.33 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 3ito h ARG 194 CO 0.00 0.83 0.37 0.00 -1.07 0.00 0.00 179.97 180.11 3ito h ALA 195 N 1.24 0.90 -0.50 0.04 0.00 -1.26 -0.69 119.26 118.99 3ito h ALA 195 Ca 0.29 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.96 3ito h ALA 195 Cb 0.02 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3ito h ALA 195 CO -0.05 0.43 -0.17 0.35 0.00 0.00 0.00 179.25 179.81 3ito h PHE 196 N 0.97 1.12 -0.70 0.00 3.57 -0.92 -1.17 116.94 119.80 3ito h PHE 196 Ca 0.25 -0.25 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 3ito h PHE 196 Cb 0.06 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.49 3ito h PHE 196 CO -0.00 1.07 0.43 0.93 -2.23 0.00 0.00 178.31 178.50 3ito h GLU 197 N 0.87 0.95 -0.55 1.11 5.08 -0.52 0.12 114.58 121.64 3ito h GLU 197 Ca 0.12 -0.08 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 3ito h GLU 197 Cb 0.73 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 3ito h GLU 197 CO 0.06 0.67 0.23 0.00 -1.00 0.00 0.00 179.01 178.97 3ito h ARG 198 N 0.96 0.82 -0.02 2.33 3.08 -0.90 -1.55 114.38 119.09 3ito h ARG 198 Ca 0.25 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 60.16 3ito h ARG 198 Cb -0.04 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 29.87 3ito h ARG 198 CO -0.05 0.70 0.02 -0.92 -1.07 0.00 0.00 179.97 178.65 3ito h TYR 199 N 0.75 0.03 -0.86 3.04 5.03 -0.59 -1.54 116.97 122.83 3ito h TYR 199 Ca 0.18 0.00 0.05 0.00 2.58 0.00 0.00 58.73 61.55 3ito h TYR 199 Cb 0.18 -0.01 -0.06 0.00 1.55 0.00 0.00 36.73 38.39 3ito h TYR 199 CO 0.01 0.02 0.54 -0.07 -1.32 0.00 0.00 178.16 177.34 3ito h LEU 200 N 0.03 0.86 -0.54 2.82 3.38 -0.60 -0.39 115.31 120.87 3ito h LEU 200 Ca 0.01 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 3ito h LEU 200 Cb -0.00 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 3ito h LEU 200 CO -0.00 0.56 0.12 -1.28 0.09 0.00 0.00 178.44 177.93 3ito h SER 201 N 1.00 0.84 -0.39 -0.43 0.87 -0.99 -1.70 113.55 112.74 3ito h SER 201 Ca 0.37 -0.24 -0.10 0.00 -1.23 0.00 0.00 61.79 60.59 3ito h SER 201 Cb 0.13 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 3ito h SER 201 CO -0.16 0.86 -0.15 0.00 -0.53 0.00 0.00 176.83 176.85 3ito h ALA 202 N 1.01 0.54 -0.13 6.23 0.00 -0.83 -2.77 119.26 123.31 3ito h ALA 202 Ca 0.17 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 3ito h ALA 202 Cb 0.36 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3ito h ALA 202 CO 0.00 0.45 -0.07 0.52 0.00 0.00 0.00 179.25 180.16 3ito h MET 203 N 0.59 0.20 -0.58 0.00 2.07 -0.99 -1.33 114.93 114.89 3ito h MET 203 Ca 0.09 -0.03 -0.04 0.00 -2.07 0.00 0.00 59.70 57.65 3ito h MET 203 Cb 0.69 -0.03 -0.03 0.00 -1.87 0.00 0.00 31.60 30.36 3ito h MET 203 CO 0.05 0.28 0.21 0.00 1.07 0.00 0.00 176.91 178.52 3ito h ALA 204 N 1.75 1.28 -0.48 6.32 0.00 -1.03 0.38 119.26 127.48 3ito h ALA 204 Ca 0.04 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.67 3ito h ALA 204 Cb 0.25 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3ito h ALA 204 CO 0.01 0.52 -0.18 0.93 0.00 0.00 0.00 179.25 180.53 3ito h GLU 205 N 0.83 0.95 -0.54 0.00 5.08 -1.08 -2.50 114.58 117.31 3ito h GLU 205 Ca 0.19 -0.38 -0.10 0.00 -1.00 0.00 0.00 59.36 58.08 3ito h GLU 205 Cb 0.20 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 3ito h GLU 205 CO -0.01 1.04 -0.03 0.82 -1.00 0.00 0.00 179.01 179.82 3ito h ILE 206 N 0.83 1.27 -0.95 3.13 2.04 -0.97 -2.81 117.51 120.04 3ito h ILE 206 Ca 0.12 -1.16 0.08 0.00 1.00 0.00 0.00 64.86 64.89 3ito h ILE 206 Cb 0.74 0.92 -0.07 0.00 -0.74 0.00 0.00 36.82 37.68 3ito h ILE 206 CO 0.06 0.41 0.61 0.22 0.00 0.00 0.00 178.15 179.45 3ito h TYR 207 N 0.86 1.08 0.00 1.37 5.03 -0.75 -0.32 116.97 124.24 3ito h TYR 207 Ca 0.15 0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.49 3ito h TYR 207 Cb 0.58 -0.35 -0.00 0.00 1.55 0.00 0.00 36.73 38.51 3ito h TYR 207 CO 0.04 0.53 -0.01 0.87 -1.32 0.00 0.00 178.16 178.27 3ito h LYS 208 N 1.03 0.00 -0.31 1.82 1.57 -1.18 -1.90 116.57 117.61 3ito h LYS 208 Ca 0.42 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.20 3ito h LYS 208 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 3ito h LYS 208 CO -0.18 0.01 0.00 0.41 -0.57 0.00 0.00 179.45 179.12 3ito n GLY 209 N -0.88 0.90 3.73 3.86 0.00 -0.13 -4.93 105.19 107.75 3ito n GLY 209 Ca -0.02 -0.52 -0.40 0.00 0.00 0.00 0.00 46.02 45.07 3ito n GLY 209 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ito s LEU 210 N -1.38 4.42 0.96 0.99 1.43 -0.72 -5.00 118.68 119.39 3ito s LEU 210 Ca 0.33 1.43 -0.12 0.00 -1.03 0.00 0.00 54.13 54.75 3ito s LEU 210 Cb 0.18 -3.25 0.17 0.00 0.03 0.00 0.00 46.19 43.32 3ito s LEU 210 CO 0.26 -0.04 1.09 -2.84 0.23 0.00 0.00 176.35 175.04 3ito s PRO 211 N 0.22 0.70 0.56 1.29 0.02 -1.26 -4.89 135.00 131.64 3ito s PRO 211 Ca 0.40 0.92 0.28 0.00 0.02 0.00 0.00 61.00 62.62 3ito s PRO 211 Cb -0.20 -1.74 1.66 0.00 0.02 0.00 0.00 34.50 34.24 3ito s PRO 211 CO 0.23 -2.65 2.19 -0.44 -0.33 0.00 0.00 177.00 176.00 3ito h ASP 212 N -1.85 0.00 -0.49 2.53 3.32 -2.00 -2.46 116.42 115.48 3ito h ASP 212 Ca -0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.54 3ito h ASP 212 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 3ito h ASP 212 CO 0.52 0.04 0.00 -0.90 -1.72 0.00 0.00 179.24 177.18 3ito n ASP 213 N -3.83 4.27 -4.96 6.45 5.75 -1.26 -4.99 116.55 117.97 3ito n ASP 213 Ca -0.03 -2.54 -0.20 0.00 -0.01 0.00 0.00 54.79 52.01 3ito n ASP 213 Cb 0.13 -0.51 -0.02 0.00 -1.03 0.00 0.00 41.12 39.70 3ito n ASP 213 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 3ito s TRP 214 N -2.00 3.24 0.08 2.11 0.52 -0.93 -4.90 118.94 117.07 3ito s TRP 214 Ca 0.44 -0.13 0.06 0.00 0.02 0.00 0.00 56.10 56.48 3ito s TRP 214 Cb 0.30 -1.76 -0.03 0.00 -1.15 0.00 0.00 33.47 30.82 3ito s TRP 214 CO 0.18 0.23 -0.16 0.15 0.02 0.00 0.00 176.95 177.37 3ito s LYS 215 N -4.06 0.90 -0.22 4.98 1.02 -0.88 -4.83 119.74 116.64 3ito s LYS 215 Ca 0.39 -1.02 -0.00 0.00 0.02 0.00 0.00 55.97 55.36 3ito s LYS 215 Cb -0.09 -0.95 0.03 0.00 -0.52 0.00 0.00 37.83 36.30 3ito s LYS 215 CO 0.29 0.21 -0.12 -1.17 -0.92 0.00 0.00 175.35 173.65 3ito s LEU 216 N -1.83 2.85 -0.23 3.17 2.96 0.44 -1.75 118.68 124.29 3ito s LEU 216 Ca 0.01 -0.85 -0.07 0.00 -0.22 0.00 0.00 54.13 53.00 3ito s LEU 216 Cb -0.10 -1.59 -0.03 0.00 0.50 0.00 0.00 46.19 44.97 3ito s LEU 216 CO 0.03 -0.09 0.07 -0.36 -1.32 0.00 0.00 176.35 174.68 3ito s PHE 217 N 1.29 3.13 -0.14 5.38 0.08 0.63 -1.30 117.98 127.04 3ito s PHE 217 Ca 0.01 -0.25 -0.08 0.00 0.12 0.00 0.00 56.93 56.73 3ito s PHE 217 Cb -0.16 -2.19 -0.04 0.00 -0.57 0.00 0.00 43.02 40.06 3ito s PHE 217 CO -0.07 -0.19 0.13 -1.54 -0.10 0.00 0.00 175.22 173.45 3ito s SER 218 N 1.21 6.30 -0.19 1.36 1.04 -0.91 0.55 113.70 123.06 3ito s SER 218 Ca 0.05 0.39 -0.01 0.00 0.48 0.00 0.00 55.95 56.86 3ito s SER 218 Cb -0.14 -2.06 0.00 0.00 0.10 0.00 0.00 66.02 63.92 3ito s SER 218 CO 0.03 0.34 -0.13 -0.70 0.98 0.00 0.00 173.24 173.77 3ito s GLU 219 N -0.63 3.20 0.41 4.02 2.12 -0.84 -1.33 118.70 125.65 3ito s GLU 219 Ca 0.13 -0.73 -0.10 0.00 0.36 0.00 0.00 54.97 54.63 3ito s GLU 219 Cb -0.12 -2.75 -0.06 0.00 0.26 0.00 0.00 34.13 31.46 3ito s GLU 219 CO 0.02 -0.14 0.77 -3.38 -0.54 0.00 0.00 175.26 171.99 3ito s HIS 220 N 1.22 3.48 -0.25 5.30 -3.43 -1.26 -4.71 115.29 115.64 3ito s HIS 220 Ca 0.02 1.02 -0.12 0.00 -0.80 0.00 0.00 55.06 55.19 3ito s HIS 220 Cb -0.14 -2.43 0.09 0.00 -1.43 0.00 0.00 32.58 28.67 3ito s HIS 220 CO -0.06 -0.12 0.59 0.21 -2.00 0.00 0.00 174.74 173.37 3ito s LYS 221 N -3.91 0.57 0.22 -0.38 2.20 -0.14 -4.75 119.74 113.57 3ito s LYS 221 Ca 0.51 1.16 -0.09 0.00 -0.36 0.00 0.00 55.97 57.19 3ito s LYS 221 Cb -0.10 0.27 0.20 0.00 -1.51 0.00 0.00 37.83 36.69 3ito s LYS 221 CO 0.32 -0.17 1.89 1.98 -0.36 0.00 0.00 175.35 179.01 3ito h MET 222 N 7.35 1.09 -2.55 4.03 1.85 -0.97 -3.35 114.93 122.38 3ito h MET 222 Ca -0.28 -0.07 0.13 0.00 -0.61 0.00 0.00 59.70 58.88 3ito h MET 222 Cb 1.18 -0.25 -0.08 0.00 0.43 0.00 0.00 31.60 32.88 3ito h MET 222 CO 0.17 0.72 0.40 1.52 -0.40 0.00 0.00 176.91 179.32 3ito s TYR 223 N -6.13 -0.19 0.02 1.39 1.13 -1.26 -4.53 117.35 107.78 3ito s TYR 223 Ca -0.13 -0.13 0.00 0.00 -1.41 0.00 0.00 57.07 55.40 3ito s TYR 223 Cb 0.16 0.64 0.00 0.00 -1.10 0.00 0.00 41.96 41.66 3ito s TYR 223 CO 0.79 -0.91 0.00 -1.91 -2.51 0.00 0.00 175.55 171.01 3ito n GLU 224 N -0.44 -0.68 0.09 -3.49 2.13 -1.26 -4.82 120.64 112.17 3ito n GLU 224 Ca -0.06 0.92 0.11 0.00 0.66 0.00 0.00 57.16 58.79 3ito n GLU 224 Cb 0.61 -0.68 0.45 0.00 0.27 0.00 0.00 31.44 32.08 3ito n GLU 224 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 3ito n PRO 225 N 0.23 0.15 -3.00 5.31 -0.04 -1.26 -4.96 135.00 131.43 3ito n PRO 225 Ca 0.00 0.35 -0.40 0.00 -0.04 0.00 0.00 63.50 63.41 3ito n PRO 225 Cb 0.00 -1.76 -0.05 0.00 -0.04 0.00 0.00 33.50 31.65 3ito n PRO 225 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3ito s ALA 226 N -3.21 3.32 -1.09 0.55 0.00 -1.26 -4.97 121.76 115.11 3ito s ALA 226 Ca 0.06 0.21 0.15 0.00 0.00 0.00 0.00 51.96 52.37 3ito s ALA 226 Cb 0.10 -3.01 0.45 0.00 0.00 0.00 0.00 23.12 20.66 3ito s ALA 226 CO 0.39 -0.08 1.38 1.19 0.00 0.00 0.00 175.76 178.63 3ito n PHE 227 N 3.61 0.74 0.05 0.00 3.72 -1.21 -4.58 117.46 119.78 3ito n PHE 227 Ca -0.01 -0.55 0.00 0.00 -0.05 0.00 0.00 57.45 56.84 3ito n PHE 227 Cb 0.51 -0.08 0.00 0.00 -0.94 0.00 0.00 39.48 38.97 3ito n PHE 227 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 3ito n TYR 228 N 0.71 -0.47 -3.97 1.38 9.36 -0.02 -4.91 117.16 119.25 3ito n TYR 228 Ca 0.17 0.08 -0.09 0.00 3.32 0.00 0.00 57.90 61.38 3ito n TYR 228 Cb 0.57 0.18 -0.10 0.00 -0.63 0.00 0.00 39.34 39.36 3ito n TYR 228 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 3ito s SER 229 N -5.37 0.24 -0.02 2.98 1.04 -0.41 -4.97 113.70 107.18 3ito s SER 229 Ca 0.00 -0.56 0.02 0.00 0.48 0.00 0.00 55.95 55.89 3ito s SER 229 Cb 0.00 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.30 3ito s SER 229 CO 0.00 -0.43 -0.09 -0.89 0.98 0.00 0.00 173.24 172.81 3ito s THR 230 N -2.27 0.76 0.09 2.02 2.01 -1.26 0.33 115.64 117.32 3ito s THR 230 Ca -0.08 -0.35 -0.30 0.00 0.31 0.00 0.00 61.69 61.27 3ito s THR 230 Cb -0.04 -0.68 -0.13 0.00 0.01 0.00 0.00 72.50 71.67 3ito s THR 230 CO -0.03 0.24 1.62 0.58 -0.69 0.00 0.00 174.62 176.34 3ito h VAL 231 N 5.38 0.34 -2.82 3.82 2.07 -1.77 -3.01 116.25 120.26 3ito h VAL 231 Ca -0.33 0.00 -0.79 0.00 0.82 0.00 0.00 66.70 66.39 3ito h VAL 231 Cb 1.17 0.34 -0.26 0.00 -1.52 0.00 0.00 31.29 31.03 3ito h VAL 231 CO 0.49 0.00 0.91 0.52 0.02 0.00 0.00 177.57 179.51 3ito n VAL 232 N -5.43 4.93 0.06 2.57 0.31 -1.26 -4.82 118.33 114.68 3ito n VAL 232 Ca -0.10 -5.50 -0.09 0.00 -0.01 0.00 0.00 64.34 58.64 3ito n VAL 232 Cb 0.34 -2.28 -0.13 0.00 -0.91 0.00 0.00 33.84 30.86 3ito n VAL 232 CO 0.00 0.00 0.00 0.06 -1.32 0.00 0.00 176.83 175.57 3ito h GLN 233 N 5.91 0.07 -4.08 5.55 -0.00 -1.66 -0.34 115.11 120.55 3ito h GLN 233 Ca 0.23 -0.12 -0.28 0.00 -0.00 0.00 0.00 58.65 58.48 3ito h GLN 233 Cb 0.70 0.04 -0.07 0.00 -0.00 0.00 0.00 27.48 28.15 3ito h GLN 233 CO 1.29 0.99 -0.15 0.16 -0.00 0.00 0.00 178.83 181.12 3ito s ASP 234 N -6.74 0.99 0.60 0.06 1.47 -1.26 -2.11 116.67 109.68 3ito s ASP 234 Ca -0.01 -1.52 0.38 0.00 1.18 0.00 0.00 52.55 52.57 3ito s ASP 234 Cb 0.09 0.69 1.85 0.00 -0.34 0.00 0.00 42.92 45.22 3ito s ASP 234 CO 0.83 -1.35 2.17 4.11 0.68 0.00 0.00 175.17 181.61 3ito h TRP 235 N 2.07 0.00 0.13 2.11 5.08 -1.94 -0.87 115.95 122.52 3ito h TRP 235 Ca -0.28 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.68 3ito h TRP 235 Cb 1.24 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.40 3ito h TRP 235 CO 1.63 0.02 -0.06 0.78 -1.28 0.00 0.00 178.44 179.52 3ito h GLY 236 N 0.96 -0.19 1.04 11.11 0.00 -1.99 0.16 103.07 114.17 3ito h GLY 236 Ca -0.00 0.07 -0.05 0.00 0.00 0.00 0.00 47.33 47.35 3ito h GLY 236 CO 0.00 -0.07 0.24 -0.84 0.00 0.00 0.00 176.54 175.88 3ito h THR 237 N -0.60 1.26 -0.83 4.70 2.02 -1.87 -2.15 112.91 115.44 3ito h THR 237 Ca -0.02 -0.87 0.01 0.00 0.77 0.00 0.00 66.41 66.30 3ito h THR 237 Cb 0.46 0.45 -0.04 0.00 -1.74 0.00 0.00 68.15 67.29 3ito h THR 237 CO 0.03 0.34 0.55 -1.13 0.37 0.00 0.00 175.52 175.68 3ito h ASN 238 N 1.06 0.95 -0.35 4.18 -0.73 -1.10 -0.98 115.58 118.61 3ito h ASN 238 Ca 0.24 -0.03 -0.04 0.00 1.87 0.00 0.00 56.30 58.35 3ito h ASN 238 Cb 0.28 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 38.62 3ito h ASN 238 CO -0.01 0.69 0.08 0.22 -0.37 0.00 0.00 177.43 178.04 3ito h TYR 239 N 1.12 0.59 -0.73 0.67 3.20 -0.13 -1.76 116.97 119.92 3ito h TYR 239 Ca 0.30 -0.07 0.05 0.00 3.14 0.00 0.00 58.73 62.15 3ito h TYR 239 Cb -0.13 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 37.93 3ito h TYR 239 CO 0.00 0.60 0.48 -0.07 -1.64 0.00 0.00 178.16 177.53 3ito h LEU 240 N 0.41 0.72 0.40 2.82 3.38 -0.76 0.06 115.31 122.34 3ito h LEU 240 Ca 0.11 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 3ito h LEU 240 Cb 0.31 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3ito h LEU 240 CO 0.00 0.48 -0.19 0.40 0.09 0.00 0.00 178.44 179.22 3ito h ILE 241 N 0.83 0.58 -0.83 1.22 2.04 -0.81 -1.51 117.51 119.03 3ito h ILE 241 Ca 0.30 -0.38 0.03 0.00 1.00 0.00 0.00 64.86 65.82 3ito h ILE 241 Cb 0.15 0.76 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 3ito h ILE 241 CO -0.10 0.07 0.53 0.00 0.00 0.00 0.00 178.15 178.66 3ito h ALA 242 N -0.27 1.09 -0.60 1.87 0.00 -0.94 0.05 119.26 120.46 3ito h ALA 242 Ca -0.05 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 3ito h ALA 242 Cb 0.52 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3ito h ALA 242 CO 0.09 0.37 -0.00 0.37 0.00 0.00 0.00 179.25 180.07 3ito h GLN 243 N 1.04 1.06 -0.20 0.00 5.75 -1.00 -2.86 115.11 118.90 3ito h GLN 243 Ca 0.33 -0.34 -0.11 0.00 -0.15 0.00 0.00 58.65 58.38 3ito h GLN 243 Cb 0.00 -0.09 -0.00 0.00 1.07 0.00 0.00 27.48 28.46 3ito h GLN 243 CO -0.11 1.04 -0.29 1.15 -2.65 0.00 0.00 178.83 177.97 3ito h THR 244 N 0.96 1.33 0.16 2.39 2.02 -0.84 -3.35 112.91 115.58 3ito h THR 244 Ca 0.17 -1.50 -0.01 0.00 0.77 0.00 0.00 66.41 65.85 3ito h THR 244 Cb 0.57 1.81 0.00 0.00 -1.74 0.00 0.00 68.15 68.79 3ito h THR 244 CO 0.03 0.46 -0.08 -0.07 0.37 0.00 0.00 175.52 176.23 3ito h LEU 245 N 0.23 -0.19 0.00 2.58 3.38 -1.00 -3.50 115.31 116.82 3ito h LEU 245 Ca 0.02 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3ito h LEU 245 Cb 0.87 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.66 3ito h LEU 245 CO 0.07 0.07 0.00 0.61 0.09 0.00 0.00 178.44 179.28 3ito n GLY 246 N -0.55 0.45 0.38 0.83 0.00 -1.08 -4.94 105.19 100.29 3ito n GLY 246 Ca -0.09 -1.63 0.16 0.00 0.00 0.00 0.00 46.02 44.46 3ito n GLY 246 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3ito h PRO 247 N 0.00 0.35 -0.00 1.61 0.11 -1.92 -1.09 132.00 131.07 3ito h PRO 247 Ca 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.09 3ito h PRO 247 Cb 0.00 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.03 3ito h PRO 247 CO 0.00 0.23 -0.06 1.63 -0.21 0.00 0.00 178.00 179.59 3ito n LYS 248 N -4.46 0.54 -3.73 1.05 5.02 -1.26 -4.79 118.16 110.52 3ito n LYS 248 Ca 0.14 -0.11 -0.36 0.00 -2.02 0.00 0.00 58.31 55.96 3ito n LYS 248 Cb 0.54 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.96 3ito n LYS 248 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ito s ALA 249 N -2.54 3.59 0.26 7.82 0.00 -0.41 -0.42 121.76 130.06 3ito s ALA 249 Ca 0.28 -0.81 0.02 0.00 0.00 0.00 0.00 51.96 51.45 3ito s ALA 249 Cb 0.20 -2.21 -0.04 0.00 0.00 0.00 0.00 23.12 21.07 3ito s ALA 249 CO 0.47 -0.04 0.14 -0.65 0.00 0.00 0.00 175.76 175.68 3ito s GLN 250 N 0.76 1.44 -0.11 0.00 -0.21 -0.42 -4.75 119.66 116.36 3ito s GLN 250 Ca 0.07 -1.79 -0.05 0.00 0.02 0.00 0.00 55.36 53.60 3ito s GLN 250 Cb -0.13 -0.05 -0.04 0.00 1.00 0.00 0.00 33.01 33.80 3ito s GLN 250 CO 0.02 -0.39 0.10 0.00 -2.12 0.00 0.00 175.29 172.89 3ito s LEU 252 N -0.95 3.68 -0.33 0.00 1.43 -0.44 -0.04 118.68 122.03 3ito s LEU 252 Ca 0.14 0.04 -0.08 0.00 -1.03 0.00 0.00 54.13 53.20 3ito s LEU 252 Cb -0.12 -1.91 0.02 0.00 0.03 0.00 0.00 46.19 44.20 3ito s LEU 252 CO 0.03 0.19 0.13 -0.69 0.23 0.00 0.00 176.35 176.25 3ito s VAL 253 N 0.28 4.23 -0.31 -1.59 1.01 -0.33 -4.01 120.40 119.66 3ito s VAL 253 Ca 0.02 -0.77 -0.12 0.00 0.00 0.00 0.00 61.98 61.11 3ito s VAL 253 Cb -0.13 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.95 3ito s VAL 253 CO 0.01 -0.06 0.21 -0.62 0.00 0.00 0.00 175.10 174.64 3ito s ASP 254 N 1.52 6.02 0.29 3.32 -1.08 -1.26 -1.53 116.67 123.96 3ito s ASP 254 Ca 0.02 -0.24 0.02 0.00 -0.52 0.00 0.00 52.55 51.83 3ito s ASP 254 Cb -0.18 -2.12 0.74 0.00 -1.46 0.00 0.00 42.92 39.89 3ito s ASP 254 CO 0.04 -0.15 1.62 -0.07 0.52 0.00 0.00 175.17 177.14 3ito h LEU 255 N 8.43 -0.13 -1.70 -1.34 3.38 -1.78 -1.51 115.31 120.66 3ito h LEU 255 Ca -0.33 0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.86 3ito h LEU 255 Cb 1.17 0.33 0.00 0.00 0.09 0.00 0.00 40.66 42.25 3ito h LEU 255 CO 0.60 -0.23 0.00 0.61 0.09 0.00 0.00 178.44 179.51 3ito n GLY 256 N -1.40 1.45 1.73 0.83 0.00 -1.26 -4.21 105.19 102.33 3ito n GLY 256 Ca 0.22 -0.37 0.03 0.00 0.00 0.00 0.00 46.02 45.90 3ito n GLY 256 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3ito n HIS 257 N 0.32 1.98 -4.34 1.61 8.25 -0.57 -3.41 115.22 119.07 3ito n HIS 257 Ca 0.11 -0.94 -0.23 0.00 -0.26 0.00 0.00 57.72 56.40 3ito n HIS 257 Cb 0.49 -0.54 -0.08 0.00 1.12 0.00 0.00 29.99 30.98 3ito n HIS 257 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3ito s HIS 258 N -2.88 2.57 0.78 4.41 3.76 -1.26 -2.25 115.29 120.42 3ito s HIS 258 Ca 0.52 -0.28 -0.13 0.00 -0.15 0.00 0.00 55.06 55.02 3ito s HIS 258 Cb 0.41 -1.19 0.07 0.00 1.11 0.00 0.00 32.58 32.98 3ito s HIS 258 CO 0.13 0.62 1.15 0.00 -0.85 0.00 0.00 174.74 175.79 3ito s ALA 259 N -2.40 2.03 0.31 -1.40 0.00 -1.26 -4.92 121.76 114.12 3ito s ALA 259 Ca 0.32 0.59 -0.29 0.00 0.00 0.00 0.00 51.96 52.58 3ito s ALA 259 Cb -0.05 -3.39 -0.13 0.00 0.00 0.00 0.00 23.12 19.55 3ito s ALA 259 CO 0.19 -1.99 1.29 -2.30 0.00 0.00 0.00 175.76 172.94 3ito n PRO 260 N -3.28 2.00 -0.85 0.00 -0.02 -1.26 -2.23 135.00 129.37 3ito n PRO 260 Ca 0.11 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 3ito n PRO 260 Cb 0.52 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 3ito n PRO 260 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3ito n ASN 261 N 1.20 -1.72 -4.73 2.55 3.02 -1.26 -4.98 115.26 109.33 3ito n ASN 261 Ca 0.07 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.20 3ito n ASN 261 Cb 0.34 -1.53 -0.00 0.00 -0.61 0.00 0.00 39.78 37.98 3ito n ASN 261 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3ito n THR 262 N -2.19 2.04 -2.87 3.41 -1.04 -0.95 -4.90 114.28 107.78 3ito n THR 262 Ca 0.00 -0.50 -0.43 0.00 -2.04 0.00 0.00 64.05 61.08 3ito n THR 262 Cb 0.10 -1.74 -0.03 0.00 -1.82 0.00 0.00 70.33 66.83 3ito n THR 262 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 3ito s ASN 263 N -0.25 6.44 0.16 8.00 3.84 -1.26 -4.86 114.94 127.01 3ito s ASN 263 Ca 0.55 -1.59 -0.10 0.00 0.21 0.00 0.00 52.86 51.93 3ito s ASN 263 Cb -0.53 -2.42 0.00 0.00 -0.55 0.00 0.00 41.25 37.76 3ito s ASN 263 CO 0.63 -1.25 1.52 0.40 -2.79 0.00 0.00 177.10 175.61 3ito h ILE 264 N 5.97 1.27 0.00 -5.21 2.04 -1.98 -3.02 117.51 116.58 3ito h ILE 264 Ca -0.01 -1.47 -0.01 0.00 1.00 0.00 0.00 64.86 64.37 3ito h ILE 264 Cb 1.04 1.26 -0.00 0.00 -0.74 0.00 0.00 36.82 38.38 3ito h ILE 264 CO 1.16 0.50 -0.05 1.05 0.00 0.00 0.00 178.15 180.81 3ito h GLU 265 N 0.79 0.00 -0.32 2.37 9.09 -1.91 -1.73 114.58 122.88 3ito h GLU 265 Ca 0.08 0.00 -0.16 0.00 0.05 0.00 0.00 59.36 59.33 3ito h GLU 265 Cb 0.89 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.98 3ito h GLU 265 CO 0.08 0.05 -0.44 1.98 0.05 0.00 0.00 179.01 180.74 3ito h MET 266 N 0.00 0.85 -0.66 1.06 4.05 -1.93 -2.15 114.93 116.15 3ito h MET 266 Ca -0.00 -0.50 0.04 0.00 -0.28 0.00 0.00 59.70 58.97 3ito h MET 266 Cb 0.11 0.04 -0.05 0.00 -0.80 0.00 0.00 31.60 30.90 3ito h MET 266 CO 0.01 1.13 0.39 0.82 0.23 0.00 0.00 176.91 179.49 3ito h ILE 267 N 0.64 1.03 -0.26 1.77 2.04 -1.33 0.41 117.51 121.81 3ito h ILE 267 Ca 0.03 -0.25 0.04 0.00 1.00 0.00 0.00 64.86 65.68 3ito h ILE 267 Cb 1.04 0.22 -0.04 0.00 -0.74 0.00 0.00 36.82 37.30 3ito h ILE 267 CO 0.10 0.14 0.02 0.58 0.00 0.00 0.00 178.15 178.99 3ito h VAL 268 N 0.74 0.84 -0.56 1.67 2.07 -1.28 -0.83 116.25 118.90 3ito h VAL 268 Ca 0.28 -0.04 0.01 0.00 0.82 0.00 0.00 66.70 67.77 3ito h VAL 268 Cb 0.10 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 3ito h VAL 268 CO -0.14 0.02 0.37 0.00 0.02 0.00 0.00 177.57 177.84 3ito h ALA 269 N 1.21 0.71 -0.70 1.67 0.00 -0.65 -1.30 119.26 120.20 3ito h ALA 269 Ca 0.12 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3ito h ALA 269 Cb 0.15 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3ito h ALA 269 CO -0.19 0.14 0.42 0.00 0.00 0.00 0.00 179.25 179.62 3ito h ARG 270 N 0.75 0.96 -0.31 0.00 2.47 -0.46 -0.60 114.38 117.18 3ito h ARG 270 Ca 0.21 -0.09 -0.11 0.00 -1.26 0.00 0.00 59.98 58.72 3ito h ARG 270 Cb -0.07 -0.20 -0.01 0.00 -1.65 0.00 0.00 29.97 28.04 3ito h ARG 270 CO -0.05 0.68 -0.28 -0.07 0.56 0.00 0.00 179.97 180.81 3ito h LEU 271 N 0.96 0.66 -0.46 3.04 3.38 -0.88 -2.49 115.31 119.52 3ito h LEU 271 Ca 0.25 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 3ito h LEU 271 Cb -0.02 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 3ito h LEU 271 CO -0.05 0.91 -0.01 0.40 0.09 0.00 0.00 178.44 179.78 3ito h ILE 272 N 0.56 1.26 -0.95 1.22 2.04 -0.91 0.31 117.51 121.03 3ito h ILE 272 Ca 0.07 -1.07 0.06 0.00 1.00 0.00 0.00 64.86 64.93 3ito h ILE 272 Cb 0.76 1.04 -0.07 0.00 -0.74 0.00 0.00 36.82 37.82 3ito h ILE 272 CO 0.06 0.37 0.61 -0.61 0.00 0.00 0.00 178.15 178.58 3ito h GLN 273 N 0.67 1.07 -0.57 2.37 4.15 -0.89 -2.06 115.11 119.86 3ito h GLN 273 Ca 0.13 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.48 3ito h GLN 273 Cb 0.51 -0.24 0.00 0.00 0.21 0.00 0.00 27.48 27.96 3ito h GLN 273 CO 0.03 0.71 0.00 1.19 -1.93 0.00 0.00 178.83 178.83 3ito n PHE 274 N -4.54 1.96 -3.55 3.99 3.72 -0.96 -4.95 117.46 113.13 3ito n PHE 274 Ca 0.14 -0.72 -0.26 0.00 -0.05 0.00 0.00 57.45 56.56 3ito n PHE 274 Cb 0.18 -0.47 0.04 0.00 -0.94 0.00 0.00 39.48 38.29 3ito n PHE 274 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ito n GLY 275 N 0.63 -0.52 0.23 1.37 0.00 -0.68 -4.91 105.19 101.32 3ito n GLY 275 Ca 0.27 0.19 0.07 0.00 0.00 0.00 0.00 46.02 46.55 3ito n GLY 275 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ito n LYS 276 N -4.51 0.97 -2.88 1.61 4.76 0.99 -4.95 118.16 114.15 3ito n LYS 276 Ca -0.01 -2.23 -0.43 0.00 -2.87 0.00 0.00 58.31 52.77 3ito n LYS 276 Cb 0.56 -1.24 -0.03 0.00 -1.84 0.00 0.00 35.03 32.48 3ito n LYS 276 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3ito s LEU 277 N -2.15 4.68 0.11 -0.35 2.96 -1.18 -0.40 118.68 122.35 3ito s LEU 277 Ca 0.25 -1.52 -0.12 0.00 -0.22 0.00 0.00 54.13 52.51 3ito s LEU 277 Cb 0.22 -2.41 -0.13 0.00 0.50 0.00 0.00 46.19 44.36 3ito s LEU 277 CO 0.01 -1.26 1.33 1.23 -1.32 0.00 0.00 176.35 176.35 3ito h GLY 278 N 10.95 0.90 0.00 7.98 0.00 -0.74 -3.42 103.07 118.73 3ito h GLY 278 Ca -0.05 -1.21 0.00 0.00 0.00 0.00 0.00 47.33 46.06 3ito h GLY 278 CO 1.16 1.08 0.00 0.61 0.00 0.00 0.00 176.54 179.39 3ito n GLY 279 N 0.61 -1.70 3.43 4.60 0.00 -1.14 -0.67 105.19 110.32 3ito n GLY 279 Ca -0.07 -1.10 -0.25 0.00 0.00 0.00 0.00 46.02 44.60 3ito n GLY 279 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ito s PHE 280 N -2.20 2.24 -0.27 1.61 0.08 -0.81 -1.19 117.98 117.44 3ito s PHE 280 Ca 0.00 -0.36 0.00 0.00 0.12 0.00 0.00 56.93 56.69 3ito s PHE 280 Cb 0.00 -1.07 0.08 0.00 -0.57 0.00 0.00 43.02 41.46 3ito s PHE 280 CO 0.00 0.55 0.02 -1.01 -0.10 0.00 0.00 175.22 174.68 3ito s HIS 281 N -1.98 2.28 0.20 0.36 3.76 -0.58 -1.24 115.29 118.08 3ito s HIS 281 Ca 0.23 -1.87 -0.22 0.00 -0.15 0.00 0.00 55.06 53.06 3ito s HIS 281 Cb -0.07 -1.79 -0.08 0.00 1.11 0.00 0.00 32.58 31.75 3ito s HIS 281 CO 0.11 -0.82 0.75 -0.06 -0.85 0.00 0.00 174.74 173.87 3ito s PHE 282 N 1.43 3.75 0.00 1.40 0.08 0.12 -2.37 117.98 122.39 3ito s PHE 282 Ca 0.02 1.49 0.00 0.00 0.12 0.00 0.00 56.93 58.56 3ito s PHE 282 Cb -0.18 -2.68 0.00 0.00 -0.57 0.00 0.00 43.02 39.59 3ito s PHE 282 CO -0.12 0.40 0.00 0.27 -0.10 0.00 0.00 175.22 175.67 3ito n ASN 283 N 1.06 0.00 -4.31 1.36 0.23 -1.26 -1.36 115.26 110.98 3ito n ASN 283 Ca -0.04 0.00 -0.16 0.00 -0.53 0.00 0.00 54.58 53.85 3ito n ASN 283 Cb 0.50 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.10 3ito n ASN 283 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3ito s ASP 284 N 0.00 1.68 0.18 0.53 -1.08 -0.18 -4.58 116.67 113.22 3ito s ASP 284 Ca 0.00 -1.22 -0.24 0.00 -0.52 0.00 0.00 52.55 50.57 3ito s ASP 284 Cb 0.00 0.04 0.05 0.00 -1.46 0.00 0.00 42.92 41.55 3ito s ASP 284 CO 0.00 -0.53 0.83 -0.94 0.52 0.00 0.00 175.17 175.04 3ito s SER 285 N -3.28 -0.27 0.00 -0.34 1.04 -1.26 -0.86 113.70 108.73 3ito s SER 285 Ca 0.28 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.32 3ito s SER 285 Cb 0.06 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.75 3ito s SER 285 CO 0.08 -1.04 0.00 1.17 0.98 0.00 0.00 173.24 174.43 3ito n LYS 286 N -0.43 1.29 -0.00 4.02 4.81 -1.26 -4.77 118.16 121.82 3ito n LYS 286 Ca -0.07 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.33 3ito n LYS 286 Cb 0.61 -0.66 -0.01 0.00 0.02 0.00 0.00 35.03 34.99 3ito n LYS 286 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3ito n TYR 287 N -0.96 0.00 0.00 5.64 4.01 -1.26 -5.10 117.16 119.49 3ito n TYR 287 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3ito n TYR 287 Cb 0.15 -0.18 0.00 0.00 -0.31 0.00 0.00 39.34 39.01 3ito n TYR 287 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3ito n GLY 288 N 2.81 5.38 2.69 2.72 0.00 -1.26 -4.90 105.19 112.64 3ito n GLY 288 Ca -0.07 -0.83 -0.41 0.00 0.00 0.00 0.00 46.02 44.70 3ito n GLY 288 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3ito n ASP 289 N 0.00 6.01 0.27 1.61 2.03 -1.22 -4.71 116.55 120.54 3ito n ASP 289 Ca 0.00 -3.03 0.15 0.00 0.52 0.00 0.00 54.79 52.43 3ito n ASP 289 Cb 0.00 -1.48 0.78 0.00 -0.72 0.00 0.00 41.12 39.70 3ito n ASP 289 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 3ito h ASP 290 N 5.42 0.00 -5.93 1.67 3.32 -1.83 -3.47 116.42 115.59 3ito h ASP 290 Ca 0.55 0.00 -0.44 0.00 0.02 0.00 0.00 57.03 57.16 3ito h ASP 290 Cb 0.51 0.00 0.04 0.00 0.22 0.00 0.00 39.33 40.10 3ito h ASP 290 CO 1.65 0.09 -0.71 0.47 -1.72 0.00 0.00 179.24 179.02 3ito n ASP 291 N -3.48 -5.52 -4.91 6.45 8.00 -1.23 -4.77 116.55 111.09 3ito n ASP 291 Ca -0.02 -0.63 -0.27 0.00 0.71 0.00 0.00 54.79 54.59 3ito n ASP 291 Cb 0.23 -4.38 0.06 0.00 -0.02 0.00 0.00 41.12 37.01 3ito n ASP 291 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3ito s LEU 292 N -7.21 2.83 0.10 0.64 1.43 -0.04 -1.25 118.68 115.18 3ito s LEU 292 Ca 0.60 0.67 -0.33 0.00 -1.03 0.00 0.00 54.13 54.04 3ito s LEU 292 Cb -0.28 -3.34 -0.13 0.00 0.03 0.00 0.00 46.19 42.47 3ito s LEU 292 CO 0.74 -1.54 1.70 0.47 0.23 0.00 0.00 176.35 177.94 3ito n ASP 293 N -2.97 3.40 -4.60 2.29 9.92 -1.26 -1.01 116.55 122.32 3ito n ASP 293 Ca 0.07 1.04 -0.52 0.00 -0.53 0.00 0.00 54.79 54.85 3ito n ASP 293 Cb 0.60 -1.45 -0.06 0.00 -0.64 0.00 0.00 41.12 39.57 3ito n ASP 293 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3ito n ALA 294 N 4.53 -0.87 -0.69 2.24 0.00 -1.26 -1.35 120.51 123.11 3ito n ALA 294 Ca 0.18 0.51 0.00 0.00 0.00 0.00 0.00 53.44 54.13 3ito n ALA 294 Cb 0.31 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.67 3ito n ALA 294 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ito n GLY 295 N 2.60 1.15 0.22 0.00 0.00 -1.26 -4.74 105.19 103.16 3ito n GLY 295 Ca 0.19 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.35 3ito n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ito h ALA 296 N 0.00 1.00 0.00 4.61 0.00 -1.58 -3.28 119.26 120.01 3ito h ALA 296 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 3ito h ALA 296 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3ito h ALA 296 CO 0.00 0.00 -1.57 -0.89 0.00 0.00 0.00 179.25 176.79 3ito n ILE 297 N -2.85 0.55 -3.59 0.00 2.08 -1.26 -4.92 119.36 109.37 3ito n ILE 297 Ca 0.02 -0.14 -0.28 0.00 0.56 0.00 0.00 62.75 62.91 3ito n ILE 297 Cb 0.35 -1.62 -0.11 0.00 -0.75 0.00 0.00 39.64 37.51 3ito n ILE 297 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 3ito s GLU 298 N -2.19 1.42 0.35 0.38 2.02 -1.26 -4.98 118.70 114.45 3ito s GLU 298 Ca -0.14 -2.44 0.06 0.00 0.02 0.00 0.00 54.97 52.46 3ito s GLU 298 Cb 0.05 -2.14 0.66 0.00 0.10 0.00 0.00 34.13 32.80 3ito s GLU 298 CO 0.18 -1.32 1.89 -1.00 0.02 0.00 0.00 175.26 175.03 3ito h PRO 299 N 5.76 0.45 -0.68 0.39 0.13 -1.92 -2.95 132.00 133.18 3ito h PRO 299 Ca 0.19 -0.09 -0.06 0.00 -0.87 0.00 0.00 66.00 65.17 3ito h PRO 299 Cb 0.87 -0.07 -0.03 0.00 0.13 0.00 0.00 31.00 31.90 3ito h PRO 299 CO 0.49 0.50 0.21 -0.92 -0.23 0.00 0.00 178.00 178.05 3ito h TYR 300 N 0.43 1.10 -1.01 1.56 3.20 -1.93 -1.43 116.97 118.89 3ito h TYR 300 Ca 0.09 -0.11 0.02 0.00 3.14 0.00 0.00 58.73 61.87 3ito h TYR 300 Cb 0.33 -0.32 -0.05 0.00 1.54 0.00 0.00 36.73 38.23 3ito h TYR 300 CO 0.01 0.89 0.67 -0.09 -1.64 0.00 0.00 178.16 177.99 3ito h ARG 301 N 1.00 1.30 -0.80 1.82 2.43 -1.95 0.20 114.38 118.38 3ito h ARG 301 Ca 0.22 -0.08 -0.03 0.00 -0.81 0.00 0.00 59.98 59.28 3ito h ARG 301 Cb 0.30 -0.29 -0.04 0.00 -0.42 0.00 0.00 29.97 29.52 3ito h ARG 301 CO -0.01 0.86 0.36 1.25 -1.51 0.00 0.00 179.97 180.93 3ito h LEU 302 N 1.34 1.06 -0.41 3.80 5.85 -1.32 -1.22 115.31 124.40 3ito h LEU 302 Ca 0.38 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 3ito h LEU 302 Cb -0.11 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.63 3ito h LEU 302 CO -0.09 0.91 0.18 0.15 -0.34 0.00 0.00 178.44 179.25 3ito h PHE 303 N 1.14 0.61 -0.41 1.25 3.57 -0.14 -1.97 116.94 120.99 3ito h PHE 303 Ca 0.27 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.71 3ito h PHE 303 Cb 0.15 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 3ito h PHE 303 CO 0.01 0.52 0.15 -0.07 -2.23 0.00 0.00 178.31 176.69 3ito h LEU 304 N 0.53 0.53 -0.26 0.59 3.38 -0.16 0.40 115.31 120.31 3ito h LEU 304 Ca 0.14 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 3ito h LEU 304 Cb 0.15 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3ito h LEU 304 CO -0.01 0.50 -0.06 0.58 0.09 0.00 0.00 178.44 179.53 3ito h VAL 305 N 0.58 1.28 0.00 1.22 2.07 -1.00 -2.67 116.25 117.73 3ito h VAL 305 Ca 0.14 -1.08 -0.05 0.00 0.82 0.00 0.00 66.70 66.53 3ito h VAL 305 Cb 0.14 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 3ito h VAL 305 CO -0.01 0.34 -0.25 -0.26 0.02 0.00 0.00 177.57 177.41 3ito h PHE 306 N 0.26 0.00 -0.93 1.57 0.04 -0.56 -1.98 116.94 115.33 3ito h PHE 306 Ca 0.07 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.84 3ito h PHE 306 Cb 0.54 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.64 3ito h PHE 306 CO 0.05 0.25 0.60 -0.97 -0.60 0.00 0.00 178.31 177.64 3ito h ASN 307 N 0.00 1.09 -0.40 2.17 -1.24 0.10 0.23 115.58 117.52 3ito h ASN 307 Ca -0.00 -0.04 -0.12 0.00 0.71 0.00 0.00 56.30 56.85 3ito h ASN 307 Cb 0.51 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 39.28 3ito h ASN 307 CO 0.03 0.81 -0.21 -0.33 -1.29 0.00 0.00 177.43 176.44 3ito h GLU 308 N 1.27 0.85 -0.71 6.67 4.39 -1.16 -1.26 114.58 124.63 3ito h GLU 308 Ca 0.34 -0.38 -0.03 0.00 0.34 0.00 0.00 59.36 59.64 3ito h GLU 308 Cb -0.11 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.48 3ito h GLU 308 CO -0.07 1.02 0.34 -0.07 -1.16 0.00 0.00 179.01 179.07 3ito h LEU 309 N 0.67 0.93 -0.47 1.33 3.38 -0.83 -2.49 115.31 117.83 3ito h LEU 309 Ca 0.09 -0.13 -0.17 0.00 0.09 0.00 0.00 57.88 57.76 3ito h LEU 309 Cb 0.77 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 3ito h LEU 309 CO 0.06 0.80 -0.73 0.58 0.09 0.00 0.00 178.44 179.24 3ito h VAL 310 N 0.99 1.42 -0.49 1.22 2.07 -0.52 -1.09 116.25 119.86 3ito h VAL 310 Ca 0.24 -2.24 -0.04 0.00 0.82 0.00 0.00 66.70 65.48 3ito h VAL 310 Cb 0.12 2.19 -0.02 0.00 -1.52 0.00 0.00 31.29 32.05 3ito h VAL 310 CO -0.03 0.66 0.14 -0.78 0.02 0.00 0.00 177.57 177.58 3ito h ASP 311 N 0.17 0.67 0.06 0.57 1.82 -1.01 0.17 116.42 118.86 3ito h ASP 311 Ca -0.02 -0.10 -0.21 0.00 -0.39 0.00 0.00 57.03 56.30 3ito h ASP 311 Cb 1.29 -0.17 0.02 0.00 0.68 0.00 0.00 39.33 41.15 3ito h ASP 311 CO 0.11 0.64 -0.87 0.00 -1.61 0.00 0.00 179.24 177.52 3ito h ALA 312 N 1.45 0.03 0.00 -0.78 0.00 -1.36 -1.95 119.26 116.65 3ito h ALA 312 Ca 0.16 -0.66 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 3ito h ALA 312 Cb 0.23 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 3ito h ALA 312 CO -0.01 0.49 -0.05 1.49 0.00 0.00 0.00 179.25 181.17 3ito h GLU 313 N 0.02 0.00 0.01 0.00 4.81 -0.84 -2.33 114.58 116.25 3ito h GLU 313 Ca -0.13 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 58.81 3ito h GLU 313 Cb 1.59 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.92 3ito h GLU 313 CO 0.17 0.05 -1.72 0.00 -0.73 0.00 0.00 179.01 176.78 3ito n ALA 314 N -2.36 1.47 0.56 2.92 0.00 0.58 -3.97 120.51 119.71 3ito n ALA 314 Ca -0.03 -0.75 -0.03 0.00 0.00 0.00 0.00 53.44 52.63 3ito n ALA 314 Cb 0.14 -0.85 0.05 0.00 0.00 0.00 0.00 19.45 18.79 3ito n ALA 314 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3ito n ARG 315 N -3.07 1.46 -1.32 0.00 1.74 -0.74 -4.84 116.66 109.90 3ito n ARG 315 Ca -0.17 -0.64 -0.12 0.00 -0.77 0.00 0.00 57.85 56.15 3ito n ARG 315 Cb 1.05 -1.39 -0.05 0.00 -1.02 0.00 0.00 32.46 31.05 3ito n ARG 315 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ito n GLY 316 N 0.15 1.16 3.51 -0.13 0.00 -1.20 -4.79 105.19 103.89 3ito n GLY 316 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 3ito n GLY 316 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3ito n VAL 317 N -1.83 -0.02 -1.94 1.61 0.31 -0.94 -4.81 118.33 110.70 3ito n VAL 317 Ca -0.12 -0.23 -0.39 0.00 -0.01 0.00 0.00 64.34 63.59 3ito n VAL 317 Cb 0.43 -1.08 0.02 0.00 -0.91 0.00 0.00 33.84 32.30 3ito n VAL 317 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3ito s LYS 318 N 8.73 3.55 -1.08 5.55 1.02 -1.26 -3.36 119.74 132.89 3ito s LYS 318 Ca 1.26 2.16 -0.04 0.00 0.02 0.00 0.00 55.97 59.37 3ito s LYS 318 Cb -0.95 -2.48 0.00 0.00 -0.52 0.00 0.00 37.83 33.89 3ito s LYS 318 CO 0.43 -0.84 0.92 0.41 -0.92 0.00 0.00 175.35 175.36 3ito n GLY 319 N 0.63 -0.27 2.96 -3.33 0.00 -1.26 -4.98 105.19 98.94 3ito n GLY 319 Ca 0.07 0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 3ito n GLY 319 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3ito s PHE 320 N -3.28 3.22 -0.47 1.61 5.36 -1.21 -4.96 117.98 118.24 3ito s PHE 320 Ca 0.28 -3.14 0.07 0.00 -0.96 0.00 0.00 56.93 53.18 3ito s PHE 320 Cb -0.12 -2.85 0.25 0.00 -0.34 0.00 0.00 43.02 39.95 3ito s PHE 320 CO 0.61 -0.75 0.59 0.72 -1.46 0.00 0.00 175.22 174.92 3ito n HIS 321 N 3.17 0.95 -1.93 10.12 8.25 -1.26 -5.04 115.22 129.47 3ito n HIS 321 Ca 0.05 -3.75 -0.41 0.00 -0.26 0.00 0.00 57.72 53.35 3ito n HIS 321 Cb 0.33 -0.41 -0.01 0.00 1.12 0.00 0.00 29.99 31.02 3ito n HIS 321 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3ito s PRO 322 N -1.57 4.21 -0.53 -0.41 0.04 -1.26 -4.95 135.00 130.53 3ito s PRO 322 Ca 0.36 2.42 -0.24 0.00 0.04 0.00 0.00 61.00 63.58 3ito s PRO 322 Cb 0.16 -3.02 0.04 0.00 0.04 0.00 0.00 34.50 31.72 3ito s PRO 322 CO -0.08 -0.40 0.94 0.00 0.04 0.00 0.00 177.00 177.50 3ito s ALA 323 N -0.99 3.17 0.02 8.56 0.00 0.15 -4.90 121.76 127.79 3ito s ALA 323 Ca 0.52 -1.15 -0.18 0.00 0.00 0.00 0.00 51.96 51.16 3ito s ALA 323 Cb -0.44 -3.72 -0.06 0.00 0.00 0.00 0.00 23.12 18.91 3ito s ALA 323 CO 0.57 -2.32 0.51 -1.01 0.00 0.00 0.00 175.76 173.51 3ito s HIS 324 N 3.91 3.74 -0.03 0.00 3.76 -1.26 -1.93 115.29 123.48 3ito s HIS 324 Ca 0.32 1.14 -0.13 0.00 -0.15 0.00 0.00 55.06 56.24 3ito s HIS 324 Cb -0.12 -2.45 0.02 0.00 1.11 0.00 0.00 32.58 31.15 3ito s HIS 324 CO 0.21 0.55 0.29 1.41 -0.85 0.00 0.00 174.74 176.34 3ito s MET 325 N -0.85 0.59 -0.05 1.40 1.75 -0.37 -0.85 119.30 120.91 3ito s MET 325 Ca 0.27 -0.12 -0.18 0.00 -1.25 0.00 0.00 55.69 54.41 3ito s MET 325 Cb -0.18 0.26 -0.05 0.00 2.84 0.00 0.00 34.83 37.70 3ito s MET 325 CO 0.16 -0.15 0.50 0.42 -0.65 0.00 0.00 175.02 175.30 3ito s ILE 326 N -1.09 5.05 -0.33 10.11 1.01 -0.02 0.16 121.20 136.09 3ito s ILE 326 Ca -0.12 1.03 -0.01 0.00 0.00 0.00 0.00 60.65 61.55 3ito s ILE 326 Cb -0.05 -3.83 0.12 0.00 0.01 0.00 0.00 42.46 38.71 3ito s ILE 326 CO 0.03 0.42 0.17 0.21 0.00 0.00 0.00 174.94 175.77 3ito s ASN 327 N -0.06 3.35 0.26 3.58 2.47 -0.46 -3.76 114.94 120.33 3ito s ASN 327 Ca 0.27 -1.83 0.01 0.00 0.42 0.00 0.00 52.86 51.73 3ito s ASN 327 Cb -0.17 -0.49 -0.05 0.00 -1.45 0.00 0.00 41.25 39.10 3ito s ASN 327 CO 0.13 -0.37 0.12 -1.10 -3.72 0.00 0.00 177.10 172.16 3ito s GLN 328 N 1.45 1.42 -0.08 0.43 -0.21 -1.26 -4.55 119.66 116.85 3ito s GLN 328 Ca 0.14 -1.78 0.02 0.00 0.02 0.00 0.00 55.36 53.76 3ito s GLN 328 Cb -0.20 -0.15 0.01 0.00 1.00 0.00 0.00 33.01 33.68 3ito s GLN 328 CO -0.16 -0.34 -0.13 0.45 -2.12 0.00 0.00 175.29 172.99 3ito s SER 329 N -3.30 2.02 -0.44 5.90 0.15 -0.38 -4.75 113.70 112.90 3ito s SER 329 Ca 0.37 -0.34 -0.06 0.00 0.70 0.00 0.00 55.95 56.63 3ito s SER 329 Cb 0.07 -0.91 0.12 0.00 -1.71 0.00 0.00 66.02 63.59 3ito s SER 329 CO 0.14 0.02 0.28 -1.00 1.20 0.00 0.00 173.24 173.88 3ito s HIS 330 N 0.84 3.51 -0.13 3.44 0.09 -1.26 -4.63 115.29 117.14 3ito s HIS 330 Ca -0.11 -2.16 0.21 0.00 -0.00 0.00 0.00 55.06 53.00 3ito s HIS 330 Cb -0.15 -3.36 -0.18 0.00 -0.00 0.00 0.00 32.58 28.88 3ito s HIS 330 CO 0.02 -0.98 0.70 0.09 -0.00 0.00 0.00 174.74 174.56 3ito n ASN 331 N 4.73 0.42 -0.99 1.40 3.02 -1.26 -1.26 115.26 121.31 3ito n ASN 331 Ca -0.05 0.17 0.04 0.00 -0.03 0.00 0.00 54.58 54.71 3ito n ASN 331 Cb 0.41 1.12 0.05 0.00 -0.61 0.00 0.00 39.78 40.75 3ito n ASN 331 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 3ito n VAL 332 N -2.53 0.45 -4.06 2.41 0.24 -1.26 -4.81 118.33 108.77 3ito n VAL 332 Ca -0.06 -1.14 -0.10 0.00 -2.04 0.00 0.00 64.34 61.01 3ito n VAL 332 Cb 0.64 0.60 -0.08 0.00 -1.47 0.00 0.00 33.84 33.53 3ito n VAL 332 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3ito s THR 333 N -0.67 0.04 -0.25 3.34 -4.23 -1.26 -5.10 115.64 107.51 3ito s THR 333 Ca 0.25 -1.63 -0.29 0.00 -1.18 0.00 0.00 61.69 58.84 3ito s THR 333 Cb 0.27 -2.14 -0.01 0.00 1.34 0.00 0.00 72.50 71.96 3ito s THR 333 CO -0.09 -0.16 1.43 -0.62 -0.54 0.00 0.00 174.62 174.64 3ito s ASP 334 N -3.04 6.59 0.32 3.99 -1.08 -1.26 -4.88 116.67 117.29 3ito s ASP 334 Ca 0.25 1.46 0.08 0.00 -0.52 0.00 0.00 52.55 53.82 3ito s ASP 334 Cb 0.04 -2.54 0.91 0.00 -1.46 0.00 0.00 42.92 39.87 3ito s ASP 334 CO 0.06 -1.11 1.64 -0.65 0.52 0.00 0.00 175.17 175.63 3ito h PRO 335 N 9.74 0.20 -0.43 4.34 0.11 -1.88 -0.28 132.00 143.80 3ito h PRO 335 Ca -0.30 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.77 3ito h PRO 335 Cb 1.12 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 3ito h PRO 335 CO 1.01 0.13 0.15 0.82 -0.21 0.00 0.00 178.00 179.90 3ito h ILE 336 N 0.20 1.21 -0.55 4.15 2.04 -1.86 -1.19 117.51 121.51 3ito h ILE 336 Ca 0.65 -0.69 -0.02 0.00 1.00 0.00 0.00 64.86 65.80 3ito h ILE 336 Cb 1.43 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 38.35 3ito h ILE 336 CO -0.68 0.25 0.26 -0.33 0.00 0.00 0.00 178.15 177.64 3ito h GLU 337 N 0.55 0.80 -0.16 2.37 5.08 -1.47 -0.87 114.58 120.87 3ito h GLU 337 Ca 0.14 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3ito h GLU 337 Cb 0.24 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3ito h GLU 337 CO -0.01 0.66 0.08 0.77 -1.00 0.00 0.00 179.01 179.52 3ito h SER 338 N 0.74 0.22 -0.55 1.42 0.02 -1.25 -1.76 113.55 112.39 3ito h SER 338 Ca 0.19 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3ito h SER 338 Cb 0.14 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.59 3ito h SER 338 CO -0.02 0.28 0.35 -0.07 -1.14 0.00 0.00 176.83 176.23 3ito h LEU 339 N 0.13 0.66 0.48 5.07 3.38 -1.04 0.41 115.31 124.40 3ito h LEU 339 Ca 0.06 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3ito h LEU 339 Cb 0.13 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.72 3ito h LEU 339 CO -0.01 0.50 -0.23 0.40 0.09 0.00 0.00 178.44 179.19 3ito h ILE 340 N 0.77 0.51 0.00 1.22 2.04 -0.78 -1.33 117.51 119.93 3ito h ILE 340 Ca 0.20 -0.20 -0.04 0.00 1.00 0.00 0.00 64.86 65.83 3ito h ILE 340 Cb -0.05 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 3ito h ILE 340 CO -0.04 0.03 -0.18 0.78 0.00 0.00 0.00 178.15 178.74 3ito h ASN 341 N -0.77 0.00 -0.13 1.72 2.35 -1.06 -1.65 115.58 116.04 3ito h ASN 341 Ca -0.07 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.60 3ito h ASN 341 Cb 0.55 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.92 3ito h ASN 341 CO 0.11 0.18 -0.23 0.28 -1.65 0.00 0.00 177.43 176.12 3ito h SER 342 N 0.00 0.43 -0.64 5.81 0.02 -0.79 0.21 113.55 118.59 3ito h SER 342 Ca -0.00 -0.54 -0.01 0.00 -0.84 0.00 0.00 61.79 60.40 3ito h SER 342 Cb 0.54 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.93 3ito h SER 342 CO 0.02 0.89 0.38 0.00 -1.14 0.00 0.00 176.83 176.98 3ito h ALA 343 N 0.55 1.43 -0.20 3.77 0.00 -1.00 -1.31 119.26 122.51 3ito h ALA 343 Ca 0.01 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 3ito h ALA 343 Cb 0.81 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3ito h ALA 343 CO 0.05 0.48 0.05 -0.91 0.00 0.00 0.00 179.25 178.93 3ito h ASN 344 N 0.91 0.30 -0.56 0.00 -0.26 -1.08 -2.20 115.58 112.68 3ito h ASN 344 Ca 0.24 -0.22 0.00 0.00 -0.56 0.00 0.00 56.30 55.76 3ito h ASN 344 Cb -0.01 -0.08 -0.03 0.00 -1.06 0.00 0.00 38.32 37.15 3ito h ASN 344 CO -0.04 0.44 0.36 -0.33 -1.06 0.00 0.00 177.43 176.80 3ito h GLU 345 N 0.14 0.76 -0.45 0.81 4.39 -0.35 0.64 114.58 120.52 3ito h GLU 345 Ca 0.06 -0.05 -0.07 0.00 0.34 0.00 0.00 59.36 59.64 3ito h GLU 345 Cb 0.25 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 28.72 3ito h GLU 345 CO -0.00 0.51 -0.01 0.82 -1.16 0.00 0.00 179.01 179.17 3ito h ILE 346 N 0.78 1.26 0.00 3.13 2.04 -1.05 -0.67 117.51 122.99 3ito h ILE 346 Ca 0.21 -1.07 -0.10 0.00 1.00 0.00 0.00 64.86 64.90 3ito h ILE 346 Cb -0.07 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 3ito h ILE 346 CO -0.04 0.37 -0.47 0.03 0.00 0.00 0.00 178.15 178.03 3ito h ARG 347 N 0.65 0.00 0.02 2.37 3.08 -0.80 -1.56 114.38 118.14 3ito h ARG 347 Ca 0.13 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 3ito h ARG 347 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 3ito h ARG 347 CO 0.03 0.47 -0.01 -0.09 -1.07 0.00 0.00 179.97 179.29 3ito h ARG 348 N 0.00 -0.03 -0.55 0.04 2.43 -0.41 0.14 114.38 116.00 3ito h ARG 348 Ca -0.00 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 3ito h ARG 348 Cb 0.84 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.37 3ito h ARG 348 CO 0.06 0.17 0.16 0.00 -1.51 0.00 0.00 179.97 178.86 3ito h ALA 349 N 0.74 1.25 -0.05 2.80 0.00 -0.98 -1.25 119.26 121.78 3ito h ALA 349 Ca -0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 3ito h ALA 349 Cb 0.22 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3ito h ALA 349 CO 0.01 0.53 0.01 -0.92 0.00 0.00 0.00 179.25 178.88 3ito h TYR 350 N 0.80 0.07 -0.61 0.00 3.20 -1.04 -1.72 116.97 117.68 3ito h TYR 350 Ca 0.18 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.07 3ito h TYR 350 Cb 0.25 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.46 3ito h TYR 350 CO 0.01 0.26 0.38 0.00 -1.64 0.00 0.00 178.16 177.17 3ito h ALA 351 N 0.81 0.79 -0.43 1.82 0.00 -0.43 -1.77 119.26 120.06 3ito h ALA 351 Ca 0.01 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3ito h ALA 351 Cb 0.22 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3ito h ALA 351 CO -0.00 0.12 0.01 1.96 0.00 0.00 0.00 179.25 181.34 3ito h GLN 352 N 0.74 0.68 -0.10 0.00 4.20 -1.17 -1.73 115.11 117.73 3ito h GLN 352 Ca 0.25 -0.16 -0.05 0.00 0.06 0.00 0.00 58.65 58.74 3ito h GLN 352 Cb 0.02 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 3ito h GLN 352 CO -0.10 0.69 -0.19 0.00 -0.67 0.00 0.00 178.83 178.56 3ito h ALA 353 N 1.37 1.50 0.00 3.87 0.00 -0.65 -1.84 119.26 123.52 3ito h ALA 353 Ca 0.13 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3ito h ALA 353 Cb 0.38 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 3ito h ALA 353 CO 0.01 0.36 -0.07 -0.07 0.00 0.00 0.00 179.25 179.48 3ito h LEU 354 N 0.15 0.00 0.00 0.00 3.38 -0.48 -2.93 115.31 115.43 3ito h LEU 354 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3ito h LEU 354 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3ito h LEU 354 CO 0.03 0.07 -0.13 0.18 0.09 0.00 0.00 178.44 178.68 3ito n LEU 355 N -3.19 0.37 -4.71 1.67 4.77 -0.69 -4.88 117.00 110.35 3ito n LEU 355 Ca 0.01 0.43 -0.42 0.00 -0.03 0.00 0.00 56.01 55.99 3ito n LEU 355 Cb 0.35 -0.38 -0.03 0.00 -2.33 0.00 0.00 43.42 41.03 3ito n LEU 355 CO 0.29 -0.04 1.35 -0.69 -1.33 0.00 0.00 177.39 176.97 3ito s VAL 356 N -3.05 2.50 -0.97 4.08 1.01 -1.11 -4.78 120.40 118.09 3ito s VAL 356 Ca 0.12 0.23 -0.24 0.00 0.00 0.00 0.00 61.98 62.10 3ito s VAL 356 Cb 0.16 -3.15 0.03 0.00 0.00 0.00 0.00 36.38 33.42 3ito s VAL 356 CO 0.59 0.01 1.53 -0.62 0.00 0.00 0.00 175.10 176.61 3ito s ASP 357 N 1.76 6.22 0.28 3.32 -1.08 -1.26 -4.84 116.67 121.07 3ito s ASP 357 Ca 0.75 -1.21 0.00 0.00 -0.52 0.00 0.00 52.55 51.57 3ito s ASP 357 Cb -0.45 -2.57 0.51 0.00 -1.46 0.00 0.00 42.92 38.95 3ito s ASP 357 CO 0.33 -1.76 1.85 0.03 0.52 0.00 0.00 175.17 176.14 3ito h ARG 358 N 10.16 1.02 -0.31 4.34 2.47 -1.96 -0.23 114.38 129.87 3ito h ARG 358 Ca 0.14 -0.06 -0.04 0.00 -1.26 0.00 0.00 59.98 58.76 3ito h ARG 358 Cb 1.02 -0.23 -0.01 0.00 -1.65 0.00 0.00 29.97 29.09 3ito h ARG 358 CO 1.38 0.68 0.05 0.00 0.56 0.00 0.00 179.97 182.63 3ito h ALA 359 N 1.52 0.42 -0.30 0.04 0.00 -1.99 -1.02 119.26 117.91 3ito h ALA 359 Ca 0.48 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 3ito h ALA 359 Cb 0.39 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3ito h ALA 359 CO -0.24 0.12 0.11 0.00 0.00 0.00 0.00 179.25 179.24 3ito h ALA 360 N 0.88 0.39 -0.26 0.00 0.00 -1.83 -2.02 119.26 116.43 3ito h ALA 360 Ca 0.09 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.90 3ito h ALA 360 Cb 0.35 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3ito h ALA 360 CO 0.01 0.00 0.09 1.25 0.00 0.00 0.00 179.25 180.59 3ito h LEU 361 N 0.34 0.09 -1.03 0.00 5.85 -0.97 -1.61 115.31 117.98 3ito h LEU 361 Ca 0.10 0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.92 3ito h LEU 361 Cb 0.20 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.18 3ito h LEU 361 CO -0.01 0.09 0.64 -1.28 -0.34 0.00 0.00 178.44 177.54 3ito h SER 362 N 0.20 1.00 -0.31 1.25 0.87 -1.05 0.21 113.55 115.73 3ito h SER 362 Ca 0.11 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.67 3ito h SER 362 Cb 0.08 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 3ito h SER 362 CO -0.12 0.62 0.11 1.23 -0.53 0.00 0.00 176.83 178.14 3ito h GLY 363 N 1.12 0.50 1.84 5.77 0.00 -0.62 -0.94 103.07 110.74 3ito h GLY 363 Ca 0.44 -0.29 -0.08 0.00 0.00 0.00 0.00 47.33 47.40 3ito h GLY 363 CO -0.19 0.27 -0.32 -0.97 0.00 0.00 0.00 176.54 175.33 3ito h TYR 364 N 0.34 0.21 -0.11 5.60 0.05 -0.68 -1.05 116.97 121.32 3ito h TYR 364 Ca 0.10 -0.04 -0.03 0.00 0.05 0.00 0.00 58.73 58.81 3ito h TYR 364 Cb 0.22 -0.05 -0.00 0.00 1.01 0.00 0.00 36.73 37.90 3ito h TYR 364 CO 0.00 0.49 -0.04 1.96 -1.05 0.00 0.00 178.16 179.52 3ito h GLN 365 N 0.16 0.22 -0.44 4.88 4.20 -0.74 0.13 115.11 123.52 3ito h GLN 365 Ca 0.02 -0.09 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 3ito h GLN 365 Cb 0.66 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.41 3ito h GLN 365 CO 0.05 0.55 0.21 0.93 -0.67 0.00 0.00 178.83 179.90 3ito h GLU 366 N -0.12 0.62 -0.01 1.46 4.39 -0.92 -1.76 114.58 118.24 3ito h GLU 366 Ca 0.03 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.65 3ito h GLU 366 Cb 0.48 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 3ito h GLU 366 CO 0.01 0.49 -0.05 -0.25 -1.16 0.00 0.00 179.01 178.05 3ito n ASP 367 N -4.39 0.95 -3.57 1.42 8.00 -0.42 -4.93 116.55 113.61 3ito n ASP 367 Ca 0.03 -1.16 -0.25 0.00 0.71 0.00 0.00 54.79 54.13 3ito n ASP 367 Cb 0.13 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.29 3ito n ASP 367 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3ito n ASN 368 N -0.37 -6.10 -4.25 -2.24 4.13 -0.41 -4.90 115.26 101.13 3ito n ASN 368 Ca 0.18 -0.54 -0.44 0.00 1.68 0.00 0.00 54.58 55.46 3ito n ASN 368 Cb 0.29 -4.82 0.00 0.00 -1.54 0.00 0.00 39.78 33.71 3ito n ASN 368 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 3ito n ASP 369 N -2.91 5.54 -0.21 6.41 -0.08 0.31 -4.87 116.55 120.74 3ito n ASP 369 Ca -0.00 -3.10 0.01 0.00 -1.51 0.00 0.00 54.79 50.19 3ito n ASP 369 Cb 0.56 -1.43 0.12 0.00 2.34 0.00 0.00 41.12 42.71 3ito n ASP 369 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3ito h ALA 370 N 6.45 0.81 0.15 -1.67 0.00 -1.91 -0.71 119.26 122.39 3ito h ALA 370 Ca 0.26 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.26 3ito h ALA 370 Cb 0.79 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 3ito h ALA 370 CO 1.23 -0.20 -0.14 1.25 0.00 0.00 0.00 179.25 181.38 3ito h LEU 371 N 0.40 -0.38 -1.17 0.00 5.85 -1.97 -0.95 115.31 117.10 3ito h LEU 371 Ca 0.32 0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.99 3ito h LEU 371 Cb 0.41 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 3ito h LEU 371 CO -0.33 -0.22 -0.41 0.24 -0.34 0.00 0.00 178.44 177.38 3ito h MET 372 N -0.32 0.00 -0.25 1.25 2.86 -1.92 -0.57 114.93 115.98 3ito h MET 372 Ca 0.00 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 3ito h MET 372 Cb 0.30 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.95 3ito h MET 372 CO -0.04 0.41 0.01 0.00 1.06 0.00 0.00 176.91 178.35 3ito h ALA 373 N 1.59 0.33 -0.18 6.32 0.00 -0.81 0.18 119.26 126.71 3ito h ALA 373 Ca -0.00 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.55 3ito h ALA 373 Cb 0.74 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 3ito h ALA 373 CO 0.05 0.06 -0.50 0.00 0.00 0.00 0.00 179.25 178.87 3ito h THR 374 N 0.21 1.32 0.00 0.00 1.03 -1.00 -2.69 112.91 111.79 3ito h THR 374 Ca 0.07 -1.72 -0.06 0.00 -0.01 0.00 0.00 66.41 64.68 3ito h THR 374 Cb 0.40 1.73 -0.01 0.00 -1.07 0.00 0.00 68.15 69.20 3ito h THR 374 CO 0.01 0.53 -0.31 -0.08 -0.01 0.00 0.00 175.52 175.66 3ito h GLU 375 N 0.38 0.00 -0.36 0.00 4.57 -0.93 -1.31 114.58 116.93 3ito h GLU 375 Ca 0.02 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 58.09 3ito h GLU 375 Cb 1.00 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.58 3ito h GLU 375 CO 0.09 0.31 -0.22 1.15 -1.18 0.00 0.00 179.01 179.16 3ito h THR 376 N 0.00 1.27 -0.22 0.32 2.02 -0.62 -0.62 112.91 115.06 3ito h THR 376 Ca -0.00 -1.30 -0.14 0.00 0.77 0.00 0.00 66.41 65.74 3ito h THR 376 Cb 0.62 1.23 0.00 0.00 -1.74 0.00 0.00 68.15 68.26 3ito h THR 376 CO 0.04 0.43 -0.40 -0.07 0.37 0.00 0.00 175.52 175.90 3ito h LEU 377 N 0.61 0.73 -1.35 2.58 3.38 -1.29 -3.18 115.31 116.79 3ito h LEU 377 Ca 0.09 -0.54 -0.04 0.00 0.09 0.00 0.00 57.88 57.48 3ito h LEU 377 Cb 0.70 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 3ito h LEU 377 CO 0.05 1.13 0.02 0.11 0.09 0.00 0.00 178.44 179.84 3ito h LYS 378 N 0.35 0.45 -0.30 1.13 1.79 -1.04 -0.63 116.57 118.33 3ito h LYS 378 Ca 0.01 -0.08 -0.02 0.00 -2.18 0.00 0.00 60.65 58.38 3ito h LYS 378 Cb 0.99 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.55 3ito h LYS 378 CO 0.09 0.47 0.12 0.00 -1.08 0.00 0.00 179.45 179.04 3ito h ARG 379 N 0.44 0.42 0.06 3.15 3.08 -1.10 0.45 114.38 120.88 3ito h ARG 379 Ca 0.10 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 60.01 3ito h ARG 379 Cb 0.26 -0.08 0.01 0.00 0.08 0.00 0.00 29.97 30.24 3ito h ARG 379 CO 0.01 0.35 -0.41 0.00 -1.07 0.00 0.00 179.97 178.85 3ito h ALA 380 N 1.72 -0.03 -0.71 0.04 0.00 -1.41 -3.29 119.26 115.57 3ito h ALA 380 Ca 0.11 -0.58 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 3ito h ALA 380 Cb 0.09 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3ito h ALA 380 CO -0.01 0.18 0.31 -0.92 0.00 0.00 0.00 179.25 178.82 3ito h TYR 381 N -0.61 1.03 0.00 0.00 3.20 -0.75 -2.52 116.97 117.33 3ito h TYR 381 Ca -0.07 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.75 3ito h TYR 381 Cb 1.28 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 39.23 3ito h TYR 381 CO 0.22 0.77 0.00 0.00 -1.64 0.00 0.00 178.16 177.51 3ito h ARG 382 N 1.02 0.00 -6.39 1.82 3.08 -0.23 -3.44 114.38 110.24 3ito h ARG 382 Ca 0.24 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.75 3ito h ARG 382 Cb 0.15 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.20 3ito h ARG 382 CO -0.03 0.00 0.91 0.99 -1.07 0.00 0.00 179.97 180.77 3ito s THR 383 N -3.55 3.45 -0.66 2.04 2.01 -0.95 -4.93 115.64 113.05 3ito s THR 383 Ca 0.02 0.85 -0.27 0.00 0.31 0.00 0.00 61.69 62.60 3ito s THR 383 Cb 0.09 -3.55 0.03 0.00 0.01 0.00 0.00 72.50 69.09 3ito s THR 383 CO 0.47 -0.01 1.22 -0.62 -0.69 0.00 0.00 174.62 175.00 3ito s ASP 384 N 2.15 6.29 0.00 3.53 2.15 -1.26 -4.85 116.67 124.68 3ito s ASP 384 Ca 0.68 -0.22 0.15 0.00 0.43 0.00 0.00 52.55 53.59 3ito s ASP 384 Cb -0.35 -2.55 0.43 0.00 -0.30 0.00 0.00 42.92 40.16 3ito s ASP 384 CO 0.29 -1.65 1.36 1.33 -0.17 0.00 0.00 175.17 176.32 3ito n VAL 385 N 6.49 0.60 -0.30 1.11 0.24 -1.26 -4.45 118.33 120.76 3ito n VAL 385 Ca 0.05 -0.62 0.16 0.00 -2.04 0.00 0.00 64.34 61.89 3ito n VAL 385 Cb 0.49 0.33 0.41 0.00 -1.47 0.00 0.00 33.84 33.60 3ito n VAL 385 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3ito h GLU 386 N 2.77 0.59 -0.68 7.34 4.57 -1.98 0.13 114.58 127.31 3ito h GLU 386 Ca 0.00 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.12 3ito h GLU 386 Cb 0.63 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 29.06 3ito h GLU 386 CO 0.00 0.39 0.34 -1.35 -1.18 0.00 0.00 179.01 177.21 3ito h PRO 387 N 0.60 0.96 -0.39 0.92 0.11 -1.92 0.95 132.00 133.24 3ito h PRO 387 Ca 0.53 -0.12 -0.08 0.00 0.11 0.00 0.00 66.00 66.44 3ito h PRO 387 Cb 1.03 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.94 3ito h PRO 387 CO -0.28 0.74 -0.06 0.82 -0.21 0.00 0.00 178.00 179.01 3ito h ILE 388 N 0.96 1.27 -0.56 4.15 2.04 -1.33 0.34 117.51 124.39 3ito h ILE 388 Ca 0.24 -1.11 -0.04 0.00 1.00 0.00 0.00 64.86 64.95 3ito h ILE 388 Cb 0.08 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 3ito h ILE 388 CO -0.03 0.37 0.20 -0.07 0.00 0.00 0.00 178.15 178.61 3ito h LEU 389 N 0.53 0.79 -0.34 1.44 4.07 -0.91 -0.33 115.31 120.56 3ito h LEU 389 Ca 0.10 -0.19 -0.09 0.00 0.08 0.00 0.00 57.88 57.78 3ito h LEU 389 Cb 0.56 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.08 3ito h LEU 389 CO 0.03 0.77 -0.14 0.00 -1.08 0.00 0.00 178.44 178.02 3ito h ALA 390 N 1.05 0.48 -0.55 1.53 0.00 -0.72 -2.41 119.26 118.63 3ito h ALA 390 Ca 0.18 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 3ito h ALA 390 Cb 0.24 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3ito h ALA 390 CO -0.01 0.38 0.03 1.49 0.00 0.00 0.00 179.25 181.13 3ito h GLU 391 N 0.48 0.93 -0.53 0.00 4.57 -0.83 -1.03 114.58 118.17 3ito h GLU 391 Ca 0.08 -0.26 -0.00 0.00 -1.18 0.00 0.00 59.36 58.00 3ito h GLU 391 Cb 0.67 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 29.13 3ito h GLU 391 CO 0.05 0.91 0.33 0.00 -1.18 0.00 0.00 179.01 179.11 3ito h ALA 392 N 1.15 0.68 -0.30 2.92 0.00 -0.96 -0.43 119.26 122.33 3ito h ALA 392 Ca 0.17 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 3ito h ALA 392 Cb 0.48 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3ito h ALA 392 CO 0.02 0.15 0.06 0.00 0.00 0.00 0.00 179.25 179.48 3ito h ARG 393 N 0.72 0.48 -0.24 0.00 3.08 -1.17 -2.72 114.38 114.53 3ito h ARG 393 Ca 0.19 -0.12 0.03 0.00 0.07 0.00 0.00 59.98 60.15 3ito h ARG 393 Cb -0.03 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 29.93 3ito h ARG 393 CO -0.04 0.57 0.07 -0.09 -1.07 0.00 0.00 179.97 179.41 3ito h ARG 394 N 0.32 0.17 0.00 0.04 2.43 -0.86 1.06 114.38 117.53 3ito h ARG 394 Ca 0.09 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 3ito h ARG 394 Cb 0.31 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 3ito h ARG 394 CO 0.00 0.11 0.00 0.54 -1.51 0.00 0.00 179.97 179.11 3ito n ARG 395 N -5.06 0.15 -0.22 0.20 1.74 -0.20 -2.74 116.66 110.53 3ito n ARG 395 Ca -0.02 0.41 0.06 0.00 -0.77 0.00 0.00 57.85 57.53 3ito n ARG 395 Cb 0.09 -1.80 0.16 0.00 -1.02 0.00 0.00 32.46 29.90 3ito n ARG 395 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3ito n THR 396 N -2.07 1.36 -0.43 0.55 -2.24 -0.88 -4.96 114.28 105.61 3ito n THR 396 Ca 0.02 -1.27 0.00 0.00 -2.27 0.00 0.00 64.05 60.53 3ito n THR 396 Cb 0.19 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 3ito n THR 396 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ito n GLY 397 N 0.06 0.77 0.00 3.38 0.00 -1.00 -5.01 105.19 103.39 3ito n GLY 397 Ca 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3ito n GLY 397 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ito n GLY 398 N -2.43 1.72 3.65 -0.02 0.00 0.36 -4.80 105.19 103.67 3ito n GLY 398 Ca 0.00 -2.08 -0.35 0.00 0.00 0.00 0.00 46.02 43.59 3ito n GLY 398 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ito s ALA 399 N -2.14 3.24 0.16 4.61 0.00 -0.07 -4.17 121.76 123.40 3ito s ALA 399 Ca 0.00 -0.81 -0.15 0.00 0.00 0.00 0.00 51.96 51.00 3ito s ALA 399 Cb 0.00 -1.51 0.09 0.00 0.00 0.00 0.00 23.12 21.70 3ito s ALA 399 CO 0.00 0.51 1.77 0.28 0.00 0.00 0.00 175.76 178.31 3ito h VAL 400 N 4.35 0.92 -3.24 0.00 2.07 -1.88 -3.27 116.25 115.21 3ito h VAL 400 Ca -0.47 -0.12 -0.63 0.00 0.82 0.00 0.00 66.70 66.30 3ito h VAL 400 Cb 1.19 0.53 -0.41 0.00 -1.52 0.00 0.00 31.29 31.08 3ito h VAL 400 CO 0.57 0.07 -0.65 -0.62 0.02 0.00 0.00 177.57 176.95 3ito s ASP 401 N -5.41 4.18 0.23 0.57 -1.08 -1.26 -4.68 116.67 109.21 3ito s ASP 401 Ca -0.13 -3.04 -0.10 0.00 -0.52 0.00 0.00 52.55 48.76 3ito s ASP 401 Cb 0.13 -1.49 0.34 0.00 -1.46 0.00 0.00 42.92 40.44 3ito s ASP 401 CO 0.72 -0.22 1.65 -0.65 0.52 0.00 0.00 175.17 177.19 3ito h PRO 402 N 6.39 0.10 -0.30 4.34 0.11 -1.86 -1.39 132.00 139.39 3ito h PRO 402 Ca -0.03 -0.01 -0.17 0.00 0.11 0.00 0.00 66.00 65.90 3ito h PRO 402 Cb 0.88 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.97 3ito h PRO 402 CO 0.64 0.07 -0.48 0.28 -0.21 0.00 0.00 178.00 178.29 3ito h VAL 403 N 0.10 1.28 -0.65 3.15 2.07 -1.94 -0.51 116.25 119.75 3ito h VAL 403 Ca 0.36 -1.67 -0.00 0.00 0.82 0.00 0.00 66.70 66.21 3ito h VAL 403 Cb 0.59 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.92 3ito h VAL 403 CO -0.59 0.55 0.40 0.00 0.02 0.00 0.00 177.57 177.94 3ito h ALA 404 N 0.69 0.83 -0.61 1.67 0.00 -1.91 0.10 119.26 120.03 3ito h ALA 404 Ca 0.03 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 3ito h ALA 404 Cb 1.09 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 3ito h ALA 404 CO 0.11 0.29 -0.01 1.15 0.00 0.00 0.00 179.25 180.79 3ito h THR 405 N 0.88 1.27 -0.39 0.00 2.02 -1.19 -1.06 112.91 114.43 3ito h THR 405 Ca 0.23 -1.17 0.01 0.00 0.77 0.00 0.00 66.41 66.25 3ito h THR 405 Cb -0.04 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 3ito h THR 405 CO -0.05 0.43 0.25 0.22 0.37 0.00 0.00 175.52 176.74 3ito h TYR 406 N 0.98 0.47 -0.26 3.16 3.20 -0.44 -0.94 116.97 123.14 3ito h TYR 406 Ca 0.17 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.94 3ito h TYR 406 Cb 0.57 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 3ito h TYR 406 CO 0.04 0.29 -0.33 0.00 -1.64 0.00 0.00 178.16 176.52 3ito h ARG 407 N 0.51 0.56 0.00 1.82 3.08 -0.84 -2.87 114.38 116.63 3ito h ARG 407 Ca 0.15 -0.25 -0.06 0.00 0.07 0.00 0.00 59.98 59.89 3ito h ARG 407 Cb -0.03 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 3ito h ARG 407 CO -0.05 0.81 -0.29 0.00 -1.07 0.00 0.00 179.97 179.38 3ito h ALA 408 N 1.17 1.20 0.00 0.04 0.00 -0.79 -2.93 119.26 117.96 3ito h ALA 408 Ca 0.06 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 3ito h ALA 408 Cb 0.80 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3ito h ALA 408 CO 0.07 0.36 -0.48 0.66 0.00 0.00 0.00 179.25 179.86 3ito h SER 409 N 0.00 0.00 -0.11 0.00 4.64 -0.95 -3.47 113.55 113.65 3ito h SER 409 Ca -0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 3ito h SER 409 Cb 0.65 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.72 3ito h SER 409 CO 0.04 0.48 -0.04 0.61 -0.87 0.00 0.00 176.83 177.05 3ito n GLY 410 N 0.57 0.58 0.20 -0.77 0.00 -1.11 -4.95 105.19 99.71 3ito n GLY 410 Ca 0.00 -0.56 -0.03 0.00 0.00 0.00 0.00 46.02 45.43 3ito n GLY 410 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3ito h TYR 411 N 0.00 -0.27 -0.68 1.61 3.20 -1.86 -1.32 116.97 117.65 3ito h TYR 411 Ca -0.05 0.05 0.07 0.00 3.14 0.00 0.00 58.73 61.94 3ito h TYR 411 Cb 0.23 0.20 -0.06 0.00 1.54 0.00 0.00 36.73 38.63 3ito h TYR 411 CO 0.11 -0.22 0.36 -0.09 -1.64 0.00 0.00 178.16 176.68 3ito h ARG 412 N -0.00 0.62 -0.76 1.82 9.65 -1.92 -0.63 114.38 123.15 3ito h ARG 412 Ca 0.24 -0.04 -0.04 0.00 -1.10 0.00 0.00 59.98 59.04 3ito h ARG 412 Cb 0.37 -0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 28.77 3ito h ARG 412 CO -0.51 0.41 0.32 0.00 2.80 0.00 0.00 179.97 182.99 3ito h ALA 413 N 1.38 1.14 0.80 2.80 0.00 -1.75 -1.04 119.26 122.59 3ito h ALA 413 Ca 0.32 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 3ito h ALA 413 Cb 0.26 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 17.75 3ito h ALA 413 CO -0.22 0.63 -0.39 -0.09 0.00 0.00 0.00 179.25 179.19 3ito h ARG 414 N 1.09 -1.04 0.00 0.00 2.43 -0.12 -2.49 114.38 114.25 3ito h ARG 414 Ca 0.26 0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.47 3ito h ARG 414 Cb 0.17 0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 29.96 3ito h ARG 414 CO -0.03 -0.68 -0.12 -0.39 -1.51 0.00 0.00 179.97 177.25 3ito h VAL 415 N -1.19 0.77 -0.23 0.20 -1.51 -1.16 -0.95 116.25 112.18 3ito h VAL 415 Ca -0.11 -0.45 -0.05 0.00 -1.23 0.00 0.00 66.70 64.86 3ito h VAL 415 Cb 0.84 1.27 -0.01 0.00 -2.13 0.00 0.00 31.29 31.26 3ito h VAL 415 CO 0.18 0.11 -0.06 0.00 -1.23 0.00 0.00 177.57 176.57 3ito h ALA 416 N 1.88 1.47 0.00 5.19 0.00 -1.02 0.20 119.26 126.99 3ito h ALA 416 Ca -0.00 -0.19 -0.20 0.00 0.00 0.00 0.00 54.91 54.52 3ito h ALA 416 Cb 0.26 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3ito h ALA 416 CO 0.02 0.37 -0.94 0.00 0.00 0.00 0.00 179.25 178.70 3ito h ALA 417 N 1.60 0.42 0.00 0.00 0.00 -0.73 -3.33 119.26 117.22 3ito h ALA 417 Ca 0.07 -0.86 -0.19 0.00 0.00 0.00 0.00 54.91 53.94 3ito h ALA 417 Cb 0.33 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 3ito h ALA 417 CO 0.02 1.18 -1.05 0.93 0.00 0.00 0.00 179.25 180.32 3ito h GLU 418 N 0.00 0.00 -6.17 0.00 5.08 -0.90 -3.47 114.58 109.12 3ito h GLU 418 Ca -0.01 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.72 3ito h GLU 418 Cb 1.69 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.86 3ito h GLU 418 CO 0.12 0.65 -0.59 1.03 -1.00 0.00 0.00 179.01 179.22 3ito s ARG 419 N -2.80 2.91 0.74 2.33 0.52 0.00 -5.09 118.95 117.56 3ito s ARG 419 Ca 0.00 -0.71 -0.15 0.00 -0.52 0.00 0.00 55.73 54.36 3ito s ARG 419 Cb 0.09 -2.73 0.04 0.00 0.52 0.00 0.00 34.95 32.87 3ito s ARG 419 CO 0.80 0.56 1.19 -1.25 0.02 0.00 0.00 175.30 176.62 3ito s PRO 420 N -2.51 2.13 0.61 3.54 0.04 -1.26 -4.76 135.00 132.79 3ito s PRO 420 Ca 0.30 1.71 -0.16 0.00 0.04 0.00 0.00 61.00 62.89 3ito s PRO 420 Cb -0.12 -1.84 -0.03 0.00 0.04 0.00 0.00 34.50 32.56 3ito s PRO 420 CO 0.23 -1.83 1.09 0.00 0.04 0.00 0.00 177.00 176.52 3ito s ALA 421 N -2.06 2.62 0.33 8.56 0.00 -1.26 -4.63 121.76 125.32 3ito s ALA 421 Ca 0.73 0.53 0.09 0.00 0.00 0.00 0.00 51.96 53.30 3ito s ALA 421 Cb -0.28 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.51 3ito s ALA 421 CO 0.46 -0.98 0.10 -1.12 0.00 0.00 0.00 175.76 174.22 3ito s SER 422 N -2.52 4.57 0.00 0.00 0.01 -1.26 -5.08 113.70 109.42 3ito s SER 422 Ca 0.66 -0.80 0.07 0.00 1.31 0.00 0.00 55.95 57.20 3ito s SER 422 Cb -0.19 -0.71 -0.02 0.00 0.21 0.00 0.00 66.02 65.31 3ito s SER 422 CO 0.37 -0.25 -0.22 0.68 0.41 0.00 0.00 173.24 174.23 3ito s VAL 423 N -2.43 1.76 0.60 3.43 -7.23 -1.26 -5.01 120.40 110.26 3ito s VAL 423 Ca 0.36 -1.04 -0.13 0.00 -1.81 0.00 0.00 61.98 59.36 3ito s VAL 423 Cb -0.02 -1.48 -0.04 0.00 0.56 0.00 0.00 36.38 35.40 3ito s VAL 423 CO 0.22 0.41 1.03 0.00 -0.31 0.00 0.00 175.10 176.45 3ito s ALA 424 N -0.61 2.94 0.19 1.32 0.00 -1.26 -4.74 121.76 119.59 3ito s ALA 424 Ca 0.09 0.11 -0.15 0.00 0.00 0.00 0.00 51.96 52.00 3ito s ALA 424 Cb -0.09 -3.14 0.05 0.00 0.00 0.00 0.00 23.12 19.95 3ito s ALA 424 CO 0.00 -0.70 0.74 0.41 0.00 0.00 0.00 175.76 176.21 3ito n GLY 425 N -1.95 0.89 3.93 0.00 0.00 -0.98 -5.01 105.19 102.07 3ito n GLY 425 Ca 0.07 -1.13 -0.26 0.00 0.00 0.00 0.00 46.02 44.70 3ito n GLY 425 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ito s GLY 426 N -2.94 1.68 0.00 -0.02 0.00 -1.26 -0.82 107.32 103.96 3ito s GLY 426 Ca 0.16 -0.91 0.00 0.00 0.00 0.00 0.00 44.72 43.97 3ito s GLY 426 CO 0.06 -0.49 0.00 0.61 0.00 0.00 0.00 173.10 173.28 3ito n GLY 427 N -2.98 0.35 0.00 0.20 0.00 -0.91 -4.55 105.19 97.30 3ito n GLY 427 Ca 0.08 -1.87 0.02 0.00 0.00 0.00 0.00 46.02 44.25 3ito n GLY 427 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ito n GLY 428 N 5.00 -0.81 0.33 -0.02 0.00 -1.15 -3.86 105.19 104.68 3ito n GLY 428 Ca 0.00 -0.02 0.09 0.00 0.00 0.00 0.00 46.02 46.09 3ito n GLY 428 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3ito h ILE 429 N 0.00 0.98 0.00 -0.61 2.10 -1.74 -3.51 117.51 114.73 3ito h ILE 429 Ca 0.00 -0.14 0.00 0.00 1.08 0.00 0.00 64.86 65.80 3ito h ILE 429 Cb 0.00 0.52 0.00 0.00 -1.09 0.00 0.00 36.82 36.25 3ito h ILE 429 CO 0.00 0.08 0.00 2.30 -1.08 0.00 0.00 178.15 179.45