#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xwo s THR 17 N 0.00 -0.64 -0.10 0.44 -4.23 -1.26 -5.02 115.64 104.84 1xwo s THR 17 Ca 0.00 -0.37 -0.19 0.00 -1.18 0.00 0.00 61.69 59.95 1xwo s THR 17 Cb 0.00 -0.83 -0.15 0.00 1.34 0.00 0.00 72.50 72.86 1xwo s THR 17 CO 0.00 -0.29 0.62 -0.78 -0.54 0.00 0.00 174.62 173.63 1xwo h ASP 18 N 7.83 -0.07 -0.00 3.99 3.58 -2.06 -2.33 116.42 127.36 1xwo h ASP 18 Ca -0.04 -0.50 0.00 0.00 0.42 0.00 0.00 57.03 56.91 1xwo h ASP 18 Cb 1.12 0.02 -0.00 0.00 1.72 0.00 0.00 39.33 42.19 1xwo h ASP 18 CO 0.23 0.63 0.01 1.55 -2.88 0.00 0.00 179.24 178.78 1xwo h PRO 19 N -0.94 0.00 0.02 0.28 0.13 -1.99 0.15 132.00 129.65 1xwo h PRO 19 Ca -0.01 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.87 1xwo h PRO 19 Cb 0.56 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.66 1xwo h PRO 19 CO 0.01 0.00 -1.32 0.82 -0.23 0.00 0.00 178.00 177.28 1xwo h ILE 20 N 0.00 1.34 -0.20 -3.56 2.04 -1.97 -3.06 117.51 112.11 1xwo h ILE 20 Ca 0.00 -3.09 0.06 0.00 1.00 0.00 0.00 64.86 62.83 1xwo h ILE 20 Cb 0.02 2.70 -0.01 0.00 -0.74 0.00 0.00 36.82 38.78 1xwo h ILE 20 CO -0.00 0.79 0.14 -0.03 0.00 0.00 0.00 178.15 179.05 1xwo h MET 21 N 0.01 0.00 0.00 2.37 1.85 -0.12 0.41 114.93 119.45 1xwo h MET 21 Ca -0.14 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.95 1xwo h MET 21 Cb 1.89 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.92 1xwo h MET 21 CO 0.12 0.00 -0.13 1.04 -0.40 0.00 0.00 176.91 177.54 1xwo n GLN 22 N -4.48 0.19 0.18 0.39 6.02 -0.93 -3.69 117.38 115.07 1xwo n GLN 22 Ca 0.02 0.13 0.07 0.00 -0.01 0.00 0.00 57.00 57.21 1xwo n GLN 22 Cb 0.28 -1.70 0.18 0.00 1.02 0.00 0.00 30.24 30.03 1xwo n GLN 22 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.06 176.57 1xwo h MET 23 N 0.00 0.00 0.00 -1.09 2.86 -0.11 -3.24 114.93 113.35 1xwo h MET 23 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1xwo h MET 23 Cb 0.67 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.33 1xwo h MET 23 CO 0.00 0.32 -0.01 -0.07 1.06 0.00 0.00 176.91 178.20 1xwo h LEU 24 N 0.00 0.00 -1.79 1.22 3.38 -1.63 -3.34 115.31 113.15 1xwo h LEU 24 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xwo h LEU 24 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1xwo h LEU 24 CO 0.04 0.16 0.00 -1.54 0.09 0.00 0.00 178.44 177.19 1xwo n SER 25 N -2.86 0.36 -3.98 -0.43 3.41 -1.26 -4.55 113.62 104.31 1xwo n SER 25 Ca -0.00 -0.28 -0.14 0.00 -0.26 0.00 0.00 58.87 58.19 1xwo n SER 25 Cb 0.01 -0.07 -0.13 0.00 -0.26 0.00 0.00 64.21 63.76 1xwo n SER 25 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1xwo s THR 26 N 0.48 0.36 -0.39 6.66 -1.32 -1.22 -4.96 115.64 115.26 1xwo s THR 26 Ca 0.00 -0.53 0.06 0.00 -1.21 0.00 0.00 61.69 60.01 1xwo s THR 26 Cb 0.00 -0.37 0.30 0.00 -1.51 0.00 0.00 72.50 70.91 1xwo s THR 26 CO 0.00 -0.12 1.24 -1.54 -2.21 0.00 0.00 174.62 171.99 1xwo n SER 27 N 2.36 -1.77 -0.36 8.08 3.41 -1.26 -4.94 113.62 119.14 1xwo n SER 27 Ca -0.17 -2.52 0.10 0.00 -0.26 0.00 0.00 58.87 56.02 1xwo n SER 27 Cb 0.57 1.26 0.28 0.00 -0.26 0.00 0.00 64.21 66.06 1xwo n SER 27 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 1xwo h MET 28 N 2.09 0.86 -0.53 4.33 2.86 -1.90 0.88 114.93 123.52 1xwo h MET 28 Ca -0.30 -0.05 0.06 0.00 -2.06 0.00 0.00 59.70 57.34 1xwo h MET 28 Cb 1.23 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 32.67 1xwo h MET 28 CO -0.04 0.57 0.35 0.66 1.06 0.00 0.00 176.91 179.51 1xwo h SER 29 N 0.88 0.43 0.15 1.22 4.64 -1.94 -2.80 113.55 116.13 1xwo h SER 29 Ca 0.54 -0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.50 1xwo h SER 29 Cb 0.69 -0.09 -0.05 0.00 -0.31 0.00 0.00 62.40 62.64 1xwo h SER 29 CO -0.32 0.28 -2.16 0.35 -0.87 0.00 0.00 176.83 174.12 1xwo n THR 30 N -4.47 1.55 -0.20 2.95 -2.24 0.39 -4.35 114.28 107.91 1xwo n THR 30 Ca 0.07 -0.73 0.13 0.00 -2.27 0.00 0.00 64.05 61.25 1xwo n THR 30 Cb 0.23 -1.11 0.44 0.00 -2.10 0.00 0.00 70.33 67.79 1xwo n THR 30 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1xwo h GLU 31 N 0.02 0.55 -0.16 -0.78 4.39 0.81 -1.91 114.58 117.49 1xwo h GLU 31 Ca -0.46 -0.03 0.05 0.00 0.34 0.00 0.00 59.36 59.25 1xwo h GLU 31 Cb 2.06 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 30.58 1xwo h GLU 31 CO 0.03 0.36 0.21 1.96 -1.16 0.00 0.00 179.01 180.41 1xwo h GLN 32 N 0.56 0.00 0.00 2.33 4.20 -1.70 0.13 115.11 120.64 1xwo h GLN 32 Ca 0.38 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.09 1xwo h GLN 32 Cb 0.69 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.47 1xwo h GLN 32 CO -0.14 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 178.02 1xwo h ARG 33 N 0.00 0.00 -0.46 1.46 2.47 -1.60 -2.19 114.38 114.06 1xwo h ARG 33 Ca 0.08 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 1xwo h ARG 33 Cb 0.50 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.82 1xwo h ARG 33 CO -0.00 0.00 0.00 1.28 0.56 0.00 0.00 179.97 181.81 1xwo n LEU 34 N -2.61 5.02 0.25 3.04 7.99 0.03 -4.69 117.00 126.03 1xwo n LEU 34 Ca -0.01 -2.96 -0.15 0.00 -0.01 0.00 0.00 56.01 52.89 1xwo n LEU 34 Cb 0.11 -0.63 -0.08 0.00 -0.11 0.00 0.00 43.42 42.71 1xwo n LEU 34 CO 0.17 0.65 0.52 0.77 -1.51 0.00 0.00 177.39 177.99 1xwo h SER 35 N 3.16 -1.09 -0.06 -1.43 4.64 -1.55 -1.84 113.55 115.39 1xwo h SER 35 Ca 0.00 0.08 0.03 0.00 -0.47 0.00 0.00 61.79 61.43 1xwo h SER 35 Cb 1.77 0.35 -0.03 0.00 -0.31 0.00 0.00 62.40 64.18 1xwo h SER 35 CO 0.39 -0.54 -0.11 -0.08 -0.87 0.00 0.00 176.83 175.61 1xwo h GLU 36 N -0.83 -0.16 -0.65 4.77 4.57 -1.85 -1.70 114.58 118.73 1xwo h GLU 36 Ca -0.06 0.01 0.06 0.00 -1.18 0.00 0.00 59.36 58.20 1xwo h GLU 36 Cb 0.71 0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 29.28 1xwo h GLU 36 CO -0.03 -0.10 0.35 -0.39 -1.18 0.00 0.00 179.01 177.66 1xwo h VAL 37 N -0.16 0.95 -0.07 0.32 -1.51 -1.87 0.12 116.25 114.03 1xwo h VAL 37 Ca 0.06 -0.22 0.03 0.00 -1.23 0.00 0.00 66.70 65.34 1xwo h VAL 37 Cb 0.25 0.25 -0.03 0.00 -2.13 0.00 0.00 31.29 29.62 1xwo h VAL 37 CO -0.16 0.12 -0.12 -0.78 -1.23 0.00 0.00 177.57 175.39 1xwo h ASP 38 N 0.65 -0.38 -0.29 4.19 -0.00 -0.92 -0.84 116.42 118.84 1xwo h ASP 38 Ca 0.29 0.07 -0.01 0.00 -0.00 0.00 0.00 57.03 57.38 1xwo h ASP 38 Cb 0.20 0.17 -0.02 0.00 -0.00 0.00 0.00 39.33 39.69 1xwo h ASP 38 CO -0.19 -0.17 0.15 0.40 -0.00 0.00 0.00 179.24 179.43 1xwo h ILE 39 N -0.18 1.12 -0.47 2.25 2.04 -0.74 -1.38 117.51 120.16 1xwo h ILE 39 Ca 0.07 -0.36 0.03 0.00 1.00 0.00 0.00 64.86 65.59 1xwo h ILE 39 Cb 0.27 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 1xwo h ILE 39 CO -0.17 0.14 0.27 1.56 0.00 0.00 0.00 178.15 179.95 1xwo h GLN 40 N 0.46 0.52 -0.06 2.37 1.08 0.57 -1.45 115.11 118.60 1xwo h GLN 40 Ca 0.12 -0.03 -0.20 0.00 -1.45 0.00 0.00 58.65 57.09 1xwo h GLN 40 Cb 0.07 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 27.38 1xwo h GLN 40 CO -0.01 0.34 -0.79 0.00 -0.95 0.00 0.00 178.83 177.42 1xwo h ALA 41 N 1.22 0.51 -0.93 3.87 0.00 -0.74 -1.40 119.26 121.79 1xwo h ALA 41 Ca 0.19 -0.64 0.01 0.00 0.00 0.00 0.00 54.91 54.48 1xwo h ALA 41 Cb 0.04 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 1xwo h ALA 41 CO -0.10 0.77 0.62 0.77 0.00 0.00 0.00 179.25 181.31 1xwo h SER 42 N 0.28 1.07 -0.05 0.00 0.02 -0.91 0.44 113.55 114.41 1xwo h SER 42 Ca -0.04 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.86 1xwo h SER 42 Cb 1.39 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 63.66 1xwo h SER 42 CO 0.14 0.78 -0.02 0.40 -1.14 0.00 0.00 176.83 176.99 1xwo h ILE 43 N 1.27 1.32 -0.77 3.27 2.04 -1.22 0.24 117.51 123.66 1xwo h ILE 43 Ca 0.34 -0.99 0.07 0.00 1.00 0.00 0.00 64.86 65.29 1xwo h ILE 43 Cb -0.15 1.88 -0.05 0.00 -0.74 0.00 0.00 36.82 37.76 1xwo h ILE 43 CO -0.07 0.27 0.51 0.00 0.00 0.00 0.00 178.15 178.85 1xwo h ALA 44 N 0.63 1.68 0.02 1.87 0.00 -0.49 -1.21 119.26 121.76 1xwo h ALA 44 Ca 0.01 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 1xwo h ALA 44 Cb 0.44 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.04 1xwo h ALA 44 CO 0.01 0.18 -0.50 -0.92 0.00 0.00 0.00 179.25 178.02 1xwo h TYR 45 N 0.80 0.47 -0.14 0.00 5.03 -0.03 -3.08 116.97 120.02 1xwo h TYR 45 Ca 0.34 -0.27 0.05 0.00 2.58 0.00 0.00 58.73 61.43 1xwo h TYR 45 Cb 0.30 -0.05 -0.06 0.00 1.55 0.00 0.00 36.73 38.47 1xwo h TYR 45 CO -0.00 1.10 -0.22 0.00 -1.32 0.00 0.00 178.16 177.72 1xwo h ALA 46 N 0.26 -0.18 -0.93 1.82 0.00 -0.20 0.23 119.26 120.26 1xwo h ALA 46 Ca -0.07 0.04 0.17 0.00 0.00 0.00 0.00 54.91 55.05 1xwo h ALA 46 Cb 1.25 0.43 -0.10 0.00 0.00 0.00 0.00 17.79 19.37 1xwo h ALA 46 CO 0.10 -0.68 0.53 0.87 0.00 0.00 0.00 179.25 180.07 1xwo h LYS 47 N -0.28 0.68 0.00 0.00 1.57 -1.28 0.22 116.57 117.49 1xwo h LYS 47 Ca 0.10 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.73 1xwo h LYS 47 Cb 0.43 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 1xwo h LYS 47 CO -0.30 0.45 -0.53 0.00 -0.57 0.00 0.00 179.45 178.51 1xwo h ALA 48 N 1.60 0.99 -0.46 3.86 0.00 -1.18 -2.36 119.26 121.71 1xwo h ALA 48 Ca 0.52 -0.48 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1xwo h ALA 48 Cb 0.77 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1xwo h ALA 48 CO -0.37 0.66 -0.11 1.25 0.00 0.00 0.00 179.25 180.67 1xwo h LEU 49 N 0.00 0.84 -0.48 0.00 5.85 0.26 -1.72 115.31 120.06 1xwo h LEU 49 Ca -0.01 -0.26 -0.16 0.00 0.84 0.00 0.00 57.88 58.29 1xwo h LEU 49 Cb 1.02 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 1xwo h LEU 49 CO 0.07 0.97 -0.50 -0.08 -0.34 0.00 0.00 178.44 178.56 1xwo h GLU 50 N 0.76 0.68 0.00 1.25 4.22 -1.05 -0.99 114.58 119.45 1xwo h GLU 50 Ca 0.12 -0.40 0.00 0.00 0.08 0.00 0.00 59.36 59.16 1xwo h GLU 50 Cb 0.62 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1xwo h GLU 50 CO 0.04 1.02 0.00 1.17 -2.18 0.00 0.00 179.01 179.06 1xwo n LYS 51 N -4.00 0.14 0.00 1.92 0.00 -0.90 -1.33 118.16 113.98 1xwo n LYS 51 Ca -0.03 0.42 0.10 0.00 0.00 0.00 0.00 58.31 58.80 1xwo n LYS 51 Cb 0.58 -1.79 -0.10 0.00 0.00 0.00 0.00 35.03 33.72 1xwo n LYS 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1xwo n ALA 52 N -1.70 4.18 0.00 3.14 0.00 -0.69 -4.97 120.51 120.47 1xwo n ALA 52 Ca 0.02 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.90 1xwo n ALA 52 Cb 0.18 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 18.83 1xwo n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xwo n GLY 53 N 1.44 0.60 0.30 0.00 0.00 -0.45 -4.91 105.19 102.18 1xwo n GLY 53 Ca 0.02 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.24 1xwo n GLY 53 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1xwo h ILE 54 N 0.00 0.00 -3.66 -0.61 5.03 -1.44 -3.41 117.51 113.42 1xwo h ILE 54 Ca 0.00 -0.29 -0.47 0.00 -0.12 0.00 0.00 64.86 63.98 1xwo h ILE 54 Cb 0.00 1.29 -0.32 0.00 -3.03 0.00 0.00 36.82 34.76 1xwo h ILE 54 CO 0.00 0.00 -0.80 -0.76 -0.68 0.00 0.00 178.15 175.91 1xwo s LEU 55 N -6.17 1.69 0.62 1.44 1.43 -1.17 -4.95 118.68 111.57 1xwo s LEU 55 Ca -0.02 -0.23 -0.14 0.00 -1.03 0.00 0.00 54.13 52.71 1xwo s LEU 55 Cb 0.11 -0.67 -0.03 0.00 0.03 0.00 0.00 46.19 45.64 1xwo s LEU 55 CO 0.49 0.05 1.05 0.42 0.23 0.00 0.00 176.35 178.59 1xwo s THR 56 N 0.42 3.98 0.33 5.49 -4.23 -1.26 -4.36 115.64 115.99 1xwo s THR 56 Ca -0.08 0.83 0.09 0.00 -1.18 0.00 0.00 61.69 61.35 1xwo s THR 56 Cb -0.12 -3.43 0.32 0.00 1.34 0.00 0.00 72.50 70.61 1xwo s THR 56 CO 0.02 -0.66 1.76 0.11 -0.54 0.00 0.00 174.62 175.31 1xwo h LYS 57 N 0.08 0.62 -0.12 3.99 1.57 -1.98 0.06 116.57 120.79 1xwo h LYS 57 Ca -0.46 -0.04 -0.20 0.00 -1.87 0.00 0.00 60.65 58.09 1xwo h LYS 57 Cb 1.21 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.38 1xwo h LYS 57 CO 0.58 0.41 -0.73 1.15 -0.57 0.00 0.00 179.45 180.28 1xwo h THR 58 N 0.64 1.33 -0.62 -0.16 2.02 -2.00 -2.61 112.91 111.51 1xwo h THR 58 Ca 0.60 -2.04 -0.08 0.00 0.77 0.00 0.00 66.41 65.66 1xwo h THR 58 Cb 1.11 2.03 -0.02 0.00 -1.74 0.00 0.00 68.15 69.52 1xwo h THR 58 CO -0.39 0.63 0.07 -0.33 0.37 0.00 0.00 175.52 175.87 1xwo h GLU 59 N 0.40 1.04 0.52 6.66 5.08 -1.45 -3.01 114.58 123.83 1xwo h GLU 59 Ca -0.04 -0.29 -0.03 0.00 -1.00 0.00 0.00 59.36 58.00 1xwo h GLU 59 Cb 1.33 -0.11 0.01 0.00 0.50 0.00 0.00 28.75 30.47 1xwo h GLU 59 CO 0.14 0.99 -0.25 1.25 -1.00 0.00 0.00 179.01 180.13 1xwo h LEU 60 N 0.95 -0.60 -1.52 1.33 5.85 -1.05 -2.27 115.31 118.00 1xwo h LEU 60 Ca 0.18 0.01 0.26 0.00 0.84 0.00 0.00 57.88 59.17 1xwo h LEU 60 Cb 0.47 0.15 -0.08 0.00 0.37 0.00 0.00 40.66 41.58 1xwo h LEU 60 CO 0.02 -0.41 0.67 -0.08 -0.34 0.00 0.00 178.44 178.30 1xwo h GLU 61 N -0.73 0.32 -0.04 1.25 4.81 -1.44 0.77 114.58 119.51 1xwo h GLU 61 Ca -0.07 -0.02 -0.19 0.00 -0.13 0.00 0.00 59.36 58.95 1xwo h GLU 61 Cb 0.55 -0.07 0.01 0.00 0.63 0.00 0.00 28.75 29.87 1xwo h GLU 61 CO 0.12 0.21 -0.72 0.87 -0.73 0.00 0.00 179.01 178.75 1xwo h LYS 62 N 0.33 0.57 -0.58 1.92 1.57 -1.36 -0.74 116.57 118.28 1xwo h LYS 62 Ca 0.54 -0.55 -0.06 0.00 -1.87 0.00 0.00 60.65 58.71 1xwo h LYS 62 Cb 1.51 0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.94 1xwo h LYS 62 CO -0.21 1.17 0.11 0.82 -0.57 0.00 0.00 179.45 180.78 1xwo h ILE 63 N 0.17 1.24 -0.09 1.86 2.04 -0.57 0.18 117.51 122.34 1xwo h ILE 63 Ca -0.08 -0.90 -0.13 0.00 1.00 0.00 0.00 64.86 64.74 1xwo h ILE 63 Cb 1.39 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 1xwo h ILE 63 CO 0.14 0.34 -0.54 -0.07 0.00 0.00 0.00 178.15 178.02 1xwo h LEU 64 N 0.87 0.30 -0.36 1.44 3.38 -0.91 0.22 115.31 120.25 1xwo h LEU 64 Ca 0.18 -0.16 -0.17 0.00 0.09 0.00 0.00 57.88 57.82 1xwo h LEU 64 Cb 0.35 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1xwo h LEU 64 CO 0.00 0.78 -0.48 -1.28 0.09 0.00 0.00 178.44 177.56 1xwo h SER 65 N 0.21 0.96 -0.09 -0.43 0.87 -0.55 -2.18 113.55 112.35 1xwo h SER 65 Ca 0.00 -0.48 -0.01 0.00 -1.23 0.00 0.00 61.79 60.07 1xwo h SER 65 Cb 1.01 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.70 1xwo h SER 65 CO 0.08 1.28 0.01 1.23 -0.53 0.00 0.00 176.83 178.90 1xwo h GLY 66 N 0.76 0.15 0.78 5.77 0.00 -0.32 -2.55 103.07 107.67 1xwo h GLY 66 Ca 0.03 -0.10 0.07 0.00 0.00 0.00 0.00 47.33 47.34 1xwo h GLY 66 CO 0.11 0.09 0.60 1.41 0.00 0.00 0.00 176.54 178.76 1xwo h LEU 67 N -0.09 0.92 -0.98 3.11 4.07 -0.95 -1.62 115.31 119.77 1xwo h LEU 67 Ca 0.03 0.01 -0.09 0.00 0.08 0.00 0.00 57.88 57.91 1xwo h LEU 67 Cb 0.28 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 41.82 1xwo h LEU 67 CO 0.00 0.58 -0.24 -0.33 -1.08 0.00 0.00 178.44 177.37 1xwo h GLU 68 N 1.04 0.46 -0.08 1.13 5.08 -1.26 -0.82 114.58 120.13 1xwo h GLU 68 Ca 0.41 -0.17 -0.14 0.00 -1.00 0.00 0.00 59.36 58.46 1xwo h GLU 68 Cb 0.25 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1xwo h GLU 68 CO -0.16 0.67 -0.59 0.87 -1.00 0.00 0.00 179.01 178.79 1xwo h LYS 69 N 0.41 0.25 0.02 2.33 1.57 -0.90 -1.66 116.57 118.59 1xwo h LYS 69 Ca 0.06 -0.17 -0.20 0.00 -1.87 0.00 0.00 60.65 58.47 1xwo h LYS 69 Cb 0.64 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.96 1xwo h LYS 69 CO 0.05 0.77 -0.93 0.82 -0.57 0.00 0.00 179.45 179.59 1xwo h ILE 70 N 0.19 1.57 -0.05 1.86 2.04 -1.06 -1.55 117.51 120.52 1xwo h ILE 70 Ca -0.00 -2.91 -0.00 0.00 1.00 0.00 0.00 64.86 62.95 1xwo h ILE 70 Cb 1.09 2.62 -0.00 0.00 -0.74 0.00 0.00 36.82 39.79 1xwo h ILE 70 CO 0.09 0.84 0.02 -1.28 0.00 0.00 0.00 178.15 177.82 1xwo h SER 71 N 0.05 0.07 -0.21 1.72 0.87 -0.96 -1.90 113.55 113.19 1xwo h SER 71 Ca -0.04 -0.13 -0.09 0.00 -1.23 0.00 0.00 61.79 60.31 1xwo h SER 71 Cb 1.60 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 63.52 1xwo h SER 71 CO 0.13 0.18 -0.15 -0.33 -0.53 0.00 0.00 176.83 176.13 1xwo h GLU 72 N -0.05 0.62 -0.75 2.24 4.39 -1.28 -1.89 114.58 117.86 1xwo h GLU 72 Ca 0.02 -0.20 -0.01 0.00 0.34 0.00 0.00 59.36 59.51 1xwo h GLU 72 Cb 0.13 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 28.69 1xwo h GLU 72 CO -0.00 0.74 0.43 0.93 -1.16 0.00 0.00 179.01 179.95 1xwo h GLU 73 N 0.56 1.03 -0.21 2.33 5.08 -1.08 -0.81 114.58 121.48 1xwo h GLU 73 Ca 0.10 -0.11 -0.08 0.00 -1.00 0.00 0.00 59.36 58.27 1xwo h GLU 73 Cb 0.58 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 1xwo h GLU 73 CO 0.04 0.75 -0.17 -1.49 -1.00 0.00 0.00 179.01 177.14 1xwo h TRP 74 N 1.03 0.57 -0.07 4.33 4.06 -1.15 0.36 115.95 125.07 1xwo h TRP 74 Ca 0.27 -0.16 0.04 0.00 2.06 0.00 0.00 58.89 61.09 1xwo h TRP 74 Cb 0.00 -0.12 -0.06 0.00 -1.00 0.00 0.00 29.16 27.98 1xwo h TRP 74 CO -0.00 0.81 -0.40 0.77 -3.56 0.00 0.00 178.44 176.06 1xwo h SER 75 N 0.17 -1.23 0.00 -3.49 0.02 -0.99 0.22 113.55 108.25 1xwo h SER 75 Ca 0.04 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 1xwo h SER 75 Cb 0.69 0.50 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1xwo h SER 75 CO 0.04 -0.43 0.00 0.29 -1.14 0.00 0.00 176.83 175.60 1xwo n LYS 76 N -5.44 0.69 -1.54 3.45 5.02 -0.34 -4.77 118.16 115.23 1xwo n LYS 76 Ca -0.05 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.18 1xwo n LYS 76 Cb 0.36 -1.30 -0.02 0.00 -0.02 0.00 0.00 35.03 34.05 1xwo n LYS 76 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xwo n GLY 77 N 0.16 0.30 1.25 0.72 0.00 0.78 -4.73 105.19 103.66 1xwo n GLY 77 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1xwo n GLY 77 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1xwo n VAL 78 N -1.84 1.10 -3.00 1.61 0.24 0.02 -4.95 118.33 111.52 1xwo n VAL 78 Ca -0.07 -0.90 -0.36 0.00 -2.04 0.00 0.00 64.34 60.97 1xwo n VAL 78 Cb 0.30 0.29 -0.06 0.00 -1.47 0.00 0.00 33.84 32.90 1xwo n VAL 78 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1xwo s PHE 79 N -1.40 3.66 -0.10 6.34 5.36 -0.64 -4.91 117.98 126.29 1xwo s PHE 79 Ca 0.43 1.52 0.02 0.00 -0.96 0.00 0.00 56.93 57.93 1xwo s PHE 79 Cb 0.24 -2.72 0.02 0.00 -0.34 0.00 0.00 43.02 40.22 1xwo s PHE 79 CO 0.26 0.30 -0.14 0.54 -1.46 0.00 0.00 175.22 174.71 1xwo s VAL 80 N -1.55 1.41 -0.02 3.12 0.11 -1.26 -5.01 120.40 117.19 1xwo s VAL 80 Ca 0.45 -0.59 -0.06 0.00 -2.93 0.00 0.00 61.98 58.85 1xwo s VAL 80 Cb -0.17 -1.30 -0.05 0.00 -1.53 0.00 0.00 36.38 33.34 1xwo s VAL 80 CO 0.22 0.42 0.24 0.68 -3.33 0.00 0.00 175.10 173.33 1xwo s VAL 81 N 1.00 5.35 0.36 2.04 -7.23 -1.26 -5.07 120.40 115.59 1xwo s VAL 81 Ca -0.07 0.15 0.03 0.00 -1.81 0.00 0.00 61.98 60.29 1xwo s VAL 81 Cb -0.15 -3.54 -0.02 0.00 0.56 0.00 0.00 36.38 33.24 1xwo s VAL 81 CO -0.01 0.41 0.53 -0.89 -0.31 0.00 0.00 175.10 174.83 1xwo s THR 82 N -1.24 4.47 -2.00 5.32 2.01 -1.26 -4.96 115.64 117.97 1xwo s THR 82 Ca 0.25 -0.72 0.04 0.00 0.31 0.00 0.00 61.69 61.56 1xwo s THR 82 Cb -0.13 -3.60 0.11 0.00 0.01 0.00 0.00 72.50 68.89 1xwo s THR 82 CO 0.14 -0.33 0.71 0.00 -0.69 0.00 0.00 174.62 174.46 1xwo n GLN 83 N -1.77 0.49 -0.00 4.92 3.00 -1.26 -1.72 117.38 121.03 1xwo n GLN 83 Ca -0.02 0.00 0.07 0.00 -0.01 0.00 0.00 57.00 57.04 1xwo n GLN 83 Cb 0.57 -1.13 -0.10 0.00 0.00 0.00 0.00 30.24 29.58 1xwo n GLN 83 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 1xwo n SER 84 N -0.63 1.47 -4.58 1.08 3.41 -1.26 -4.94 113.62 108.18 1xwo n SER 84 Ca 0.03 -0.20 -0.41 0.00 -0.26 0.00 0.00 58.87 58.03 1xwo n SER 84 Cb 0.01 1.49 -0.03 0.00 -0.26 0.00 0.00 64.21 65.43 1xwo n SER 84 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1xwo s ASP 85 N -3.32 5.61 0.00 4.04 1.11 -0.70 -4.93 116.67 118.48 1xwo s ASP 85 Ca -0.03 0.88 0.00 0.00 0.18 0.00 0.00 52.55 53.58 1xwo s ASP 85 Cb 0.09 -2.53 0.00 0.00 1.07 0.00 0.00 42.92 41.56 1xwo s ASP 85 CO 0.59 -2.01 0.45 -0.62 1.18 0.00 0.00 175.17 174.76 1xwo n GLU 86 N 8.74 0.00 -2.73 8.23 1.02 -1.26 -4.87 120.64 129.76 1xwo n GLU 86 Ca 0.22 0.32 -0.10 0.00 -0.02 0.00 0.00 57.16 57.59 1xwo n GLU 86 Cb 0.49 -1.10 -0.02 0.00 -0.02 0.00 0.00 31.44 30.80 1xwo n GLU 86 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1xwo n ASP 87 N -1.47 2.30 -0.12 1.62 5.68 -1.26 -4.13 116.55 119.18 1xwo n ASP 87 Ca 0.00 -1.67 -0.10 0.00 -0.50 0.00 0.00 54.79 52.52 1xwo n ASP 87 Cb 0.00 0.09 -0.02 0.00 -1.14 0.00 0.00 41.12 40.05 1xwo n ASP 87 CO 0.00 0.00 0.00 0.16 -1.33 0.00 0.00 177.20 176.03 1xwo h ILE 88 N 1.00 1.21 -0.58 2.12 3.07 -1.94 -0.18 117.51 122.22 1xwo h ILE 88 Ca -0.13 -0.70 0.10 0.00 1.55 0.00 0.00 64.86 65.68 1xwo h ILE 88 Cb 0.39 1.02 -0.08 0.00 -0.27 0.00 0.00 36.82 37.88 1xwo h ILE 88 CO 0.21 0.24 0.14 0.45 -1.05 0.00 0.00 178.15 178.14 1xwo h HIS 89 N 0.41 0.23 -0.42 0.16 3.86 -1.97 1.01 115.15 118.44 1xwo h HIS 89 Ca 0.11 0.03 -0.10 0.00 -1.16 0.00 0.00 60.37 59.26 1xwo h HIS 89 Cb 0.27 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.71 1xwo h HIS 89 CO 0.01 0.00 -0.11 1.15 0.86 0.00 0.00 177.93 179.84 1xwo h THR 90 N 0.28 1.27 0.00 2.45 2.02 -1.92 -1.15 112.91 115.87 1xwo h THR 90 Ca 0.30 -1.22 0.00 0.00 0.77 0.00 0.00 66.41 66.26 1xwo h THR 90 Cb 0.42 1.19 0.00 0.00 -1.74 0.00 0.00 68.15 68.02 1xwo h THR 90 CO -0.37 0.41 0.00 0.00 0.37 0.00 0.00 175.52 175.94 1xwo h ALA 91 N 0.85 1.00 0.11 6.16 0.00 0.07 -2.79 119.26 124.67 1xwo h ALA 91 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.67 1xwo h ALA 91 Cb 0.65 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1xwo h ALA 91 CO 0.04 0.00 -1.90 -0.91 0.00 0.00 0.00 179.25 176.48 1xwo h ASN 92 N 0.00 0.36 1.25 0.00 2.35 0.14 -3.20 115.58 116.47 1xwo h ASN 92 Ca 0.00 -0.77 0.00 0.00 -0.55 0.00 0.00 56.30 54.98 1xwo h ASN 92 Cb 0.66 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.92 1xwo h ASN 92 CO 0.00 1.69 0.00 -1.84 -1.65 0.00 0.00 177.43 175.63 1xwo n GLU 93 N -3.41 0.17 0.03 0.81 0.28 -0.46 -1.87 120.64 116.18 1xwo n GLU 93 Ca -0.28 0.16 -0.19 0.00 -0.16 0.00 0.00 57.16 56.69 1xwo n GLU 93 Cb 1.05 -1.70 -0.13 0.00 1.43 0.00 0.00 31.44 32.09 1xwo n GLU 93 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 177.13 176.88 1xwo h ARG 94 N 0.00 0.33 -0.29 3.44 2.43 -1.61 -2.22 114.38 116.46 1xwo h ARG 94 Ca 0.00 -0.47 -0.16 0.00 -0.81 0.00 0.00 59.98 58.54 1xwo h ARG 94 Cb 0.62 0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.33 1xwo h ARG 94 CO 0.00 1.18 -0.47 -0.09 -1.51 0.00 0.00 179.97 179.08 1xwo h ARG 95 N -0.29 0.78 -0.18 0.20 1.12 -1.53 -2.01 114.38 112.47 1xwo h ARG 95 Ca -0.11 -0.45 -0.01 0.00 -1.11 0.00 0.00 59.98 58.30 1xwo h ARG 95 Cb 1.49 0.03 -0.01 0.00 -0.01 0.00 0.00 29.97 31.48 1xwo h ARG 95 CO 0.13 1.08 0.09 1.25 -3.11 0.00 0.00 179.97 179.41 1xwo h LEU 96 N 0.62 0.24 -2.03 3.80 5.85 -1.44 -0.62 115.31 121.73 1xwo h LEU 96 Ca 0.03 -0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.65 1xwo h LEU 96 Cb 1.05 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.01 1xwo h LEU 96 CO 0.10 0.30 0.07 0.50 -0.34 0.00 0.00 178.44 179.07 1xwo h LYS 97 N 0.16 0.00 0.00 1.25 3.11 -1.37 0.79 116.57 120.51 1xwo h LYS 97 Ca 0.06 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.90 1xwo h LYS 97 Cb 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.35 1xwo h LYS 97 CO -0.01 0.00 0.00 0.93 -2.81 0.00 0.00 179.45 177.56 1xwo h GLU 98 N 0.00 0.00 0.00 1.90 5.08 -0.43 0.22 114.58 121.35 1xwo h GLU 98 Ca 0.05 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 58.02 1xwo h GLU 98 Cb 0.19 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.38 1xwo h GLU 98 CO -0.00 0.00 -2.23 1.28 -1.00 0.00 0.00 179.01 177.06 1xwo n LEU 99 N -2.74 1.95 0.02 1.33 4.77 0.12 -4.67 117.00 117.78 1xwo n LEU 99 Ca 0.04 0.35 0.06 0.00 -0.03 0.00 0.00 56.01 56.43 1xwo n LEU 99 Cb 0.43 -0.82 -0.10 0.00 -2.33 0.00 0.00 43.42 40.60 1xwo n LEU 99 CO 0.30 0.43 -0.48 -0.38 -1.33 0.00 0.00 177.39 175.93 1xwo n ILE 100 N -4.30 0.59 -2.31 -0.08 5.41 0.23 -5.09 119.36 113.81 1xwo n ILE 100 Ca -0.47 -0.60 0.00 0.00 1.00 0.00 0.00 62.75 62.68 1xwo n ILE 100 Cb 0.82 -0.30 0.00 0.00 -0.71 0.00 0.00 39.64 39.44 1xwo n ILE 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1xwo n GLY 101 N 1.32 -2.05 0.23 7.39 0.00 0.79 -4.26 105.19 108.61 1xwo n GLY 101 Ca -0.07 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.28 1xwo n GLY 101 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xwo h ASP 102 N 0.00 0.00 0.36 1.61 3.32 -1.94 0.27 116.42 120.04 1xwo h ASP 102 Ca 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 1xwo h ASP 102 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1xwo h ASP 102 CO 0.00 0.00 -0.13 0.40 -1.72 0.00 0.00 179.24 177.79 1xwo h ILE 103 N 0.00 0.63 -0.31 0.35 2.04 -1.93 -2.85 117.51 115.44 1xwo h ILE 103 Ca 0.00 -0.57 0.03 0.00 1.00 0.00 0.00 64.86 65.32 1xwo h ILE 103 Cb 1.67 1.36 -0.02 0.00 -0.74 0.00 0.00 36.82 39.09 1xwo h ILE 103 CO 0.00 0.13 0.21 0.00 0.00 0.00 0.00 178.15 178.49 1xwo h ALA 104 N 1.87 1.92 -0.98 1.87 0.00 -1.23 -2.94 119.26 119.77 1xwo h ALA 104 Ca -0.00 -0.01 0.19 0.00 0.00 0.00 0.00 54.91 55.08 1xwo h ALA 104 Cb 0.35 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 17.97 1xwo h ALA 104 CO 0.02 0.03 0.61 0.78 0.00 0.00 0.00 179.25 180.70 1xwo h GLY 105 N 0.29 1.54 -0.32 0.00 0.00 -1.74 -1.59 103.07 101.25 1xwo h GLY 105 Ca 0.13 -0.32 0.33 0.00 0.00 0.00 0.00 47.33 47.46 1xwo h GLY 105 CO -0.03 -0.03 0.81 0.50 0.00 0.00 0.00 176.54 177.80 1xwo h LYS 106 N 0.69 0.07 -0.74 4.80 1.79 -1.76 -1.45 116.57 119.98 1xwo h LYS 106 Ca 0.55 -0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 59.00 1xwo h LYS 106 Cb 0.94 -0.02 -0.04 0.00 -1.58 0.00 0.00 32.23 31.54 1xwo h LYS 106 CO -0.32 0.05 0.43 1.25 -1.08 0.00 0.00 179.45 179.78 1xwo h LEU 107 N 0.08 0.91 0.00 2.94 5.85 -1.51 -2.08 115.31 121.49 1xwo h LEU 107 Ca 0.57 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 59.21 1xwo h LEU 107 Cb 2.11 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.91 1xwo h LEU 107 CO -0.07 0.72 0.00 0.59 -0.34 0.00 0.00 178.44 179.34 1xwo n ASN 108 N -4.49 0.00 -4.63 1.25 3.02 -0.54 -4.75 115.26 105.12 1xwo n ASN 108 Ca 0.07 -0.80 -0.43 0.00 -0.03 0.00 0.00 54.58 53.39 1xwo n ASN 108 Cb 0.07 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.22 1xwo n ASN 108 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1xwo s THR 109 N -2.00 3.90 0.00 3.41 2.01 -0.79 -3.85 115.64 118.32 1xwo s THR 109 Ca 0.13 1.02 0.00 0.00 0.31 0.00 0.00 61.69 63.15 1xwo s THR 109 Cb 0.06 -3.90 0.00 0.00 0.01 0.00 0.00 72.50 68.67 1xwo s THR 109 CO 0.10 -0.35 0.00 0.61 -0.69 0.00 0.00 174.62 174.28 1xwo n GLY 110 N 4.46 2.32 3.87 4.40 0.00 -1.26 -5.02 105.19 113.95 1xwo n GLY 110 Ca 0.17 -0.53 -0.31 0.00 0.00 0.00 0.00 46.02 45.34 1xwo n GLY 110 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1xwo s ARG 111 N 0.00 3.86 0.35 1.61 1.70 -1.25 -4.67 118.95 120.56 1xwo s ARG 111 Ca 0.00 0.47 0.09 0.00 -0.47 0.00 0.00 55.73 55.82 1xwo s ARG 111 Cb 0.00 -2.48 -0.07 0.00 -0.57 0.00 0.00 34.95 31.84 1xwo s ARG 111 CO 0.00 0.13 -0.08 -1.54 -1.08 0.00 0.00 175.30 172.73 1xwo s SER 112 N -2.65 3.70 0.32 -2.89 1.04 -1.26 -4.93 113.70 107.04 1xwo s SER 112 Ca 0.51 -1.22 0.01 0.00 0.48 0.00 0.00 55.95 55.72 1xwo s SER 112 Cb -0.10 -0.35 0.52 0.00 0.10 0.00 0.00 66.02 66.19 1xwo s SER 112 CO 0.24 -0.25 1.92 0.03 0.98 0.00 0.00 173.24 176.16 1xwo h ARG 113 N 2.00 0.83 -0.97 4.02 -0.00 -1.99 -1.76 114.38 116.52 1xwo h ARG 113 Ca -0.42 -0.10 0.19 0.00 -0.50 0.00 0.00 59.98 59.15 1xwo h ARG 113 Cb 1.25 -0.16 -0.09 0.00 0.00 0.00 0.00 29.97 30.97 1xwo h ARG 113 CO 0.72 0.65 0.61 -0.91 0.00 0.00 0.00 179.97 181.04 1xwo h ASN 114 N 0.83 0.66 0.20 7.04 4.21 -1.92 0.74 115.58 127.34 1xwo h ASN 114 Ca 0.21 0.07 -0.01 0.00 1.21 0.00 0.00 56.30 57.78 1xwo h ASN 114 Cb 0.09 -0.05 0.00 0.00 -1.12 0.00 0.00 38.32 37.24 1xwo h ASN 114 CO -0.03 0.25 -0.10 -0.08 -1.29 0.00 0.00 177.43 176.19 1xwo h GLU 115 N 0.65 -0.26 -0.62 0.81 4.81 -1.34 -3.19 114.58 115.43 1xwo h GLU 115 Ca 0.53 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.78 1xwo h GLU 115 Cb 0.98 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.39 1xwo h GLU 115 CO -0.30 0.08 0.40 1.96 -0.73 0.00 0.00 179.01 180.42 1xwo h GLN 116 N -0.63 0.83 0.23 1.92 4.20 -1.02 -2.25 115.11 118.38 1xwo h GLN 116 Ca -0.03 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1xwo h GLN 116 Cb 0.46 -0.18 -0.04 0.00 0.30 0.00 0.00 27.48 28.01 1xwo h GLN 116 CO 0.05 0.56 -0.53 0.28 -0.67 0.00 0.00 178.83 178.52 1xwo h VAL 117 N 0.85 0.00 0.00 -0.54 2.07 -0.89 0.32 116.25 118.06 1xwo h VAL 117 Ca 0.23 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.75 1xwo h VAL 117 Cb -0.07 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.70 1xwo h VAL 117 CO -0.05 0.00 0.00 -0.37 0.02 0.00 0.00 177.57 177.17 1xwo h VAL 118 N -0.83 0.00 0.17 2.57 -1.51 -1.55 -2.31 116.25 112.79 1xwo h VAL 118 Ca -0.02 -0.65 -0.30 0.00 -1.23 0.00 0.00 66.70 64.49 1xwo h VAL 118 Cb 0.80 1.64 0.02 0.00 -2.13 0.00 0.00 31.29 31.61 1xwo h VAL 118 CO -0.23 0.00 -1.38 0.74 -1.23 0.00 0.00 177.57 175.47 1xwo h THR 119 N 0.00 1.36 -0.21 7.19 2.02 -0.93 -2.60 112.91 119.74 1xwo h THR 119 Ca 0.00 -2.89 -0.13 0.00 0.77 0.00 0.00 66.41 64.16 1xwo h THR 119 Cb 0.67 2.95 0.00 0.00 -1.74 0.00 0.00 68.15 70.03 1xwo h THR 119 CO 0.00 0.86 -0.39 0.44 0.37 0.00 0.00 175.52 176.80 1xwo h ASP 120 N 0.10 0.70 -0.02 4.18 3.32 -0.28 -2.29 116.42 122.14 1xwo h ASP 120 Ca -0.20 -0.54 -0.14 0.00 0.02 0.00 0.00 57.03 56.17 1xwo h ASP 120 Cb 2.05 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 41.39 1xwo h ASP 120 CO 0.22 1.11 -0.46 -0.07 -1.72 0.00 0.00 179.24 178.33 1xwo h LEU 121 N 0.31 0.61 -0.90 1.55 3.38 -1.52 -1.38 115.31 117.35 1xwo h LEU 121 Ca 0.01 -0.29 -0.11 0.00 0.09 0.00 0.00 57.88 57.58 1xwo h LEU 121 Cb 0.99 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1xwo h LEU 121 CO 0.09 0.98 -0.41 0.11 0.09 0.00 0.00 178.44 179.30 1xwo h LYS 122 N 0.45 0.30 -0.18 1.13 1.57 -1.50 -0.04 116.57 118.30 1xwo h LYS 122 Ca 0.03 -0.14 -0.10 0.00 -1.87 0.00 0.00 60.65 58.57 1xwo h LYS 122 Cb 0.98 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.28 1xwo h LYS 122 CO 0.09 0.66 -0.27 -0.07 -0.57 0.00 0.00 179.45 179.28 1xwo h LEU 123 N 0.25 0.56 0.46 2.94 3.38 -1.21 -2.25 115.31 119.43 1xwo h LEU 123 Ca 0.02 -0.52 -0.02 0.00 0.09 0.00 0.00 57.88 57.45 1xwo h LEU 123 Cb 0.83 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1xwo h LEU 123 CO 0.07 0.97 -0.22 0.15 0.09 0.00 0.00 178.44 179.49 1xwo h PHE 124 N 0.16 -0.58 -0.81 1.13 3.57 -1.15 -2.97 116.94 116.30 1xwo h PHE 124 Ca 0.02 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.63 1xwo h PHE 124 Cb 0.85 0.19 -0.09 0.00 2.79 0.00 0.00 35.95 39.70 1xwo h PHE 124 CO 0.09 -0.36 0.41 0.52 -2.23 0.00 0.00 178.31 176.74 1xwo h MET 125 N -0.62 0.60 -0.48 1.11 2.86 -1.02 -1.56 114.93 115.82 1xwo h MET 125 Ca -0.06 -0.04 0.10 0.00 -2.06 0.00 0.00 59.70 57.64 1xwo h MET 125 Cb 0.48 -0.14 -0.09 0.00 0.06 0.00 0.00 31.60 31.91 1xwo h MET 125 CO 0.10 0.40 -0.14 0.87 1.06 0.00 0.00 176.91 179.20 1xwo h LYS 126 N 0.62 -0.02 -0.47 1.72 1.57 -1.25 0.43 116.57 119.17 1xwo h LYS 126 Ca 0.42 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 59.10 1xwo h LYS 126 Cb 0.55 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.85 1xwo h LYS 126 CO -0.33 -0.01 -0.14 -0.91 -0.57 0.00 0.00 179.45 177.48 1xwo h ASN 127 N -0.02 0.89 -0.09 0.86 2.35 -1.26 -2.81 115.58 115.49 1xwo h ASN 127 Ca 0.23 -0.29 -0.02 0.00 -0.55 0.00 0.00 56.30 55.67 1xwo h ASN 127 Cb 0.38 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.50 1xwo h ASN 127 CO -0.51 1.03 -0.03 0.28 -1.65 0.00 0.00 177.43 176.56 1xwo h SER 128 N 0.79 0.17 -0.93 5.81 0.02 -0.17 -2.79 113.55 116.46 1xwo h SER 128 Ca 0.12 -0.38 0.15 0.00 -0.84 0.00 0.00 61.79 60.84 1xwo h SER 128 Cb 0.67 -0.05 -0.09 0.00 0.14 0.00 0.00 62.40 63.07 1xwo h SER 128 CO 0.05 0.52 0.53 -0.07 -1.14 0.00 0.00 176.83 176.72 1xwo h LEU 129 N -0.17 0.70 -1.36 5.07 4.07 -0.24 0.26 115.31 123.63 1xwo h LEU 129 Ca 0.02 0.08 0.03 0.00 0.08 0.00 0.00 57.88 58.09 1xwo h LEU 129 Cb 0.45 -0.04 -0.04 0.00 1.08 0.00 0.00 40.66 42.11 1xwo h LEU 129 CO 0.01 0.30 0.46 -1.28 -1.08 0.00 0.00 178.44 176.85 1xwo h SER 130 N 0.75 0.73 0.31 -0.43 0.87 -1.28 0.28 113.55 114.78 1xwo h SER 130 Ca 0.50 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 61.04 1xwo h SER 130 Cb 0.67 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 1xwo h SER 130 CO -0.34 0.51 -0.15 0.58 -0.53 0.00 0.00 176.83 176.90 1xwo h VAL 131 N 0.85 0.57 -0.71 2.23 2.07 -0.31 -2.47 116.25 118.48 1xwo h VAL 131 Ca 0.27 -0.76 0.14 0.00 0.82 0.00 0.00 66.70 67.17 1xwo h VAL 131 Cb 0.04 0.89 -0.10 0.00 -1.52 0.00 0.00 31.29 30.60 1xwo h VAL 131 CO -0.07 0.12 0.23 0.40 0.02 0.00 0.00 177.57 178.27 1xwo h ILE 132 N -0.90 0.62 -0.65 4.57 2.04 -0.90 -0.01 117.51 122.28 1xwo h ILE 132 Ca -0.04 -0.12 0.09 0.00 1.00 0.00 0.00 64.86 65.79 1xwo h ILE 132 Cb 0.52 0.24 -0.07 0.00 -0.74 0.00 0.00 36.82 36.76 1xwo h ILE 132 CO 0.07 0.06 0.29 -1.28 0.00 0.00 0.00 178.15 177.29 1xwo h SER 133 N 0.36 0.35 -0.19 1.72 0.87 -0.43 0.33 113.55 116.55 1xwo h SER 133 Ca 0.39 0.07 -0.13 0.00 -1.23 0.00 0.00 61.79 60.88 1xwo h SER 133 Cb 0.60 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.57 1xwo h SER 133 CO -0.43 0.20 -0.35 0.74 -0.53 0.00 0.00 176.83 176.47 1xwo h THR 134 N 0.51 1.28 -0.34 2.23 2.02 -0.59 -1.37 112.91 116.66 1xwo h THR 134 Ca 0.32 -1.50 -0.12 0.00 0.77 0.00 0.00 66.41 65.88 1xwo h THR 134 Cb 0.36 1.42 -0.01 0.00 -1.74 0.00 0.00 68.15 68.18 1xwo h THR 134 CO -0.28 0.49 -0.25 0.45 0.37 0.00 0.00 175.52 176.30 1xwo h HIS 135 N 0.60 0.91 -0.40 3.16 -0.00 -0.31 -2.83 115.15 116.27 1xwo h HIS 135 Ca 0.06 -0.25 0.01 0.00 -0.00 0.00 0.00 60.37 60.19 1xwo h HIS 135 Cb 0.88 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 28.07 1xwo h HIS 135 CO 0.04 1.01 0.25 1.25 -0.00 0.00 0.00 177.93 180.49 1xwo h LEU 136 N 0.55 0.43 -2.59 2.43 5.85 -0.21 -0.92 115.31 120.85 1xwo h LEU 136 Ca 0.06 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 1xwo h LEU 136 Cb 0.82 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.75 1xwo h LEU 136 CO 0.07 0.31 -0.00 -0.07 -0.34 0.00 0.00 178.44 178.41 1xwo h LEU 137 N 0.52 0.00 -0.55 2.25 -0.00 -1.18 -0.88 115.31 115.47 1xwo h LEU 137 Ca 0.15 0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 57.97 1xwo h LEU 137 Cb -0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.61 1xwo h LEU 137 CO -0.05 0.00 -0.28 1.56 -0.00 0.00 0.00 178.44 179.68 1xwo h GLN 138 N 0.00 0.00 0.15 1.13 1.08 -0.92 -2.06 115.11 114.49 1xwo h GLN 138 Ca -0.00 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 1xwo h GLN 138 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1xwo h GLN 138 CO 0.00 0.28 -0.07 1.25 -0.95 0.00 0.00 178.83 179.34 1xwo h LEU 139 N 0.00 -0.17 -0.13 1.46 6.46 -1.02 -1.99 115.31 119.93 1xwo h LEU 139 Ca -0.00 -0.38 0.02 0.00 -0.12 0.00 0.00 57.88 57.40 1xwo h LEU 139 Cb 1.01 0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.96 1xwo h LEU 139 CO 0.04 0.39 -0.00 -0.29 -0.62 0.00 0.00 178.44 177.96 1xwo h ILE 140 N -0.85 0.91 -0.73 4.05 2.10 -1.58 0.40 117.51 121.81 1xwo h ILE 140 Ca -0.02 -0.01 0.10 0.00 1.08 0.00 0.00 64.86 66.00 1xwo h ILE 140 Cb 0.53 0.87 -0.07 0.00 -1.09 0.00 0.00 36.82 37.06 1xwo h ILE 140 CO 0.03 0.01 0.37 0.11 -1.08 0.00 0.00 178.15 177.59 1xwo h LYS 141 N 0.04 0.60 -0.70 2.19 1.57 -1.44 0.94 116.57 119.77 1xwo h LYS 141 Ca 0.06 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 1xwo h LYS 141 Cb 0.07 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 1xwo h LYS 141 CO -0.10 0.40 0.25 1.15 -0.57 0.00 0.00 179.45 180.58 1xwo h THR 142 N 0.62 1.25 0.54 -0.16 2.02 -0.68 0.24 112.91 116.74 1xwo h THR 142 Ca 0.36 -0.83 -0.03 0.00 0.77 0.00 0.00 66.41 66.69 1xwo h THR 142 Cb 0.39 0.47 0.01 0.00 -1.74 0.00 0.00 68.15 67.27 1xwo h THR 142 CO -0.27 0.33 -0.26 -0.07 0.37 0.00 0.00 175.52 175.61 1xwo h LEU 143 N 1.02 -0.62 -0.45 2.58 3.38 0.21 -2.29 115.31 119.14 1xwo h LEU 143 Ca 0.23 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.29 1xwo h LEU 143 Cb 0.25 0.16 -0.07 0.00 0.09 0.00 0.00 40.66 41.09 1xwo h LEU 143 CO -0.01 -0.21 0.01 0.58 0.09 0.00 0.00 178.44 178.90 1xwo h VAL 144 N -1.18 0.66 -0.48 1.22 2.07 0.78 0.21 116.25 119.53 1xwo h VAL 144 Ca -0.07 -0.04 0.09 0.00 0.82 0.00 0.00 66.70 67.49 1xwo h VAL 144 Cb 0.58 0.53 -0.07 0.00 -1.52 0.00 0.00 31.29 30.80 1xwo h VAL 144 CO 0.12 0.02 0.06 -0.08 0.02 0.00 0.00 177.57 177.72 1xwo h GLU 145 N 0.13 0.18 -0.12 1.57 4.81 -0.57 -1.03 114.58 119.54 1xwo h GLU 145 Ca 0.23 -0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.33 1xwo h GLU 145 Cb 0.33 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 1xwo h GLU 145 CO -0.36 0.12 -0.43 -0.09 -0.73 0.00 0.00 179.01 177.52 1xwo h ARG 146 N 0.19 0.27 -0.23 1.92 2.43 -0.76 -2.33 114.38 115.88 1xwo h ARG 146 Ca 0.24 -0.14 0.05 0.00 -0.81 0.00 0.00 59.98 59.33 1xwo h ARG 146 Cb 0.34 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 1xwo h ARG 146 CO -0.35 0.66 0.16 0.00 -1.51 0.00 0.00 179.97 178.93 1xwo h ALA 147 N 1.33 2.11 0.12 2.80 0.00 0.31 -1.19 119.26 124.74 1xwo h ALA 147 Ca 0.02 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.64 1xwo h ALA 147 Cb 0.85 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1xwo h ALA 147 CO 0.07 -0.17 -1.28 0.00 0.00 0.00 0.00 179.25 177.87 1xwo h ALA 148 N 1.88 0.14 0.00 0.00 0.00 -0.85 -3.16 119.26 117.27 1xwo h ALA 148 Ca 0.10 -0.93 -0.01 0.00 0.00 0.00 0.00 54.91 54.08 1xwo h ALA 148 Cb 0.31 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1xwo h ALA 148 CO -0.01 1.02 -0.02 0.82 0.00 0.00 0.00 179.25 181.05 1xwo h ILE 149 N 0.07 0.05 -0.26 0.00 2.04 -0.92 -3.31 117.51 115.18 1xwo h ILE 149 Ca -0.15 -0.89 -0.21 0.00 1.00 0.00 0.00 64.86 64.61 1xwo h ILE 149 Cb 1.97 1.85 -0.20 0.00 -0.74 0.00 0.00 36.82 39.70 1xwo h ILE 149 CO 0.19 0.02 -0.70 -0.62 0.00 0.00 0.00 178.15 177.05 1xwo n GLU 150 N -3.11 2.06 0.28 2.37 1.02 -0.55 -4.85 120.64 117.86 1xwo n GLU 150 Ca 0.03 -3.45 0.16 0.00 -0.02 0.00 0.00 57.16 53.87 1xwo n GLU 150 Cb 0.46 -1.65 0.91 0.00 -0.02 0.00 0.00 31.44 31.14 1xwo n GLU 150 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1xwo h ILE 151 N 2.34 0.51 0.00 -3.67 2.04 -1.64 -2.37 117.51 114.72 1xwo h ILE 151 Ca 0.08 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.94 1xwo h ILE 151 Cb 1.29 0.97 0.00 0.00 -0.74 0.00 0.00 36.82 38.34 1xwo h ILE 151 CO 0.26 0.00 -0.39 0.47 0.00 0.00 0.00 178.15 178.49 1xwo n ASP 152 N -3.83 0.55 -4.72 1.72 8.00 -1.26 -4.77 116.55 112.25 1xwo n ASP 152 Ca -0.02 0.16 -0.42 0.00 0.71 0.00 0.00 54.79 55.22 1xwo n ASP 152 Cb 0.12 -0.08 -0.03 0.00 -0.02 0.00 0.00 41.12 41.11 1xwo n ASP 152 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1xwo s VAL 153 N -3.08 3.67 -0.00 2.53 1.01 -0.89 -4.97 120.40 118.66 1xwo s VAL 153 Ca 0.09 1.24 0.07 0.00 0.00 0.00 0.00 61.98 63.38 1xwo s VAL 153 Cb 0.15 -3.79 -0.02 0.00 0.00 0.00 0.00 36.38 32.72 1xwo s VAL 153 CO 0.66 0.12 -0.21 -0.63 0.00 0.00 0.00 175.10 175.04 1xwo s ILE 154 N 0.85 1.69 0.25 2.22 1.01 -1.26 -0.68 121.20 125.27 1xwo s ILE 154 Ca 0.60 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 60.28 1xwo s ILE 154 Cb -0.33 -1.42 -0.00 0.00 0.01 0.00 0.00 42.46 40.72 1xwo s ILE 154 CO 0.31 0.42 0.30 0.00 0.00 0.00 0.00 174.94 175.97 1xwo n LEU 155 N 2.39 0.00 -4.80 2.97 -0.00 -0.86 -3.39 117.00 113.30 1xwo n LEU 155 Ca -0.16 -2.11 -0.35 0.00 -0.00 0.00 0.00 56.01 53.39 1xwo n LEU 155 Cb 0.53 1.60 -0.07 0.00 -0.00 0.00 0.00 43.42 45.49 1xwo n LEU 155 CO 0.23 -0.44 0.60 -2.84 -0.00 0.00 0.00 177.39 174.95 1xwo s PRO 156 N -2.70 4.39 -0.14 1.47 0.02 -1.26 -2.01 135.00 134.77 1xwo s PRO 156 Ca 0.23 1.16 -0.05 0.00 0.02 0.00 0.00 61.00 62.36 1xwo s PRO 156 Cb 0.00 -2.60 -0.04 0.00 0.02 0.00 0.00 34.50 31.88 1xwo s PRO 156 CO 0.17 0.20 0.05 0.20 -0.33 0.00 0.00 177.00 177.28 1xwo s GLY 157 N -1.83 1.91 0.52 0.52 0.00 -0.61 -4.81 107.32 103.01 1xwo s GLY 157 Ca 0.53 -0.75 0.07 0.00 0.00 0.00 0.00 44.72 44.57 1xwo s GLY 157 CO 0.20 -0.20 0.71 -1.72 0.00 0.00 0.00 173.10 172.10 1xwo n TYR 158 N 2.92 -2.46 -3.37 1.90 4.02 -1.26 0.03 117.16 118.94 1xwo n TYR 158 Ca -0.18 -1.80 0.03 0.00 -0.01 0.00 0.00 57.90 55.94 1xwo n TYR 158 Cb 0.53 -0.49 -0.05 0.00 -0.02 0.00 0.00 39.34 39.31 1xwo n TYR 158 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 1xwo s THR 159 N -2.17 -0.05 -1.47 -0.72 -4.23 -1.01 -4.76 115.64 101.23 1xwo s THR 159 Ca 0.53 0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 60.97 1xwo s THR 159 Cb -0.04 -1.00 0.03 0.00 1.34 0.00 0.00 72.50 72.83 1xwo s THR 159 CO 0.34 0.00 0.79 1.41 -0.54 0.00 0.00 174.62 176.62 1xwo n HIS 160 N 4.00 -2.23 -2.87 3.99 8.25 -1.26 -0.42 115.22 124.68 1xwo n HIS 160 Ca -0.11 0.69 -0.12 0.00 -0.26 0.00 0.00 57.72 57.93 1xwo n HIS 160 Cb 0.56 -4.36 -0.01 0.00 1.12 0.00 0.00 29.99 27.30 1xwo n HIS 160 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1xwo n LEU 161 N -4.33 -0.62 -4.29 2.41 4.77 -1.26 -4.93 117.00 108.75 1xwo n LEU 161 Ca -0.05 0.08 -0.32 0.00 -0.03 0.00 0.00 56.01 55.69 1xwo n LEU 161 Cb 0.58 -1.52 -0.16 0.00 -2.33 0.00 0.00 43.42 39.99 1xwo n LEU 161 CO 0.56 0.01 -0.52 -1.10 -1.33 0.00 0.00 177.39 175.01 1xwo s GLN 162 N -5.44 2.99 -0.02 3.23 -1.52 0.44 -5.07 119.66 114.28 1xwo s GLN 162 Ca 0.17 -0.82 -0.36 0.00 -1.95 0.00 0.00 55.36 52.40 1xwo s GLN 162 Cb -0.09 -2.36 -0.14 0.00 -0.22 0.00 0.00 33.01 30.20 1xwo s GLN 162 CO 0.20 0.26 1.66 1.63 -0.25 0.00 0.00 175.29 178.80 1xwo n LYS 163 N 3.31 1.78 -0.04 2.91 5.02 -1.26 -2.39 118.16 127.49 1xwo n LYS 163 Ca -0.18 0.65 -0.04 0.00 -2.02 0.00 0.00 58.31 56.72 1xwo n LYS 163 Cb 0.53 -2.40 -0.01 0.00 -0.02 0.00 0.00 35.03 33.12 1xwo n LYS 163 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xwo n ALA 164 N 4.67 0.47 -3.46 7.82 0.00 0.11 -4.94 120.51 125.18 1xwo n ALA 164 Ca 0.21 -0.47 -0.10 0.00 0.00 0.00 0.00 53.44 53.07 1xwo n ALA 164 Cb 0.24 0.02 -0.02 0.00 0.00 0.00 0.00 19.45 19.69 1xwo n ALA 164 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1xwo s GLN 165 N -1.79 1.05 0.07 0.00 -2.07 -1.21 -4.79 119.66 110.92 1xwo s GLN 165 Ca -0.12 -0.37 -0.32 0.00 -1.82 0.00 0.00 55.36 52.74 1xwo s GLN 165 Cb 0.02 0.49 -0.11 0.00 -1.09 0.00 0.00 33.01 32.32 1xwo s GLN 165 CO 0.17 -0.46 1.86 -2.30 -1.32 0.00 0.00 175.29 173.25 1xwo n PRO 166 N -0.28 2.66 -4.26 9.60 -0.02 -1.26 -1.58 135.00 139.87 1xwo n PRO 166 Ca -0.13 0.97 -0.16 0.00 -2.02 0.00 0.00 63.50 62.16 1xwo n PRO 166 Cb 0.63 -2.87 -0.10 0.00 -0.02 0.00 0.00 33.50 31.14 1xwo n PRO 166 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1xwo s ILE 167 N 3.28 1.29 0.03 4.25 1.10 -0.85 -4.47 121.20 125.82 1xwo s ILE 167 Ca 0.85 -2.00 -0.19 0.00 -0.51 0.00 0.00 60.65 58.81 1xwo s ILE 167 Cb -0.52 -1.79 -0.06 0.00 0.15 0.00 0.00 42.46 40.24 1xwo s ILE 167 CO 0.41 -0.65 0.56 -0.13 -2.11 0.00 0.00 174.94 173.02 1xwo s ARG 168 N -3.46 4.22 0.29 3.50 0.52 -1.26 -2.03 118.95 120.72 1xwo s ARG 168 Ca 0.15 0.69 0.03 0.00 -0.52 0.00 0.00 55.73 56.09 1xwo s ARG 168 Cb 0.00 -3.28 0.71 0.00 0.52 0.00 0.00 34.95 32.90 1xwo s ARG 168 CO 0.02 0.53 1.69 2.35 0.02 0.00 0.00 175.30 179.91 1xwo h TRP 169 N 5.02 0.58 -0.90 -0.53 -0.00 -1.19 0.20 115.95 119.14 1xwo h TRP 169 Ca -0.48 0.04 0.05 0.00 -0.00 0.00 0.00 58.89 58.50 1xwo h TRP 169 Cb 1.21 -0.12 -0.06 0.00 -0.00 0.00 0.00 29.16 30.19 1xwo h TRP 169 CO 0.67 -0.07 0.57 0.77 -0.00 0.00 0.00 178.44 180.38 1xwo h SER 170 N 0.36 0.93 0.11 2.65 0.02 -1.77 -1.87 113.55 113.98 1xwo h SER 170 Ca 0.55 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 61.52 1xwo h SER 170 Cb 1.05 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 63.35 1xwo h SER 170 CO -0.54 0.62 -0.32 -0.61 -1.14 0.00 0.00 176.83 174.83 1xwo h GLN 171 N 1.08 -0.52 0.17 3.45 5.75 -0.98 0.61 115.11 124.66 1xwo h GLN 171 Ca 0.37 0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.91 1xwo h GLN 171 Cb 0.08 0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.71 1xwo h GLN 171 CO -0.14 -0.35 -0.41 0.35 -2.65 0.00 0.00 178.83 175.63 1xwo h PHE 172 N -0.54 -1.17 -0.66 3.99 3.57 -0.96 0.64 116.94 121.81 1xwo h PHE 172 Ca 0.03 0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.65 1xwo h PHE 172 Cb 0.57 0.49 -0.11 0.00 2.79 0.00 0.00 35.95 39.69 1xwo h PHE 172 CO -0.29 -0.48 -0.47 -0.07 -2.23 0.00 0.00 178.31 174.77 1xwo h LEU 173 N -0.64 -1.63 -2.04 0.59 3.38 -1.05 0.11 115.31 114.04 1xwo h LEU 173 Ca -0.02 0.26 0.08 0.00 0.09 0.00 0.00 57.88 58.30 1xwo h LEU 173 Cb 0.61 0.74 -0.01 0.00 0.09 0.00 0.00 40.66 42.09 1xwo h LEU 173 CO -0.18 -0.32 0.20 -0.07 0.09 0.00 0.00 178.44 178.16 1xwo h LEU 174 N -0.19 0.00 -0.55 1.67 3.38 0.66 0.61 115.31 120.88 1xwo h LEU 174 Ca 0.18 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.08 1xwo h LEU 174 Cb 0.55 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1xwo h LEU 174 CO -0.74 0.00 0.07 0.77 0.09 0.00 0.00 178.44 178.62 1xwo h SER 175 N 0.00 0.90 -0.52 -0.43 4.64 0.16 -0.19 113.55 118.10 1xwo h SER 175 Ca 0.13 -0.27 -0.09 0.00 -0.47 0.00 0.00 61.79 61.09 1xwo h SER 175 Cb 0.53 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.37 1xwo h SER 175 CO -0.00 0.94 -0.01 0.45 -0.87 0.00 0.00 176.83 177.34 1xwo h HIS 176 N 0.82 1.02 -0.94 4.77 3.86 -0.53 -2.73 115.15 121.42 1xwo h HIS 176 Ca 0.17 -0.18 0.05 0.00 -1.16 0.00 0.00 60.37 59.24 1xwo h HIS 176 Cb 0.44 -0.26 -0.06 0.00 1.06 0.00 0.00 27.41 28.59 1xwo h HIS 176 CO 0.03 0.94 0.60 0.00 0.86 0.00 0.00 177.93 180.37 1xwo h ALA 177 N 0.94 1.26 -0.28 2.45 0.00 -1.01 -1.88 119.26 120.74 1xwo h ALA 177 Ca 0.15 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1xwo h ALA 177 Cb 0.54 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1xwo h ALA 177 CO 0.03 0.44 0.15 0.28 0.00 0.00 0.00 179.25 180.14 1xwo h VAL 178 N 1.14 1.14 -0.04 0.00 2.07 -0.79 -0.54 116.25 119.23 1xwo h VAL 178 Ca 0.39 -0.38 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 1xwo h VAL 178 Cb 0.07 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 1xwo h VAL 178 CO -0.14 0.14 -0.11 0.00 0.02 0.00 0.00 177.57 177.48 1xwo h ALA 179 N 1.01 1.75 0.01 1.67 0.00 -1.18 -1.88 119.26 120.64 1xwo h ALA 179 Ca 0.10 -0.12 -0.20 0.00 0.00 0.00 0.00 54.91 54.69 1xwo h ALA 179 Cb 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1xwo h ALA 179 CO -0.01 0.19 -0.89 -0.07 0.00 0.00 0.00 179.25 178.47 1xwo h LEU 180 N 0.06 0.24 -0.52 0.00 3.38 -0.62 -3.06 115.31 114.79 1xwo h LEU 180 Ca 0.01 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 57.83 1xwo h LEU 180 Cb 0.23 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 1xwo h LEU 180 CO 0.01 1.01 0.27 0.74 0.09 0.00 0.00 178.44 180.57 1xwo h THR 181 N 0.10 0.96 -0.59 0.22 2.02 -0.29 0.28 112.91 115.61 1xwo h THR 181 Ca -0.04 -0.18 0.02 0.00 0.77 0.00 0.00 66.41 66.97 1xwo h THR 181 Cb 1.53 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 68.30 1xwo h THR 181 CO 0.13 0.10 0.39 0.03 0.37 0.00 0.00 175.52 176.54 1xwo h ARG 182 N 0.53 0.74 -0.07 6.66 3.08 -1.48 -0.93 114.38 122.91 1xwo h ARG 182 Ca 0.23 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.24 1xwo h ARG 182 Cb 0.13 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 1xwo h ARG 182 CO -0.15 0.49 0.02 -0.44 -1.07 0.00 0.00 179.97 178.82 1xwo h ASP 183 N 0.77 0.02 -0.77 7.04 3.45 -0.40 -0.49 116.42 126.03 1xwo h ASP 183 Ca 0.23 0.01 0.12 0.00 0.43 0.00 0.00 57.03 57.81 1xwo h ASP 183 Cb -0.03 0.00 -0.08 0.00 -0.56 0.00 0.00 39.33 38.66 1xwo h ASP 183 CO -0.05 0.03 0.38 -1.28 -1.57 0.00 0.00 179.24 176.74 1xwo h SER 184 N 0.06 0.45 0.41 6.45 0.87 -0.01 -0.92 113.55 120.86 1xwo h SER 184 Ca 0.03 0.08 -0.02 0.00 -1.23 0.00 0.00 61.79 60.65 1xwo h SER 184 Cb 0.01 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 1xwo h SER 184 CO -0.03 0.22 -0.20 -0.08 -0.53 0.00 0.00 176.83 176.21 1xwo h GLU 185 N 0.58 -0.53 -0.81 2.24 4.81 -0.79 -1.67 114.58 118.41 1xwo h GLU 185 Ca 0.41 0.04 0.13 0.00 -0.13 0.00 0.00 59.36 59.80 1xwo h GLU 185 Cb 0.53 0.12 -0.09 0.00 0.63 0.00 0.00 28.75 29.94 1xwo h GLU 185 CO -0.33 -0.29 0.41 0.00 -0.73 0.00 0.00 179.01 178.07 1xwo h ARG 186 N -0.66 0.61 -0.70 1.92 3.08 -0.40 -0.03 114.38 118.20 1xwo h ARG 186 Ca -0.06 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 1xwo h ARG 186 Cb 0.48 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.36 1xwo h ARG 186 CO 0.09 0.40 0.44 1.25 -1.07 0.00 0.00 179.97 181.08 1xwo h LEU 187 N 0.63 0.83 -0.75 3.04 5.85 -1.03 -0.65 115.31 123.22 1xwo h LEU 187 Ca 0.43 -0.05 0.11 0.00 0.84 0.00 0.00 57.88 59.21 1xwo h LEU 187 Cb 0.56 -0.21 -0.08 0.00 0.37 0.00 0.00 40.66 41.31 1xwo h LEU 187 CO -0.34 0.63 0.37 1.23 -0.34 0.00 0.00 178.44 180.00 1xwo h GLY 188 N 0.96 1.15 0.76 3.75 0.00 -0.04 -0.62 103.07 109.03 1xwo h GLY 188 Ca 0.25 -0.22 -0.00 0.00 0.00 0.00 0.00 47.33 47.36 1xwo h GLY 188 CO -0.05 0.02 0.00 0.83 0.00 0.00 0.00 176.54 177.35 1xwo h GLU 189 N 0.60 0.04 -0.33 4.80 5.08 -0.75 -2.82 114.58 121.20 1xwo h GLU 189 Ca 0.38 -0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.81 1xwo h GLU 189 Cb 0.46 -0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.63 1xwo h GLU 189 CO -0.30 0.27 -0.18 0.28 -1.00 0.00 0.00 179.01 178.08 1xwo h VAL 190 N -0.20 0.47 -1.05 3.13 2.07 -0.48 -0.89 116.25 119.31 1xwo h VAL 190 Ca 0.01 0.00 0.27 0.00 0.82 0.00 0.00 66.70 67.80 1xwo h VAL 190 Cb 0.25 0.47 -0.10 0.00 -1.52 0.00 0.00 31.29 30.40 1xwo h VAL 190 CO 0.00 0.00 0.67 0.50 0.02 0.00 0.00 177.57 178.76 1xwo h LYS 191 N -0.14 0.39 -0.30 1.57 3.64 -0.96 -1.06 116.57 119.72 1xwo h LYS 191 Ca 0.17 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.49 1xwo h LYS 191 Cb 0.39 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1xwo h LYS 191 CO -0.41 0.26 0.05 0.00 -2.27 0.00 0.00 179.45 177.07 1xwo h ARG 192 N 0.40 0.49 0.00 1.90 3.08 -0.91 0.38 114.38 119.72 1xwo h ARG 192 Ca 0.61 -0.13 -0.07 0.00 0.07 0.00 0.00 59.98 60.45 1xwo h ARG 192 Cb 1.51 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.50 1xwo h ARG 192 CO -0.32 0.59 -0.34 0.00 -1.07 0.00 0.00 179.97 178.83 1xwo h ARG 193 N 0.31 0.00 -0.02 0.04 3.08 -1.35 -1.36 114.38 115.09 1xwo h ARG 193 Ca 0.09 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 60.01 1xwo h ARG 193 Cb 0.34 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 1xwo h ARG 193 CO 0.01 0.34 -0.60 0.82 -1.07 0.00 0.00 179.97 179.47 1xwo h ILE 194 N 0.00 1.42 0.00 2.04 2.04 -0.38 -3.24 117.51 119.38 1xwo h ILE 194 Ca -0.00 -2.03 -0.11 0.00 1.00 0.00 0.00 64.86 63.71 1xwo h ILE 194 Cb 0.65 2.08 -0.04 0.00 -0.74 0.00 0.00 36.82 38.77 1xwo h ILE 194 CO 0.04 0.59 -0.22 -3.20 0.00 0.00 0.00 178.15 175.36 1xwo n ASN 195 N -3.84 5.07 -3.92 1.72 4.05 0.13 -4.73 115.26 113.74 1xwo n ASN 195 Ca -0.01 -2.41 -0.29 0.00 0.45 0.00 0.00 54.58 52.32 1xwo n ASN 195 Cb 0.60 -1.26 -0.16 0.00 1.23 0.00 0.00 39.78 40.19 1xwo n ASN 195 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1xwo s VAL 196 N 0.70 1.28 0.01 3.44 1.01 -1.23 -1.33 120.40 124.28 1xwo s VAL 196 Ca 0.40 -0.80 -0.30 0.00 0.00 0.00 0.00 61.98 61.28 1xwo s VAL 196 Cb 0.19 -1.45 -0.08 0.00 0.00 0.00 0.00 36.38 35.04 1xwo s VAL 196 CO 0.00 0.10 1.85 -0.22 0.00 0.00 0.00 175.10 176.82 1xwo s LEU 197 N 1.55 4.39 0.00 3.92 2.96 -0.34 -4.63 118.68 126.53 1xwo s LEU 197 Ca -0.01 2.52 0.22 0.00 -0.22 0.00 0.00 54.13 56.64 1xwo s LEU 197 Cb -0.16 -3.53 -0.26 0.00 0.50 0.00 0.00 46.19 42.74 1xwo s LEU 197 CO -0.08 -1.00 0.57 -0.81 -1.32 0.00 0.00 176.35 173.71 1xwo n PRO 198 N 7.32 0.65 -1.51 0.98 -0.04 -1.26 0.24 135.00 141.38 1xwo n PRO 198 Ca 0.19 -0.11 -0.48 0.00 -0.04 0.00 0.00 63.50 63.06 1xwo n PRO 198 Cb 0.42 -1.59 -0.06 0.00 -0.04 0.00 0.00 33.50 32.23 1xwo n PRO 198 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1xwo n LEU 199 N -2.41 2.55 0.00 1.53 7.94 -1.26 -2.75 117.00 122.60 1xwo n LEU 199 Ca -0.06 0.40 0.00 0.00 -1.11 0.00 0.00 56.01 55.24 1xwo n LEU 199 Cb 0.63 -1.35 0.00 0.00 0.53 0.00 0.00 43.42 43.23 1xwo n LEU 199 CO 0.44 -0.67 0.00 0.61 -1.11 0.00 0.00 177.39 176.67 1xwo n GLY 200 N 6.14 0.35 1.02 -3.96 0.00 -1.26 -4.95 105.19 102.53 1xwo n GLY 200 Ca 0.36 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.50 1xwo n GLY 200 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xwo n SER 201 N 0.00 3.15 0.00 1.61 7.64 -1.11 -1.96 113.62 122.96 1xwo n SER 201 Ca 0.00 -2.00 0.00 0.00 1.01 0.00 0.00 58.87 57.88 1xwo n SER 201 Cb 0.00 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 1xwo n SER 201 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xwo n GLY 202 N 1.40 2.89 0.15 0.23 0.00 -1.23 -0.68 105.19 107.94 1xwo n GLY 202 Ca 0.16 -0.29 0.02 0.00 0.00 0.00 0.00 46.02 45.91 1xwo n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xwo n ALA 203 N 10.66 2.49 0.00 4.61 0.00 -1.26 -3.41 120.51 133.60 1xwo n ALA 203 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1xwo n ALA 203 Cb 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.32 1xwo n ALA 203 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1xwo n LEU 204 N 0.10 -0.03 -0.89 0.00 0.00 -1.13 -4.80 117.00 110.25 1xwo n LEU 204 Ca 0.02 0.15 0.10 0.00 0.00 0.00 0.00 56.01 56.28 1xwo n LEU 204 Cb 0.10 0.18 0.14 0.00 0.00 0.00 0.00 43.42 43.84 1xwo n LEU 204 CO 0.03 -0.01 0.61 0.00 0.00 0.00 0.00 177.39 178.03 1xwo n ALA 205 N -2.30 2.41 0.00 1.96 0.00 -1.25 -2.79 120.51 118.55 1xwo n ALA 205 Ca 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 53.44 52.59 1xwo n ALA 205 Cb 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 19.45 18.76 1xwo n ALA 205 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xwo n GLY 206 N 1.16 -0.97 3.71 0.00 0.00 0.15 -4.91 105.19 104.32 1xwo n GLY 206 Ca 0.14 -2.25 -0.42 0.00 0.00 0.00 0.00 46.02 43.50 1xwo n GLY 206 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1xwo s ASN 207 N -0.60 7.36 0.01 1.61 2.47 -0.83 -3.57 114.94 121.39 1xwo s ASN 207 Ca 0.00 1.65 0.26 0.00 0.42 0.00 0.00 52.86 55.19 1xwo s ASN 207 Cb 0.00 -2.56 0.72 0.00 -1.45 0.00 0.00 41.25 37.95 1xwo s ASN 207 CO 0.00 -0.23 1.57 -0.81 -3.72 0.00 0.00 177.10 173.91 1xwo n PRO 208 N 3.75 0.02 -0.18 0.43 -0.04 -1.26 -3.84 135.00 133.87 1xwo n PRO 208 Ca 0.05 0.01 0.11 0.00 -0.04 0.00 0.00 63.50 63.62 1xwo n PRO 208 Cb 0.51 -1.51 0.27 0.00 -0.04 0.00 0.00 33.50 32.72 1xwo n PRO 208 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1xwo n LEU 209 N -1.54 2.82 -2.69 1.53 4.77 -1.26 -4.94 117.00 115.69 1xwo n LEU 209 Ca 0.06 -1.25 -0.22 0.00 -0.03 0.00 0.00 56.01 54.57 1xwo n LEU 209 Cb 0.34 -0.24 0.01 0.00 -2.33 0.00 0.00 43.42 41.21 1xwo n LEU 209 CO 0.33 0.63 -0.13 -0.67 -1.33 0.00 0.00 177.39 176.21 1xwo n ASP 210 N 1.06 -6.03 -4.53 -1.43 4.64 -1.25 -4.93 116.55 104.08 1xwo n ASP 210 Ca 0.18 -0.15 -0.36 0.00 -1.38 0.00 0.00 54.79 53.08 1xwo n ASP 210 Cb 0.49 -4.94 0.08 0.00 -1.04 0.00 0.00 41.12 35.71 1xwo n ASP 210 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1xwo n ILE 211 N -4.27 2.16 -2.42 5.18 3.06 -1.26 -4.83 119.36 116.97 1xwo n ILE 211 Ca -0.18 -0.38 -0.39 0.00 -2.50 0.00 0.00 62.75 59.30 1xwo n ILE 211 Cb 0.65 -0.89 -0.03 0.00 0.54 0.00 0.00 39.64 39.91 1xwo n ILE 211 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 1xwo s ASP 212 N -1.56 6.03 0.23 9.51 -1.08 -1.26 -4.83 116.67 123.71 1xwo s ASP 212 Ca 0.69 -0.72 -0.08 0.00 -0.52 0.00 0.00 52.55 51.91 1xwo s ASP 212 Cb -0.35 -2.56 0.20 0.00 -1.46 0.00 0.00 42.92 38.76 1xwo s ASP 212 CO 0.55 -1.91 1.88 0.03 0.52 0.00 0.00 175.17 176.24 1xwo h ARG 213 N 10.77 1.18 0.28 4.34 2.47 -1.92 -2.39 114.38 129.11 1xwo h ARG 213 Ca -0.06 -0.10 -0.01 0.00 -1.26 0.00 0.00 59.98 58.55 1xwo h ARG 213 Cb 1.05 -0.25 -0.01 0.00 -1.65 0.00 0.00 29.97 29.11 1xwo h ARG 213 CO 1.32 0.82 -0.19 1.49 0.56 0.00 0.00 179.97 183.97 1xwo h GLU 214 N 1.20 -0.44 -0.98 0.04 4.57 -1.97 -0.32 114.58 116.67 1xwo h GLU 214 Ca 0.31 0.03 0.21 0.00 -1.18 0.00 0.00 59.36 58.73 1xwo h GLU 214 Cb -0.06 0.10 -0.09 0.00 -0.16 0.00 0.00 28.75 28.54 1xwo h GLU 214 CO -0.06 -0.29 0.62 1.98 -1.18 0.00 0.00 179.01 180.08 1xwo h MET 215 N -0.46 0.55 -0.51 1.92 4.05 -1.92 0.70 114.93 119.26 1xwo h MET 215 Ca -0.02 -0.03 -0.10 0.00 -0.28 0.00 0.00 59.70 59.26 1xwo h MET 215 Cb 0.39 -0.12 -0.02 0.00 -0.80 0.00 0.00 31.60 31.05 1xwo h MET 215 CO 0.02 0.36 -0.07 -0.07 0.23 0.00 0.00 176.91 177.37 1xwo h LEU 216 N 0.56 0.95 -1.29 3.39 3.38 -0.82 -1.64 115.31 119.84 1xwo h LEU 216 Ca 0.55 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 1xwo h LEU 216 Cb 1.12 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 1xwo h LEU 216 CO -0.29 1.07 0.22 -0.09 0.09 0.00 0.00 178.44 179.43 1xwo h ARG 217 N 0.81 0.71 0.21 1.13 2.43 0.76 -2.78 114.38 117.66 1xwo h ARG 217 Ca 0.14 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1xwo h ARG 217 Cb 0.62 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 1xwo h ARG 217 CO 0.04 0.57 -0.10 1.03 -1.51 0.00 0.00 179.97 180.00 1xwo h SER 218 N 0.71 -0.24 -0.46 -3.80 0.87 -0.67 0.22 113.55 110.17 1xwo h SER 218 Ca 0.18 -0.25 0.09 0.00 -1.23 0.00 0.00 61.79 60.57 1xwo h SER 218 Cb 0.11 0.06 -0.07 0.00 -0.44 0.00 0.00 62.40 62.06 1xwo h SER 218 CO -0.02 0.16 0.02 -0.33 -0.53 0.00 0.00 176.83 176.12 1xwo h GLU 219 N -0.69 0.13 -0.00 2.24 4.39 -1.16 -1.36 114.58 118.12 1xwo h GLU 219 Ca -0.03 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.66 1xwo h GLU 219 Cb 0.48 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 1xwo h GLU 219 CO 0.05 0.08 -0.15 1.28 -1.16 0.00 0.00 179.01 179.11 1xwo n LEU 220 N -5.20 0.27 -2.89 1.33 4.77 -1.06 -4.98 117.00 109.24 1xwo n LEU 220 Ca 0.04 0.20 -0.09 0.00 -0.03 0.00 0.00 56.01 56.13 1xwo n LEU 220 Cb 0.24 -0.32 0.01 0.00 -2.33 0.00 0.00 43.42 41.03 1xwo n LEU 220 CO 0.18 0.06 -0.05 -0.67 -1.33 0.00 0.00 177.39 175.58 1xwo n ASP 221 N -1.30 -7.78 -4.33 -1.43 2.03 -0.51 -5.05 116.55 98.17 1xwo n ASP 221 Ca 0.10 0.60 -0.25 0.00 0.52 0.00 0.00 54.79 55.76 1xwo n ASP 221 Cb 0.31 -5.08 -0.12 0.00 -0.72 0.00 0.00 41.12 35.50 1xwo n ASP 221 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1xwo s PHE 222 N -2.39 1.97 0.02 -0.67 0.40 -0.02 -5.03 117.98 112.26 1xwo s PHE 222 Ca 0.23 -0.41 -0.25 0.00 -0.60 0.00 0.00 56.93 55.89 1xwo s PHE 222 Cb -0.06 -1.04 -0.18 0.00 0.51 0.00 0.00 43.02 42.25 1xwo s PHE 222 CO 0.77 0.29 1.41 0.00 0.70 0.00 0.00 175.22 178.39 1xwo h ALA 223 N 3.77 -0.13 -3.27 5.36 0.00 -1.53 -3.44 119.26 120.02 1xwo h ALA 223 Ca -0.46 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1xwo h ALA 223 Cb 1.19 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1xwo h ALA 223 CO 0.43 -0.42 0.00 0.43 0.00 0.00 0.00 179.25 179.69 1xwo n SER 224 N -5.01 0.60 -4.10 0.00 7.64 -1.08 -5.04 113.62 106.64 1xwo n SER 224 Ca -0.08 -0.89 -0.24 0.00 1.01 0.00 0.00 58.87 58.67 1xwo n SER 224 Cb 0.19 0.00 -0.16 0.00 -1.01 0.00 0.00 64.21 63.24 1xwo n SER 224 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1xwo s ILE 225 N -1.56 1.20 -0.22 0.44 1.01 -1.26 -1.20 121.20 119.61 1xwo s ILE 225 Ca 0.00 -0.62 -0.43 0.00 0.00 0.00 0.00 60.65 59.60 1xwo s ILE 225 Cb 0.00 -1.02 -0.20 0.00 0.01 0.00 0.00 42.46 41.25 1xwo s ILE 225 CO 0.00 0.35 1.31 -1.54 0.00 0.00 0.00 174.94 175.05 1xwo n SER 226 N 2.98 0.55 -0.03 3.58 3.41 0.66 -4.82 113.62 119.95 1xwo n SER 226 Ca -0.16 1.17 -0.13 0.00 -0.26 0.00 0.00 58.87 59.48 1xwo n SER 226 Cb 0.54 -0.91 -0.09 0.00 -0.26 0.00 0.00 64.21 63.49 1xwo n SER 226 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1xwo h LEU 227 N 3.91 0.16 -7.73 1.04 3.38 -1.99 -3.45 115.31 110.64 1xwo h LEU 227 Ca -0.48 -0.52 -0.55 0.00 0.09 0.00 0.00 57.88 56.42 1xwo h LEU 227 Cb 1.40 -0.05 -0.37 0.00 0.09 0.00 0.00 40.66 41.74 1xwo h LEU 227 CO 0.80 0.66 -0.81 0.21 0.09 0.00 0.00 178.44 179.38 1xwo s ASN 228 N -5.93 2.43 0.23 -0.43 2.47 -1.26 -5.05 114.94 107.40 1xwo s ASN 228 Ca -0.15 -0.42 -0.07 0.00 0.42 0.00 0.00 52.86 52.64 1xwo s ASN 228 Cb 0.03 -0.93 0.37 0.00 -1.45 0.00 0.00 41.25 39.27 1xwo s ASN 228 CO 0.71 -0.12 1.74 0.77 -3.72 0.00 0.00 177.10 176.48 1xwo h SER 229 N 8.14 0.24 0.01 -4.21 4.64 -1.86 -0.92 113.55 119.60 1xwo h SER 229 Ca -0.31 0.10 0.03 0.00 -0.47 0.00 0.00 61.79 61.14 1xwo h SER 229 Cb 1.13 0.08 -0.05 0.00 -0.31 0.00 0.00 62.40 63.25 1xwo h SER 229 CO 0.43 0.12 -0.27 0.24 -0.87 0.00 0.00 176.83 176.48 1xwo h MET 230 N 0.43 -0.41 0.25 4.77 2.86 -1.86 -2.63 114.93 118.35 1xwo h MET 230 Ca 0.36 0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 58.02 1xwo h MET 230 Cb 0.51 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.25 1xwo h MET 230 CO -0.36 -0.27 -0.21 0.22 1.06 0.00 0.00 176.91 177.35 1xwo h ASP 231 N -0.42 -0.56 -0.95 1.22 3.58 -1.62 -2.76 116.42 114.91 1xwo h ASP 231 Ca 0.06 0.04 0.37 0.00 0.42 0.00 0.00 57.03 57.92 1xwo h ASP 231 Cb 0.50 0.18 -0.17 0.00 1.72 0.00 0.00 39.33 41.55 1xwo h ASP 231 CO -0.23 -0.29 0.40 0.00 -2.88 0.00 0.00 179.24 176.24 1xwo n ALA 232 N -2.44 0.87 0.07 -0.78 0.00 -0.45 -0.24 120.51 117.54 1xwo n ALA 232 Ca -0.05 0.98 -0.15 0.00 0.00 0.00 0.00 53.44 54.22 1xwo n ALA 232 Cb 0.20 -0.92 -0.07 0.00 0.00 0.00 0.00 19.45 18.66 1xwo n ALA 232 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1xwo h ILE 233 N 0.00 1.40 -0.03 0.00 2.04 -1.40 -3.33 117.51 116.19 1xwo h ILE 233 Ca 0.76 -2.54 0.00 0.00 1.00 0.00 0.00 64.86 64.07 1xwo h ILE 233 Cb 1.93 2.53 0.00 0.00 -0.74 0.00 0.00 36.82 40.54 1xwo h ILE 233 CO -0.77 0.76 -0.09 -1.54 0.00 0.00 0.00 178.15 176.51 1xwo n SER 234 N -3.72 2.71 -4.89 1.72 3.41 0.23 -4.67 113.62 108.41 1xwo n SER 234 Ca -0.08 -1.87 -0.32 0.00 -0.26 0.00 0.00 58.87 56.34 1xwo n SER 234 Cb 0.88 0.09 -0.05 0.00 -0.26 0.00 0.00 64.21 64.87 1xwo n SER 234 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1xwo s GLU 235 N -2.09 3.61 -0.01 4.33 4.04 0.67 -4.89 118.70 124.36 1xwo s GLU 235 Ca 0.27 -0.09 0.13 0.00 0.04 0.00 0.00 54.97 55.32 1xwo s GLU 235 Cb 0.20 -2.93 0.22 0.00 0.02 0.00 0.00 34.13 31.64 1xwo s GLU 235 CO 0.35 0.52 1.09 0.54 -1.84 0.00 0.00 175.26 175.93 1xwo n ARG 236 N 0.39 0.07 -0.26 -4.83 5.12 -1.26 -4.86 116.66 111.02 1xwo n ARG 236 Ca -0.05 -1.57 0.04 0.00 -1.93 0.00 0.00 57.85 54.34 1xwo n ARG 236 Cb 0.52 -0.31 0.17 0.00 -1.16 0.00 0.00 32.46 31.68 1xwo n ARG 236 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 1xwo h ASP 237 N 0.50 0.39 -0.58 0.55 3.45 -1.99 -0.45 116.42 118.29 1xwo h ASP 237 Ca -0.11 0.08 0.10 0.00 0.43 0.00 0.00 57.03 57.54 1xwo h ASP 237 Cb 1.62 0.03 -0.03 0.00 -0.56 0.00 0.00 39.33 40.38 1xwo h ASP 237 CO 0.05 0.19 0.39 2.19 -1.57 0.00 0.00 179.24 180.49 1xwo h PHE 238 N 0.54 0.38 0.18 4.55 -5.15 -1.95 0.33 116.94 115.82 1xwo h PHE 238 Ca 0.39 0.01 -0.01 0.00 -0.20 0.00 0.00 57.97 58.16 1xwo h PHE 238 Cb 0.51 -0.12 0.00 0.00 0.22 0.00 0.00 35.95 36.56 1xwo h PHE 238 CO -0.13 0.18 -0.09 0.28 -2.00 0.00 0.00 178.31 176.55 1xwo h VAL 239 N 0.35 0.71 0.25 0.88 2.07 -1.52 -2.75 116.25 116.25 1xwo h VAL 239 Ca 0.27 -1.09 0.01 0.00 0.82 0.00 0.00 66.70 66.71 1xwo h VAL 239 Cb 0.60 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 1xwo h VAL 239 CO -0.07 0.19 -0.35 0.58 0.02 0.00 0.00 177.57 177.94 1xwo h VAL 240 N -0.91 0.27 -1.01 2.57 2.07 -0.55 -0.89 116.25 117.80 1xwo h VAL 240 Ca -0.02 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.65 1xwo h VAL 240 Cb 0.50 0.27 -0.10 0.00 -1.52 0.00 0.00 31.29 30.44 1xwo h VAL 240 CO 0.04 0.00 0.62 -0.08 0.02 0.00 0.00 177.57 178.17 1xwo h GLU 241 N -0.67 0.85 -0.44 1.57 4.81 -0.51 0.38 114.58 120.57 1xwo h GLU 241 Ca -0.00 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.11 1xwo h GLU 241 Cb 0.64 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.81 1xwo h GLU 241 CO -0.13 0.56 0.01 0.35 -0.73 0.00 0.00 179.01 179.07 1xwo h PHE 242 N 0.87 0.84 0.00 0.92 3.57 -1.09 -1.57 116.94 120.48 1xwo h PHE 242 Ca 0.54 -0.14 -0.01 0.00 3.53 0.00 0.00 57.97 61.89 1xwo h PHE 242 Cb 0.72 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 39.23 1xwo h PHE 242 CO -0.00 0.82 -0.06 -0.07 -2.23 0.00 0.00 178.31 176.77 1xwo h LEU 243 N 0.62 0.00 0.09 0.59 3.38 0.40 -0.61 115.31 119.78 1xwo h LEU 243 Ca 0.13 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1xwo h LEU 243 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1xwo h LEU 243 CO 0.02 0.06 -0.05 0.28 0.09 0.00 0.00 178.44 178.84 1xwo h SER 244 N 0.00 -0.11 -0.54 -0.43 0.02 -0.55 -1.17 113.55 110.77 1xwo h SER 244 Ca -0.00 -0.47 0.09 0.00 -0.84 0.00 0.00 61.79 60.57 1xwo h SER 244 Cb 0.32 0.03 -0.07 0.00 0.14 0.00 0.00 62.40 62.82 1xwo h SER 244 CO 0.01 0.53 0.13 0.58 -1.14 0.00 0.00 176.83 176.94 1xwo h VAL 245 N -0.87 0.72 -0.75 2.27 2.07 -1.06 -1.23 116.25 117.40 1xwo h VAL 245 Ca -0.01 -0.10 0.02 0.00 0.82 0.00 0.00 66.70 67.43 1xwo h VAL 245 Cb 0.57 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 1xwo h VAL 245 CO 0.02 0.05 0.49 0.00 0.02 0.00 0.00 177.57 178.15 1xwo h ALA 246 N 1.41 0.96 -0.58 1.67 0.00 -1.14 -1.52 119.26 120.07 1xwo h ALA 246 Ca 0.27 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 1xwo h ALA 246 Cb 0.37 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1xwo h ALA 246 CO -0.33 0.33 0.19 1.15 0.00 0.00 0.00 179.25 180.58 1xwo h THR 247 N 0.98 1.24 -0.26 0.00 2.02 -0.22 -2.02 112.91 114.65 1xwo h THR 247 Ca 0.28 -0.80 -0.03 0.00 0.77 0.00 0.00 66.41 66.63 1xwo h THR 247 Cb -0.07 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 1xwo h THR 247 CO -0.08 0.30 0.04 0.25 0.37 0.00 0.00 175.52 176.41 1xwo h LEU 248 N 0.81 0.41 -0.63 2.58 6.46 -0.98 -0.34 115.31 123.62 1xwo h LEU 248 Ca 0.19 -0.26 0.13 0.00 -0.12 0.00 0.00 57.88 57.82 1xwo h LEU 248 Cb 0.27 -0.11 -0.11 0.00 -0.73 0.00 0.00 40.66 39.98 1xwo h LEU 248 CO -0.01 0.57 -0.03 0.25 -0.62 0.00 0.00 178.44 178.59 1xwo h LEU 249 N 0.24 -0.35 -0.65 2.25 5.85 -1.11 0.18 115.31 121.71 1xwo h LEU 249 Ca 0.08 0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.95 1xwo h LEU 249 Cb 0.33 0.31 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 1xwo h LEU 249 CO 0.01 -0.14 0.35 0.24 -0.34 0.00 0.00 178.44 178.55 1xwo h MET 250 N 0.09 0.91 -0.65 1.25 2.86 -1.09 -1.07 114.93 117.23 1xwo h MET 250 Ca 0.33 -0.11 -0.02 0.00 -2.06 0.00 0.00 59.70 57.84 1xwo h MET 250 Cb 0.53 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 31.98 1xwo h MET 250 CO -0.57 0.69 0.34 0.82 1.06 0.00 0.00 176.91 179.26 1xwo h ILE 251 N 0.89 1.21 -0.49 -1.22 5.03 0.78 0.33 117.51 124.05 1xwo h ILE 251 Ca 0.23 -0.56 0.10 0.00 -0.12 0.00 0.00 64.86 64.50 1xwo h ILE 251 Cb 0.05 0.39 -0.09 0.00 -3.03 0.00 0.00 36.82 34.14 1xwo h ILE 251 CO -0.04 0.24 -0.08 0.45 -0.68 0.00 0.00 178.15 178.05 1xwo h HIS 252 N 0.90 -0.17 0.00 1.37 3.86 -0.06 -0.25 115.15 120.80 1xwo h HIS 252 Ca 0.23 0.04 -0.09 0.00 -1.16 0.00 0.00 60.37 59.39 1xwo h HIS 252 Cb 0.07 0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.68 1xwo h HIS 252 CO -0.00 -0.18 -0.44 -0.07 0.86 0.00 0.00 177.93 178.10 1xwo h LEU 253 N 0.04 0.00 -1.16 2.43 3.38 -0.63 -2.87 115.31 116.50 1xwo h LEU 253 Ca 0.24 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.14 1xwo h LEU 253 Cb 0.37 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1xwo h LEU 253 CO -0.47 0.44 -0.35 0.77 0.09 0.00 0.00 178.44 178.91 1xwo h SER 254 N 0.00 0.00 1.26 -0.43 4.64 0.14 -0.54 113.55 118.61 1xwo h SER 254 Ca -0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1xwo h SER 254 Cb 0.88 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.95 1xwo h SER 254 CO 0.06 0.35 -0.42 0.50 -0.87 0.00 0.00 176.83 176.45 1xwo h LYS 255 N 0.00 0.00 0.12 4.77 3.64 -1.08 -2.02 116.57 122.00 1xwo h LYS 255 Ca -0.00 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 59.10 1xwo h LYS 255 Cb 0.76 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.58 1xwo h LYS 255 CO 0.05 0.42 -1.42 1.98 -2.27 0.00 0.00 179.45 178.20 1xwo h MET 256 N 0.00 0.26 -0.39 1.90 4.05 -1.35 -2.40 114.93 116.99 1xwo h MET 256 Ca -0.00 -0.44 0.08 0.00 -0.28 0.00 0.00 59.70 59.06 1xwo h MET 256 Cb 1.16 0.16 -0.08 0.00 -0.80 0.00 0.00 31.60 32.04 1xwo h MET 256 CO 0.05 1.21 -0.13 0.00 0.23 0.00 0.00 176.91 178.27 1xwo h ALA 257 N -0.03 0.21 -0.14 0.39 0.00 -1.14 0.14 119.26 118.70 1xwo h ALA 257 Ca -0.30 0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.79 1xwo h ALA 257 Cb 1.78 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 19.89 1xwo h ALA 257 CO 0.07 -0.49 -0.10 1.49 0.00 0.00 0.00 179.25 180.23 1xwo h GLU 258 N -0.04 -0.10 0.19 0.00 4.57 -1.47 0.67 114.58 118.40 1xwo h GLU 258 Ca 0.19 0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.39 1xwo h GLU 258 Cb 0.34 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.91 1xwo h GLU 258 CO -0.43 -0.07 -0.34 -0.44 -1.18 0.00 0.00 179.01 176.55 1xwo h ASP 259 N -0.10 -0.98 0.46 1.04 3.32 -0.39 -2.43 116.42 117.34 1xwo h ASP 259 Ca 0.09 0.10 -0.08 0.00 0.02 0.00 0.00 57.03 57.16 1xwo h ASP 259 Cb 0.23 0.36 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 1xwo h ASP 259 CO -0.20 -0.45 -0.37 -0.07 -1.72 0.00 0.00 179.24 176.43 1xwo h LEU 260 N -0.62 0.00 0.16 1.55 3.38 -0.70 -1.68 115.31 117.41 1xwo h LEU 260 Ca 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1xwo h LEU 260 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1xwo h LEU 260 CO -0.16 0.37 -0.08 0.40 0.09 0.00 0.00 178.44 179.06 1xwo h ILE 261 N 0.00 0.87 0.06 1.22 2.04 -0.68 0.23 117.51 121.25 1xwo h ILE 261 Ca -0.00 -0.14 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 1xwo h ILE 261 Cb 0.70 0.96 0.00 0.00 -0.74 0.00 0.00 36.82 37.74 1xwo h ILE 261 CO 0.05 0.03 -0.03 0.40 0.00 0.00 0.00 178.15 178.60 1xwo h ILE 262 N -0.28 0.97 0.00 -0.67 2.04 -1.34 -2.12 117.51 116.10 1xwo h ILE 262 Ca -0.02 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.76 1xwo h ILE 262 Cb 0.22 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 1xwo h ILE 262 CO 0.04 0.02 0.00 -1.22 0.00 0.00 0.00 178.15 176.99 1xwo n TYR 263 N -5.11 0.00 0.80 1.37 4.02 -0.64 -0.95 117.16 116.65 1xwo n TYR 263 Ca -0.08 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 57.91 1xwo n TYR 263 Cb 0.07 -0.48 0.05 0.00 -0.02 0.00 0.00 39.34 38.96 1xwo n TYR 263 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1xwo n SER 264 N -1.48 2.26 -4.79 7.72 3.41 0.05 -1.52 113.62 119.27 1xwo n SER 264 Ca 0.01 -1.63 -0.30 0.00 -0.26 0.00 0.00 58.87 56.69 1xwo n SER 264 Cb 0.05 0.19 0.09 0.00 -0.26 0.00 0.00 64.21 64.27 1xwo n SER 264 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1xwo s THR 265 N -1.79 3.34 0.25 6.66 -4.23 -0.12 -4.76 115.64 114.99 1xwo s THR 265 Ca 0.19 0.44 0.04 0.00 -1.18 0.00 0.00 61.69 61.18 1xwo s THR 265 Cb 0.15 -3.08 -0.02 0.00 1.34 0.00 0.00 72.50 70.90 1xwo s THR 265 CO 0.33 -0.57 1.59 0.77 -0.54 0.00 0.00 174.62 176.20 1xwo h SER 266 N -1.07 0.32 -0.94 3.99 4.64 -1.93 0.25 113.55 118.83 1xwo h SER 266 Ca -0.46 -0.17 0.19 0.00 -0.47 0.00 0.00 61.79 60.88 1xwo h SER 266 Cb 1.25 -0.09 -0.08 0.00 -0.31 0.00 0.00 62.40 63.16 1xwo h SER 266 CO 0.56 0.80 0.60 -0.33 -0.87 0.00 0.00 176.83 177.59 1xwo h GLU 267 N 0.23 0.57 0.00 4.77 3.07 -1.91 -3.17 114.58 118.13 1xwo h GLU 267 Ca 0.00 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 58.82 1xwo h GLU 267 Cb 1.02 -0.13 -0.00 0.00 -0.84 0.00 0.00 28.75 28.80 1xwo h GLU 267 CO 0.09 0.38 -0.79 1.19 -1.40 0.00 0.00 179.01 178.47 1xwo n PHE 268 N -4.59 0.48 -2.37 4.33 3.01 -1.06 -5.03 117.46 112.23 1xwo n PHE 268 Ca 0.20 0.21 -0.09 0.00 1.01 0.00 0.00 57.45 58.78 1xwo n PHE 268 Cb 0.61 -0.66 0.01 0.00 -0.01 0.00 0.00 39.48 39.43 1xwo n PHE 268 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1xwo n GLY 269 N 1.53 0.12 0.11 1.37 0.00 0.86 -4.95 105.19 104.24 1xwo n GLY 269 Ca -0.12 -0.47 -0.16 0.00 0.00 0.00 0.00 46.02 45.26 1xwo n GLY 269 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1xwo h PHE 270 N -0.30 0.41 -3.39 1.61 0.04 -1.52 -3.43 116.94 110.37 1xwo h PHE 270 Ca -0.21 -0.30 -0.01 0.00 2.80 0.00 0.00 57.97 60.26 1xwo h PHE 270 Cb 1.15 -0.02 -0.07 0.00 2.20 0.00 0.00 35.95 39.21 1xwo h PHE 270 CO 0.21 1.38 0.02 -0.48 -0.60 0.00 0.00 178.31 178.85 1xwo s LEU 271 N -6.90 0.08 -0.10 1.54 0.05 -0.83 0.97 118.68 113.49 1xwo s LEU 271 Ca -0.10 -0.79 -0.07 0.00 0.05 0.00 0.00 54.13 53.22 1xwo s LEU 271 Cb 0.07 2.16 0.04 0.00 -2.05 0.00 0.00 46.19 46.40 1xwo s LEU 271 CO 0.84 -1.22 0.26 0.28 -0.55 0.00 0.00 176.35 175.96 1xwo s THR 272 N -3.98 -0.02 0.93 5.48 -1.32 -0.52 -4.07 115.64 112.15 1xwo s THR 272 Ca 0.18 0.08 -0.12 0.00 -1.21 0.00 0.00 61.69 60.62 1xwo s THR 272 Cb -0.03 -0.38 0.15 0.00 -1.51 0.00 0.00 72.50 70.72 1xwo s THR 272 CO 0.08 0.03 1.10 -0.76 -2.21 0.00 0.00 174.62 172.86 1xwo s LEU 273 N 0.76 2.02 0.56 9.08 1.02 -1.26 -0.90 118.68 129.96 1xwo s LEU 273 Ca -0.05 1.31 -0.07 0.00 0.02 0.00 0.00 54.13 55.34 1xwo s LEU 273 Cb -0.06 -3.65 -0.02 0.00 0.02 0.00 0.00 46.19 42.48 1xwo s LEU 273 CO -0.05 -2.75 0.89 -0.94 0.02 0.00 0.00 176.35 173.52 1xwo s SER 274 N -3.54 5.97 0.63 2.29 1.04 -1.26 -4.77 113.70 114.06 1xwo s SER 274 Ca 0.64 0.95 0.35 0.00 0.48 0.00 0.00 55.95 58.38 1xwo s SER 274 Cb -0.18 -2.08 1.99 0.00 0.10 0.00 0.00 66.02 65.86 1xwo s SER 274 CO 0.57 -0.85 2.21 0.44 0.98 0.00 0.00 173.24 176.59 1xwo h ASP 275 N -0.07 0.00 1.51 7.02 3.45 -1.96 -2.07 116.42 124.30 1xwo h ASP 275 Ca -0.46 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.00 1xwo h ASP 275 Cb 1.22 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.99 1xwo h ASP 275 CO 0.62 0.00 0.00 0.00 -1.57 0.00 0.00 179.24 178.29 1xwo h ALA 276 N 1.84 1.00 0.00 3.45 0.00 -2.01 -3.25 119.26 120.28 1xwo h ALA 276 Ca 0.02 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1xwo h ALA 276 Cb 0.23 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1xwo h ALA 276 CO -0.00 0.00 -0.17 1.19 0.00 0.00 0.00 179.25 180.27 1xwo n PHE 277 N -2.41 0.00 -3.85 0.00 3.01 -0.79 -5.03 117.46 108.39 1xwo n PHE 277 Ca 0.05 -0.97 -0.10 0.00 1.01 0.00 0.00 57.45 57.44 1xwo n PHE 277 Cb 0.43 -0.16 -0.01 0.00 -0.01 0.00 0.00 39.48 39.73 1xwo n PHE 277 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1xwo n SER 278 N -1.18 -1.11 -2.39 4.37 3.41 -1.17 -3.03 113.62 112.51 1xwo n SER 278 Ca 0.15 -2.32 -0.11 0.00 -0.26 0.00 0.00 58.87 56.32 1xwo n SER 278 Cb 0.67 2.01 -0.03 0.00 -0.26 0.00 0.00 64.21 66.60 1xwo n SER 278 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1xwo n THR 279 N -0.41 0.00 0.00 6.66 -2.24 -0.32 -4.88 114.28 113.09 1xwo n THR 279 Ca -0.01 -1.33 0.00 0.00 -2.27 0.00 0.00 64.05 60.45 1xwo n THR 279 Cb 0.42 0.76 0.00 0.00 -2.10 0.00 0.00 70.33 69.42 1xwo n THR 279 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xwo n GLY 280 N -0.40 0.74 3.88 3.38 0.00 -1.26 -0.50 105.19 111.03 1xwo n GLY 280 Ca 0.02 -0.89 -0.30 0.00 0.00 0.00 0.00 46.02 44.84 1xwo n GLY 280 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xwo s SER 281 N 0.00 6.48 0.12 1.61 0.15 -1.26 -5.01 113.70 115.78 1xwo s SER 281 Ca 0.00 1.13 -0.11 0.00 0.70 0.00 0.00 55.95 57.67 1xwo s SER 281 Cb 0.00 -2.32 -0.12 0.00 -1.71 0.00 0.00 66.02 61.87 1xwo s SER 281 CO 0.00 -0.45 1.33 0.28 1.20 0.00 0.00 173.24 175.60 1xwo h SER 282 N 1.04 0.87 1.29 5.45 0.02 -2.00 -3.26 113.55 116.95 1xwo h SER 282 Ca -0.47 -0.57 -0.06 0.00 -0.84 0.00 0.00 61.79 59.86 1xwo h SER 282 Cb 1.19 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 63.47 1xwo h SER 282 CO 0.63 1.36 -0.27 -0.07 -1.14 0.00 0.00 176.83 177.35 1xwo h LEU 283 N 0.50 0.00 -6.31 5.07 -0.00 -2.03 -3.35 115.31 109.19 1xwo h LEU 283 Ca -0.05 0.00 -0.60 0.00 -0.00 0.00 0.00 57.88 57.23 1xwo h LEU 283 Cb 1.39 0.00 -0.42 0.00 -0.00 0.00 0.00 40.66 41.63 1xwo h LEU 283 CO 0.15 0.27 -0.64 0.23 -0.00 0.00 0.00 178.44 178.45 1xwo n MET 284 N -3.27 2.25 0.00 1.13 2.81 -1.23 -4.94 117.12 113.87 1xwo n MET 284 Ca 0.01 -4.51 0.00 0.00 -1.81 0.00 0.00 57.70 51.39 1xwo n MET 284 Cb 0.54 -2.17 0.00 0.00 -0.71 0.00 0.00 33.22 30.88 1xwo n MET 284 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 1xwo n PRO 285 N 1.08 0.00 0.03 0.03 -0.04 -1.25 -1.00 135.00 133.85 1xwo n PRO 285 Ca 0.28 0.19 0.04 0.00 -0.04 0.00 0.00 63.50 63.97 1xwo n PRO 285 Cb 0.41 -1.53 -0.08 0.00 -0.04 0.00 0.00 33.50 32.25 1xwo n PRO 285 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1xwo n GLN 286 N -1.15 0.63 -2.31 0.54 3.00 -1.26 -4.86 117.38 111.96 1xwo n GLN 286 Ca 0.00 0.10 -0.42 0.00 -0.01 0.00 0.00 57.00 56.67 1xwo n GLN 286 Cb 0.03 -1.73 -0.03 0.00 0.00 0.00 0.00 30.24 28.51 1xwo n GLN 286 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.06 177.27 1xwo s LYS 287 N -3.10 4.26 -0.24 -1.09 2.20 -0.17 -5.00 119.74 116.59 1xwo s LYS 287 Ca -0.04 1.83 0.00 0.00 -0.36 0.00 0.00 55.97 57.40 1xwo s LYS 287 Cb 0.10 -3.71 0.07 0.00 -1.51 0.00 0.00 37.83 32.77 1xwo s LYS 287 CO 0.82 -0.65 -0.02 0.21 -0.36 0.00 0.00 175.35 175.36 1xwo s LYS 288 N 3.06 1.37 -0.18 4.03 2.20 -1.26 -4.47 119.74 124.49 1xwo s LYS 288 Ca 0.60 -0.95 -0.19 0.00 -0.36 0.00 0.00 55.97 55.07 1xwo s LYS 288 Cb -0.27 -2.49 -0.03 0.00 -1.51 0.00 0.00 37.83 33.53 1xwo s LYS 288 CO 0.21 -0.66 0.54 -0.80 -0.36 0.00 0.00 175.35 174.28 1xwo s ASN 289 N 1.47 6.63 -1.46 1.43 0.01 0.35 -4.90 114.94 118.46 1xwo s ASN 289 Ca -0.03 0.76 -0.09 0.00 -0.71 0.00 0.00 52.86 52.79 1xwo s ASN 289 Cb -0.18 -2.31 -0.08 0.00 0.41 0.00 0.00 41.25 39.09 1xwo s ASN 289 CO -0.08 -0.16 2.77 -0.81 -1.51 0.00 0.00 177.10 177.31 1xwo n PRO 290 N 4.56 3.33 -0.11 -0.60 -0.04 -1.26 -1.17 135.00 139.71 1xwo n PRO 290 Ca -0.04 -2.03 -0.12 0.00 -0.04 0.00 0.00 63.50 61.26 1xwo n PRO 290 Cb 0.51 -2.72 -0.07 0.00 -0.04 0.00 0.00 33.50 31.17 1xwo n PRO 290 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1xwo h ASP 291 N 5.31 -1.62 -0.91 3.54 5.19 -1.90 -1.17 116.42 124.86 1xwo h ASP 291 Ca 0.79 0.22 0.09 0.00 -0.62 0.00 0.00 57.03 57.52 1xwo h ASP 291 Cb 0.26 0.68 -0.12 0.00 0.18 0.00 0.00 39.33 40.33 1xwo h ASP 291 CO 1.71 -0.40 -0.50 -1.54 -3.12 0.00 0.00 179.24 175.39 1xwo n SER 292 N -5.41 -0.89 -0.25 6.45 3.41 -1.17 0.40 113.62 116.17 1xwo n SER 292 Ca -0.03 1.61 -0.01 0.00 -0.26 0.00 0.00 58.87 60.18 1xwo n SER 292 Cb 0.35 -0.24 0.19 0.00 -0.26 0.00 0.00 64.21 64.26 1xwo n SER 292 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1xwo h LEU 293 N 0.00 0.94 0.25 1.04 3.38 -1.67 -1.48 115.31 117.77 1xwo h LEU 293 Ca 0.18 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1xwo h LEU 293 Cb 0.40 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1xwo h LEU 293 CO -0.86 0.71 -0.12 -0.33 0.09 0.00 0.00 178.44 177.93 1xwo h GLU 294 N 1.10 -0.33 0.15 1.13 5.08 0.12 -0.88 114.58 120.94 1xwo h GLU 294 Ca 0.29 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.69 1xwo h GLU 294 Cb -0.07 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.21 1xwo h GLU 294 CO -0.06 -0.21 -0.48 -0.07 -1.00 0.00 0.00 179.01 177.20 1xwo h LEU 295 N -0.35 -1.43 -0.25 1.33 3.38 -0.53 -0.51 115.31 116.94 1xwo h LEU 295 Ca -0.03 0.15 0.05 0.00 0.09 0.00 0.00 57.88 58.14 1xwo h LEU 295 Cb 0.27 0.53 -0.08 0.00 0.09 0.00 0.00 40.66 41.47 1xwo h LEU 295 CO 0.06 -0.54 -0.46 0.40 0.09 0.00 0.00 178.44 177.98 1xwo h ILE 296 N -0.73 0.09 -0.41 1.22 2.04 -1.18 -1.19 117.51 117.34 1xwo h ILE 296 Ca 0.00 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.95 1xwo h ILE 296 Cb 0.74 0.09 -0.09 0.00 -0.74 0.00 0.00 36.82 36.82 1xwo h ILE 296 CO -0.25 0.00 -0.19 -0.09 0.00 0.00 0.00 178.15 177.62 1xwo h ARG 297 N -0.45 -0.10 -0.62 2.37 2.43 -0.96 -0.60 114.38 116.44 1xwo h ARG 297 Ca 0.09 0.01 0.10 0.00 -0.81 0.00 0.00 59.98 59.36 1xwo h ARG 297 Cb 0.62 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.16 1xwo h ARG 297 CO -0.49 -0.07 0.42 0.66 -1.51 0.00 0.00 179.97 178.98 1xwo h SER 298 N -0.11 0.39 0.24 -3.80 4.64 -0.03 -1.21 113.55 113.67 1xwo h SER 298 Ca 0.20 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 1xwo h SER 298 Cb 0.42 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1xwo h SER 298 CO -0.48 0.23 0.00 0.11 -0.87 0.00 0.00 176.83 175.82 1xwo h LYS 299 N 0.43 0.00 -0.29 4.77 1.79 0.03 -1.50 116.57 121.80 1xwo h LYS 299 Ca 0.29 0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.79 1xwo h LYS 299 Cb 0.55 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.17 1xwo h LYS 299 CO -0.08 0.00 0.09 0.00 -1.08 0.00 0.00 179.45 178.38 1xwo h ALA 300 N 2.08 0.32 -0.56 3.86 0.00 -1.25 0.16 119.26 123.88 1xwo h ALA 300 Ca 0.00 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1xwo h ALA 300 Cb 0.12 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1xwo h ALA 300 CO 0.00 -0.31 0.17 0.78 0.00 0.00 0.00 179.25 179.89 1xwo h GLY 301 N 0.22 0.94 0.33 0.00 0.00 -1.45 0.30 103.07 103.41 1xwo h GLY 301 Ca 0.13 -0.56 -0.01 0.00 0.00 0.00 0.00 47.33 46.90 1xwo h GLY 301 CO -0.14 0.52 -0.40 -0.09 0.00 0.00 0.00 176.54 176.43 1xwo h ARG 302 N 0.79 -0.71 0.10 4.80 2.43 -1.40 0.30 114.38 120.68 1xwo h ARG 302 Ca 0.18 0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.41 1xwo h ARG 302 Cb 0.29 0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.97 1xwo h ARG 302 CO -0.01 -0.48 -0.37 0.28 -1.51 0.00 0.00 179.97 177.89 1xwo h VAL 303 N -0.74 0.00 -0.87 0.20 2.07 -0.92 -1.68 116.25 114.30 1xwo h VAL 303 Ca -0.04 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.65 1xwo h VAL 303 Cb 0.66 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.27 1xwo h VAL 303 CO -0.09 0.00 -0.24 0.33 0.02 0.00 0.00 177.57 177.59 1xwo n PHE 304 N -4.53 0.25 -0.25 1.57 7.35 0.09 0.38 117.46 122.32 1xwo n PHE 304 Ca -0.06 1.07 0.05 0.00 -0.76 0.00 0.00 57.45 57.74 1xwo n PHE 304 Cb 0.29 -0.97 0.16 0.00 0.35 0.00 0.00 39.48 39.31 1xwo n PHE 304 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 1xwo h GLY 305 N 0.00 0.87 1.02 7.13 0.00 0.55 0.22 103.07 112.86 1xwo h GLY 305 Ca 0.39 0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.78 1xwo h GLY 305 CO -0.89 -0.26 0.49 3.21 0.00 0.00 0.00 176.54 179.10 1xwo h ARG 306 N 0.15 1.15 -0.23 4.80 2.47 0.19 0.62 114.38 123.52 1xwo h ARG 306 Ca 0.40 -0.11 -0.00 0.00 -1.26 0.00 0.00 59.98 59.01 1xwo h ARG 306 Cb 0.70 -0.24 -0.01 0.00 -1.65 0.00 0.00 29.97 28.77 1xwo h ARG 306 CO -0.60 0.82 0.13 1.25 0.56 0.00 0.00 179.97 182.13 1xwo h LEU 307 N 1.16 0.28 -1.12 3.04 5.85 -0.60 -1.87 115.31 122.05 1xwo h LEU 307 Ca 0.30 -0.07 -0.06 0.00 0.84 0.00 0.00 57.88 58.89 1xwo h LEU 307 Cb -0.02 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 1xwo h LEU 307 CO -0.05 0.27 -0.08 0.00 -0.34 0.00 0.00 178.44 178.24 1xwo h ALA 308 N 1.03 1.28 0.76 1.25 0.00 -0.95 -1.16 119.26 121.47 1xwo h ALA 308 Ca 0.08 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1xwo h ALA 308 Cb 0.04 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.70 1xwo h ALA 308 CO -0.01 0.48 -0.38 1.03 0.00 0.00 0.00 179.25 180.37 1xwo h SER 309 N 0.49 -0.90 -0.09 0.00 0.87 -0.50 -1.71 113.55 111.71 1xwo h SER 309 Ca 0.10 0.03 0.01 0.00 -1.23 0.00 0.00 61.79 60.70 1xwo h SER 309 Cb 0.44 0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.63 1xwo h SER 309 CO 0.02 -0.63 0.03 0.40 -0.53 0.00 0.00 176.83 176.13 1xwo h ILE 310 N -1.03 0.99 -0.62 2.23 2.04 -1.32 -1.96 117.51 117.84 1xwo h ILE 310 Ca -0.10 -0.03 0.09 0.00 1.00 0.00 0.00 64.86 65.82 1xwo h ILE 310 Cb 0.80 0.90 -0.11 0.00 -0.74 0.00 0.00 36.82 37.66 1xwo h ILE 310 CO 0.16 0.01 -0.44 0.25 0.00 0.00 0.00 178.15 178.14 1xwo h LEU 311 N 0.08 -1.53 -0.51 1.44 5.85 -1.20 0.27 115.31 119.71 1xwo h LEU 311 Ca 0.04 0.25 0.10 0.00 0.84 0.00 0.00 57.88 59.11 1xwo h LEU 311 Cb 0.01 0.70 -0.08 0.00 0.37 0.00 0.00 40.66 41.66 1xwo h LEU 311 CO -0.03 -0.33 0.00 -0.03 -0.34 0.00 0.00 178.44 177.71 1xwo h MET 312 N -0.20 0.11 -0.50 1.25 4.05 -0.75 -2.03 114.93 116.86 1xwo h MET 312 Ca 0.19 -0.01 0.10 0.00 -0.28 0.00 0.00 59.70 59.70 1xwo h MET 312 Cb 0.56 -0.03 -0.10 0.00 -0.80 0.00 0.00 31.60 31.23 1xwo h MET 312 CO -0.72 0.07 -0.22 0.28 0.23 0.00 0.00 176.91 176.56 1xwo h VAL 313 N 0.12 0.35 -0.58 -5.77 2.07 0.25 -2.29 116.25 110.40 1xwo h VAL 313 Ca 0.26 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.72 1xwo h VAL 313 Cb 0.39 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1xwo h VAL 313 CO -0.43 0.00 0.15 -0.07 0.02 0.00 0.00 177.57 177.24 1xwo h LEU 314 N -0.11 0.87 -8.96 2.57 3.38 -0.72 -3.42 115.31 108.92 1xwo h LEU 314 Ca 0.23 -0.23 -0.76 0.00 0.09 0.00 0.00 57.88 57.22 1xwo h LEU 314 Cb 0.47 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.99 1xwo h LEU 314 CO -0.56 0.87 0.96 1.17 0.09 0.00 0.00 178.44 180.97 1xwo n LYS 315 N -4.38 0.85 -0.72 1.13 0.00 -0.83 -0.58 118.16 113.63 1xwo n LYS 315 Ca 0.03 0.30 0.00 0.00 0.00 0.00 0.00 58.31 58.64 1xwo n LYS 315 Cb 0.23 -1.99 0.00 0.00 0.00 0.00 0.00 35.03 33.27 1xwo n LYS 315 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1xwo n GLY 316 N 4.69 1.18 3.73 3.14 0.00 -1.26 -5.01 105.19 111.65 1xwo n GLY 316 Ca 0.31 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.91 1xwo n GLY 316 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xwo s LEU 317 N 0.00 4.39 0.83 0.99 1.43 0.26 -5.00 118.68 121.57 1xwo s LEU 317 Ca 0.00 2.43 -0.11 0.00 -1.03 0.00 0.00 54.13 55.42 1xwo s LEU 317 Cb 0.00 -3.60 0.09 0.00 0.03 0.00 0.00 46.19 42.71 1xwo s LEU 317 CO 0.00 -0.64 1.10 -2.16 0.23 0.00 0.00 176.35 174.88 1xwo s PRO 318 N 0.55 1.81 0.24 1.29 0.04 -1.26 -4.95 135.00 132.71 1xwo s PRO 318 Ca 0.62 1.14 -0.30 0.00 0.04 0.00 0.00 61.00 62.51 1xwo s PRO 318 Cb -0.38 -1.85 -0.10 0.00 0.04 0.00 0.00 34.50 32.21 1xwo s PRO 318 CO 0.34 -1.95 1.39 -1.12 0.04 0.00 0.00 177.00 175.70 1xwo s SER 319 N -3.28 6.74 0.00 6.66 0.01 -1.26 -4.83 113.70 117.74 1xwo s SER 319 Ca 0.63 2.58 0.00 0.00 1.31 0.00 0.00 55.95 60.47 1xwo s SER 319 Cb -0.18 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.43 1xwo s SER 319 CO 0.57 -0.63 0.00 0.41 0.41 0.00 0.00 173.24 173.99 1xwo n THR 320 N 2.32 0.00 -1.00 1.44 -1.04 -1.26 -4.99 114.28 109.75 1xwo n THR 320 Ca 0.06 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.73 1xwo n THR 320 Cb 0.41 0.00 0.10 0.00 -1.82 0.00 0.00 70.33 69.02 1xwo n THR 320 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xwo n TYR 321 N -0.13 -1.13 -3.64 -1.42 9.36 -1.26 -4.75 117.16 114.17 1xwo n TYR 321 Ca 0.00 0.28 -0.06 0.00 3.32 0.00 0.00 57.90 61.44 1xwo n TYR 321 Cb 0.00 -1.85 -0.07 0.00 -0.63 0.00 0.00 39.34 36.80 1xwo n TYR 321 CO 0.00 0.00 0.00 -0.80 0.22 0.00 0.00 176.86 176.28 1xwo s ASN 322 N -1.79 -0.74 0.59 2.98 0.01 -1.26 -5.04 114.94 109.70 1xwo s ASN 322 Ca 0.61 1.22 0.22 0.00 -0.71 0.00 0.00 52.86 54.20 1xwo s ASN 322 Cb -0.27 1.29 1.20 0.00 0.41 0.00 0.00 41.25 43.89 1xwo s ASN 322 CO 0.63 -0.20 1.65 0.50 -1.51 0.00 0.00 177.10 178.18 1xwo h LYS 323 N 6.21 0.00 0.00 -0.60 3.11 -2.03 -1.06 116.57 122.21 1xwo h LYS 323 Ca -0.29 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.54 1xwo h LYS 323 Cb 1.21 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 32.43 1xwo h LYS 323 CO 0.15 0.00 -0.03 -0.44 -2.81 0.00 0.00 179.45 176.32 1xwo h ASP 324 N 0.00 0.00 0.23 4.20 5.19 -1.97 -2.35 116.42 121.72 1xwo h ASP 324 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1xwo h ASP 324 Cb 0.84 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.35 1xwo h ASP 324 CO 0.00 0.03 0.00 0.18 -3.12 0.00 0.00 179.24 176.33 1xwo n LEU 325 N -4.06 0.00 0.00 1.55 4.77 -0.40 -2.80 117.00 116.05 1xwo n LEU 325 Ca -0.03 0.30 0.09 0.00 -0.03 0.00 0.00 56.01 56.34 1xwo n LEU 325 Cb 0.12 -0.30 0.44 0.00 -2.33 0.00 0.00 43.42 41.34 1xwo n LEU 325 CO 0.30 -0.19 0.78 1.67 -1.33 0.00 0.00 177.39 178.63 1xwo n GLN 326 N -1.30 0.16 0.00 3.23 0.00 -0.88 -3.09 117.38 115.50 1xwo n GLN 326 Ca 0.05 0.14 0.15 0.00 -0.00 0.00 0.00 57.00 57.35 1xwo n GLN 326 Cb 0.10 -1.50 0.85 0.00 0.00 0.00 0.00 30.24 29.68 1xwo n GLN 326 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 1xwo n GLU 327 N -1.37 0.99 0.09 3.69 -0.58 -1.12 -4.00 120.64 118.35 1xwo n GLU 327 Ca 0.07 -0.14 -0.13 0.00 -0.42 0.00 0.00 57.16 56.54 1xwo n GLU 327 Cb 0.17 -1.50 -0.13 0.00 -0.57 0.00 0.00 31.44 29.41 1xwo n GLU 327 CO 0.00 0.00 0.00 0.38 -0.48 0.00 0.00 177.13 177.03 1xwo h ASP 328 N 0.34 0.29 0.13 1.62 -0.00 -1.83 -3.30 116.42 113.67 1xwo h ASP 328 Ca 0.00 -0.31 0.01 0.00 -0.00 0.00 0.00 57.03 56.72 1xwo h ASP 328 Cb 0.12 -0.09 -0.03 0.00 -0.00 0.00 0.00 39.33 39.33 1xwo h ASP 328 CO 0.00 1.25 -0.41 0.11 -0.00 0.00 0.00 179.24 180.19 1xwo h LYS 329 N 0.05 -0.58 -0.92 4.15 1.57 -1.84 0.06 116.57 119.06 1xwo h LYS 329 Ca -0.10 0.04 0.06 0.00 -1.87 0.00 0.00 60.65 58.78 1xwo h LYS 329 Cb 1.91 0.13 -0.06 0.00 0.08 0.00 0.00 32.23 34.29 1xwo h LYS 329 CO 0.18 -0.39 0.60 0.93 -0.57 0.00 0.00 179.45 180.20 1xwo h GLU 330 N -0.61 1.02 -0.09 3.15 5.08 -1.85 -0.66 114.58 120.62 1xwo h GLU 330 Ca -0.01 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1xwo h GLU 330 Cb 0.60 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 1xwo h GLU 330 CO -0.20 0.67 0.06 0.00 -1.00 0.00 0.00 179.01 178.54 1xwo h ALA 331 N 1.50 0.12 0.05 3.43 0.00 -1.51 -1.42 119.26 121.43 1xwo h ALA 331 Ca 0.39 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.27 1xwo h ALA 331 Cb 0.19 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1xwo h ALA 331 CO -0.15 -0.37 -0.02 0.28 0.00 0.00 0.00 179.25 178.99 1xwo h VAL 332 N 0.09 1.02 -0.66 0.00 2.07 -0.31 -2.70 116.25 115.76 1xwo h VAL 332 Ca 0.03 -0.24 0.09 0.00 0.82 0.00 0.00 66.70 67.40 1xwo h VAL 332 Cb 0.03 1.19 -0.07 0.00 -1.52 0.00 0.00 31.29 30.92 1xwo h VAL 332 CO -0.01 0.06 0.31 -0.26 0.02 0.00 0.00 177.57 177.69 1xwo h PHE 333 N -0.18 0.55 0.81 1.57 0.05 -1.07 -0.44 116.94 118.23 1xwo h PHE 333 Ca -0.01 0.03 -0.04 0.00 3.82 0.00 0.00 57.97 61.78 1xwo h PHE 333 Cb 0.15 -0.15 -0.00 0.00 2.00 0.00 0.00 35.95 37.95 1xwo h PHE 333 CO -0.04 0.19 -0.49 0.22 -0.18 0.00 0.00 178.31 178.01 1xwo h ASP 334 N 0.54 -1.25 -0.78 2.17 -0.00 -1.13 -1.38 116.42 114.59 1xwo h ASP 334 Ca 0.32 0.07 0.11 0.00 -0.00 0.00 0.00 57.03 57.53 1xwo h ASP 334 Cb 0.34 0.36 -0.08 0.00 -0.00 0.00 0.00 39.33 39.96 1xwo h ASP 334 CO -0.27 -0.76 0.41 0.58 -0.00 0.00 0.00 179.24 179.20 1xwo h VAL 335 N -1.22 0.83 -0.32 2.25 2.07 -1.29 0.74 116.25 119.31 1xwo h VAL 335 Ca -0.11 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 67.21 1xwo h VAL 335 Cb 0.97 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 1xwo h VAL 335 CO 0.11 0.12 0.15 0.58 0.02 0.00 0.00 177.57 178.55 1xwo h VAL 336 N 0.66 0.97 -0.34 2.57 2.07 -0.89 0.21 116.25 121.51 1xwo h VAL 336 Ca 0.39 -0.11 -0.12 0.00 0.82 0.00 0.00 66.70 67.68 1xwo h VAL 336 Cb 0.44 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1xwo h VAL 336 CO -0.29 0.06 -0.27 0.44 0.02 0.00 0.00 177.57 177.52 1xwo h ASP 337 N 0.31 0.82 0.07 0.57 3.32 -0.81 -2.65 116.42 118.06 1xwo h ASP 337 Ca 0.13 -0.45 0.02 0.00 0.02 0.00 0.00 57.03 56.75 1xwo h ASP 337 Cb 0.06 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.35 1xwo h ASP 337 CO -0.10 1.10 -0.20 0.74 -1.72 0.00 0.00 179.24 179.05 1xwo h THR 338 N 0.55 0.53 -0.63 0.35 2.02 -0.45 -1.93 112.91 113.35 1xwo h THR 338 Ca 0.06 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.25 1xwo h THR 338 Cb 0.84 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 67.76 1xwo h THR 338 CO 0.07 0.00 0.42 -0.07 0.37 0.00 0.00 175.52 176.31 1xwo h LEU 339 N -0.37 0.73 0.28 2.58 4.07 -0.63 -0.56 115.31 121.42 1xwo h LEU 339 Ca 0.04 -0.02 -0.01 0.00 0.08 0.00 0.00 57.88 57.96 1xwo h LEU 339 Cb 0.41 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 41.96 1xwo h LEU 339 CO -0.14 0.53 -0.14 0.74 -1.08 0.00 0.00 178.44 178.36 1xwo h THR 340 N 0.86 0.75 0.62 0.22 2.02 -1.08 -0.45 112.91 115.85 1xwo h THR 340 Ca 0.23 -0.23 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 1xwo h THR 340 Cb -0.09 0.88 0.01 0.00 -1.74 0.00 0.00 68.15 67.20 1xwo h THR 340 CO -0.05 0.05 -0.30 0.00 0.37 0.00 0.00 175.52 175.59 1xwo h ALA 341 N 0.19 -0.84 -0.56 6.16 0.00 -1.15 -2.41 119.26 120.65 1xwo h ALA 341 Ca -0.04 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 54.79 1xwo h ALA 341 Cb 0.37 0.32 -0.10 0.00 0.00 0.00 0.00 17.79 18.39 1xwo h ALA 341 CO 0.06 -0.94 -0.06 0.28 0.00 0.00 0.00 179.25 178.60 1xwo h VAL 342 N -0.89 0.50 -0.88 0.00 2.07 -1.13 -0.23 116.25 115.68 1xwo h VAL 342 Ca -0.09 -0.02 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 1xwo h VAL 342 Cb 0.66 0.43 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 1xwo h VAL 342 CO 0.14 0.01 0.46 -0.07 0.02 0.00 0.00 177.57 178.13 1xwo h LEU 343 N 0.07 1.12 -0.07 2.57 3.38 -1.02 0.34 115.31 121.70 1xwo h LEU 343 Ca 0.28 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 1xwo h LEU 343 Cb 0.45 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1xwo h LEU 343 CO -0.52 0.91 -0.02 1.56 0.09 0.00 0.00 178.44 180.47 1xwo h GLN 344 N 1.24 0.13 -0.11 1.13 4.20 -0.79 -1.59 115.11 119.32 1xwo h GLN 344 Ca 0.31 -0.05 0.02 0.00 0.06 0.00 0.00 58.65 58.98 1xwo h GLN 344 Cb 0.06 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1xwo h GLN 344 CO -0.05 0.46 0.08 0.28 -0.67 0.00 0.00 178.83 178.94 1xwo h VAL 345 N -0.21 0.99 0.51 -0.54 2.07 -0.87 -0.51 116.25 117.69 1xwo h VAL 345 Ca 0.02 -0.03 -0.03 0.00 0.82 0.00 0.00 66.70 67.48 1xwo h VAL 345 Cb 0.42 0.90 0.01 0.00 -1.52 0.00 0.00 31.29 31.09 1xwo h VAL 345 CO 0.01 0.01 -0.25 0.00 0.02 0.00 0.00 177.57 177.36 1xwo h ALA 346 N 1.94 -0.69 -0.73 1.67 0.00 -0.08 -2.52 119.26 118.84 1xwo h ALA 346 Ca 0.05 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 54.85 1xwo h ALA 346 Cb 0.09 0.27 -0.07 0.00 0.00 0.00 0.00 17.79 18.08 1xwo h ALA 346 CO -0.01 -0.78 0.39 1.15 0.00 0.00 0.00 179.25 180.00 1xwo h THR 347 N -0.91 0.90 -0.03 0.00 2.02 -0.38 -2.49 112.91 112.02 1xwo h THR 347 Ca -0.07 -0.23 0.03 0.00 0.77 0.00 0.00 66.41 66.91 1xwo h THR 347 Cb 0.61 0.16 -0.05 0.00 -1.74 0.00 0.00 68.15 67.13 1xwo h THR 347 CO 0.12 0.12 -0.23 1.23 0.37 0.00 0.00 175.52 177.12 1xwo h GLY 348 N 0.67 -0.32 0.27 2.16 0.00 -1.08 0.08 103.07 104.85 1xwo h GLY 348 Ca 0.35 0.28 0.02 0.00 0.00 0.00 0.00 47.33 47.98 1xwo h GLY 348 CO -0.24 -0.20 -0.43 -2.08 0.00 0.00 0.00 176.54 173.59 1xwo h VAL 349 N -0.35 0.14 0.00 4.60 2.07 -1.03 -0.25 116.25 121.43 1xwo h VAL 349 Ca 0.07 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.59 1xwo h VAL 349 Cb 0.45 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1xwo h VAL 349 CO -0.23 0.00 -0.02 0.40 0.02 0.00 0.00 177.57 177.74 1xwo h ILE 350 N -0.67 0.18 0.07 4.57 2.04 -1.35 -1.91 117.51 120.45 1xwo h ILE 350 Ca 0.02 -0.18 -0.22 0.00 1.00 0.00 0.00 64.86 65.47 1xwo h ILE 350 Cb 0.69 1.15 0.02 0.00 -0.74 0.00 0.00 36.82 37.94 1xwo h ILE 350 CO -0.24 0.02 -0.90 -1.28 0.00 0.00 0.00 178.15 175.74 1xwo h SER 351 N 0.00 0.67 -0.12 1.72 0.87 0.69 -3.39 113.55 113.99 1xwo h SER 351 Ca -0.00 -0.82 0.00 0.00 -1.23 0.00 0.00 61.79 59.74 1xwo h SER 351 Cb 0.15 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 61.90 1xwo h SER 351 CO 0.00 1.42 0.00 0.35 -0.53 0.00 0.00 176.83 178.07 1xwo n THR 352 N -4.03 0.45 -2.38 2.23 -2.24 -0.45 -5.03 114.28 102.83 1xwo n THR 352 Ca -0.12 -0.72 -0.36 0.00 -2.27 0.00 0.00 64.05 60.58 1xwo n THR 352 Cb 0.83 0.87 -0.02 0.00 -2.10 0.00 0.00 70.33 69.91 1xwo n THR 352 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 1xwo s LEU 353 N -0.83 3.92 0.12 3.22 0.05 -0.74 -4.51 118.68 119.92 1xwo s LEU 353 Ca 0.13 2.13 -0.15 0.00 0.05 0.00 0.00 54.13 56.29 1xwo s LEU 353 Cb 0.08 -4.40 -0.07 0.00 -2.05 0.00 0.00 46.19 39.75 1xwo s LEU 353 CO 0.11 -0.89 0.53 -1.10 -0.55 0.00 0.00 176.35 174.45 1xwo s GLN 354 N -2.95 3.99 -0.11 1.48 -1.52 -0.07 -4.96 119.66 115.52 1xwo s GLN 354 Ca 0.66 0.50 0.01 0.00 -1.95 0.00 0.00 55.36 54.57 1xwo s GLN 354 Cb -0.23 -3.00 -0.02 0.00 -0.22 0.00 0.00 33.01 29.54 1xwo s GLN 354 CO 0.28 0.52 -0.12 0.42 -0.25 0.00 0.00 175.29 176.14 1xwo s ILE 355 N -1.38 3.19 -1.05 1.08 1.09 -1.26 -1.43 121.20 121.42 1xwo s ILE 355 Ca 0.35 -0.63 -0.12 0.00 -1.10 0.00 0.00 60.65 59.15 1xwo s ILE 355 Cb -0.16 -2.32 0.24 0.00 -1.06 0.00 0.00 42.46 39.16 1xwo s ILE 355 CO 0.19 0.55 1.09 -0.55 -0.10 0.00 0.00 174.94 176.11 1xwo s SER 356 N -0.03 7.12 0.55 3.58 0.15 0.27 -4.82 113.70 120.52 1xwo s SER 356 Ca -0.03 -3.21 0.29 0.00 0.70 0.00 0.00 55.95 53.71 1xwo s SER 356 Cb -0.14 -2.25 1.46 0.00 -1.71 0.00 0.00 66.02 63.37 1xwo s SER 356 CO 0.04 -0.47 1.93 0.50 1.20 0.00 0.00 173.24 176.44 1xwo h LYS 357 N 7.12 0.00 0.06 5.44 3.64 -1.95 -1.64 116.57 129.25 1xwo h LYS 357 Ca 0.18 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.56 1xwo h LYS 357 Cb 0.92 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.74 1xwo h LYS 357 CO 1.00 0.00 -0.03 1.49 -2.27 0.00 0.00 179.45 179.64 1xwo h GLU 358 N 0.00 -0.08 -0.13 1.90 4.81 -1.94 -2.77 114.58 116.36 1xwo h GLU 358 Ca 0.32 0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.46 1xwo h GLU 358 Cb 1.34 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.73 1xwo h GLU 358 CO -0.00 0.35 -0.33 -0.91 -0.73 0.00 0.00 179.01 177.39 1xwo h ASN 359 N -0.55 0.25 -0.02 1.04 2.35 -1.68 -0.93 115.58 116.05 1xwo h ASN 359 Ca -0.01 -0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 55.65 1xwo h ASN 359 Cb 0.47 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 38.77 1xwo h ASN 359 CO 0.01 0.58 0.00 0.24 -1.65 0.00 0.00 177.43 176.61 1xwo h MET 360 N 0.22 0.03 0.00 0.81 2.86 -1.37 -1.08 114.93 116.40 1xwo h MET 360 Ca 0.03 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1xwo h MET 360 Cb 0.69 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.35 1xwo h MET 360 CO 0.05 0.31 0.00 1.49 1.06 0.00 0.00 176.91 179.82 1xwo h GLU 361 N -0.26 0.00 0.00 1.72 4.22 -1.34 -2.24 114.58 116.68 1xwo h GLU 361 Ca 0.00 0.00 -0.09 0.00 0.08 0.00 0.00 59.36 59.36 1xwo h GLU 361 Cb 0.29 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 1xwo h GLU 361 CO 0.00 0.00 -0.91 -0.22 -2.18 0.00 0.00 179.01 175.70 1xwo h LYS 362 N 0.00 0.00 0.00 1.92 3.64 -0.62 -3.31 116.57 118.20 1xwo h LYS 362 Ca 0.00 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 1xwo h LYS 362 Cb 0.29 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1xwo h LYS 362 CO 0.00 0.22 -0.16 0.00 -2.27 0.00 0.00 179.45 177.24 1xwo h ALA 363 N 1.67 0.93 -2.68 5.00 0.00 -0.57 -3.44 119.26 120.16 1xwo h ALA 363 Ca -0.06 -0.15 -0.53 0.00 0.00 0.00 0.00 54.91 54.18 1xwo h ALA 363 Cb 1.30 -0.03 0.05 0.00 0.00 0.00 0.00 17.79 19.11 1xwo h ALA 363 CO 0.03 0.20 0.75 -0.51 0.00 0.00 0.00 179.25 179.72 1xwo s LEU 364 N -6.38 4.39 0.20 0.00 1.43 -1.23 -4.90 118.68 112.18 1xwo s LEU 364 Ca 0.04 2.56 0.08 0.00 -1.03 0.00 0.00 54.13 55.78 1xwo s LEU 364 Cb 0.07 -3.61 -0.05 0.00 0.03 0.00 0.00 46.19 42.64 1xwo s LEU 364 CO 0.66 -0.68 -0.15 0.42 0.23 0.00 0.00 176.35 176.83 1xwo s THR 365 N 0.33 1.79 0.57 5.49 -4.23 -1.26 -5.03 115.64 113.31 1xwo s THR 365 Ca 0.61 -2.17 0.28 0.00 -1.18 0.00 0.00 61.69 59.23 1xwo s THR 365 Cb -0.40 -2.02 0.34 0.00 1.34 0.00 0.00 72.50 71.76 1xwo s THR 365 CO 0.39 -0.54 2.23 -0.65 -0.54 0.00 0.00 174.62 175.51 1xwo h PRO 366 N 2.67 0.00 0.00 3.99 0.11 -2.01 -1.40 132.00 135.36 1xwo h PRO 366 Ca -0.39 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.67 1xwo h PRO 366 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 1xwo h PRO 366 CO 0.60 0.01 -0.24 0.93 -0.21 0.00 0.00 178.00 179.09 1xwo h GLU 367 N 0.00 0.00 0.00 1.05 3.07 -2.00 -1.67 114.58 115.03 1xwo h GLU 367 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1xwo h GLU 367 Cb 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 1xwo h GLU 367 CO 0.00 0.24 0.00 -1.33 -1.40 0.00 0.00 179.01 176.52 1xwo n MET 368 N -4.25 0.16 0.00 2.33 2.81 -0.53 -2.11 117.12 115.54 1xwo n MET 368 Ca -0.02 0.41 0.13 0.00 -1.81 0.00 0.00 57.70 56.41 1xwo n MET 368 Cb 0.29 -1.82 0.27 0.00 -0.71 0.00 0.00 33.22 31.25 1xwo n MET 368 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1xwo n LEU 369 N -2.14 1.56 -0.29 4.03 4.77 -0.63 -4.24 117.00 120.07 1xwo n LEU 369 Ca 0.02 -0.51 0.14 0.00 -0.03 0.00 0.00 56.01 55.63 1xwo n LEU 369 Cb 0.21 -0.06 0.39 0.00 -2.33 0.00 0.00 43.42 41.64 1xwo n LEU 369 CO 0.18 0.28 1.22 0.77 -1.33 0.00 0.00 177.39 178.51 1xwo h SER 370 N 2.06 0.63 -0.39 -1.43 4.64 -1.50 0.13 113.55 117.70 1xwo h SER 370 Ca 0.00 0.05 -0.05 0.00 -0.47 0.00 0.00 61.79 61.33 1xwo h SER 370 Cb 0.62 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.63 1xwo h SER 370 CO 0.00 0.28 0.05 0.74 -0.87 0.00 0.00 176.83 177.03 1xwo h THR 371 N 0.65 1.24 -0.48 2.95 2.02 -1.82 -2.48 112.91 114.99 1xwo h THR 371 Ca 0.49 -0.89 0.02 0.00 0.77 0.00 0.00 66.41 66.80 1xwo h THR 371 Cb 0.88 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 68.33 1xwo h THR 371 CO -0.24 0.30 0.32 0.44 0.37 0.00 0.00 175.52 176.71 1xwo h ASP 372 N 0.49 0.52 -0.14 4.18 3.32 -1.09 -1.74 116.42 121.95 1xwo h ASP 372 Ca 0.12 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 1xwo h ASP 372 Cb 0.39 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 1xwo h ASP 372 CO 0.01 0.37 0.05 0.25 -1.72 0.00 0.00 179.24 178.19 1xwo h LEU 373 N 0.61 0.20 -0.53 1.55 5.85 -0.61 0.25 115.31 122.63 1xwo h LEU 373 Ca 0.18 -0.19 0.08 0.00 0.84 0.00 0.00 57.88 58.79 1xwo h LEU 373 Cb -0.00 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 40.91 1xwo h LEU 373 CO -0.04 0.34 0.17 0.00 -0.34 0.00 0.00 178.44 178.57 1xwo h ALA 374 N 0.87 0.64 -0.98 1.25 0.00 -1.01 -1.35 119.26 118.68 1xwo h ALA 374 Ca 0.05 0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.07 1xwo h ALA 374 Cb 0.21 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 1xwo h ALA 374 CO -0.00 -0.24 0.65 -0.07 0.00 0.00 0.00 179.25 179.59 1xwo h LEU 375 N 0.33 1.08 -0.76 0.00 3.38 -0.96 -1.20 115.31 117.19 1xwo h LEU 375 Ca 0.26 -0.01 0.16 0.00 0.09 0.00 0.00 57.88 58.38 1xwo h LEU 375 Cb 0.31 -0.25 -0.11 0.00 0.09 0.00 0.00 40.66 40.70 1xwo h LEU 375 CO -0.28 0.75 0.22 0.22 0.09 0.00 0.00 178.44 179.43 1xwo h TYR 376 N 1.26 0.35 -0.22 1.13 3.20 0.23 0.96 116.97 123.88 1xwo h TYR 376 Ca 0.39 0.04 -0.11 0.00 3.14 0.00 0.00 58.73 62.19 1xwo h TYR 376 Cb -0.03 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.20 1xwo h TYR 376 CO -0.00 -0.06 -0.34 -0.07 -1.64 0.00 0.00 178.16 176.04 1xwo h LEU 377 N 0.31 0.47 -1.32 2.82 3.38 -1.13 -2.93 115.31 116.91 1xwo h LEU 377 Ca 0.43 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 58.14 1xwo h LEU 377 Cb 0.74 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1xwo h LEU 377 CO -0.50 0.79 -0.34 0.58 0.09 0.00 0.00 178.44 179.06 1xwo h VAL 378 N 0.39 1.20 0.00 1.22 2.07 -0.25 -1.31 116.25 119.57 1xwo h VAL 378 Ca 0.04 -1.17 -0.07 0.00 0.82 0.00 0.00 66.70 66.32 1xwo h VAL 378 Cb 0.79 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 32.19 1xwo h VAL 378 CO 0.06 0.33 -0.34 0.03 0.02 0.00 0.00 177.57 177.67 1xwo h ARG 379 N 0.00 0.00 -0.79 1.57 3.08 -1.09 -2.58 114.38 114.57 1xwo h ARG 379 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1xwo h ARG 379 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1xwo h ARG 379 CO 0.04 0.34 0.00 1.63 -1.07 0.00 0.00 179.97 180.92 1xwo n LYS 380 N -3.34 2.31 -0.98 0.04 5.02 -0.80 -4.85 118.16 115.57 1xwo n LYS 380 Ca 0.01 -1.10 0.00 0.00 -2.02 0.00 0.00 58.31 55.20 1xwo n LYS 380 Cb 0.56 -1.72 0.00 0.00 -0.02 0.00 0.00 35.03 33.85 1xwo n LYS 380 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xwo n GLY 381 N 0.29 0.49 3.78 0.72 0.00 -0.97 -5.03 105.19 104.48 1xwo n GLY 381 Ca 0.10 -0.19 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 1xwo n GLY 381 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1xwo s MET 382 N -0.36 4.34 0.39 1.61 0.00 -0.56 -5.00 119.30 119.72 1xwo s MET 382 Ca 0.00 0.86 -0.28 0.00 0.00 0.00 0.00 55.69 56.28 1xwo s MET 382 Cb 0.00 -3.28 -0.11 0.00 0.00 0.00 0.00 34.83 31.44 1xwo s MET 382 CO 0.00 0.52 1.48 -2.30 0.00 0.00 0.00 175.02 174.72 1xwo n PRO 383 N 2.04 2.60 -0.06 4.11 -0.02 -1.26 -4.07 135.00 138.35 1xwo n PRO 383 Ca -0.08 0.91 -0.03 0.00 -2.02 0.00 0.00 63.50 62.29 1xwo n PRO 383 Cb 0.50 -2.66 -0.02 0.00 -0.02 0.00 0.00 33.50 31.30 1xwo n PRO 383 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1xwo h PHE 384 N 2.84 -0.39 -0.93 6.00 3.04 -1.95 -0.01 116.94 125.53 1xwo h PHE 384 Ca -0.51 0.02 0.24 0.00 3.98 0.00 0.00 57.97 61.71 1xwo h PHE 384 Cb 1.25 0.19 -0.13 0.00 2.56 0.00 0.00 35.95 39.82 1xwo h PHE 384 CO 0.52 -0.10 0.45 -0.09 -2.02 0.00 0.00 178.31 177.08 1xwo h ARG 385 N -0.05 0.40 -0.56 1.11 9.65 -2.00 0.35 114.38 123.28 1xwo h ARG 385 Ca 0.02 -0.02 -0.08 0.00 -1.10 0.00 0.00 59.98 58.80 1xwo h ARG 385 Cb 0.11 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 28.58 1xwo h ARG 385 CO -0.16 0.26 0.03 1.96 2.80 0.00 0.00 179.97 184.87 1xwo h GLN 386 N 0.41 0.93 -0.02 0.20 1.08 -1.74 -2.89 115.11 113.08 1xwo h GLN 386 Ca 0.60 -0.26 -0.16 0.00 -1.45 0.00 0.00 58.65 57.39 1xwo h GLN 386 Cb 1.19 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 28.50 1xwo h GLN 386 CO -0.54 0.90 -0.72 0.00 -0.95 0.00 0.00 178.83 177.52 1xwo h ALA 387 N 1.16 0.75 0.63 3.87 0.00 0.15 -1.52 119.26 124.29 1xwo h ALA 387 Ca 0.17 -0.63 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 1xwo h ALA 387 Cb 0.47 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.17 1xwo h ALA 387 CO 0.02 0.84 -0.31 1.25 0.00 0.00 0.00 179.25 181.05 1xwo h HIS 388 N 0.09 -0.80 -0.44 0.00 -0.00 -0.76 -0.68 115.15 112.55 1xwo h HIS 388 Ca -0.02 -0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.33 1xwo h HIS 388 Cb 1.28 0.27 -0.02 0.00 -0.00 0.00 0.00 27.41 28.93 1xwo h HIS 388 CO 0.02 -0.49 0.27 1.15 -0.00 0.00 0.00 177.93 178.87 1xwo h THR 389 N -0.85 1.13 -0.69 6.26 2.02 -1.52 0.11 112.91 119.37 1xwo h THR 389 Ca -0.09 -0.27 -0.06 0.00 0.77 0.00 0.00 66.41 66.76 1xwo h THR 389 Cb 0.66 0.49 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 1xwo h THR 389 CO 0.14 0.13 0.18 0.00 0.37 0.00 0.00 175.52 176.34 1xwo h ALA 390 N 1.69 0.91 0.00 6.16 0.00 -0.95 -1.49 119.26 125.58 1xwo h ALA 390 Ca 0.16 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1xwo h ALA 390 Cb -0.03 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1xwo h ALA 390 CO -0.03 0.62 -0.38 1.03 0.00 0.00 0.00 179.25 180.48 1xwo h SER 391 N 1.03 0.00 0.50 0.00 0.87 -0.33 -3.00 113.55 112.63 1xwo h SER 391 Ca 0.22 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 60.61 1xwo h SER 391 Cb 0.35 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.30 1xwo h SER 391 CO -0.00 0.38 -0.73 1.23 -0.53 0.00 0.00 176.83 177.19 1xwo h GLY 392 N 2.35 0.21 1.65 5.77 0.00 -0.36 -2.59 103.07 110.10 1xwo h GLY 392 Ca -0.00 -0.30 -0.22 0.00 0.00 0.00 0.00 47.33 46.80 1xwo h GLY 392 CO 0.05 0.27 -0.95 0.50 0.00 0.00 0.00 176.54 176.40 1xwo h LYS 393 N 0.12 0.30 -0.33 4.80 1.57 -1.26 -2.62 116.57 119.16 1xwo h LYS 393 Ca -0.02 -0.35 -0.06 0.00 -1.87 0.00 0.00 60.65 58.35 1xwo h LYS 393 Cb 1.29 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.68 1xwo h LYS 393 CO 0.11 1.06 -0.04 0.00 -0.57 0.00 0.00 179.45 180.00 1xwo h ALA 394 N 0.81 1.31 0.37 3.86 0.00 -1.49 0.45 119.26 124.57 1xwo h ALA 394 Ca -0.07 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 1xwo h ALA 394 Cb 1.60 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.25 1xwo h ALA 394 CO 0.16 0.46 -0.18 0.28 0.00 0.00 0.00 179.25 179.97 1xwo h VAL 395 N 0.50 0.58 0.04 0.00 2.07 -1.39 -2.27 116.25 115.78 1xwo h VAL 395 Ca 0.10 -0.52 0.02 0.00 0.82 0.00 0.00 66.70 67.12 1xwo h VAL 395 Cb 0.39 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 1xwo h VAL 395 CO 0.02 0.09 -0.15 -0.74 0.02 0.00 0.00 177.57 176.81 1xwo h HIS 396 N -0.82 -0.38 -0.54 1.57 6.17 -1.30 0.51 115.15 120.37 1xwo h HIS 396 Ca -0.05 0.01 0.11 0.00 0.71 0.00 0.00 60.37 61.14 1xwo h HIS 396 Cb 0.53 0.16 -0.09 0.00 2.52 0.00 0.00 27.41 30.54 1xwo h HIS 396 CO 0.02 -0.22 0.01 1.25 0.71 0.00 0.00 177.93 179.70 1xwo h LEU 397 N -0.26 -0.22 -1.37 0.26 5.85 -0.97 0.39 115.31 118.98 1xwo h LEU 397 Ca 0.04 0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.85 1xwo h LEU 397 Cb 0.30 0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1xwo h LEU 397 CO -0.12 -0.08 0.07 0.00 -0.34 0.00 0.00 178.44 177.97 1xwo h ALA 398 N 1.48 1.50 -0.38 1.25 0.00 -0.93 -0.82 119.26 121.36 1xwo h ALA 398 Ca 0.27 -0.15 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 1xwo h ALA 398 Cb 0.42 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1xwo h ALA 398 CO -0.45 0.37 -0.32 1.49 0.00 0.00 0.00 179.25 180.35 1xwo h GLU 399 N 0.48 0.84 -0.17 0.00 4.22 0.16 0.36 114.58 120.47 1xwo h GLU 399 Ca 0.11 -0.40 -0.13 0.00 0.08 0.00 0.00 59.36 59.03 1xwo h GLU 399 Cb 0.21 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 1xwo h GLU 399 CO -0.00 1.04 -0.43 1.79 -2.18 0.00 0.00 179.01 179.22 1xwo h THR 400 N 0.71 1.31 -0.00 0.32 1.35 0.26 -1.55 112.91 115.31 1xwo h THR 400 Ca 0.08 -1.60 0.00 0.00 -0.55 0.00 0.00 66.41 64.33 1xwo h THR 400 Cb 0.87 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 68.94 1xwo h THR 400 CO 0.08 0.49 -0.01 0.29 -0.25 0.00 0.00 175.52 176.12 1xwo n LYS 401 N -4.01 0.80 -2.02 4.72 5.02 -0.37 -4.91 118.16 117.38 1xwo n LYS 401 Ca -0.02 -0.05 -0.14 0.00 -2.02 0.00 0.00 58.31 56.08 1xwo n LYS 401 Cb 0.52 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 34.01 1xwo n LYS 401 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xwo n GLY 402 N 1.13 0.26 3.26 0.72 0.00 -0.55 -5.02 105.19 104.99 1xwo n GLY 402 Ca 0.20 -0.31 -0.15 0.00 0.00 0.00 0.00 46.02 45.75 1xwo n GLY 402 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xwo s ILE 403 N -2.65 1.24 0.32 -0.61 1.01 0.01 -5.02 121.20 115.50 1xwo s ILE 403 Ca 0.00 -2.05 -0.28 0.00 0.00 0.00 0.00 60.65 58.32 1xwo s ILE 403 Cb 0.00 -1.84 -0.09 0.00 0.01 0.00 0.00 42.46 40.54 1xwo s ILE 403 CO 0.00 -0.71 1.14 0.42 0.00 0.00 0.00 174.94 175.79 1xwo s THR 404 N -3.20 3.32 0.56 2.92 -4.23 -1.26 -4.17 115.64 109.58 1xwo s THR 404 Ca 0.17 1.25 0.31 0.00 -1.18 0.00 0.00 61.69 62.23 1xwo s THR 404 Cb 0.02 -3.76 0.45 0.00 1.34 0.00 0.00 72.50 70.54 1xwo s THR 404 CO 0.01 0.24 1.86 0.16 -0.54 0.00 0.00 174.62 176.35 1xwo h ILE 405 N 2.83 0.45 0.00 2.99 -0.00 -1.89 0.25 117.51 122.14 1xwo h ILE 405 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.38 1xwo h ILE 405 Cb 1.22 0.55 0.00 0.00 -0.00 0.00 0.00 36.82 38.58 1xwo h ILE 405 CO 0.65 0.00 0.00 -0.55 -0.00 0.00 0.00 178.15 178.25 1xwo h ASN 406 N 0.00 0.00 -0.50 2.16 -1.07 -1.91 -2.40 115.58 111.86 1xwo h ASN 406 Ca 0.36 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.73 1xwo h ASN 406 Cb 1.59 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.84 1xwo h ASN 406 CO -0.00 0.00 0.00 0.59 0.07 0.00 0.00 177.43 178.09 1xwo n ASN 407 N -2.79 3.09 -4.77 6.14 3.02 0.88 -4.95 115.26 115.88 1xwo n ASN 407 Ca 0.01 -1.97 -0.33 0.00 -0.03 0.00 0.00 54.58 52.27 1xwo n ASN 407 Cb 0.29 -0.33 0.05 0.00 -0.61 0.00 0.00 39.78 39.18 1xwo n ASN 407 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1xwo s LEU 408 N -1.18 3.37 0.21 3.41 1.43 -0.91 -4.98 118.68 120.03 1xwo s LEU 408 Ca 0.39 1.99 -0.23 0.00 -1.03 0.00 0.00 54.13 55.25 1xwo s LEU 408 Cb 0.21 -4.55 -0.08 0.00 0.03 0.00 0.00 46.19 41.80 1xwo s LEU 408 CO 0.28 -1.66 0.78 -0.89 0.23 0.00 0.00 176.35 175.09 1xwo s THR 409 N -2.37 4.42 0.43 5.49 2.01 -1.26 -4.92 115.64 119.44 1xwo s THR 409 Ca 0.67 1.56 0.19 0.00 0.31 0.00 0.00 61.69 64.42 1xwo s THR 409 Cb -0.20 -4.02 0.39 0.00 0.01 0.00 0.00 72.50 68.68 1xwo s THR 409 CO 0.42 0.36 1.85 0.25 -0.69 0.00 0.00 174.62 176.81 1xwo h LEU 410 N 3.84 0.36 -0.22 4.42 5.85 -1.97 0.67 115.31 128.26 1xwo h LEU 410 Ca -0.47 0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.21 1xwo h LEU 410 Cb 1.20 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 42.20 1xwo h LEU 410 CO 0.66 0.14 -0.19 -0.08 -0.34 0.00 0.00 178.44 178.63 1xwo h GLU 411 N 0.36 0.51 -0.76 1.25 4.81 -1.95 0.63 114.58 119.43 1xwo h GLU 411 Ca 0.48 -0.26 0.11 0.00 -0.13 0.00 0.00 59.36 59.56 1xwo h GLU 411 Cb 1.26 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.56 1xwo h GLU 411 CO -0.17 0.83 0.37 -0.44 -0.73 0.00 0.00 179.01 178.87 1xwo h ASP 412 N 0.19 0.46 -0.09 1.04 3.45 -0.23 -0.84 116.42 120.41 1xwo h ASP 412 Ca 0.04 0.07 -0.02 0.00 0.43 0.00 0.00 57.03 57.55 1xwo h ASP 412 Cb 0.72 -0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.49 1xwo h ASP 412 CO 0.05 0.24 -0.03 -0.07 -1.57 0.00 0.00 179.24 177.86 1xwo h LEU 413 N 0.60 0.18 -2.72 1.55 3.38 -0.14 -2.93 115.31 115.24 1xwo h LEU 413 Ca 0.39 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xwo h LEU 413 Cb 0.47 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 1xwo h LEU 413 CO -0.31 0.53 0.09 0.11 0.09 0.00 0.00 178.44 178.95 1xwo h LYS 414 N -0.16 0.00 -0.04 1.13 1.57 -0.19 0.12 116.57 119.00 1xwo h LYS 414 Ca 0.02 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.65 1xwo h LYS 414 Cb 0.45 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 1xwo h LYS 414 CO 0.01 0.00 -0.65 0.66 -0.57 0.00 0.00 179.45 178.90 1xwo h SER 415 N 0.00 0.18 1.36 0.86 4.64 -0.98 -2.95 113.55 116.67 1xwo h SER 415 Ca 0.00 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 1xwo h SER 415 Cb 0.18 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1xwo h SER 415 CO -0.00 0.78 -0.55 0.40 -0.87 0.00 0.00 176.83 176.59 1xwo h ILE 416 N 0.11 0.00 0.00 0.95 2.04 -0.84 -3.46 117.51 116.32 1xwo h ILE 416 Ca -0.01 -0.91 0.00 0.00 1.00 0.00 0.00 64.86 64.94 1xwo h ILE 416 Cb 1.16 1.62 0.00 0.00 -0.74 0.00 0.00 36.82 38.87 1xwo h ILE 416 CO 0.09 0.00 0.00 -0.24 0.00 0.00 0.00 178.15 178.00 1xwo n SER 417 N -2.74 0.00 0.29 1.72 2.88 -0.80 -4.96 113.62 110.01 1xwo n SER 417 Ca 0.02 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 57.74 1xwo n SER 417 Cb 0.52 0.00 0.95 0.00 -0.75 0.00 0.00 64.21 64.94 1xwo n SER 417 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1xwo h PRO 418 N 0.00 0.00 -0.06 -1.46 0.11 -1.80 -2.48 132.00 126.31 1xwo h PRO 418 Ca 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.08 1xwo h PRO 418 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 1xwo h PRO 418 CO 0.00 0.00 -0.08 -0.07 -0.21 0.00 0.00 178.00 177.64 1xwo h LEU 419 N 0.00 0.08 -8.56 2.35 3.38 -1.93 -3.41 115.31 107.23 1xwo h LEU 419 Ca 0.00 -0.01 -0.49 0.00 0.09 0.00 0.00 57.88 57.47 1xwo h LEU 419 Cb 0.20 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1xwo h LEU 419 CO 0.00 0.18 1.63 0.49 0.09 0.00 0.00 178.44 180.83 1xwo n PHE 420 N -4.39 1.37 -2.77 1.13 3.72 -0.93 -4.92 117.46 110.67 1xwo n PHE 420 Ca -0.02 0.14 -0.21 0.00 -0.05 0.00 0.00 57.45 57.31 1xwo n PHE 420 Cb 0.19 -2.60 0.06 0.00 -0.94 0.00 0.00 39.48 36.19 1xwo n PHE 420 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1xwo s SER 421 N 11.10 4.97 0.34 4.37 0.01 -1.26 -4.62 113.70 128.61 1xwo s SER 421 Ca 1.05 -0.40 0.09 0.00 1.31 0.00 0.00 55.95 58.00 1xwo s SER 421 Cb -0.39 -0.26 0.83 0.00 0.21 0.00 0.00 66.02 66.41 1xwo s SER 421 CO 0.32 -1.39 1.83 -1.28 0.41 0.00 0.00 173.24 173.13 1xwo h SER 422 N -0.03 0.67 0.00 2.44 0.87 -1.97 -0.31 113.55 115.23 1xwo h SER 422 Ca -0.37 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.26 1xwo h SER 422 Cb 1.28 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 1xwo h SER 422 CO 0.44 0.29 0.00 -0.90 -0.53 0.00 0.00 176.83 176.13 1xwo n ASP 423 N -4.63 0.00 0.00 6.23 5.68 -1.26 -3.18 116.55 119.39 1xwo n ASP 423 Ca 0.20 -0.70 0.05 0.00 -0.50 0.00 0.00 54.79 53.85 1xwo n ASP 423 Cb 0.56 0.00 0.32 0.00 -1.14 0.00 0.00 41.12 40.86 1xwo n ASP 423 CO 0.00 0.00 0.00 0.55 -1.33 0.00 0.00 177.20 176.42 1xwo n VAL 424 N -0.65 0.00 0.02 2.12 3.14 -0.13 -2.62 118.33 120.21 1xwo n VAL 424 Ca 0.03 0.00 -0.05 0.00 -2.96 0.00 0.00 64.34 61.36 1xwo n VAL 424 Cb 0.01 -0.44 -0.11 0.00 -1.06 0.00 0.00 33.84 32.25 1xwo n VAL 424 CO 0.00 0.00 0.00 0.77 -6.46 0.00 0.00 176.83 171.14 1xwo h SER 425 N 0.00 0.00 0.16 6.55 4.64 -1.81 -3.27 113.55 119.82 1xwo h SER 425 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xwo h SER 425 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1xwo h SER 425 CO 0.00 0.84 0.00 0.00 -0.87 0.00 0.00 176.83 176.80 1xwo n GLN 426 N -3.07 0.11 -0.03 4.77 6.02 -1.08 -1.27 117.38 122.83 1xwo n GLN 426 Ca -0.10 0.55 -0.08 0.00 -0.01 0.00 0.00 57.00 57.36 1xwo n GLN 426 Cb 0.94 -1.81 0.10 0.00 1.02 0.00 0.00 30.24 30.49 1xwo n GLN 426 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1xwo h VAL 427 N 0.00 1.29 -1.41 5.09 2.07 -1.78 -3.32 116.25 118.19 1xwo h VAL 427 Ca 0.00 -1.51 -0.76 0.00 0.82 0.00 0.00 66.70 65.26 1xwo h VAL 427 Cb 0.08 1.47 -0.15 0.00 -1.52 0.00 0.00 31.29 31.16 1xwo h VAL 427 CO 0.00 0.48 2.04 0.49 0.02 0.00 0.00 177.57 180.60 1xwo n PHE 428 N -4.05 2.82 -3.39 1.57 3.01 -0.39 -4.74 117.46 112.28 1xwo n PHE 428 Ca -0.01 -2.78 -0.05 0.00 1.01 0.00 0.00 57.45 55.62 1xwo n PHE 428 Cb 0.50 -1.89 -0.06 0.00 -0.01 0.00 0.00 39.48 38.02 1xwo n PHE 428 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 1xwo s ASN 429 N 0.62 -0.44 0.62 4.37 3.84 -1.25 -5.04 114.94 117.66 1xwo s ASN 429 Ca 0.42 0.70 0.37 0.00 0.21 0.00 0.00 52.86 54.55 1xwo s ASN 429 Cb 0.11 1.57 2.04 0.00 -0.55 0.00 0.00 41.25 44.42 1xwo s ASN 429 CO -0.01 -0.27 2.27 -0.26 -2.79 0.00 0.00 177.10 176.05 1xwo h PHE 430 N 8.11 0.00 0.12 0.43 -1.00 -1.93 0.60 116.94 123.27 1xwo h PHE 430 Ca -0.19 0.00 -0.17 0.00 2.81 0.00 0.00 57.97 60.41 1xwo h PHE 430 Cb 1.14 0.00 0.02 0.00 3.61 0.00 0.00 35.95 40.72 1xwo h PHE 430 CO 0.15 0.02 -0.75 0.28 -1.61 0.00 0.00 178.31 176.40 1xwo h VAL 431 N 0.00 1.52 0.00 -0.55 2.07 -1.96 -3.04 116.25 114.29 1xwo h VAL 431 Ca -0.00 -2.47 -0.06 0.00 0.82 0.00 0.00 66.70 64.99 1xwo h VAL 431 Cb 0.08 3.14 -0.01 0.00 -1.52 0.00 0.00 31.29 32.98 1xwo h VAL 431 CO 0.00 0.70 -0.26 0.78 0.02 0.00 0.00 177.57 178.81 1xwo h ASN 432 N -0.37 0.00 0.75 0.57 2.35 -1.68 -2.22 115.58 114.98 1xwo h ASN 432 Ca -0.13 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.59 1xwo h ASN 432 Cb 1.58 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.95 1xwo h ASN 432 CO 0.14 0.26 -0.36 -1.28 -1.65 0.00 0.00 177.43 174.55 1xwo h SER 433 N 0.00 -0.85 0.04 5.81 0.87 -0.92 -2.66 113.55 115.84 1xwo h SER 433 Ca -0.00 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1xwo h SER 433 Cb 0.48 0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 62.66 1xwo h SER 433 CO 0.03 -0.58 -0.02 -0.37 -0.53 0.00 0.00 176.83 175.37 1xwo h VAL 434 N -1.06 0.56 0.00 2.23 -1.51 -1.46 -2.00 116.25 113.01 1xwo h VAL 434 Ca -0.10 -0.06 0.00 0.00 -1.23 0.00 0.00 66.70 65.30 1xwo h VAL 434 Cb 0.77 1.04 0.00 0.00 -2.13 0.00 0.00 31.29 30.97 1xwo h VAL 434 CO 0.17 0.01 0.00 1.21 -1.23 0.00 0.00 177.57 177.73 1xwo n GLU 435 N -3.86 0.11 0.08 5.19 4.07 -0.84 -2.53 120.64 122.86 1xwo n GLU 435 Ca -0.03 0.22 -0.12 0.00 -0.06 0.00 0.00 57.16 57.17 1xwo n GLU 435 Cb 0.10 -1.50 -0.05 0.00 -0.06 0.00 0.00 31.44 29.93 1xwo n GLU 435 CO 0.00 0.00 0.00 1.96 -0.06 0.00 0.00 177.13 179.03 1xwo h GLN 436 N 0.00 0.27 -2.94 5.31 4.20 -1.36 -3.38 115.11 117.21 1xwo h GLN 436 Ca 0.00 -0.33 -0.71 0.00 0.06 0.00 0.00 58.65 57.67 1xwo h GLN 436 Cb 0.10 0.10 -0.05 0.00 0.30 0.00 0.00 27.48 27.94 1xwo h GLN 436 CO 0.00 1.06 3.14 0.66 -0.67 0.00 0.00 178.83 183.02 1xwo n TYR 437 N -3.64 2.59 1.37 2.96 4.02 -1.05 -4.56 117.16 118.85 1xwo n TYR 437 Ca -0.05 -2.96 0.14 0.00 -0.01 0.00 0.00 57.90 55.02 1xwo n TYR 437 Cb 0.87 -2.21 0.68 0.00 -0.02 0.00 0.00 39.34 38.66 1xwo n TYR 437 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1xwo n THR 438 N 2.93 0.00 -1.60 -0.72 -2.24 -1.26 -2.55 114.28 108.84 1xwo n THR 438 Ca 0.68 -0.02 -0.33 0.00 -2.27 0.00 0.00 64.05 62.12 1xwo n THR 438 Cb 0.25 -0.33 0.06 0.00 -2.10 0.00 0.00 70.33 68.21 1xwo n THR 438 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xwo s ALA 439 N -2.59 2.38 -0.12 6.98 0.00 -1.26 -4.56 121.76 122.60 1xwo s ALA 439 Ca 0.27 0.49 -0.41 0.00 0.00 0.00 0.00 51.96 52.31 1xwo s ALA 439 Cb 0.20 -3.32 -0.19 0.00 0.00 0.00 0.00 23.12 19.81 1xwo s ALA 439 CO 0.48 -1.45 1.27 -1.33 0.00 0.00 0.00 175.76 174.73 1xwo n MET 440 N -2.74 0.21 0.00 0.00 2.81 -1.26 -0.48 117.12 115.66 1xwo n MET 440 Ca 0.10 0.08 0.00 0.00 -1.81 0.00 0.00 57.70 56.07 1xwo n MET 440 Cb 0.52 -1.61 0.00 0.00 -0.71 0.00 0.00 33.22 31.43 1xwo n MET 440 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xwo n GLY 441 N 2.36 3.11 3.16 3.03 0.00 -1.26 -5.03 105.19 110.57 1xwo n GLY 441 Ca 0.23 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.00 1xwo n GLY 441 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xwo n GLY 442 N -1.46 -2.85 0.73 -0.02 0.00 0.37 -4.93 105.19 97.03 1xwo n GLY 442 Ca 0.00 -1.09 0.13 0.00 0.00 0.00 0.00 46.02 45.05 1xwo n GLY 442 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1xwo n THR 443 N -4.87 0.00 -1.46 2.61 5.66 -1.15 -4.24 114.28 110.82 1xwo n THR 443 Ca 0.07 -0.38 -0.36 0.00 -3.05 0.00 0.00 64.05 60.32 1xwo n THR 443 Cb 0.49 1.11 0.07 0.00 -1.55 0.00 0.00 70.33 70.45 1xwo n THR 443 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1xwo n ALA 444 N 0.76 -0.20 -0.35 1.79 0.00 -1.06 -4.55 120.51 116.89 1xwo n ALA 444 Ca 0.15 -0.12 0.08 0.00 0.00 0.00 0.00 53.44 53.56 1xwo n ALA 444 Cb 0.50 -2.09 0.27 0.00 0.00 0.00 0.00 19.45 18.13 1xwo n ALA 444 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1xwo h LYS 445 N 0.01 0.91 -0.24 0.00 1.63 -1.91 -0.26 116.57 116.71 1xwo h LYS 445 Ca -0.48 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 59.25 1xwo h LYS 445 Cb 1.35 -0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 32.76 1xwo h LYS 445 CO 0.48 0.60 0.07 0.66 -3.45 0.00 0.00 179.45 177.81 1xwo h SER 446 N 0.94 0.35 -0.67 4.20 4.64 -1.94 -2.14 113.55 118.93 1xwo h SER 446 Ca 0.50 -0.22 -0.05 0.00 -0.47 0.00 0.00 61.79 61.55 1xwo h SER 446 Cb 0.57 -0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 62.53 1xwo h SER 446 CO -0.27 0.48 0.21 -1.28 -0.87 0.00 0.00 176.83 175.10 1xwo h SER 447 N 0.21 0.99 -0.29 4.97 0.87 -1.59 -2.17 113.55 116.53 1xwo h SER 447 Ca 0.07 -0.18 -0.11 0.00 -1.23 0.00 0.00 61.79 60.35 1xwo h SER 447 Cb 0.26 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 1xwo h SER 447 CO -0.00 0.92 -0.20 -0.37 -0.53 0.00 0.00 176.83 176.65 1xwo h VAL 448 N 1.02 1.27 -0.16 2.23 -1.51 -0.93 -1.86 116.25 116.30 1xwo h VAL 448 Ca 0.22 -1.30 -0.00 0.00 -1.23 0.00 0.00 66.70 64.40 1xwo h VAL 448 Cb 0.29 1.18 -0.01 0.00 -2.13 0.00 0.00 31.29 30.62 1xwo h VAL 448 CO -0.01 0.43 0.09 0.74 -1.23 0.00 0.00 177.57 177.60 1xwo h THR 449 N 0.67 1.09 -0.51 7.19 2.02 -1.08 -1.16 112.91 121.11 1xwo h THR 449 Ca 0.10 -0.22 -0.03 0.00 0.77 0.00 0.00 66.41 67.02 1xwo h THR 449 Cb 0.70 0.94 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 1xwo h THR 449 CO 0.05 0.08 0.19 0.74 0.37 0.00 0.00 175.52 176.96 1xwo h THR 450 N 0.17 1.19 -0.55 3.16 2.02 -1.27 -1.12 112.91 116.52 1xwo h THR 450 Ca 0.06 -0.62 -0.03 0.00 0.77 0.00 0.00 66.41 66.59 1xwo h THR 450 Cb 0.05 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.03 1xwo h THR 450 CO -0.01 0.24 0.24 1.56 0.37 0.00 0.00 175.52 177.92 1xwo h GLN 451 N 0.73 0.81 -0.32 6.66 4.20 -0.97 0.64 115.11 126.87 1xwo h GLN 451 Ca 0.18 -0.13 -0.04 0.00 0.06 0.00 0.00 58.65 58.71 1xwo h GLN 451 Cb 0.17 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 1xwo h GLN 451 CO -0.01 0.68 0.03 0.82 -0.67 0.00 0.00 178.83 179.67 1xwo h ILE 452 N 0.74 1.18 -0.25 2.54 2.04 -0.28 -1.33 117.51 122.15 1xwo h ILE 452 Ca 0.19 -0.67 -0.07 0.00 1.00 0.00 0.00 64.86 65.31 1xwo h ILE 452 Cb 0.16 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 1xwo h ILE 452 CO -0.02 0.23 -0.10 -0.33 0.00 0.00 0.00 178.15 177.93 1xwo h GLU 453 N 0.46 0.51 0.34 2.37 5.08 -0.38 -2.51 114.58 120.45 1xwo h GLU 453 Ca 0.10 -0.21 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1xwo h GLU 453 Cb 0.26 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1xwo h GLU 453 CO 0.00 0.76 -0.42 0.45 -1.00 0.00 0.00 179.01 178.81 1xwo h HIS 454 N 0.23 -1.17 -0.85 4.33 3.86 -0.28 -2.44 115.15 118.83 1xwo h HIS 454 Ca 0.06 0.01 0.22 0.00 -1.16 0.00 0.00 60.37 59.50 1xwo h HIS 454 Cb 0.60 0.47 -0.13 0.00 1.06 0.00 0.00 27.41 29.40 1xwo h HIS 454 CO 0.06 -0.53 0.23 -0.07 0.86 0.00 0.00 177.93 178.48 1xwo h LEU 455 N -0.77 0.02 -1.18 2.43 4.07 -1.29 0.38 115.31 118.98 1xwo h LEU 455 Ca -0.04 0.18 0.09 0.00 0.08 0.00 0.00 57.88 58.19 1xwo h LEU 455 Cb 0.69 0.24 -0.06 0.00 1.08 0.00 0.00 40.66 42.61 1xwo h LEU 455 CO -0.09 -0.12 0.58 0.03 -1.08 0.00 0.00 178.44 177.76 1xwo h ARG 456 N 0.24 0.90 0.01 1.13 2.47 -1.15 0.72 114.38 118.70 1xwo h ARG 456 Ca 0.52 -0.05 -0.19 0.00 -1.26 0.00 0.00 59.98 59.00 1xwo h ARG 456 Cb 1.01 -0.20 -0.02 0.00 -1.65 0.00 0.00 29.97 29.11 1xwo h ARG 456 CO -0.62 0.60 -0.88 0.93 0.56 0.00 0.00 179.97 180.56 1xwo h GLU 457 N 0.93 0.12 -0.04 0.04 4.39 0.13 -2.88 114.58 117.26 1xwo h GLU 457 Ca 0.41 -0.14 -0.21 0.00 0.34 0.00 0.00 59.36 59.76 1xwo h GLU 457 Cb 0.35 0.04 0.01 0.00 -0.10 0.00 0.00 28.75 29.05 1xwo h GLU 457 CO -0.17 0.92 -0.78 -0.07 -1.16 0.00 0.00 179.01 177.74 1xwo h LEU 458 N 0.06 0.76 -1.99 1.33 3.38 0.85 0.44 115.31 120.13 1xwo h LEU 458 Ca -0.03 -0.71 0.04 0.00 0.09 0.00 0.00 57.88 57.26 1xwo h LEU 458 Cb 1.52 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 1xwo h LEU 458 CO 0.13 1.36 0.10 0.24 0.09 0.00 0.00 178.44 180.36 1xwo h MET 459 N 0.22 0.01 0.00 1.13 2.86 0.35 1.30 114.93 120.80 1xwo h MET 459 Ca -0.09 -0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.52 1xwo h MET 459 Cb 1.45 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.10 1xwo h MET 459 CO 0.16 0.01 -1.23 1.63 1.06 0.00 0.00 176.91 178.53 1xwo n LYS 460 N -4.50 0.62 -0.04 1.72 4.01 -1.09 -1.74 118.16 117.14 1xwo n LYS 460 Ca 0.00 0.10 -0.14 0.00 -0.51 0.00 0.00 58.31 57.76 1xwo n LYS 460 Cb 0.22 -1.78 -0.09 0.00 -0.51 0.00 0.00 35.03 32.88 1xwo n LYS 460 CO 0.00 0.00 0.00 -0.22 -1.11 0.00 0.00 177.40 176.07 1xwo h LYS 461 N 0.00 0.27 0.00 1.97 1.63 0.37 -3.39 116.57 117.43 1xwo h LYS 461 Ca -0.04 -0.18 0.00 0.00 -0.85 0.00 0.00 60.65 59.58 1xwo h LYS 461 Cb 1.13 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.78 1xwo h LYS 461 CO 0.01 0.79 0.00 1.04 -3.45 0.00 0.00 179.45 177.84 1xwo n GLN 462 N -4.55 0.00 0.00 1.90 3.00 0.41 -4.74 117.38 113.40 1xwo n GLN 462 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.91 1xwo n GLN 462 Cb 0.41 -0.13 0.00 0.00 0.00 0.00 0.00 30.24 30.52 1xwo n GLN 462 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1xwo n LYS 463 N 0.00 0.00 -0.16 -1.09 4.76 -0.71 -5.04 118.16 115.92 1xwo n LYS 463 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1xwo n LYS 463 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 1xwo n LYS 463 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12