#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ptw s PRO 80 N 0.00 4.45 -0.67 9.51 0.04 -1.26 -4.77 135.00 142.30 1ptw s PRO 80 Ca 0.00 1.10 -0.27 0.00 0.04 0.00 0.00 61.00 61.87 1ptw s PRO 80 Cb 0.00 -3.48 0.01 0.00 0.04 0.00 0.00 34.50 31.07 1ptw s PRO 80 CO 0.00 -0.05 1.52 1.03 0.04 0.00 0.00 177.00 179.54 1ptw s ARG 81 N 1.14 2.99 -0.36 4.56 1.81 -1.05 -3.39 118.95 124.65 1ptw s ARG 81 Ca 0.43 0.18 -0.00 0.00 -1.72 0.00 0.00 55.73 54.61 1ptw s ARG 81 Cb -0.19 -4.25 -0.00 0.00 -0.45 0.00 0.00 34.95 30.06 1ptw s ARG 81 CO 0.20 -2.35 0.30 1.19 -0.68 0.00 0.00 175.30 173.97 1ptw n PHE 82 N 10.70 -0.68 -0.79 -0.53 3.72 -1.26 -3.32 117.46 125.30 1ptw n PHE 82 Ca 0.11 0.28 0.00 0.00 -0.05 0.00 0.00 57.45 57.79 1ptw n PHE 82 Cb 0.50 -2.95 0.00 0.00 -0.94 0.00 0.00 39.48 36.09 1ptw n PHE 82 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ptw n GLY 83 N -1.11 0.00 3.52 1.37 0.00 -1.22 -4.91 105.19 102.84 1ptw n GLY 83 Ca -0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 1ptw n GLY 83 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ptw s VAL 84 N -0.82 4.39 0.96 1.61 1.01 -1.21 -5.03 120.40 121.31 1ptw s VAL 84 Ca 0.00 -0.16 -0.17 0.00 0.00 0.00 0.00 61.98 61.65 1ptw s VAL 84 Cb 0.00 -3.00 -0.15 0.00 0.00 0.00 0.00 36.38 33.23 1ptw s VAL 84 CO 0.00 0.41 -0.81 0.29 0.00 0.00 0.00 175.10 174.99 1ptw n LYS 85 N 4.19 0.00 -3.15 2.72 5.02 -1.26 -2.54 118.16 123.13 1ptw n LYS 85 Ca -0.16 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 55.90 1ptw n LYS 85 Cb 0.52 -0.96 0.01 0.00 -0.02 0.00 0.00 35.03 34.57 1ptw n LYS 85 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1ptw s THR 86 N -1.93 4.13 -0.86 -0.18 2.01 -1.26 -4.66 115.64 112.90 1ptw s THR 86 Ca 0.38 -0.62 -0.04 0.00 0.31 0.00 0.00 61.69 61.72 1ptw s THR 86 Cb -0.16 -3.50 0.10 0.00 0.01 0.00 0.00 72.50 68.95 1ptw s THR 86 CO 0.79 -0.31 2.55 -0.62 -0.69 0.00 0.00 174.62 176.34 1ptw n GLU 87 N -1.94 3.47 0.00 4.92 -0.58 -1.26 -0.75 120.64 124.50 1ptw n GLU 87 Ca 0.00 -2.95 0.00 0.00 -0.42 0.00 0.00 57.16 53.80 1ptw n GLU 87 Cb 0.58 -2.37 0.00 0.00 -0.57 0.00 0.00 31.44 29.08 1ptw n GLU 87 CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 1ptw n GLN 88 N 1.16 0.00 0.27 3.49 7.27 -1.26 -4.78 117.38 123.52 1ptw n GLN 88 Ca 0.55 0.00 0.14 0.00 0.07 0.00 0.00 57.00 57.76 1ptw n GLN 88 Cb 0.40 0.00 0.72 0.00 2.41 0.00 0.00 30.24 33.77 1ptw n GLN 88 CO 0.00 0.00 0.00 1.49 0.07 0.00 0.00 177.06 178.62 1ptw h GLU 89 N 0.00 0.00 -0.02 3.69 4.81 -1.87 0.47 114.58 121.66 1ptw h GLU 89 Ca 0.00 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 1ptw h GLU 89 Cb 0.00 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.39 1ptw h GLU 89 CO 0.00 0.10 -0.49 0.22 -0.73 0.00 0.00 179.01 178.11 1ptw h ASP 90 N 0.00 0.47 -0.20 1.04 -0.00 -1.25 -1.99 116.42 114.49 1ptw h ASP 90 Ca -0.00 -0.74 -0.04 0.00 -0.00 0.00 0.00 57.03 56.25 1ptw h ASP 90 Cb 0.43 -0.14 -0.02 0.00 -0.00 0.00 0.00 39.33 39.60 1ptw h ASP 90 CO 0.01 1.14 0.01 0.58 -0.00 0.00 0.00 179.24 180.98 1ptw h VAL 91 N -0.16 1.18 -0.18 2.25 2.07 -1.59 -1.31 116.25 118.50 1ptw h VAL 91 Ca -0.06 -0.70 -0.03 0.00 0.82 0.00 0.00 66.70 66.74 1ptw h VAL 91 Cb 1.20 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 1ptw h VAL 91 CO 0.10 0.24 0.01 0.25 0.02 0.00 0.00 177.57 178.19 1ptw h LEU 92 N 0.45 0.30 -0.88 2.57 6.46 -0.92 -2.08 115.31 121.21 1ptw h LEU 92 Ca 0.10 -0.29 0.09 0.00 -0.12 0.00 0.00 57.88 57.66 1ptw h LEU 92 Cb 0.28 -0.08 -0.07 0.00 -0.73 0.00 0.00 40.66 40.06 1ptw h LEU 92 CO 0.01 0.52 0.53 0.00 -0.62 0.00 0.00 178.44 178.87 1ptw h ALA 93 N 0.80 1.26 0.00 1.25 0.00 -0.56 -0.96 119.26 121.04 1ptw h ALA 93 Ca 0.05 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1ptw h ALA 93 Cb 0.35 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1ptw h ALA 93 CO 0.01 0.20 -0.36 0.87 0.00 0.00 0.00 179.25 179.96 1ptw h LYS 94 N 0.91 0.00 -0.03 0.00 1.57 -1.09 -2.63 116.57 115.30 1ptw h LYS 94 Ca 0.41 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 59.02 1ptw h LYS 94 Cb 0.32 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 1ptw h LYS 94 CO -0.23 0.36 -0.76 0.93 -0.57 0.00 0.00 179.45 179.19 1ptw h GLU 95 N 0.00 0.21 -0.36 3.15 4.39 -0.58 -3.08 114.58 118.32 1ptw h GLU 95 Ca -0.00 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.51 1ptw h GLU 95 Cb 0.94 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.63 1ptw h GLU 95 CO 0.05 0.87 0.00 1.28 -1.16 0.00 0.00 179.01 180.05 1ptw n LEU 96 N -3.75 0.36 -0.18 1.33 4.77 -0.47 -2.89 117.00 116.18 1ptw n LEU 96 Ca -0.03 -0.18 0.12 0.00 -0.03 0.00 0.00 56.01 55.89 1ptw n LEU 96 Cb 0.73 -0.18 0.30 0.00 -2.33 0.00 0.00 43.42 41.94 1ptw n LEU 96 CO 0.46 0.09 0.55 -0.62 -1.33 0.00 0.00 177.39 176.54 1ptw n GLU 97 N -0.27 0.58 -0.72 3.23 1.02 -1.16 -3.65 120.64 119.66 1ptw n GLU 97 Ca 0.00 -0.36 0.08 0.00 -0.02 0.00 0.00 57.16 56.86 1ptw n GLU 97 Cb 0.09 -1.49 0.36 0.00 -0.02 0.00 0.00 31.44 30.37 1ptw n GLU 97 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1ptw n ASP 98 N -0.90 5.06 -0.09 1.62 8.00 -1.14 -4.60 116.55 124.51 1ptw n ASP 98 Ca 0.10 -2.88 0.07 0.00 0.71 0.00 0.00 54.79 52.78 1ptw n ASP 98 Cb 0.35 -0.62 0.42 0.00 -0.02 0.00 0.00 41.12 41.24 1ptw n ASP 98 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1ptw h VAL 99 N 3.36 1.03 -0.21 2.53 2.07 -1.80 -0.35 116.25 122.87 1ptw h VAL 99 Ca 0.00 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.32 1ptw h VAL 99 Cb 1.75 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.90 1ptw h VAL 99 CO 0.38 0.11 0.00 0.59 0.02 0.00 0.00 177.57 178.67 1ptw n ASN 100 N -4.47 1.25 -4.42 0.57 3.02 -1.26 -4.74 115.26 105.20 1ptw n ASN 100 Ca 0.07 -2.03 -0.32 0.00 -0.03 0.00 0.00 54.58 52.28 1ptw n ASN 100 Cb 0.19 -0.18 -0.14 0.00 -0.61 0.00 0.00 39.78 39.04 1ptw n ASN 100 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1ptw s LYS 101 N -1.70 2.41 0.16 3.52 1.02 -0.14 -4.89 119.74 120.12 1ptw s LYS 101 Ca 0.14 -0.76 -0.31 0.00 0.02 0.00 0.00 55.97 55.06 1ptw s LYS 101 Cb 0.08 -2.28 -0.09 0.00 -0.52 0.00 0.00 37.83 35.02 1ptw s LYS 101 CO 0.09 0.59 1.42 -0.46 -0.92 0.00 0.00 175.35 176.07 1ptw s TRP 102 N -0.67 3.18 0.00 3.18 -0.11 -1.26 -3.25 118.94 120.01 1ptw s TRP 102 Ca 0.10 0.94 0.00 0.00 1.22 0.00 0.00 56.10 58.37 1ptw s TRP 102 Cb -0.11 -3.74 0.00 0.00 -1.50 0.00 0.00 33.47 28.13 1ptw s TRP 102 CO 0.00 -2.54 0.00 0.41 -4.62 0.00 0.00 176.95 170.20 1ptw n GLY 103 N 3.18 1.08 3.70 5.86 0.00 -1.26 -4.98 105.19 112.76 1ptw n GLY 103 Ca 0.10 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1ptw n GLY 103 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ptw n LEU 104 N 0.00 4.06 -3.86 0.99 7.94 -1.20 -4.80 117.00 120.13 1ptw n LEU 104 Ca 0.00 1.08 -0.41 0.00 -1.11 0.00 0.00 56.01 55.57 1ptw n LEU 104 Cb 0.01 -1.49 -0.03 0.00 0.53 0.00 0.00 43.42 42.44 1ptw n LEU 104 CO 0.00 -0.74 2.27 1.41 -1.11 0.00 0.00 177.39 179.21 1ptw n HIS 105 N -0.36 2.91 -0.04 1.96 8.25 -1.26 -4.70 115.22 121.98 1ptw n HIS 105 Ca 0.07 -2.35 -0.02 0.00 -0.26 0.00 0.00 57.72 55.17 1ptw n HIS 105 Cb 0.40 -2.23 0.23 0.00 1.12 0.00 0.00 29.99 29.52 1ptw n HIS 105 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 1ptw h VAL 106 N 4.56 1.22 -0.22 1.59 3.04 -1.99 -1.93 116.25 122.53 1ptw h VAL 106 Ca 0.46 -0.93 -0.08 0.00 -1.01 0.00 0.00 66.70 65.14 1ptw h VAL 106 Cb 0.70 0.97 -0.01 0.00 -2.01 0.00 0.00 31.29 30.95 1ptw h VAL 106 CO 1.81 0.32 -0.23 -0.26 -1.01 0.00 0.00 177.57 178.20 1ptw h PHE 107 N 0.58 0.45 0.05 3.17 0.04 -1.97 -0.37 116.94 118.89 1ptw h PHE 107 Ca 0.12 -0.09 -0.00 0.00 2.80 0.00 0.00 57.97 60.80 1ptw h PHE 107 Cb 0.42 -0.11 0.00 0.00 2.20 0.00 0.00 35.95 38.46 1ptw h PHE 107 CO 0.02 0.61 -0.02 -0.09 -0.60 0.00 0.00 178.31 178.23 1ptw h ARG 108 N 0.37 -0.06 -0.98 1.51 2.43 -1.85 -2.47 114.38 113.32 1ptw h ARG 108 Ca 0.06 0.00 0.24 0.00 -0.81 0.00 0.00 59.98 59.47 1ptw h ARG 108 Cb 0.61 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 30.09 1ptw h ARG 108 CO 0.04 0.45 0.64 0.82 -1.51 0.00 0.00 179.97 180.41 1ptw h ILE 109 N -0.60 0.60 -0.43 1.20 2.04 -1.19 0.47 117.51 119.60 1ptw h ILE 109 Ca -0.01 -0.13 -0.04 0.00 1.00 0.00 0.00 64.86 65.68 1ptw h ILE 109 Cb 0.53 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 1ptw h ILE 109 CO 0.01 0.07 0.11 0.00 0.00 0.00 0.00 178.15 178.34 1ptw h ALA 110 N 1.60 0.56 -0.15 1.87 0.00 -0.84 -0.68 119.26 121.63 1ptw h ALA 110 Ca 0.53 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 1ptw h ALA 110 Cb 1.37 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 1ptw h ALA 110 CO -0.22 0.23 -0.03 0.93 0.00 0.00 0.00 179.25 180.16 1ptw h GLU 111 N 0.55 0.28 -0.77 0.00 5.08 0.24 0.30 114.58 120.26 1ptw h GLU 111 Ca 0.13 -0.10 0.01 0.00 -1.00 0.00 0.00 59.36 58.41 1ptw h GLU 111 Cb 0.30 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 1ptw h GLU 111 CO -0.00 0.55 0.50 -0.07 -1.00 0.00 0.00 179.01 178.99 1ptw h LEU 112 N -0.02 0.86 0.00 1.33 3.38 -0.66 -2.61 115.31 117.59 1ptw h LEU 112 Ca 0.04 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1ptw h LEU 112 Cb 0.45 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1ptw h LEU 112 CO 0.01 0.61 0.00 -1.54 0.09 0.00 0.00 178.44 177.62 1ptw n SER 113 N -4.57 0.00 -1.24 -0.43 3.41 -0.27 -4.85 113.62 105.67 1ptw n SER 113 Ca 0.08 -1.67 -0.09 0.00 -0.26 0.00 0.00 58.87 56.94 1ptw n SER 113 Cb 0.04 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.00 1ptw n SER 113 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ptw n GLY 114 N 0.65 0.18 2.41 5.00 0.00 -0.99 -3.31 105.19 109.14 1ptw n GLY 114 Ca 0.08 -0.45 -0.11 0.00 0.00 0.00 0.00 46.02 45.54 1ptw n GLY 114 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ptw n ASN 115 N 0.16 -3.47 -2.41 1.61 5.15 0.11 -4.97 115.26 111.44 1ptw n ASN 115 Ca -0.06 -0.27 -0.16 0.00 -0.60 0.00 0.00 54.58 53.49 1ptw n ASN 115 Cb 0.55 -2.72 0.03 0.00 -0.53 0.00 0.00 39.78 37.11 1ptw n ASN 115 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1ptw n ARG 116 N -2.64 2.76 -0.04 1.20 5.12 -1.21 -4.87 116.66 116.98 1ptw n ARG 116 Ca -0.04 -3.94 -0.01 0.00 -1.93 0.00 0.00 57.85 51.93 1ptw n ARG 116 Cb 0.55 -1.96 0.26 0.00 -1.16 0.00 0.00 32.46 30.15 1ptw n ARG 116 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1ptw h PRO 117 N 2.48 0.62 -0.18 5.56 0.13 -1.82 -2.12 132.00 136.67 1ptw h PRO 117 Ca 0.16 -0.13 -0.07 0.00 -0.87 0.00 0.00 66.00 65.09 1ptw h PRO 117 Cb 1.30 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 1ptw h PRO 117 CO 0.59 0.62 -0.15 1.25 -0.23 0.00 0.00 178.00 180.07 1ptw h LEU 118 N 0.60 0.45 -0.10 1.56 5.85 -1.90 -1.80 115.31 119.97 1ptw h LEU 118 Ca 0.13 -0.46 -0.01 0.00 0.84 0.00 0.00 57.88 58.38 1ptw h LEU 118 Cb 0.32 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.22 1ptw h LEU 118 CO 0.01 0.81 0.03 0.74 -0.34 0.00 0.00 178.44 179.69 1ptw h THR 119 N 0.08 1.17 -0.35 1.05 2.02 -1.81 -2.35 112.91 112.72 1ptw h THR 119 Ca 0.03 -0.52 -0.17 0.00 0.77 0.00 0.00 66.41 66.52 1ptw h THR 119 Cb 0.67 1.33 -0.00 0.00 -1.74 0.00 0.00 68.15 68.41 1ptw h THR 119 CO 0.04 0.15 -0.44 -0.37 0.37 0.00 0.00 175.52 175.27 1ptw h VAL 120 N -0.02 1.27 -0.31 3.16 -1.51 -1.45 -1.80 116.25 115.60 1ptw h VAL 120 Ca 0.03 -1.62 -0.13 0.00 -1.23 0.00 0.00 66.70 63.76 1ptw h VAL 120 Cb 0.21 1.46 -0.01 0.00 -2.13 0.00 0.00 31.29 30.82 1ptw h VAL 120 CO -0.00 0.54 -0.33 0.40 -1.23 0.00 0.00 177.57 176.95 1ptw h ILE 121 N 0.74 1.28 -0.47 7.19 2.04 -1.38 -0.75 117.51 126.16 1ptw h ILE 121 Ca 0.05 -1.47 -0.07 0.00 1.00 0.00 0.00 64.86 64.37 1ptw h ILE 121 Cb 1.04 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 38.50 1ptw h ILE 121 CO 0.10 0.47 0.03 0.24 0.00 0.00 0.00 178.15 179.00 1ptw h MET 122 N 0.57 0.80 -0.53 2.37 2.86 -1.39 -1.16 114.93 118.45 1ptw h MET 122 Ca 0.06 -0.24 -0.03 0.00 -2.06 0.00 0.00 59.70 57.44 1ptw h MET 122 Cb 0.84 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.39 1ptw h MET 122 CO 0.07 0.84 0.23 1.25 1.06 0.00 0.00 176.91 180.36 1ptw h HIS 123 N 0.66 0.80 -0.35 -0.22 -0.00 -1.19 0.21 115.15 115.06 1ptw h HIS 123 Ca 0.14 -0.05 0.01 0.00 -0.00 0.00 0.00 60.37 60.46 1ptw h HIS 123 Cb 0.45 -0.24 -0.02 0.00 -0.00 0.00 0.00 27.41 27.60 1ptw h HIS 123 CO 0.03 0.65 0.21 1.15 -0.00 0.00 0.00 177.93 179.97 1ptw h THR 124 N 0.72 1.05 -0.42 6.26 2.02 -0.97 -1.68 112.91 119.89 1ptw h THR 124 Ca 0.18 -0.15 -0.13 0.00 0.77 0.00 0.00 66.41 67.08 1ptw h THR 124 Cb 0.17 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 1ptw h THR 124 CO -0.02 0.08 -0.26 0.40 0.37 0.00 0.00 175.52 176.10 1ptw h ILE 125 N 0.43 1.28 -0.64 3.11 2.04 -1.00 -1.58 117.51 121.14 1ptw h ILE 125 Ca 0.14 -1.42 -0.02 0.00 1.00 0.00 0.00 64.86 64.56 1ptw h ILE 125 Cb -0.01 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.31 1ptw h ILE 125 CO -0.06 0.48 0.31 -0.26 0.00 0.00 0.00 178.15 178.62 1ptw h PHE 126 N 0.74 0.92 0.03 1.37 -1.00 -0.82 -1.09 116.94 117.09 1ptw h PHE 126 Ca 0.09 -0.04 -0.00 0.00 2.81 0.00 0.00 57.97 60.82 1ptw h PHE 126 Cb 0.83 -0.28 0.00 0.00 3.61 0.00 0.00 35.95 40.11 1ptw h PHE 126 CO 0.06 0.69 -0.02 1.96 -1.61 0.00 0.00 178.31 179.39 1ptw h GLN 127 N 0.88 -0.04 -0.81 1.51 1.08 -1.24 0.35 115.11 116.84 1ptw h GLN 127 Ca 0.22 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.41 1ptw h GLN 127 Cb 0.11 0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 27.51 1ptw h GLN 127 CO -0.03 0.14 0.44 1.49 -0.95 0.00 0.00 178.83 179.91 1ptw h GLU 128 N -0.22 1.13 -0.05 1.46 4.81 -1.18 -0.44 114.58 120.08 1ptw h GLU 128 Ca -0.00 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 1ptw h GLU 128 Cb 0.20 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.36 1ptw h GLU 128 CO 0.01 0.84 0.00 0.54 -0.73 0.00 0.00 179.01 179.66 1ptw n ARG 129 N -4.40 1.19 -2.41 1.92 1.74 -0.42 -4.89 116.66 109.38 1ptw n ARG 129 Ca 0.08 -0.29 -0.15 0.00 -0.77 0.00 0.00 57.85 56.72 1ptw n ARG 129 Cb 0.10 -1.25 -0.01 0.00 -1.02 0.00 0.00 32.46 30.28 1ptw n ARG 129 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1ptw n ASP 130 N -0.44 -4.55 0.22 0.55 2.03 -0.17 -4.87 116.55 109.31 1ptw n ASP 130 Ca 0.12 0.13 0.06 0.00 0.52 0.00 0.00 54.79 55.62 1ptw n ASP 130 Cb 0.12 -3.84 0.50 0.00 -0.72 0.00 0.00 41.12 37.18 1ptw n ASP 130 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1ptw h LEU 131 N 0.00 0.00 -0.31 -2.67 3.38 -0.60 -2.67 115.31 112.44 1ptw h LEU 131 Ca -0.36 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.52 1ptw h LEU 131 Cb 1.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 1ptw h LEU 131 CO 0.42 0.23 -0.17 -0.07 0.09 0.00 0.00 178.44 178.94 1ptw h LEU 132 N 0.00 0.69 -0.21 1.67 4.07 -1.88 -1.96 115.31 117.69 1ptw h LEU 132 Ca -0.00 -0.42 -0.19 0.00 0.08 0.00 0.00 57.88 57.35 1ptw h LEU 132 Cb 0.44 -0.19 0.01 0.00 1.08 0.00 0.00 40.66 41.99 1ptw h LEU 132 CO 0.03 0.96 -0.60 0.11 -1.08 0.00 0.00 178.44 177.85 1ptw h LYS 133 N 0.42 0.77 -0.56 1.13 1.57 -1.85 0.53 116.57 118.58 1ptw h LYS 133 Ca 0.07 -0.56 -0.04 0.00 -1.87 0.00 0.00 60.65 58.25 1ptw h LYS 133 Cb 0.71 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.08 1ptw h LYS 133 CO 0.05 1.18 0.19 1.15 -0.57 0.00 0.00 179.45 181.45 1ptw h THR 134 N 0.51 1.21 -0.37 -0.16 2.02 -1.49 -2.94 112.91 111.69 1ptw h THR 134 Ca -0.02 -0.70 0.00 0.00 0.77 0.00 0.00 66.41 66.46 1ptw h THR 134 Cb 1.22 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 68.22 1ptw h THR 134 CO 0.13 0.27 0.00 0.49 0.37 0.00 0.00 175.52 176.78 1ptw n PHE 135 N -4.31 0.77 -4.06 3.16 3.72 -0.74 -4.99 117.46 111.02 1ptw n PHE 135 Ca 0.04 -0.64 -0.36 0.00 -0.05 0.00 0.00 57.45 56.44 1ptw n PHE 135 Cb 0.19 -0.15 -0.02 0.00 -0.94 0.00 0.00 39.48 38.56 1ptw n PHE 135 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1ptw n LYS 136 N 0.29 -1.11 -3.34 -1.08 4.01 -0.01 -4.59 118.16 112.34 1ptw n LYS 136 Ca 0.17 0.19 -0.41 0.00 -0.51 0.00 0.00 58.31 57.76 1ptw n LYS 136 Cb 0.65 -3.41 -0.09 0.00 -0.51 0.00 0.00 35.03 31.67 1ptw n LYS 136 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1ptw s ILE 137 N -3.83 5.11 0.30 -0.18 1.01 -0.14 -4.62 121.20 118.85 1ptw s ILE 137 Ca 0.27 0.28 -0.29 0.00 0.00 0.00 0.00 60.65 60.91 1ptw s ILE 137 Cb -0.14 -3.85 -0.10 0.00 0.01 0.00 0.00 42.46 38.39 1ptw s ILE 137 CO 0.95 -0.08 1.34 -2.16 0.00 0.00 0.00 174.94 174.99 1ptw s PRO 138 N 2.17 4.33 0.18 2.79 0.04 -1.26 -4.80 135.00 138.46 1ptw s PRO 138 Ca 0.15 2.23 -0.13 0.00 0.04 0.00 0.00 61.00 63.28 1ptw s PRO 138 Cb -0.16 -3.09 0.18 0.00 0.04 0.00 0.00 34.50 31.47 1ptw s PRO 138 CO 0.12 -0.25 1.70 -0.39 0.04 0.00 0.00 177.00 178.22 1ptw h VAL 139 N 3.22 0.68 -0.76 -0.36 -1.51 -1.96 -1.65 116.25 113.90 1ptw h VAL 139 Ca -0.48 -0.06 0.08 0.00 -1.23 0.00 0.00 66.70 65.01 1ptw h VAL 139 Cb 1.22 0.49 -0.07 0.00 -2.13 0.00 0.00 31.29 30.80 1ptw h VAL 139 CO 0.69 0.03 0.42 0.44 -1.23 0.00 0.00 177.57 177.93 1ptw h ASP 140 N 0.17 0.61 -0.66 4.19 5.19 -1.97 0.11 116.42 124.06 1ptw h ASP 140 Ca 0.24 0.04 -0.08 0.00 -0.62 0.00 0.00 57.03 56.62 1ptw h ASP 140 Cb 0.35 -0.07 -0.03 0.00 0.18 0.00 0.00 39.33 39.76 1ptw h ASP 140 CO -0.36 0.36 0.10 0.74 -3.12 0.00 0.00 179.24 176.97 1ptw h THR 141 N 0.74 1.26 -0.06 0.35 2.02 -1.66 -0.24 112.91 115.32 1ptw h THR 141 Ca 0.36 -1.04 -0.01 0.00 0.77 0.00 0.00 66.41 66.49 1ptw h THR 141 Cb 0.30 0.65 -0.00 0.00 -1.74 0.00 0.00 68.15 67.36 1ptw h THR 141 CO -0.23 0.39 0.00 0.25 0.37 0.00 0.00 175.52 176.30 1ptw h LEU 142 N 1.02 0.10 -0.46 2.58 5.85 -0.23 -0.68 115.31 123.50 1ptw h LEU 142 Ca 0.20 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 1ptw h LEU 142 Cb 0.45 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 1ptw h LEU 142 CO 0.01 0.38 0.24 0.40 -0.34 0.00 0.00 178.44 179.13 1ptw h ILE 143 N -0.17 1.17 -0.47 4.05 2.04 -0.79 -0.04 117.51 123.31 1ptw h ILE 143 Ca 0.02 -0.46 -0.01 0.00 1.00 0.00 0.00 64.86 65.41 1ptw h ILE 143 Cb 0.32 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 1ptw h ILE 143 CO 0.00 0.19 0.27 0.74 0.00 0.00 0.00 178.15 179.35 1ptw h THR 144 N 0.60 1.15 -0.05 -0.27 2.02 -0.99 -0.76 112.91 114.62 1ptw h THR 144 Ca 0.16 -0.37 -0.00 0.00 0.77 0.00 0.00 66.41 66.97 1ptw h THR 144 Cb 0.08 0.55 -0.00 0.00 -1.74 0.00 0.00 68.15 67.03 1ptw h THR 144 CO -0.02 0.16 0.02 0.22 0.37 0.00 0.00 175.52 176.26 1ptw h TYR 145 N 0.62 0.08 -0.41 3.16 3.20 -0.92 -0.29 116.97 122.42 1ptw h TYR 145 Ca 0.17 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.10 1ptw h TYR 145 Cb 0.02 -0.02 -0.07 0.00 1.54 0.00 0.00 36.73 38.20 1ptw h TYR 145 CO -0.03 0.25 -0.01 -0.07 -1.64 0.00 0.00 178.16 176.66 1ptw h LEU 146 N -0.10 -0.18 -1.00 2.82 3.38 -0.79 0.92 115.31 120.37 1ptw h LEU 146 Ca 0.02 0.10 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 1ptw h LEU 146 Cb 0.20 0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1ptw h LEU 146 CO -0.00 -0.05 0.18 0.24 0.09 0.00 0.00 178.44 178.89 1ptw h MET 147 N 0.10 0.90 -0.43 1.13 2.86 -1.07 0.31 114.93 118.74 1ptw h MET 147 Ca 0.20 -0.18 -0.14 0.00 -2.06 0.00 0.00 59.70 57.53 1ptw h MET 147 Cb 0.29 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 1ptw h MET 147 CO -0.34 0.79 -0.26 1.15 1.06 0.00 0.00 176.91 179.31 1ptw h THR 148 N 0.88 1.27 -0.07 2.22 2.02 0.63 0.14 112.91 120.00 1ptw h THR 148 Ca 0.20 -1.42 -0.00 0.00 0.77 0.00 0.00 66.41 65.95 1ptw h THR 148 Cb 0.27 1.26 -0.00 0.00 -1.74 0.00 0.00 68.15 67.93 1ptw h THR 148 CO -0.01 0.48 0.03 0.25 0.37 0.00 0.00 175.52 176.64 1ptw h LEU 149 N 0.76 0.10 -1.08 2.58 5.85 0.15 -2.65 115.31 121.02 1ptw h LEU 149 Ca 0.09 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.63 1ptw h LEU 149 Cb 0.84 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.81 1ptw h LEU 149 CO 0.07 0.23 0.41 -0.08 -0.34 0.00 0.00 178.44 178.74 1ptw h GLU 150 N -0.05 1.05 -0.01 1.25 4.81 -0.31 -0.63 114.58 120.70 1ptw h GLU 150 Ca 0.02 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1ptw h GLU 150 Cb 0.17 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.34 1ptw h GLU 150 CO -0.00 0.78 0.02 -0.44 -0.73 0.00 0.00 179.01 178.63 1ptw h ASP 151 N 1.06 0.00 -0.26 1.04 3.45 -0.41 -1.47 116.42 119.83 1ptw h ASP 151 Ca 0.27 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.73 1ptw h ASP 151 Cb 0.03 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.80 1ptw h ASP 151 CO -0.04 0.00 0.00 1.41 -1.57 0.00 0.00 179.24 179.04 1ptw n HIS 152 N -3.34 0.33 -3.40 4.55 8.25 -0.25 -4.82 115.22 116.55 1ptw n HIS 152 Ca -0.03 -0.16 -0.31 0.00 -0.26 0.00 0.00 57.72 56.96 1ptw n HIS 152 Cb 0.09 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.16 1ptw n HIS 152 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1ptw s TYR 153 N -1.67 3.44 -0.22 4.41 1.51 -0.56 -1.45 117.35 122.81 1ptw s TYR 153 Ca 0.34 0.80 -0.21 0.00 -1.01 0.00 0.00 57.07 56.99 1ptw s TYR 153 Cb 0.19 -2.21 -0.02 0.00 -0.11 0.00 0.00 41.96 39.81 1ptw s TYR 153 CO 0.27 0.24 0.65 -1.01 -1.11 0.00 0.00 175.55 174.60 1ptw s HIS 154 N -1.89 3.34 0.25 2.71 3.76 -1.26 -4.85 115.29 117.35 1ptw s HIS 154 Ca 0.46 0.92 0.20 0.00 -0.15 0.00 0.00 55.06 56.49 1ptw s HIS 154 Cb -0.11 -2.84 0.88 0.00 1.11 0.00 0.00 32.58 31.62 1ptw s HIS 154 CO 0.24 -0.25 1.83 0.00 -0.85 0.00 0.00 174.74 175.71 1ptw h ALA 155 N 7.64 1.12 -0.25 -1.40 0.00 -1.94 -2.83 119.26 121.59 1ptw h ALA 155 Ca -0.29 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.31 1ptw h ALA 155 Cb 1.13 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1ptw h ALA 155 CO 0.78 0.37 0.04 -0.40 0.00 0.00 0.00 179.25 180.05 1ptw n ASP 156 N -3.62 2.94 -4.23 0.00 5.75 -1.26 -4.74 116.55 111.39 1ptw n ASP 156 Ca -0.01 -2.41 -0.33 0.00 -0.01 0.00 0.00 54.79 52.03 1ptw n ASP 156 Cb 0.42 -0.58 -0.16 0.00 -1.03 0.00 0.00 41.12 39.77 1ptw n ASP 156 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1ptw s VAL 157 N -1.62 2.43 0.14 2.12 1.01 -1.07 -5.04 120.40 118.37 1ptw s VAL 157 Ca 0.22 -0.86 -0.13 0.00 0.00 0.00 0.00 61.98 61.21 1ptw s VAL 157 Cb 0.17 -2.00 0.00 0.00 0.00 0.00 0.00 36.38 34.55 1ptw s VAL 157 CO 0.06 0.53 1.58 0.00 0.00 0.00 0.00 175.10 177.27 1ptw h ALA 158 N 7.23 0.62 0.00 5.51 0.00 -1.85 -3.41 119.26 127.37 1ptw h ALA 158 Ca -0.31 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1ptw h ALA 158 Cb 1.20 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1ptw h ALA 158 CO 0.55 0.45 -0.49 0.98 0.00 0.00 0.00 179.25 180.75 1ptw n TYR 159 N -4.34 0.00 -0.99 0.00 9.36 -1.26 -4.80 117.16 115.14 1ptw n TYR 159 Ca 0.00 0.00 -0.32 0.00 3.32 0.00 0.00 57.90 60.90 1ptw n TYR 159 Cb 0.33 -0.24 -0.03 0.00 -0.63 0.00 0.00 39.34 38.76 1ptw n TYR 159 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 1ptw n HIS 160 N -3.67 1.77 -4.13 2.98 8.25 -1.26 -4.19 115.22 114.97 1ptw n HIS 160 Ca -0.07 -2.05 -0.06 0.00 -0.26 0.00 0.00 57.72 55.28 1ptw n HIS 160 Cb 0.25 -1.80 -0.02 0.00 1.12 0.00 0.00 29.99 29.55 1ptw n HIS 160 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1ptw n ASN 161 N 5.47 1.52 0.29 0.41 0.23 -1.26 -4.44 115.26 117.48 1ptw n ASN 161 Ca 0.49 -1.47 0.14 0.00 -0.53 0.00 0.00 54.58 53.21 1ptw n ASN 161 Cb 0.25 0.16 0.87 0.00 -2.08 0.00 0.00 39.78 38.99 1ptw n ASN 161 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1ptw h ASN 162 N 0.31 0.00 -0.15 0.53 -1.07 -1.87 -2.00 115.58 111.34 1ptw h ASN 162 Ca -0.08 0.00 -0.07 0.00 0.07 0.00 0.00 56.30 56.23 1ptw h ASN 162 Cb 0.27 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.51 1ptw h ASN 162 CO 0.12 0.02 -0.16 0.40 0.07 0.00 0.00 177.43 177.88 1ptw h ILE 163 N 0.00 1.35 -0.95 6.14 2.04 -1.96 0.01 117.51 124.13 1ptw h ILE 163 Ca -0.00 -1.34 -0.00 0.00 1.00 0.00 0.00 64.86 64.52 1ptw h ILE 163 Cb 0.04 1.88 -0.05 0.00 -0.74 0.00 0.00 36.82 37.95 1ptw h ILE 163 CO 0.00 0.40 0.60 -0.74 0.00 0.00 0.00 178.15 178.40 1ptw h HIS 164 N 0.01 1.24 -0.16 1.37 2.76 -1.56 0.73 115.15 119.54 1ptw h HIS 164 Ca 0.02 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.19 1ptw h HIS 164 Cb 0.70 -0.41 -0.01 0.00 1.55 0.00 0.00 27.41 29.25 1ptw h HIS 164 CO 0.09 0.81 0.06 0.00 -1.30 0.00 0.00 177.93 177.59 1ptw h ALA 165 N 1.35 0.21 -0.86 5.26 0.00 -1.23 0.96 119.26 124.95 1ptw h ALA 165 Ca 0.35 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1ptw h ALA 165 Cb -0.09 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 1ptw h ALA 165 CO -0.07 -0.20 0.55 0.00 0.00 0.00 0.00 179.25 179.52 1ptw h ALA 166 N 0.90 1.09 -0.09 0.00 0.00 -0.61 -0.57 119.26 119.98 1ptw h ALA 166 Ca 0.05 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1ptw h ALA 166 Cb 0.17 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1ptw h ALA 166 CO -0.00 0.52 0.01 0.22 0.00 0.00 0.00 179.25 180.00 1ptw h ASP 167 N 1.17 -0.00 -0.23 0.00 3.58 -0.55 -0.87 116.42 119.51 1ptw h ASP 167 Ca 0.31 0.02 -0.06 0.00 0.42 0.00 0.00 57.03 57.71 1ptw h ASP 167 Cb -0.10 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 40.96 1ptw h ASP 167 CO -0.06 0.01 -0.04 0.58 -2.88 0.00 0.00 179.24 176.85 1ptw h VAL 168 N 0.05 1.22 0.19 2.25 2.07 -0.43 -1.09 116.25 120.51 1ptw h VAL 168 Ca 0.04 -0.91 -0.01 0.00 0.82 0.00 0.00 66.70 66.64 1ptw h VAL 168 Cb 0.04 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1ptw h VAL 168 CO -0.06 0.31 -0.09 0.58 0.02 0.00 0.00 177.57 178.33 1ptw h VAL 169 N 0.54 0.90 -0.30 2.57 2.07 -0.71 -1.68 116.25 119.65 1ptw h VAL 169 Ca 0.11 -0.58 -0.04 0.00 0.82 0.00 0.00 66.70 67.00 1ptw h VAL 169 Cb 0.41 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 1ptw h VAL 169 CO 0.02 0.13 0.00 -0.61 0.02 0.00 0.00 177.57 177.13 1ptw h GLN 170 N -0.55 0.45 -0.32 1.57 -0.00 -1.07 0.18 115.11 115.36 1ptw h GLN 170 Ca -0.03 -0.09 -0.14 0.00 -0.00 0.00 0.00 58.65 58.39 1ptw h GLN 170 Cb 0.41 -0.07 -0.00 0.00 0.00 0.00 0.00 27.48 27.82 1ptw h GLN 170 CO 0.04 0.48 -0.36 0.77 0.00 0.00 0.00 178.83 179.76 1ptw h SER 171 N 0.44 0.88 -0.44 -0.69 0.02 -1.17 -1.12 113.55 111.47 1ptw h SER 171 Ca 0.10 -0.48 -0.07 0.00 -0.84 0.00 0.00 61.79 60.49 1ptw h SER 171 Cb 0.29 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 1ptw h SER 171 CO 0.01 1.18 -0.02 0.74 -1.14 0.00 0.00 176.83 177.60 1ptw h THR 172 N 0.59 1.26 -0.67 -2.27 2.02 -1.00 -1.20 112.91 111.65 1ptw h THR 172 Ca 0.05 -1.07 0.11 0.00 0.77 0.00 0.00 66.41 66.27 1ptw h THR 172 Cb 0.95 1.08 -0.08 0.00 -1.74 0.00 0.00 68.15 68.37 1ptw h THR 172 CO 0.09 0.37 0.27 -0.74 0.37 0.00 0.00 175.52 175.88 1ptw h HIS 173 N 0.62 0.47 -0.28 3.16 6.17 -0.79 0.18 115.15 124.68 1ptw h HIS 173 Ca 0.12 0.03 -0.14 0.00 0.71 0.00 0.00 60.37 61.09 1ptw h HIS 173 Cb 0.52 -0.11 -0.01 0.00 2.52 0.00 0.00 27.41 30.33 1ptw h HIS 173 CO 0.04 0.12 -0.40 0.28 0.71 0.00 0.00 177.93 178.67 1ptw h VAL 174 N 0.46 1.29 -0.55 5.26 2.07 -0.96 -2.98 116.25 120.84 1ptw h VAL 174 Ca 0.34 -1.58 -0.04 0.00 0.82 0.00 0.00 66.70 66.24 1ptw h VAL 174 Cb 0.44 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 1ptw h VAL 174 CO -0.33 0.51 0.18 -0.07 0.02 0.00 0.00 177.57 177.88 1ptw h LEU 175 N 0.56 0.80 -1.72 2.57 3.38 -0.08 -2.70 115.31 118.12 1ptw h LEU 175 Ca 0.05 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 57.85 1ptw h LEU 175 Cb 0.94 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 1ptw h LEU 175 CO 0.09 0.79 0.26 -0.07 0.09 0.00 0.00 178.44 179.59 1ptw h LEU 176 N 0.76 0.31 0.00 1.67 3.38 -0.59 -1.59 115.31 119.26 1ptw h LEU 176 Ca 0.18 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1ptw h LEU 176 Cb 0.27 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1ptw h LEU 176 CO -0.01 0.21 0.00 -1.20 0.09 0.00 0.00 178.44 177.54 1ptw n SER 177 N -4.48 0.00 -4.77 -0.43 7.64 -1.02 -4.72 113.62 105.84 1ptw n SER 177 Ca 0.04 -1.62 -0.41 0.00 1.01 0.00 0.00 58.87 57.90 1ptw n SER 177 Cb 0.19 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.37 1ptw n SER 177 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1ptw s THR 178 N -2.00 2.62 0.26 0.44 -1.32 -0.60 -4.88 115.64 110.16 1ptw s THR 178 Ca 0.18 0.61 -0.03 0.00 -1.21 0.00 0.00 61.69 61.24 1ptw s THR 178 Cb 0.08 -3.39 0.27 0.00 -1.51 0.00 0.00 72.50 67.95 1ptw s THR 178 CO 0.14 0.14 1.66 -0.65 -2.21 0.00 0.00 174.62 173.70 1ptw h PRO 179 N 3.47 0.21 0.00 7.08 0.11 -1.91 -0.64 132.00 140.32 1ptw h PRO 179 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1ptw h PRO 179 Cb 1.23 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1ptw h PRO 179 CO 0.66 0.14 0.00 0.00 -0.21 0.00 0.00 178.00 178.59 1ptw n ALA 180 N -2.74 1.33 0.13 -0.75 0.00 -1.26 -1.96 120.51 115.25 1ptw n ALA 180 Ca 0.17 0.15 0.03 0.00 0.00 0.00 0.00 53.44 53.79 1ptw n ALA 180 Cb 0.54 -1.35 0.04 0.00 0.00 0.00 0.00 19.45 18.68 1ptw n ALA 180 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ptw n LEU 181 N -2.27 1.84 -4.57 0.00 4.77 -0.29 -1.12 117.00 115.37 1ptw n LEU 181 Ca 0.00 -1.35 -0.55 0.00 -0.03 0.00 0.00 56.01 54.08 1ptw n LEU 181 Cb 0.12 -0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.10 1ptw n LEU 181 CO 0.14 0.42 0.81 1.21 -1.33 0.00 0.00 177.39 178.64 1ptw n GLU 182 N 0.23 0.70 -2.02 3.23 2.13 -0.83 -0.86 120.64 123.22 1ptw n GLU 182 Ca 0.04 0.25 -0.12 0.00 0.66 0.00 0.00 57.16 58.00 1ptw n GLU 182 Cb 0.22 -1.84 -0.02 0.00 0.27 0.00 0.00 31.44 30.06 1ptw n GLU 182 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ptw n ALA 183 N 2.33 -0.56 0.03 4.31 0.00 -1.26 -4.85 120.51 120.51 1ptw n ALA 183 Ca 0.20 0.13 -0.22 0.00 0.00 0.00 0.00 53.44 53.55 1ptw n ALA 183 Cb 0.14 -1.37 -0.14 0.00 0.00 0.00 0.00 19.45 18.08 1ptw n ALA 183 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ptw h VAL 184 N 0.00 0.75 -2.91 0.00 2.07 -1.37 -3.47 116.25 111.31 1ptw h VAL 184 Ca -0.26 -2.40 -0.57 0.00 0.82 0.00 0.00 66.70 64.28 1ptw h VAL 184 Cb 1.03 2.60 -0.03 0.00 -1.52 0.00 0.00 31.29 33.38 1ptw h VAL 184 CO 0.33 0.88 -0.39 -0.36 0.02 0.00 0.00 177.57 178.05 1ptw s PHE 185 N -2.56 3.49 0.69 1.57 0.08 -1.26 -5.01 117.98 114.98 1ptw s PHE 185 Ca -0.20 0.34 -0.10 0.00 0.12 0.00 0.00 56.93 57.10 1ptw s PHE 185 Cb 0.06 -1.84 0.03 0.00 -0.57 0.00 0.00 43.02 40.69 1ptw s PHE 185 CO 0.80 0.47 1.05 0.95 -0.10 0.00 0.00 175.22 178.39 1ptw s THR 186 N -1.69 3.22 0.47 0.64 -4.23 -1.26 -4.88 115.64 107.90 1ptw s THR 186 Ca 0.38 0.22 0.12 0.00 -1.18 0.00 0.00 61.69 61.23 1ptw s THR 186 Cb -0.12 -3.36 0.27 0.00 1.34 0.00 0.00 72.50 70.63 1ptw s THR 186 CO 0.27 -0.44 2.11 0.44 -0.54 0.00 0.00 174.62 176.46 1ptw h ASP 187 N -0.58 0.22 0.10 3.99 3.32 -1.99 -1.38 116.42 120.11 1ptw h ASP 187 Ca -0.45 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.47 1ptw h ASP 187 Cb 1.27 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.75 1ptw h ASP 187 CO 0.63 0.16 -0.41 0.25 -1.72 0.00 0.00 179.24 178.15 1ptw h LEU 188 N 0.26 0.42 -0.19 1.55 5.85 -1.99 0.35 115.31 121.56 1ptw h LEU 188 Ca 0.07 -0.18 -0.22 0.00 0.84 0.00 0.00 57.88 58.39 1ptw h LEU 188 Cb -0.02 -0.12 0.01 0.00 0.37 0.00 0.00 40.66 40.90 1ptw h LEU 188 CO -0.02 0.79 -0.87 -0.33 -0.34 0.00 0.00 178.44 177.67 1ptw h GLU 189 N 0.33 0.57 0.03 1.25 5.08 -1.73 -2.04 114.58 118.08 1ptw h GLU 189 Ca 0.03 -0.54 -0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1ptw h GLU 189 Cb 0.86 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.24 1ptw h GLU 189 CO 0.07 1.16 -0.01 0.82 -1.00 0.00 0.00 179.01 180.05 1ptw h ILE 190 N 0.36 1.09 -0.81 3.13 2.04 -1.13 -0.66 117.51 121.52 1ptw h ILE 190 Ca -0.07 -0.35 0.12 0.00 1.00 0.00 0.00 64.86 65.56 1ptw h ILE 190 Cb 1.49 1.32 -0.08 0.00 -0.74 0.00 0.00 36.82 38.81 1ptw h ILE 190 CO 0.16 0.09 0.43 0.25 0.00 0.00 0.00 178.15 179.08 1ptw h LEU 191 N -0.19 0.57 -0.56 1.44 5.85 -0.92 -1.08 115.31 120.42 1ptw h LEU 191 Ca -0.00 0.07 -0.11 0.00 0.84 0.00 0.00 57.88 58.68 1ptw h LEU 191 Cb 0.18 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 1ptw h LEU 191 CO 0.01 0.29 -0.07 0.00 -0.34 0.00 0.00 178.44 178.32 1ptw h ALA 192 N 1.50 0.76 -0.27 1.25 0.00 -1.08 0.84 119.26 122.26 1ptw h ALA 192 Ca 0.42 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1ptw h ALA 192 Cb 0.50 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1ptw h ALA 192 CO -0.30 0.65 0.10 0.00 0.00 0.00 0.00 179.25 179.69 1ptw h ALA 193 N 0.94 0.35 -0.02 0.00 0.00 -0.15 -0.04 119.26 120.34 1ptw h ALA 193 Ca 0.15 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ptw h ALA 193 Cb 0.64 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1ptw h ALA 193 CO 0.04 -0.03 0.00 0.82 0.00 0.00 0.00 179.25 180.08 1ptw h ILE 194 N 0.28 1.24 -0.48 0.00 2.04 -1.19 -2.00 117.51 117.40 1ptw h ILE 194 Ca 0.09 -0.73 0.02 0.00 1.00 0.00 0.00 64.86 65.24 1ptw h ILE 194 Cb 0.21 1.69 -0.03 0.00 -0.74 0.00 0.00 36.82 37.95 1ptw h ILE 194 CO -0.00 0.19 0.29 0.15 0.00 0.00 0.00 178.15 178.78 1ptw h PHE 195 N -0.25 0.54 -0.89 1.37 3.57 -0.78 -1.33 116.94 119.16 1ptw h PHE 195 Ca 0.01 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.56 1ptw h PHE 195 Cb 0.31 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 38.83 1ptw h PHE 195 CO 0.03 0.31 0.57 0.00 -2.23 0.00 0.00 178.31 176.99 1ptw h ALA 196 N 1.22 1.19 -0.50 2.41 0.00 -0.98 -1.99 119.26 120.60 1ptw h ALA 196 Ca 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1ptw h ALA 196 Cb 0.02 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1ptw h ALA 196 CO -0.09 0.41 0.33 0.77 0.00 0.00 0.00 179.25 180.68 1ptw h SER 197 N 1.10 0.58 -0.49 0.00 0.02 -0.56 0.54 113.55 114.75 1ptw h SER 197 Ca 0.36 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.27 1ptw h SER 197 Cb 0.03 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.40 1ptw h SER 197 CO -0.13 0.42 0.22 0.00 -1.14 0.00 0.00 176.83 176.20 1ptw h ALA 198 N 1.18 1.40 -0.01 3.77 0.00 -0.55 -3.11 119.26 121.95 1ptw h ALA 198 Ca 0.18 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1ptw h ALA 198 Cb -0.08 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.49 1ptw h ALA 198 CO -0.04 0.46 -0.55 0.44 0.00 0.00 0.00 179.25 179.56 1ptw n ILE 199 N -4.35 0.00 -0.35 0.00 -5.35 -0.94 -4.71 119.36 103.66 1ptw n ILE 199 Ca 0.04 -0.23 0.34 0.00 -0.27 0.00 0.00 62.75 62.63 1ptw n ILE 199 Cb 0.15 1.19 0.69 0.00 -1.74 0.00 0.00 39.64 39.93 1ptw n ILE 199 CO 0.00 0.00 0.00 1.12 -1.76 0.00 0.00 176.55 175.91 1ptw h HIS 200 N 1.78 0.19 0.00 4.28 2.07 -0.81 -2.25 115.15 120.41 1ptw h HIS 200 Ca 0.00 0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.53 1ptw h HIS 200 Cb 0.65 -0.05 0.00 0.00 2.57 0.00 0.00 27.41 30.58 1ptw h HIS 200 CO 0.00 -0.00 -0.04 -0.25 -3.07 0.00 0.00 177.93 174.57 1ptw n ASP 201 N -4.31 1.65 -4.66 3.10 8.00 -1.26 -4.82 116.55 114.24 1ptw n ASP 201 Ca 0.27 -2.12 -0.45 0.00 0.71 0.00 0.00 54.79 53.21 1ptw n ASP 201 Cb 1.22 -0.12 -0.02 0.00 -0.02 0.00 0.00 41.12 42.18 1ptw n ASP 201 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 1ptw n VAL 202 N -0.63 1.22 -2.64 2.53 3.14 -0.85 -2.12 118.33 118.99 1ptw n VAL 202 Ca 0.04 -0.31 -0.15 0.00 -2.96 0.00 0.00 64.34 60.97 1ptw n VAL 202 Cb 0.42 -1.42 0.02 0.00 -1.06 0.00 0.00 33.84 31.79 1ptw n VAL 202 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1ptw n ASP 203 N 1.81 -4.55 -4.71 6.55 2.03 -0.53 -4.33 116.55 112.82 1ptw n ASP 203 Ca 0.10 -0.15 -0.42 0.00 0.52 0.00 0.00 54.79 54.85 1ptw n ASP 203 Cb 0.32 -3.50 -0.03 0.00 -0.72 0.00 0.00 41.12 37.19 1ptw n ASP 203 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 1ptw s HIS 204 N -2.90 3.16 -1.84 -0.67 2.46 -0.90 -4.91 115.29 109.68 1ptw s HIS 204 Ca 0.15 0.99 0.31 0.00 0.47 0.00 0.00 55.06 56.98 1ptw s HIS 204 Cb -0.07 -3.61 1.76 0.00 -0.13 0.00 0.00 32.58 30.54 1ptw s HIS 204 CO 0.19 -2.12 2.15 -0.35 -2.47 0.00 0.00 174.74 172.13 1ptw n PRO 205 N 4.45 0.82 -0.12 2.88 -0.04 -1.26 -4.60 135.00 137.13 1ptw n PRO 205 Ca 0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 1ptw n PRO 205 Cb 0.44 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.40 1ptw n PRO 205 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ptw n GLY 206 N 1.03 0.76 3.45 0.55 0.00 -1.26 -5.05 105.19 104.67 1ptw n GLY 206 Ca 0.21 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.01 1ptw n GLY 206 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ptw s VAL 207 N -2.40 1.77 0.83 1.61 -7.23 -1.26 -4.80 120.40 108.92 1ptw s VAL 207 Ca 0.00 -2.15 -0.11 0.00 -1.81 0.00 0.00 61.98 57.91 1ptw s VAL 207 Cb 0.00 -2.49 0.12 0.00 0.56 0.00 0.00 36.38 34.57 1ptw s VAL 207 CO 0.00 -0.28 1.17 -0.94 -0.31 0.00 0.00 175.10 174.74 1ptw s SER 208 N -3.48 4.12 0.12 4.85 1.04 -1.26 -4.92 113.70 114.17 1ptw s SER 208 Ca 0.30 0.45 -0.20 0.00 0.48 0.00 0.00 55.95 56.99 1ptw s SER 208 Cb 0.03 -0.83 -0.06 0.00 0.10 0.00 0.00 66.02 65.26 1ptw s SER 208 CO 0.13 -2.10 1.75 0.78 0.98 0.00 0.00 173.24 174.78 1ptw h ASN 209 N -1.10 0.09 -0.86 7.02 2.35 -2.01 -2.33 115.58 118.74 1ptw h ASN 209 Ca -0.44 0.01 0.13 0.00 -0.55 0.00 0.00 56.30 55.45 1ptw h ASN 209 Cb 1.29 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 39.58 1ptw h ASN 209 CO 0.54 0.08 0.48 -0.61 -1.65 0.00 0.00 177.43 176.26 1ptw h GLN 210 N 0.16 0.71 -0.32 0.81 5.75 -1.98 -0.48 115.11 119.77 1ptw h GLN 210 Ca 0.07 -0.04 -0.02 0.00 -0.15 0.00 0.00 58.65 58.52 1ptw h GLN 210 Cb 0.04 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.41 1ptw h GLN 210 CO -0.07 0.47 0.13 0.35 -2.65 0.00 0.00 178.83 177.06 1ptw h PHE 211 N 0.73 0.47 -0.30 3.99 3.04 -1.81 0.02 116.94 123.08 1ptw h PHE 211 Ca 0.45 -0.03 -0.04 0.00 3.98 0.00 0.00 57.97 62.33 1ptw h PHE 211 Cb 0.55 -0.14 -0.02 0.00 2.56 0.00 0.00 35.95 38.90 1ptw h PHE 211 CO -0.07 0.45 0.01 -0.07 -2.02 0.00 0.00 178.31 176.61 1ptw h LEU 212 N 0.36 0.42 0.20 0.59 3.38 -0.81 -1.88 115.31 117.57 1ptw h LEU 212 Ca 0.11 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1ptw h LEU 212 Cb 0.17 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1ptw h LEU 212 CO -0.01 0.48 -0.09 0.40 0.09 0.00 0.00 178.44 179.30 1ptw h ILE 213 N 0.44 0.87 0.00 1.22 2.04 -0.74 -1.13 117.51 120.21 1ptw h ILE 213 Ca 0.10 -0.90 -0.00 0.00 1.00 0.00 0.00 64.86 65.06 1ptw h ILE 213 Cb 0.27 1.36 -0.00 0.00 -0.74 0.00 0.00 36.82 37.71 1ptw h ILE 213 CO 0.01 0.19 -0.00 0.78 0.00 0.00 0.00 178.15 179.12 1ptw h ASN 214 N -0.75 0.00 0.24 1.72 2.35 -0.90 -2.15 115.58 116.08 1ptw h ASN 214 Ca -0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1ptw h ASN 214 Cb 0.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.88 1ptw h ASN 214 CO 0.04 0.00 -0.47 0.35 -1.65 0.00 0.00 177.43 175.70 1ptw n THR 215 N -3.09 0.00 -2.83 2.81 -2.24 -0.72 -4.97 114.28 103.24 1ptw n THR 215 Ca -0.01 -0.09 -0.12 0.00 -2.27 0.00 0.00 64.05 61.56 1ptw n THR 215 Cb 0.21 0.58 0.03 0.00 -2.10 0.00 0.00 70.33 69.05 1ptw n THR 215 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1ptw n ASN 216 N -0.92 -4.11 -4.74 3.42 3.02 -0.81 -4.99 115.26 106.14 1ptw n ASN 216 Ca 0.09 -0.21 -0.36 0.00 -0.03 0.00 0.00 54.58 54.07 1ptw n ASN 216 Cb 0.36 -2.86 0.06 0.00 -0.61 0.00 0.00 39.78 36.73 1ptw n ASN 216 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1ptw s SER 217 N -2.98 4.73 0.37 6.41 1.04 -0.45 -4.88 113.70 117.94 1ptw s SER 217 Ca 0.22 2.46 0.06 0.00 0.48 0.00 0.00 55.95 59.18 1ptw s SER 217 Cb -0.10 -2.60 0.73 0.00 0.10 0.00 0.00 66.02 64.15 1ptw s SER 217 CO 0.27 -1.91 1.94 1.05 0.98 0.00 0.00 173.24 175.57 1ptw h GLU 218 N 0.46 0.45 -0.45 4.02 4.11 -1.94 -2.27 114.58 118.96 1ptw h GLU 218 Ca -0.50 -0.08 0.06 0.00 0.07 0.00 0.00 59.36 58.91 1ptw h GLU 218 Cb 1.31 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 30.43 1ptw h GLU 218 CO 0.53 0.45 0.16 1.25 0.07 0.00 0.00 179.01 181.47 1ptw h LEU 219 N 0.45 0.16 -0.75 3.06 5.85 -1.93 0.18 115.31 122.32 1ptw h LEU 219 Ca 0.10 0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.82 1ptw h LEU 219 Cb 0.22 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 1ptw h LEU 219 CO 0.00 0.12 0.22 0.00 -0.34 0.00 0.00 178.44 178.45 1ptw h ALA 220 N 1.30 0.98 -0.47 1.25 0.00 -1.69 -1.95 119.26 118.69 1ptw h ALA 220 Ca 0.21 -0.23 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 1ptw h ALA 220 Cb 0.21 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1ptw h ALA 220 CO -0.22 0.67 -0.24 -0.07 0.00 0.00 0.00 179.25 179.39 1ptw h LEU 221 N 1.12 1.02 -0.37 0.00 3.38 -0.99 0.48 115.31 119.94 1ptw h LEU 221 Ca 0.24 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 1ptw h LEU 221 Cb 0.32 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1ptw h LEU 221 CO -0.01 1.20 0.23 -0.03 0.09 0.00 0.00 178.44 179.92 1ptw h MET 222 N 0.83 0.50 -0.72 1.13 4.05 -0.47 -2.68 114.93 117.58 1ptw h MET 222 Ca 0.10 -0.04 -0.05 0.00 -0.28 0.00 0.00 59.70 59.42 1ptw h MET 222 Cb 0.82 -0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 31.49 1ptw h MET 222 CO 0.07 0.37 0.07 0.66 0.23 0.00 0.00 176.91 178.31 1ptw n TYR 223 N -4.80 1.75 -4.26 1.39 4.01 -0.75 -4.94 117.16 109.57 1ptw n TYR 223 Ca -0.00 -0.70 -0.30 0.00 -0.16 0.00 0.00 57.90 56.73 1ptw n TYR 223 Cb 0.05 -0.48 -0.08 0.00 -0.31 0.00 0.00 39.34 38.52 1ptw n TYR 223 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1ptw n ASN 224 N 0.32 0.56 -0.89 7.72 3.02 -0.14 -1.05 115.26 124.81 1ptw n ASN 224 Ca 0.25 -1.22 -0.08 0.00 -0.03 0.00 0.00 54.58 53.50 1ptw n ASN 224 Cb 1.06 -1.89 -0.04 0.00 -0.61 0.00 0.00 39.78 38.30 1ptw n ASN 224 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1ptw n ASP 225 N -2.89 -3.42 -4.33 6.41 8.00 0.15 -4.94 116.55 115.53 1ptw n ASP 225 Ca -0.31 0.20 -0.35 0.00 0.71 0.00 0.00 54.79 55.05 1ptw n ASP 225 Cb 0.69 -2.84 -0.14 0.00 -0.02 0.00 0.00 41.12 38.80 1ptw n ASP 225 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1ptw s SER 226 N -1.77 4.32 -1.70 -2.24 0.01 -0.21 -4.62 113.70 107.49 1ptw s SER 226 Ca 0.00 -0.37 -0.14 0.00 1.31 0.00 0.00 55.95 56.75 1ptw s SER 226 Cb 0.00 -1.73 0.13 0.00 0.21 0.00 0.00 66.02 64.63 1ptw s SER 226 CO 0.00 0.00 0.48 -1.20 0.41 0.00 0.00 173.24 172.94 1ptw n SER 227 N 4.63 -1.36 -0.12 2.44 7.64 -1.26 -4.81 113.62 120.77 1ptw n SER 227 Ca -0.18 -1.17 -0.06 0.00 1.01 0.00 0.00 58.87 58.48 1ptw n SER 227 Cb 0.51 -2.07 -0.05 0.00 -1.01 0.00 0.00 64.21 61.59 1ptw n SER 227 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1ptw h VAL 228 N -1.37 0.00 -0.42 0.44 2.07 -1.86 0.66 116.25 115.77 1ptw h VAL 228 Ca -0.62 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 66.90 1ptw h VAL 228 Cb 1.39 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 1ptw h VAL 228 CO 0.79 0.00 0.26 -0.07 0.02 0.00 0.00 177.57 178.57 1ptw h LEU 229 N -0.10 0.50 -1.03 2.57 3.38 -1.94 -1.69 115.31 117.00 1ptw h LEU 229 Ca 0.05 -0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.01 1ptw h LEU 229 Cb 0.23 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 1ptw h LEU 229 CO -0.34 0.39 0.65 -0.33 0.09 0.00 0.00 178.44 178.91 1ptw h GLU 230 N 0.56 1.25 -0.58 1.13 3.07 -1.82 0.14 114.58 118.33 1ptw h GLU 230 Ca 0.15 -0.07 -0.10 0.00 -0.50 0.00 0.00 59.36 58.84 1ptw h GLU 230 Cb -0.02 -0.28 -0.02 0.00 -0.84 0.00 0.00 28.75 27.59 1ptw h GLU 230 CO -0.03 0.82 -0.04 -0.91 -1.40 0.00 0.00 179.01 177.46 1ptw h ASN 231 N 1.28 1.03 -0.43 1.42 2.35 -0.61 -2.56 115.58 118.06 1ptw h ASN 231 Ca 0.38 -0.31 -0.10 0.00 -0.55 0.00 0.00 56.30 55.73 1ptw h ASN 231 Cb -0.05 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.03 1ptw h ASN 231 CO -0.11 1.10 -0.13 -0.74 -1.65 0.00 0.00 177.43 175.90 1ptw h HIS 232 N 0.94 0.95 -0.31 1.19 2.76 -0.32 -0.56 115.15 119.80 1ptw h HIS 232 Ca 0.16 -0.21 0.02 0.00 -2.20 0.00 0.00 60.37 58.14 1ptw h HIS 232 Cb 0.60 -0.23 -0.03 0.00 1.55 0.00 0.00 27.41 29.30 1ptw h HIS 232 CO 0.04 0.96 0.14 0.45 -1.30 0.00 0.00 177.93 178.22 1ptw h HIS 233 N 0.66 0.26 0.14 5.26 3.86 -0.69 -0.09 115.15 124.55 1ptw h HIS 233 Ca 0.10 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.32 1ptw h HIS 233 Cb 0.67 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 29.07 1ptw h HIS 233 CO 0.05 0.13 -0.07 -0.07 0.86 0.00 0.00 177.93 178.84 1ptw h LEU 234 N 0.30 -0.16 -0.57 2.43 3.38 -1.32 0.74 115.31 120.11 1ptw h LEU 234 Ca 0.13 -0.04 0.10 0.00 0.09 0.00 0.00 57.88 58.16 1ptw h LEU 234 Cb 0.06 0.04 -0.08 0.00 0.09 0.00 0.00 40.66 40.77 1ptw h LEU 234 CO -0.10 -0.06 0.13 0.00 0.09 0.00 0.00 178.44 178.50 1ptw h ALA 235 N 0.61 0.67 -0.50 1.53 0.00 -0.74 -1.72 119.26 119.12 1ptw h ALA 235 Ca -0.02 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 1ptw h ALA 235 Cb 0.19 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1ptw h ALA 235 CO 0.03 -0.29 -0.05 0.28 0.00 0.00 0.00 179.25 179.22 1ptw h VAL 236 N 0.27 1.27 -0.51 0.00 2.07 -0.87 -0.68 116.25 117.80 1ptw h VAL 236 Ca 0.29 -1.17 0.02 0.00 0.82 0.00 0.00 66.70 66.66 1ptw h VAL 236 Cb 0.41 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 1ptw h VAL 236 CO -0.36 0.41 0.32 1.23 0.02 0.00 0.00 177.57 179.18 1ptw h GLY 237 N 0.78 0.72 0.84 2.17 0.00 -0.03 -1.66 103.07 105.89 1ptw h GLY 237 Ca 0.14 -0.24 -0.13 0.00 0.00 0.00 0.00 47.33 47.09 1ptw h GLY 237 CO 0.04 0.22 -0.45 0.74 0.00 0.00 0.00 176.54 177.08 1ptw h PHE 238 N 0.64 0.66 -0.92 5.60 0.04 -1.34 -3.26 116.94 118.36 1ptw h PHE 238 Ca 0.20 -0.28 0.17 0.00 2.80 0.00 0.00 57.97 60.86 1ptw h PHE 238 Cb -0.01 -0.10 -0.08 0.00 2.20 0.00 0.00 35.95 37.96 1ptw h PHE 238 CO -0.06 1.05 0.59 -0.22 -0.60 0.00 0.00 178.31 179.08 1ptw h LYS 239 N 0.08 0.59 0.00 1.51 1.63 -0.95 -0.87 116.57 118.56 1ptw h LYS 239 Ca -0.03 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1ptw h LYS 239 Cb 1.10 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 32.59 1ptw h LYS 239 CO 0.09 0.39 0.00 -0.07 -3.45 0.00 0.00 179.45 176.42 1ptw h LEU 240 N 0.61 0.00 -2.01 5.20 3.38 -1.34 -2.42 115.31 118.73 1ptw h LEU 240 Ca 0.48 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.44 1ptw h LEU 240 Cb 0.91 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.66 1ptw h LEU 240 CO -0.23 0.00 -0.06 -0.07 0.09 0.00 0.00 178.44 178.17 1ptw h LEU 241 N 0.00 0.00 -0.04 1.67 3.38 -1.29 -2.73 115.31 116.30 1ptw h LEU 241 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ptw h LEU 241 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1ptw h LEU 241 CO 0.00 0.06 -0.06 0.00 0.09 0.00 0.00 178.44 178.54 1ptw n GLN 242 N -3.35 0.31 -1.65 1.13 6.02 -0.91 -1.70 117.38 117.23 1ptw n GLN 242 Ca -0.01 -0.04 -0.30 0.00 -0.01 0.00 0.00 57.00 56.63 1ptw n GLN 242 Cb 0.23 -1.50 0.08 0.00 1.02 0.00 0.00 30.24 30.06 1ptw n GLN 242 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1ptw s GLU 243 N -2.72 2.36 -0.03 -1.09 2.02 -1.03 -4.88 118.70 113.33 1ptw s GLU 243 Ca 0.23 0.61 -0.39 0.00 0.02 0.00 0.00 54.97 55.44 1ptw s GLU 243 Cb 0.20 -1.95 -0.18 0.00 0.10 0.00 0.00 34.13 32.30 1ptw s GLU 243 CO 0.50 -1.42 1.36 -1.91 0.02 0.00 0.00 175.26 173.81 1ptw n GLU 244 N -3.29 0.80 -4.13 1.61 4.07 -1.26 -0.96 120.64 117.49 1ptw n GLU 244 Ca 0.07 0.29 -0.33 0.00 -0.06 0.00 0.00 57.16 57.13 1ptw n GLU 244 Cb 0.56 -1.90 -0.02 0.00 -0.06 0.00 0.00 31.44 30.03 1ptw n GLU 244 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 1ptw n ASN 245 N 2.84 -2.85 -0.13 4.31 4.05 -1.26 -4.88 115.26 117.35 1ptw n ASN 245 Ca 0.21 -0.98 0.02 0.00 0.45 0.00 0.00 54.58 54.28 1ptw n ASN 245 Cb 0.14 -2.96 0.00 0.00 1.23 0.00 0.00 39.78 38.19 1ptw n ASN 245 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1ptw s ASP 247 N -0.84 6.68 0.10 0.00 2.15 -0.69 -4.55 116.67 119.52 1ptw s ASP 247 Ca 0.04 -2.01 0.14 0.00 0.43 0.00 0.00 52.55 51.15 1ptw s ASP 247 Cb 0.04 -2.53 0.62 0.00 -0.30 0.00 0.00 42.92 40.75 1ptw s ASP 247 CO 0.12 -1.26 1.43 2.30 -0.17 0.00 0.00 175.17 177.59 1ptw n ILE 248 N 6.28 1.22 -0.47 4.11 -5.35 -1.26 -1.66 119.36 122.23 1ptw n ILE 248 Ca 0.37 0.37 0.09 0.00 -0.27 0.00 0.00 62.75 63.30 1ptw n ILE 248 Cb 0.48 -1.26 0.28 0.00 -1.74 0.00 0.00 39.64 37.40 1ptw n ILE 248 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1ptw n PHE 249 N -1.76 0.98 -0.22 4.28 3.72 -1.26 -4.67 117.46 118.54 1ptw n PHE 249 Ca 0.02 -0.58 0.21 0.00 -0.05 0.00 0.00 57.45 57.05 1ptw n PHE 249 Cb 0.12 -0.13 0.57 0.00 -0.94 0.00 0.00 39.48 39.11 1ptw n PHE 249 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1ptw h GLN 250 N 3.23 0.28 -0.17 -1.08 3.07 -1.68 -1.49 115.11 117.26 1ptw h GLN 250 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 58.65 58.72 1ptw h GLN 250 Cb 1.12 -0.06 0.00 0.00 0.08 0.00 0.00 27.48 28.61 1ptw h GLN 250 CO 0.10 0.19 0.00 0.09 0.09 0.00 0.00 178.83 179.30 1ptw n ASN 251 N -4.45 2.18 -4.79 0.06 3.02 -1.26 -4.90 115.26 105.12 1ptw n ASN 251 Ca 0.19 -1.77 -0.38 0.00 -0.03 0.00 0.00 54.58 52.60 1ptw n ASN 251 Cb 0.76 -0.10 -0.06 0.00 -0.61 0.00 0.00 39.78 39.76 1ptw n ASN 251 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ptw s LEU 252 N -1.68 4.43 0.87 3.41 1.02 -0.56 -4.95 118.68 121.22 1ptw s LEU 252 Ca 0.34 1.67 -0.11 0.00 0.02 0.00 0.00 54.13 56.05 1ptw s LEU 252 Cb 0.20 -3.67 0.12 0.00 0.02 0.00 0.00 46.19 42.85 1ptw s LEU 252 CO 0.29 0.05 1.09 0.42 0.02 0.00 0.00 176.35 178.23 1ptw s THR 253 N -1.43 2.77 0.41 5.49 -4.23 -1.26 -4.75 115.64 112.64 1ptw s THR 253 Ca 0.44 0.25 0.12 0.00 -1.18 0.00 0.00 61.69 61.31 1ptw s THR 253 Cb -0.20 -2.68 0.32 0.00 1.34 0.00 0.00 72.50 71.29 1ptw s THR 253 CO 0.24 -0.33 1.96 0.50 -0.54 0.00 0.00 174.62 176.45 1ptw h LYS 254 N -1.50 0.50 -0.01 3.99 1.63 -1.98 -1.05 116.57 118.15 1ptw h LYS 254 Ca -0.48 -0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 59.29 1ptw h LYS 254 Cb 1.27 -0.11 -0.00 0.00 -0.60 0.00 0.00 32.23 32.79 1ptw h LYS 254 CO 0.52 0.33 0.00 0.87 -3.45 0.00 0.00 179.45 177.72 1ptw h LYS 255 N 0.52 0.01 -0.95 1.90 1.57 -1.99 0.13 116.57 117.75 1ptw h LYS 255 Ca 0.31 -0.00 0.05 0.00 -1.87 0.00 0.00 60.65 59.13 1ptw h LYS 255 Cb 0.52 -0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.77 1ptw h LYS 255 CO -0.10 0.28 0.61 1.96 -0.57 0.00 0.00 179.45 181.64 1ptw h GLN 256 N -0.27 1.12 -0.42 3.15 4.20 -1.74 -1.64 115.11 119.50 1ptw h GLN 256 Ca 0.00 -0.07 -0.14 0.00 0.06 0.00 0.00 58.65 58.50 1ptw h GLN 256 Cb 0.28 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 1ptw h GLN 256 CO 0.00 0.74 -0.29 0.00 -0.67 0.00 0.00 178.83 178.61 1ptw h ARG 257 N 1.15 0.94 -0.31 1.46 3.08 -1.04 0.36 114.38 120.03 1ptw h ARG 257 Ca 0.40 -0.45 -0.10 0.00 0.07 0.00 0.00 59.98 59.89 1ptw h ARG 257 Cb 0.09 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1ptw h ARG 257 CO -0.15 1.11 -0.24 1.96 -1.07 0.00 0.00 179.97 181.58 1ptw h GLN 258 N 0.78 0.59 0.06 0.04 4.20 -0.67 -0.34 115.11 119.77 1ptw h GLN 258 Ca 0.08 -0.23 -0.00 0.00 0.06 0.00 0.00 58.65 58.56 1ptw h GLN 258 Cb 0.87 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.62 1ptw h GLN 258 CO 0.08 0.79 -0.03 1.03 -0.67 0.00 0.00 178.83 180.03 1ptw h SER 259 N 0.52 -0.07 -0.29 1.46 0.87 -1.18 -2.42 113.55 112.44 1ptw h SER 259 Ca 0.08 -0.48 0.07 0.00 -1.23 0.00 0.00 61.79 60.22 1ptw h SER 259 Cb 0.69 0.02 -0.07 0.00 -0.44 0.00 0.00 62.40 62.60 1ptw h SER 259 CO 0.05 0.47 -0.22 0.25 -0.53 0.00 0.00 176.83 176.85 1ptw h LEU 260 N -0.64 -0.72 -0.97 2.23 5.85 -0.89 -1.99 115.31 118.18 1ptw h LEU 260 Ca -0.01 0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.90 1ptw h LEU 260 Cb 0.55 0.36 -0.06 0.00 0.37 0.00 0.00 40.66 41.87 1ptw h LEU 260 CO 0.01 -0.26 0.63 -0.09 -0.34 0.00 0.00 178.44 178.40 1ptw h ARG 261 N -0.20 1.17 -0.33 1.25 2.43 -1.09 -0.30 114.38 117.30 1ptw h ARG 261 Ca 0.15 -0.07 -0.09 0.00 -0.81 0.00 0.00 59.98 59.16 1ptw h ARG 261 Cb 0.44 -0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 1ptw h ARG 261 CO -0.41 0.77 -0.15 -0.22 -1.51 0.00 0.00 179.97 178.46 1ptw h LYS 262 N 1.21 0.68 -0.38 0.20 3.64 -0.96 -1.85 116.57 119.11 1ptw h LYS 262 Ca 0.40 -0.29 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1ptw h LYS 262 Cb 0.05 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 1ptw h LYS 262 CO -0.14 0.89 0.14 0.52 -2.27 0.00 0.00 179.45 178.59 1ptw h MET 263 N 0.46 0.57 -0.97 1.90 2.86 -1.03 -0.15 114.93 118.57 1ptw h MET 263 Ca 0.08 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1ptw h MET 263 Cb 0.68 -0.09 -0.05 0.00 0.06 0.00 0.00 31.60 32.20 1ptw h MET 263 CO 0.05 0.55 0.61 0.28 1.06 0.00 0.00 176.91 179.46 1ptw h VAL 264 N 0.46 1.26 -0.38 -2.22 2.07 -1.03 0.22 116.25 116.63 1ptw h VAL 264 Ca 0.12 -0.52 -0.09 0.00 0.82 0.00 0.00 66.70 67.04 1ptw h VAL 264 Cb 0.20 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 29.82 1ptw h VAL 264 CO -0.01 0.26 -0.10 0.40 0.02 0.00 0.00 177.57 178.14 1ptw h ILE 265 N 1.33 1.28 -0.48 4.57 2.04 -1.05 -1.87 117.51 123.33 1ptw h ILE 265 Ca 0.35 -1.18 -0.03 0.00 1.00 0.00 0.00 64.86 65.00 1ptw h ILE 265 Cb -0.10 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 1ptw h ILE 265 CO -0.07 0.39 0.16 0.44 0.00 0.00 0.00 178.15 179.07 1ptw h ASP 266 N 0.53 0.63 0.02 1.72 3.45 -0.47 -2.06 116.42 120.23 1ptw h ASP 266 Ca 0.09 -0.08 -0.00 0.00 0.43 0.00 0.00 57.03 57.47 1ptw h ASP 266 Cb 0.62 -0.16 0.00 0.00 -0.56 0.00 0.00 39.33 39.22 1ptw h ASP 266 CO 0.04 0.60 -0.01 0.40 -1.57 0.00 0.00 179.24 178.70 1ptw h ILE 267 N 0.68 1.45 -0.35 0.35 2.04 -0.82 -2.98 117.51 117.88 1ptw h ILE 267 Ca 0.16 -1.51 -0.07 0.00 1.00 0.00 0.00 64.86 64.44 1ptw h ILE 267 Cb 0.19 2.46 -0.02 0.00 -0.74 0.00 0.00 36.82 38.70 1ptw h ILE 267 CO -0.01 0.38 -0.08 0.58 0.00 0.00 0.00 178.15 179.02 1ptw h VAL 268 N -0.68 1.23 0.00 1.67 2.07 -1.32 -2.11 116.25 117.11 1ptw h VAL 268 Ca -0.00 -1.00 -0.07 0.00 0.82 0.00 0.00 66.70 66.45 1ptw h VAL 268 Cb 0.65 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 1ptw h VAL 268 CO 0.00 0.34 -0.34 -0.07 0.02 0.00 0.00 177.57 177.52 1ptw h LEU 269 N 0.55 0.00 0.00 2.57 3.38 -1.46 -1.61 115.31 118.74 1ptw h LEU 269 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1ptw h LEU 269 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1ptw h LEU 269 CO 0.03 0.34 0.00 0.00 0.09 0.00 0.00 178.44 178.90 1ptw n ALA 270 N -2.46 2.20 0.72 1.53 0.00 -0.80 -2.44 120.51 119.26 1ptw n ALA 270 Ca -0.02 -0.12 0.12 0.00 0.00 0.00 0.00 53.44 53.43 1ptw n ALA 270 Cb 0.39 -1.33 0.28 0.00 0.00 0.00 0.00 19.45 18.79 1ptw n ALA 270 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ptw n THR 271 N -1.06 0.29 -1.87 0.00 -2.24 -0.61 -4.81 114.28 103.98 1ptw n THR 271 Ca 0.14 -0.19 -0.42 0.00 -2.27 0.00 0.00 64.05 61.31 1ptw n THR 271 Cb 0.09 -0.18 -0.03 0.00 -2.10 0.00 0.00 70.33 68.11 1ptw n THR 271 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ptw s ASP 272 N -3.90 6.53 0.47 3.42 -1.08 -1.02 -4.88 116.67 116.21 1ptw s ASP 272 Ca 0.09 2.68 0.19 0.00 -0.52 0.00 0.00 52.55 54.99 1ptw s ASP 272 Cb 0.15 -2.59 1.17 0.00 -1.46 0.00 0.00 42.92 40.18 1ptw s ASP 272 CO 0.67 -0.87 2.03 0.24 0.52 0.00 0.00 175.17 177.76 1ptw h MET 273 N 6.93 0.00 0.00 4.34 2.86 -1.91 -2.28 114.93 124.88 1ptw h MET 273 Ca -0.43 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.21 1ptw h MET 273 Cb 1.20 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.86 1ptw h MET 273 CO 0.93 0.16 0.00 0.66 1.06 0.00 0.00 176.91 179.71 1ptw h SER 274 N 0.00 0.00 0.02 1.22 4.64 -1.96 0.24 113.55 117.70 1ptw h SER 274 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ptw h SER 274 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1ptw h SER 274 CO 0.02 0.00 -0.24 0.29 -0.87 0.00 0.00 176.83 176.03 1ptw n LYS 275 N -2.44 1.56 0.11 4.77 4.76 -0.86 -4.62 118.16 121.44 1ptw n LYS 275 Ca -0.01 -1.21 -0.16 0.00 -2.87 0.00 0.00 58.31 54.06 1ptw n LYS 275 Cb 0.12 -1.47 -0.10 0.00 -1.84 0.00 0.00 35.03 31.74 1ptw n LYS 275 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1ptw h HIS 276 N 2.96 -1.49 -0.11 2.13 2.76 -0.60 -1.92 115.15 118.88 1ptw h HIS 276 Ca 0.00 0.04 0.04 0.00 -2.20 0.00 0.00 60.37 58.25 1ptw h HIS 276 Cb 0.77 0.63 -0.06 0.00 1.55 0.00 0.00 27.41 30.30 1ptw h HIS 276 CO 0.00 -0.59 -0.37 0.52 -1.30 0.00 0.00 177.93 176.19 1ptw h MET 277 N -0.75 -0.44 -1.00 5.26 2.86 -1.82 -1.07 114.93 117.97 1ptw h MET 277 Ca -0.00 0.03 0.07 0.00 -2.06 0.00 0.00 59.70 57.74 1ptw h MET 277 Cb 0.76 0.10 -0.07 0.00 0.06 0.00 0.00 31.60 32.45 1ptw h MET 277 CO -0.28 -0.29 0.65 -0.91 1.06 0.00 0.00 176.91 177.13 1ptw h ASN 278 N -0.46 1.03 -0.05 1.22 2.35 -1.86 0.11 115.58 117.93 1ptw h ASN 278 Ca 0.08 0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1ptw h ASN 278 Cb 0.59 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.75 1ptw h ASN 278 CO -0.36 0.65 0.03 -0.07 -1.65 0.00 0.00 177.43 176.03 1ptw h LEU 279 N 1.17 0.06 -0.76 1.61 3.38 -0.74 -1.80 115.31 118.23 1ptw h LEU 279 Ca 0.44 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.32 1ptw h LEU 279 Cb 0.19 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.88 1ptw h LEU 279 CO -0.18 0.12 0.47 0.25 0.09 0.00 0.00 178.44 179.19 1ptw h LEU 280 N -0.01 0.90 0.06 1.67 5.85 -0.63 -0.95 115.31 122.20 1ptw h LEU 280 Ca 0.02 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.69 1ptw h LEU 280 Cb 0.08 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 1ptw h LEU 280 CO -0.00 0.69 -0.13 0.00 -0.34 0.00 0.00 178.44 178.66 1ptw h ALA 281 N 1.25 -0.20 -0.21 1.25 0.00 -0.60 0.46 119.26 121.22 1ptw h ALA 281 Ca 0.27 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 1ptw h ALA 281 Cb -0.05 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1ptw h ALA 281 CO -0.05 -0.64 -0.03 -0.44 0.00 0.00 0.00 179.25 178.09 1ptw h ASP 282 N -0.25 0.29 -0.37 0.00 3.32 -1.05 0.62 116.42 118.98 1ptw h ASP 282 Ca 0.03 -0.04 -0.10 0.00 0.02 0.00 0.00 57.03 56.94 1ptw h ASP 282 Cb 0.28 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 1ptw h ASP 282 CO -0.09 0.36 -0.15 0.25 -1.72 0.00 0.00 179.24 177.89 1ptw h LEU 283 N 0.30 0.78 -0.48 1.55 5.85 -0.58 0.11 115.31 122.84 1ptw h LEU 283 Ca 0.07 -0.39 -0.06 0.00 0.84 0.00 0.00 57.88 58.34 1ptw h LEU 283 Cb 0.25 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1ptw h LEU 283 CO 0.01 1.00 0.08 0.11 -0.34 0.00 0.00 178.44 179.30 1ptw h LYS 284 N 0.55 0.79 -0.20 1.25 1.57 -0.34 0.13 116.57 120.33 1ptw h LYS 284 Ca 0.09 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 1ptw h LYS 284 Cb 0.69 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 1ptw h LYS 284 CO 0.05 0.80 0.10 1.15 -0.57 0.00 0.00 179.45 180.97 1ptw h THR 285 N 0.67 1.07 -0.04 -0.16 2.02 -0.71 -0.27 112.91 115.50 1ptw h THR 285 Ca 0.15 -0.20 -0.09 0.00 0.77 0.00 0.00 66.41 67.03 1ptw h THR 285 Cb 0.38 0.82 0.01 0.00 -1.74 0.00 0.00 68.15 67.62 1ptw h THR 285 CO 0.01 0.08 -0.34 -0.03 0.37 0.00 0.00 175.52 175.61 1ptw h MET 286 N 0.27 0.29 -0.07 6.66 1.85 0.02 -2.76 114.93 121.20 1ptw h MET 286 Ca 0.07 -0.27 0.02 0.00 -0.61 0.00 0.00 59.70 58.91 1ptw h MET 286 Cb 0.03 0.07 -0.00 0.00 0.43 0.00 0.00 31.60 32.12 1ptw h MET 286 CO -0.01 0.94 0.07 0.28 -0.40 0.00 0.00 176.91 177.79 1ptw h VAL 287 N -0.26 0.52 0.17 -5.77 2.07 0.01 0.69 116.25 113.69 1ptw h VAL 287 Ca -0.03 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 1ptw h VAL 287 Cb 1.03 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1ptw h VAL 287 CO 0.07 0.00 -0.08 -0.33 0.02 0.00 0.00 177.57 177.25 1ptw h GLU 288 N 0.00 -0.22 0.00 1.57 5.08 -1.02 -3.26 114.58 116.73 1ptw h GLU 288 Ca 0.03 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1ptw h GLU 288 Cb 0.18 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1ptw h GLU 288 CO -0.00 -0.15 0.00 0.25 -1.00 0.00 0.00 179.01 178.11 1ptw n THR 289 N -4.29 0.00 -1.70 1.13 -2.24 -1.05 -4.89 114.28 101.24 1ptw n THR 289 Ca -0.03 0.00 -0.58 0.00 -2.27 0.00 0.00 64.05 61.17 1ptw n THR 289 Cb 0.09 -0.20 -0.07 0.00 -2.10 0.00 0.00 70.33 68.05 1ptw n THR 289 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1ptw n LYS 290 N -0.60 1.07 -4.13 -0.78 4.81 0.24 -4.98 118.16 113.79 1ptw n LYS 290 Ca 0.04 0.39 -0.32 0.00 -0.87 0.00 0.00 58.31 57.55 1ptw n LYS 290 Cb 0.02 -2.07 -0.07 0.00 0.02 0.00 0.00 35.03 32.92 1ptw n LYS 290 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 1ptw s LYS 291 N 3.66 2.94 0.00 1.64 2.20 -1.26 -5.05 119.74 123.87 1ptw s LYS 291 Ca 1.00 -0.58 0.00 0.00 -0.36 0.00 0.00 55.97 56.03 1ptw s LYS 291 Cb -1.10 -2.77 0.00 0.00 -1.51 0.00 0.00 37.83 32.45 1ptw s LYS 291 CO 0.67 0.62 0.00 0.28 -0.36 0.00 0.00 175.35 176.55 1ptw n VAL 292 N 1.03 0.00 -4.81 4.02 0.31 -1.26 -2.90 118.33 114.72 1ptw n VAL 292 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 1ptw n VAL 292 Cb 0.52 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.45 1ptw n VAL 292 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1ptw n THR 293 N 0.00 0.00 0.00 2.52 -2.24 -1.02 -4.77 114.28 108.78 1ptw n THR 293 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1ptw n THR 293 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1ptw n THR 293 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1ptw n SER 294 N -2.25 0.00 0.00 3.42 2.88 -1.26 -4.20 113.62 112.20 1ptw n SER 294 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1ptw n SER 294 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1ptw n SER 294 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1ptw n SER 295 N 0.00 0.00 0.00 -3.46 7.64 -1.26 -4.95 113.62 111.59 1ptw n SER 295 Ca 0.00 -0.42 0.00 0.00 1.01 0.00 0.00 58.87 59.46 1ptw n SER 295 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1ptw n SER 295 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ptw n GLY 296 N 0.00 0.69 3.86 0.23 0.00 -1.26 -5.05 105.19 103.66 1ptw n GLY 296 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1ptw n GLY 296 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ptw s VAL 297 N -2.58 4.90 0.55 1.61 1.01 -1.26 -4.41 120.40 120.23 1ptw s VAL 297 Ca 0.00 0.63 -0.19 0.00 0.00 0.00 0.00 61.98 62.42 1ptw s VAL 297 Cb 0.00 -3.67 -0.09 0.00 0.00 0.00 0.00 36.38 32.63 1ptw s VAL 297 CO 0.00 0.08 0.60 -0.11 0.00 0.00 0.00 175.10 175.67 1ptw n LEU 298 N 0.31 1.12 -4.06 3.92 7.94 -0.27 -2.42 117.00 123.54 1ptw n LEU 298 Ca -0.02 0.77 -0.32 0.00 -1.11 0.00 0.00 56.01 55.33 1ptw n LEU 298 Cb 0.52 -1.20 -0.15 0.00 0.53 0.00 0.00 43.42 43.12 1ptw n LEU 298 CO 0.44 -2.84 -0.45 -0.22 -1.11 0.00 0.00 177.39 173.21 1ptw s LEU 299 N 0.46 3.40 -0.28 -1.96 0.20 -1.14 -4.86 118.68 114.50 1ptw s LEU 299 Ca 0.69 -1.40 -0.06 0.00 0.69 0.00 0.00 54.13 54.05 1ptw s LEU 299 Cb -0.46 -1.52 0.01 0.00 -0.43 0.00 0.00 46.19 43.79 1ptw s LEU 299 CO 0.54 -0.20 0.05 -0.76 -0.29 0.00 0.00 176.35 175.69 1ptw s LEU 300 N 1.12 3.65 0.00 -0.68 1.43 -1.26 -4.70 118.68 118.24 1ptw s LEU 300 Ca -0.08 -0.67 0.00 0.00 -1.03 0.00 0.00 54.13 52.35 1ptw s LEU 300 Cb -0.20 -1.84 0.00 0.00 0.03 0.00 0.00 46.19 44.18 1ptw s LEU 300 CO -0.05 -0.16 0.00 -0.67 0.23 0.00 0.00 176.35 175.70 1ptw n ASP 301 N 4.84 0.00 -3.17 2.29 4.64 -1.26 -4.91 116.55 118.98 1ptw n ASP 301 Ca -0.15 0.00 -0.19 0.00 -1.38 0.00 0.00 54.79 53.07 1ptw n ASP 301 Cb 0.48 0.00 0.15 0.00 -1.04 0.00 0.00 41.12 40.71 1ptw n ASP 301 CO 0.00 0.00 0.00 -0.46 -0.82 0.00 0.00 177.20 175.92 1ptw n ASN 302 N 0.00 -1.31 -0.04 1.67 0.23 -1.26 -4.88 115.26 109.67 1ptw n ASN 302 Ca 0.00 -1.00 -0.13 0.00 -0.53 0.00 0.00 54.58 52.92 1ptw n ASN 302 Cb 0.00 -0.63 -0.08 0.00 -2.08 0.00 0.00 39.78 36.99 1ptw n ASN 302 CO 0.00 0.00 0.00 0.22 -0.93 0.00 0.00 177.26 176.55 1ptw h TYR 303 N -2.10 0.25 -1.20 -2.53 3.20 -1.99 -2.95 116.97 109.64 1ptw h TYR 303 Ca -0.26 -0.07 0.35 0.00 3.14 0.00 0.00 58.73 61.89 1ptw h TYR 303 Cb 0.77 -0.05 -0.10 0.00 1.54 0.00 0.00 36.73 38.89 1ptw h TYR 303 CO 0.00 0.60 0.79 0.77 -1.64 0.00 0.00 178.16 178.68 1ptw h SER 304 N -0.17 0.29 0.01 -2.11 0.02 -1.99 0.01 113.55 109.61 1ptw h SER 304 Ca 0.02 0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 1ptw h SER 304 Cb 0.54 0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.13 1ptw h SER 304 CO 0.02 -0.03 -0.07 0.44 -1.14 0.00 0.00 176.83 176.05 1ptw h ASP 305 N 0.21 0.04 -0.26 3.07 5.19 -1.92 -2.92 116.42 119.84 1ptw h ASP 305 Ca 0.68 -0.93 -0.01 0.00 -0.62 0.00 0.00 57.03 56.15 1ptw h ASP 305 Cb 2.09 -0.01 -0.01 0.00 0.18 0.00 0.00 39.33 41.58 1ptw h ASP 305 CO -0.29 0.97 0.11 0.03 -3.12 0.00 0.00 179.24 176.95 1ptw h ARG 306 N -0.88 0.39 -0.08 3.56 3.08 -1.08 -1.81 114.38 117.56 1ptw h ARG 306 Ca -0.01 -0.07 -0.09 0.00 0.07 0.00 0.00 59.98 59.88 1ptw h ARG 306 Cb 0.99 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.97 1ptw h ARG 306 CO 0.01 0.41 -0.37 0.97 -1.07 0.00 0.00 179.97 179.92 1ptw h ILE 307 N 0.28 1.29 -0.32 2.04 6.09 -1.21 -1.84 117.51 123.84 1ptw h ILE 307 Ca 0.09 -1.38 -0.02 0.00 -1.37 0.00 0.00 64.86 62.18 1ptw h ILE 307 Cb 0.16 1.64 -0.01 0.00 0.47 0.00 0.00 36.82 39.08 1ptw h ILE 307 CO -0.01 0.41 0.13 -0.61 -3.07 0.00 0.00 178.15 175.00 1ptw h GLN 308 N 0.14 0.48 -0.12 2.19 4.15 -1.28 0.30 115.11 120.97 1ptw h GLN 308 Ca 0.02 -0.08 -0.01 0.00 0.77 0.00 0.00 58.65 59.35 1ptw h GLN 308 Cb 0.73 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.33 1ptw h GLN 308 CO 0.05 0.47 0.05 0.28 -1.93 0.00 0.00 178.83 177.76 1ptw h VAL 309 N 0.37 1.14 -0.88 2.39 2.07 -1.09 -1.53 116.25 118.72 1ptw h VAL 309 Ca 0.11 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 1ptw h VAL 309 Cb 0.17 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 1ptw h VAL 309 CO -0.01 0.12 0.53 -0.07 0.02 0.00 0.00 177.57 178.16 1ptw h LEU 310 N 0.05 1.06 -0.63 2.57 3.38 -1.16 0.22 115.31 120.80 1ptw h LEU 310 Ca 0.04 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1ptw h LEU 310 Cb 0.15 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 1ptw h LEU 310 CO -0.00 0.82 0.40 1.56 0.09 0.00 0.00 178.44 181.30 1ptw h GLN 311 N 1.21 0.83 -0.06 1.13 4.20 -0.19 -1.64 115.11 120.59 1ptw h GLN 311 Ca 0.32 -0.06 -0.15 0.00 0.06 0.00 0.00 58.65 58.82 1ptw h GLN 311 Cb -0.05 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.54 1ptw h GLN 311 CO -0.06 0.57 -0.61 -0.91 -0.67 0.00 0.00 178.83 177.15 1ptw h ASN 312 N 0.85 0.25 0.18 1.46 2.35 -0.83 -1.74 115.58 118.10 1ptw h ASN 312 Ca 0.23 -0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 1ptw h ASN 312 Cb -0.07 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.23 1ptw h ASN 312 CO -0.05 0.80 -0.09 -0.03 -1.65 0.00 0.00 177.43 176.41 1ptw h MET 313 N 0.16 -0.25 -0.11 0.81 4.05 0.06 0.42 114.93 120.08 1ptw h MET 313 Ca -0.01 0.02 -0.10 0.00 -0.28 0.00 0.00 59.70 59.34 1ptw h MET 313 Cb 1.11 0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.96 1ptw h MET 313 CO 0.09 -0.17 -0.36 0.28 0.23 0.00 0.00 176.91 176.99 1ptw h VAL 314 N -0.26 1.29 -0.39 -5.77 2.07 -1.35 -1.29 116.25 110.55 1ptw h VAL 314 Ca -0.02 -1.38 -0.07 0.00 0.82 0.00 0.00 66.70 66.04 1ptw h VAL 314 Cb 0.20 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 1ptw h VAL 314 CO 0.04 0.41 -0.06 -0.74 0.02 0.00 0.00 177.57 177.24 1ptw h HIS 315 N 0.19 0.70 -0.13 1.57 6.17 -0.75 -0.15 115.15 122.76 1ptw h HIS 315 Ca 0.02 -0.10 -0.17 0.00 0.71 0.00 0.00 60.37 60.83 1ptw h HIS 315 Cb 0.73 -0.19 -0.01 0.00 2.52 0.00 0.00 27.41 30.46 1ptw h HIS 315 CO 0.01 0.70 -0.61 0.00 0.71 0.00 0.00 177.93 178.74 1ptw h ALA 317 N 0.99 0.88 0.00 0.00 0.00 -0.82 -1.22 119.26 119.09 1ptw h ALA 317 Ca -0.01 -0.49 -0.12 0.00 0.00 0.00 0.00 54.91 54.30 1ptw h ALA 317 Cb 1.16 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1ptw h ALA 317 CO 0.11 0.67 -0.56 0.22 0.00 0.00 0.00 179.25 179.70 1ptw h ASP 318 N 0.27 0.00 -0.76 0.00 3.58 -0.93 -3.01 116.42 115.57 1ptw h ASP 318 Ca 0.01 0.00 -0.52 0.00 0.42 0.00 0.00 57.03 56.94 1ptw h ASP 318 Cb 1.00 0.00 -0.32 0.00 1.72 0.00 0.00 39.33 41.73 1ptw h ASP 318 CO 0.09 0.56 -0.13 0.18 -2.88 0.00 0.00 179.24 177.05 1ptw n LEU 319 N -3.82 5.68 0.01 2.28 4.77 -0.87 -4.63 117.00 120.43 1ptw n LEU 319 Ca -0.01 -4.41 0.11 0.00 -0.03 0.00 0.00 56.01 51.66 1ptw n LEU 319 Cb 0.57 -0.60 -0.04 0.00 -2.33 0.00 0.00 43.42 41.02 1ptw n LEU 319 CO 0.41 1.74 -0.10 -1.54 -1.33 0.00 0.00 177.39 176.57 1ptw n SER 320 N -0.86 0.63 -0.19 -1.43 3.41 -0.49 -4.41 113.62 110.28 1ptw n SER 320 Ca 0.48 -0.43 0.12 0.00 -0.26 0.00 0.00 58.87 58.78 1ptw n SER 320 Cb 0.89 1.00 0.44 0.00 -0.26 0.00 0.00 64.21 66.29 1ptw n SER 320 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1ptw h ASN 321 N 0.00 0.51 0.60 4.04 7.08 -1.82 0.12 115.58 126.11 1ptw h ASN 321 Ca 0.00 0.02 0.00 0.00 -3.08 0.00 0.00 56.30 53.24 1ptw h ASN 321 Cb 0.68 -0.08 0.00 0.00 -2.08 0.00 0.00 38.32 36.84 1ptw h ASN 321 CO 0.00 0.28 0.00 -2.65 -2.08 0.00 0.00 177.43 172.98 1ptw n PRO 322 N -4.50 0.07 0.00 4.14 -0.02 -1.26 -2.27 135.00 131.16 1ptw n PRO 322 Ca 0.14 0.30 0.12 0.00 -2.02 0.00 0.00 63.50 62.04 1ptw n PRO 322 Cb 0.44 -1.63 0.08 0.00 -0.02 0.00 0.00 33.50 32.37 1ptw n PRO 322 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1ptw n THR 323 N -1.75 0.00 -2.83 3.45 -2.24 0.39 -4.50 114.28 106.80 1ptw n THR 323 Ca 0.03 -0.44 -0.25 0.00 -2.27 0.00 0.00 64.05 61.12 1ptw n THR 323 Cb 0.20 1.42 0.01 0.00 -2.10 0.00 0.00 70.33 69.85 1ptw n THR 323 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1ptw s LYS 324 N -2.12 3.27 0.27 -0.78 -0.14 -0.96 -4.53 119.74 114.75 1ptw s LYS 324 Ca 0.26 -0.15 -0.28 0.00 -1.36 0.00 0.00 55.97 54.45 1ptw s LYS 324 Cb 0.20 -2.46 -0.15 0.00 -1.68 0.00 0.00 37.83 33.73 1ptw s LYS 324 CO 0.37 -0.25 0.83 -2.30 -0.76 0.00 0.00 175.35 173.24 1ptw n PRO 325 N -2.18 0.90 -0.32 -1.68 -0.02 -1.26 -4.35 135.00 126.09 1ptw n PRO 325 Ca 0.01 0.32 0.18 0.00 -2.02 0.00 0.00 63.50 61.98 1ptw n PRO 325 Cb 0.57 -1.57 0.38 0.00 -0.02 0.00 0.00 33.50 32.85 1ptw n PRO 325 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1ptw h LEU 326 N 1.62 0.17 -1.64 2.45 5.85 -1.94 0.18 115.31 122.00 1ptw h LEU 326 Ca -0.36 0.21 0.02 0.00 0.84 0.00 0.00 57.88 58.59 1ptw h LEU 326 Cb 1.37 0.24 -0.02 0.00 0.37 0.00 0.00 40.66 42.62 1ptw h LEU 326 CO 0.59 -0.18 0.28 -0.61 -0.34 0.00 0.00 178.44 178.17 1ptw h GLN 327 N 0.22 0.46 0.09 1.25 4.15 -2.01 -0.62 115.11 118.65 1ptw h GLN 327 Ca 0.64 -0.03 -0.00 0.00 0.77 0.00 0.00 58.65 60.03 1ptw h GLN 327 Cb 1.40 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.99 1ptw h GLN 327 CO -0.67 0.31 -0.04 -0.07 -1.93 0.00 0.00 178.83 176.43 1ptw h LEU 328 N 0.48 -0.10 -0.66 -2.39 3.38 -0.99 -3.27 115.31 111.76 1ptw h LEU 328 Ca 0.17 -0.41 0.13 0.00 0.09 0.00 0.00 57.88 57.86 1ptw h LEU 328 Cb 0.08 0.03 -0.13 0.00 0.09 0.00 0.00 40.66 40.72 1ptw h LEU 328 CO -0.04 0.55 -0.23 0.22 0.09 0.00 0.00 178.44 179.04 1ptw h TYR 329 N -0.95 -0.55 -0.40 1.13 3.20 -1.02 0.30 116.97 118.69 1ptw h TYR 329 Ca -0.01 0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1ptw h TYR 329 Cb 0.50 0.34 -0.02 0.00 1.54 0.00 0.00 36.73 39.09 1ptw h TYR 329 CO 0.11 -0.33 0.26 0.00 -1.64 0.00 0.00 178.16 176.56 1ptw h ARG 330 N -0.05 0.52 -0.55 1.82 3.08 -1.26 0.27 114.38 118.21 1ptw h ARG 330 Ca 0.30 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 60.24 1ptw h ARG 330 Cb 0.52 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 1ptw h ARG 330 CO -0.71 0.35 0.03 1.96 -1.07 0.00 0.00 179.97 180.53 1ptw h GLN 331 N 0.54 0.92 -0.42 0.04 4.20 -1.01 -0.77 115.11 118.61 1ptw h GLN 331 Ca 0.15 -0.25 -0.11 0.00 0.06 0.00 0.00 58.65 58.49 1ptw h GLN 331 Cb -0.06 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.60 1ptw h GLN 331 CO -0.03 0.89 -0.16 -1.49 -0.67 0.00 0.00 178.83 177.37 1ptw h TRP 332 N 0.86 0.98 -0.16 2.96 -0.00 -0.41 -2.83 115.95 117.34 1ptw h TRP 332 Ca 0.16 -0.23 -0.00 0.00 -0.00 0.00 0.00 58.89 58.82 1ptw h TRP 332 Cb 0.47 -0.23 -0.01 0.00 -0.00 0.00 0.00 29.16 29.39 1ptw h TRP 332 CO 0.03 1.00 0.10 1.15 -0.00 0.00 0.00 178.44 180.71 1ptw h THR 333 N 0.68 1.08 -0.66 1.49 2.02 -0.69 -0.67 112.91 116.16 1ptw h THR 333 Ca 0.10 -0.21 0.10 0.00 0.77 0.00 0.00 66.41 67.17 1ptw h THR 333 Cb 0.72 0.93 -0.08 0.00 -1.74 0.00 0.00 68.15 67.98 1ptw h THR 333 CO 0.05 0.08 0.28 0.44 0.37 0.00 0.00 175.52 176.74 1ptw h ASP 334 N 0.18 0.30 -0.13 4.18 3.32 -1.12 0.14 116.42 123.30 1ptw h ASP 334 Ca 0.06 0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 1ptw h ASP 334 Cb 0.04 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 1ptw h ASP 334 CO -0.01 0.17 0.03 0.03 -1.72 0.00 0.00 179.24 177.74 1ptw h ARG 335 N 0.47 0.20 -0.53 3.56 3.08 -1.22 0.13 114.38 120.08 1ptw h ARG 335 Ca 0.34 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 60.25 1ptw h ARG 335 Cb 0.41 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 1ptw h ARG 335 CO -0.31 0.37 -0.02 0.97 -1.07 0.00 0.00 179.97 179.91 1ptw h ILE 336 N 0.00 1.26 -0.34 2.04 6.09 -0.73 -0.55 117.51 125.29 1ptw h ILE 336 Ca 0.04 -1.13 -0.02 0.00 -1.37 0.00 0.00 64.86 62.39 1ptw h ILE 336 Cb 0.25 0.94 -0.02 0.00 0.47 0.00 0.00 36.82 38.47 1ptw h ILE 336 CO 0.00 0.40 0.15 0.24 -3.07 0.00 0.00 178.15 175.87 1ptw h MET 337 N 0.82 0.50 -0.30 2.19 2.86 -0.69 0.45 114.93 120.76 1ptw h MET 337 Ca 0.15 -0.08 0.05 0.00 -2.06 0.00 0.00 59.70 57.76 1ptw h MET 337 Cb 0.55 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.08 1ptw h MET 337 CO 0.03 0.47 0.02 1.49 1.06 0.00 0.00 176.91 179.98 1ptw h GLU 338 N 0.41 0.11 -0.78 1.72 4.81 -0.52 0.45 114.58 120.78 1ptw h GLU 338 Ca 0.12 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.31 1ptw h GLU 338 Cb 0.15 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.47 1ptw h GLU 338 CO -0.01 0.07 0.38 1.49 -0.73 0.00 0.00 179.01 180.21 1ptw h GLU 339 N 0.11 1.12 -0.36 1.92 4.81 -0.68 0.61 114.58 122.10 1ptw h GLU 339 Ca 0.14 -0.15 -0.10 0.00 -0.13 0.00 0.00 59.36 59.12 1ptw h GLU 339 Cb 0.18 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 1ptw h GLU 339 CO -0.22 0.85 -0.19 0.74 -0.73 0.00 0.00 179.01 179.46 1ptw h PHE 340 N 1.11 0.76 -0.19 0.92 0.04 0.11 -2.30 116.94 117.40 1ptw h PHE 340 Ca 0.27 -0.16 -0.11 0.00 2.80 0.00 0.00 57.97 60.78 1ptw h PHE 340 Cb 0.10 -0.19 -0.00 0.00 2.20 0.00 0.00 35.95 38.06 1ptw h PHE 340 CO 0.01 0.82 -0.30 0.74 -0.60 0.00 0.00 178.31 178.99 1ptw h PHE 341 N 0.61 0.66 -0.72 -0.55 0.04 0.43 -1.00 116.94 116.41 1ptw h PHE 341 Ca 0.09 -0.23 0.11 0.00 2.80 0.00 0.00 57.97 60.75 1ptw h PHE 341 Cb 0.66 -0.13 -0.05 0.00 2.20 0.00 0.00 35.95 38.63 1ptw h PHE 341 CO 0.03 0.94 0.48 0.00 -0.60 0.00 0.00 178.31 179.16 1ptw h ARG 342 N 0.19 0.54 -0.13 1.51 3.08 -0.77 0.59 114.38 119.39 1ptw h ARG 342 Ca 0.02 -0.03 -0.16 0.00 0.07 0.00 0.00 59.98 59.87 1ptw h ARG 342 Cb 0.88 -0.12 0.01 0.00 0.08 0.00 0.00 29.97 30.81 1ptw h ARG 342 CO 0.07 0.36 -0.55 0.37 -1.07 0.00 0.00 179.97 179.15 1ptw h GLN 343 N 0.56 0.59 -0.69 0.04 4.15 -1.26 -1.04 115.11 117.46 1ptw h GLN 343 Ca 0.34 -0.47 0.04 0.00 0.77 0.00 0.00 58.65 59.33 1ptw h GLN 343 Cb 0.56 0.09 -0.05 0.00 0.21 0.00 0.00 27.48 28.30 1ptw h GLN 343 CO -0.12 1.09 0.42 0.78 -1.93 0.00 0.00 178.83 179.07 1ptw h GLY 344 N 0.23 1.00 0.96 2.39 0.00 0.37 0.37 103.07 108.40 1ptw h GLY 344 Ca -0.03 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 1ptw h GLY 344 CO 0.11 0.24 -0.09 -0.55 0.00 0.00 0.00 176.54 176.25 1ptw h ASP 345 N 0.80 -0.22 -0.93 0.19 3.32 0.17 0.23 116.42 119.98 1ptw h ASP 345 Ca 0.29 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.31 1ptw h ASP 345 Cb 0.07 0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.64 1ptw h ASP 345 CO -0.13 -0.12 0.56 0.03 -1.72 0.00 0.00 179.24 177.86 1ptw h ARG 346 N -0.30 1.26 -0.15 3.56 3.08 -0.74 -1.12 114.38 119.96 1ptw h ARG 346 Ca -0.03 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.91 1ptw h ARG 346 Cb 0.23 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1ptw h ARG 346 CO 0.04 0.88 0.07 0.93 -1.07 0.00 0.00 179.97 180.82 1ptw h GLU 347 N 1.28 0.21 -0.08 0.04 5.08 -0.03 -3.11 114.58 117.97 1ptw h GLU 347 Ca 0.33 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.70 1ptw h GLU 347 Cb -0.06 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 1ptw h GLU 347 CO -0.06 0.26 -0.14 -0.09 -1.00 0.00 0.00 179.01 177.98 1ptw h ARG 348 N 0.12 -0.18 -1.23 2.33 2.43 -0.55 -0.50 114.38 116.81 1ptw h ARG 348 Ca 0.05 0.01 0.36 0.00 -0.81 0.00 0.00 59.98 59.59 1ptw h ARG 348 Cb 0.11 0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.65 1ptw h ARG 348 CO -0.01 -0.12 0.88 0.93 -1.51 0.00 0.00 179.97 180.14 1ptw h GLU 349 N -0.19 0.01 -0.06 0.20 5.08 -1.16 0.71 114.58 119.18 1ptw h GLU 349 Ca 0.08 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1ptw h GLU 349 Cb 0.29 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1ptw h GLU 349 CO -0.19 0.01 0.00 0.54 -1.00 0.00 0.00 179.01 178.36 1ptw n ARG 350 N -4.18 2.28 -1.08 2.33 1.74 -0.71 -4.95 116.66 112.08 1ptw n ARG 350 Ca 0.27 -1.87 -0.03 0.00 -0.77 0.00 0.00 57.85 55.45 1ptw n ARG 350 Cb 1.28 -1.47 -0.01 0.00 -1.02 0.00 0.00 32.46 31.24 1ptw n ARG 350 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ptw n GLY 351 N 1.35 0.61 3.80 -0.13 0.00 0.25 -5.02 105.19 106.05 1ptw n GLY 351 Ca 0.15 -0.64 -0.35 0.00 0.00 0.00 0.00 46.02 45.18 1ptw n GLY 351 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ptw s MET 352 N -1.78 4.37 0.11 1.61 -1.94 -0.28 -4.98 119.30 116.41 1ptw s MET 352 Ca 0.00 1.13 -0.34 0.00 -1.71 0.00 0.00 55.69 54.77 1ptw s MET 352 Cb 0.00 -2.58 -0.14 0.00 2.01 0.00 0.00 34.83 34.12 1ptw s MET 352 CO 0.00 0.19 1.60 -1.91 -0.01 0.00 0.00 175.02 174.89 1ptw n GLU 353 N 0.12 2.05 -2.45 2.03 2.13 -1.26 -4.25 120.64 119.01 1ptw n GLU 353 Ca 0.03 0.74 -0.43 0.00 0.66 0.00 0.00 57.16 58.17 1ptw n GLU 353 Cb 0.52 -2.51 -0.02 0.00 0.27 0.00 0.00 31.44 29.69 1ptw n GLU 353 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 1ptw s ILE 354 N 1.37 4.29 0.62 6.31 1.01 -1.26 -4.93 121.20 128.61 1ptw s ILE 354 Ca 0.82 1.53 -0.19 0.00 0.00 0.00 0.00 60.65 62.80 1ptw s ILE 354 Cb -0.71 -4.09 -0.02 0.00 0.01 0.00 0.00 42.46 37.65 1ptw s ILE 354 CO 0.41 -0.25 1.30 -1.20 0.00 0.00 0.00 174.94 175.20 1ptw n SER 355 N 6.89 2.21 -4.54 3.58 7.64 -1.26 -4.88 113.62 123.26 1ptw n SER 355 Ca 0.14 0.87 -0.47 0.00 1.01 0.00 0.00 58.87 60.42 1ptw n SER 355 Cb 0.46 -1.56 -0.03 0.00 -1.01 0.00 0.00 64.21 62.07 1ptw n SER 355 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1ptw n PRO 356 N -1.62 0.94 -0.20 1.43 -0.02 -1.26 -1.07 135.00 133.20 1ptw n PRO 356 Ca 0.14 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 1ptw n PRO 356 Cb 0.47 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.28 1ptw n PRO 356 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1ptw n MET 357 N 1.16 0.00 0.10 -0.52 2.81 -1.26 -4.83 117.12 114.57 1ptw n MET 357 Ca 0.14 0.00 0.12 0.00 -1.81 0.00 0.00 57.70 56.15 1ptw n MET 357 Cb 0.27 -3.03 0.27 0.00 -0.71 0.00 0.00 33.22 30.02 1ptw n MET 357 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1ptw s ASP 359 N -4.62 6.24 0.00 0.00 -1.08 -1.26 -3.93 116.67 112.02 1ptw s ASP 359 Ca 0.08 -0.69 0.02 0.00 -0.52 0.00 0.00 52.55 51.43 1ptw s ASP 359 Cb 0.12 -2.56 0.08 0.00 -1.46 0.00 0.00 42.92 39.10 1ptw s ASP 359 CO 0.66 -1.76 0.76 2.29 0.52 0.00 0.00 175.17 177.65 1ptw n LYS 360 N 9.24 0.03 -0.08 4.34 2.85 -1.26 -1.42 118.16 131.86 1ptw n LYS 360 Ca 0.10 0.18 -0.13 0.00 -1.05 0.00 0.00 58.31 57.41 1ptw n LYS 360 Cb 0.49 -1.50 -0.14 0.00 -0.65 0.00 0.00 35.03 33.23 1ptw n LYS 360 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1ptw n HIS 361 N -1.19 0.30 -1.90 5.58 8.25 -1.26 -4.39 115.22 120.62 1ptw n HIS 361 Ca 0.01 0.09 -0.29 0.00 -0.26 0.00 0.00 57.72 57.27 1ptw n HIS 361 Cb 0.01 -1.05 0.03 0.00 1.12 0.00 0.00 29.99 30.11 1ptw n HIS 361 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1ptw n ASN 362 N -3.02 5.90 -4.77 0.41 3.02 -0.50 -5.05 115.26 111.25 1ptw n ASN 362 Ca -0.34 -3.76 -0.40 0.00 -0.03 0.00 0.00 54.58 50.04 1ptw n ASN 362 Cb 1.08 -0.60 -0.02 0.00 -0.61 0.00 0.00 39.78 39.62 1ptw n ASN 362 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ptw s ALA 363 N -3.70 3.41 -0.31 5.41 0.00 -0.98 -4.89 121.76 120.70 1ptw s ALA 363 Ca 0.54 1.15 0.18 0.00 0.00 0.00 0.00 51.96 53.84 1ptw s ALA 363 Cb 0.44 -3.44 0.47 0.00 0.00 0.00 0.00 23.12 20.59 1ptw s ALA 363 CO -0.06 -0.55 1.01 0.43 0.00 0.00 0.00 175.76 176.59 1ptw n SER 364 N 0.72 1.74 -0.29 0.00 7.64 -1.26 -4.98 113.62 117.19 1ptw n SER 364 Ca 0.01 -2.60 -0.01 0.00 1.01 0.00 0.00 58.87 57.27 1ptw n SER 364 Cb 0.43 -0.51 0.02 0.00 -1.01 0.00 0.00 64.21 63.15 1ptw n SER 364 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1ptw n VAL 365 N -0.25 -0.40 -0.28 0.44 0.31 -1.26 0.37 118.33 117.26 1ptw n VAL 365 Ca 0.11 1.74 -0.01 0.00 -0.01 0.00 0.00 64.34 66.16 1ptw n VAL 365 Cb 0.81 -2.28 0.11 0.00 -0.91 0.00 0.00 33.84 31.57 1ptw n VAL 365 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1ptw h GLU 366 N 0.00 0.90 -0.36 5.55 3.07 -1.93 -1.95 114.58 119.86 1ptw h GLU 366 Ca 0.25 -0.05 -0.14 0.00 -0.50 0.00 0.00 59.36 58.92 1ptw h GLU 366 Cb 0.43 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.14 1ptw h GLU 366 CO -0.73 0.60 -0.32 0.87 -1.40 0.00 0.00 179.01 178.02 1ptw h LYS 367 N 0.93 0.85 0.04 2.33 1.57 -0.42 -2.78 116.57 119.10 1ptw h LYS 367 Ca 0.33 -0.43 0.03 0.00 -1.87 0.00 0.00 60.65 58.71 1ptw h LYS 367 Cb 0.10 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.38 1ptw h LYS 367 CO -0.15 1.08 -0.27 0.77 -0.57 0.00 0.00 179.45 180.31 1ptw h SER 368 N 0.64 -0.80 -0.61 0.86 0.02 -0.32 0.52 113.55 113.87 1ptw h SER 368 Ca 0.06 0.10 0.05 0.00 -0.84 0.00 0.00 61.79 61.16 1ptw h SER 368 Cb 0.90 0.32 -0.05 0.00 0.14 0.00 0.00 62.40 63.71 1ptw h SER 368 CO 0.08 -0.35 0.34 1.56 -1.14 0.00 0.00 176.83 177.32 1ptw h GLN 369 N -0.44 0.62 -0.65 3.45 1.08 -1.40 0.63 115.11 118.40 1ptw h GLN 369 Ca 0.05 -0.04 -0.08 0.00 -1.45 0.00 0.00 58.65 57.13 1ptw h GLN 369 Cb 0.50 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.77 1ptw h GLN 369 CO -0.21 0.41 0.08 0.28 -0.95 0.00 0.00 178.83 178.45 1ptw h VAL 370 N 0.64 1.26 -0.26 -0.54 2.07 -1.15 0.37 116.25 118.64 1ptw h VAL 370 Ca 0.27 -1.06 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 1ptw h VAL 370 Cb 0.14 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 1ptw h VAL 370 CO -0.16 0.40 0.14 1.23 0.02 0.00 0.00 177.57 179.20 1ptw h GLY 371 N 1.01 0.40 1.11 2.17 0.00 0.94 -1.20 103.07 107.50 1ptw h GLY 371 Ca 0.20 -0.18 -0.06 0.00 0.00 0.00 0.00 47.33 47.28 1ptw h GLY 371 CO 0.02 0.18 0.22 -2.75 0.00 0.00 0.00 176.54 174.20 1ptw h PHE 372 N 0.31 1.16 -0.13 5.60 3.57 0.64 -2.57 116.94 125.52 1ptw h PHE 372 Ca 0.09 -0.11 -0.18 0.00 3.53 0.00 0.00 57.97 61.29 1ptw h PHE 372 Cb 0.08 -0.34 -0.00 0.00 2.79 0.00 0.00 35.95 38.48 1ptw h PHE 372 CO -0.03 0.92 -0.68 0.82 -2.23 0.00 0.00 178.31 177.11 1ptw h ILE 373 N 1.07 1.34 0.04 1.41 2.04 -0.08 -2.13 117.51 121.20 1ptw h ILE 373 Ca 0.23 -2.00 -0.28 0.00 1.00 0.00 0.00 64.86 63.82 1ptw h ILE 373 Cb 0.31 1.98 0.02 0.00 -0.74 0.00 0.00 36.82 38.39 1ptw h ILE 373 CO -0.01 0.61 -1.11 0.44 0.00 0.00 0.00 178.15 178.09 1ptw h ASP 374 N 0.38 0.91 0.77 1.72 3.32 -1.17 0.18 116.42 122.53 1ptw h ASP 374 Ca -0.02 -0.76 -0.10 0.00 0.02 0.00 0.00 57.03 56.17 1ptw h ASP 374 Cb 1.26 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.51 1ptw h ASP 374 CO 0.12 1.56 -1.30 -1.22 -1.72 0.00 0.00 179.24 176.69 1ptw n TYR 375 N -3.84 0.91 0.02 4.55 4.02 -0.97 -4.40 117.16 117.45 1ptw n TYR 375 Ca -0.12 0.29 0.00 0.00 -0.01 0.00 0.00 57.90 58.06 1ptw n TYR 375 Cb 0.92 -1.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.23 1ptw n TYR 375 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 1ptw n ILE 376 N -2.77 0.39 0.02 -0.72 5.41 -0.91 -4.75 119.36 116.03 1ptw n ILE 376 Ca -0.06 0.13 -0.11 0.00 1.00 0.00 0.00 62.75 63.71 1ptw n ILE 376 Cb 0.72 -1.17 -0.05 0.00 -0.71 0.00 0.00 39.64 38.42 1ptw n ILE 376 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1ptw h VAL 377 N 0.00 0.86 -0.28 1.39 2.07 -1.48 -2.51 116.25 116.30 1ptw h VAL 377 Ca 0.00 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 1ptw h VAL 377 Cb 0.00 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1ptw h VAL 377 CO 0.00 0.00 -0.03 -0.74 0.02 0.00 0.00 177.57 176.82 1ptw h HIS 378 N -0.06 0.56 -0.81 1.57 -0.00 -0.89 -0.69 115.15 114.83 1ptw h HIS 378 Ca 0.04 -0.11 0.06 0.00 -0.00 0.00 0.00 60.37 60.36 1ptw h HIS 378 Cb 0.11 -0.14 -0.05 0.00 -0.00 0.00 0.00 27.41 27.33 1ptw h HIS 378 CO -0.14 0.68 0.53 -1.35 -0.00 0.00 0.00 177.93 177.64 1ptw h PRO 379 N 0.28 0.87 0.24 5.26 0.11 -1.75 0.11 132.00 137.12 1ptw h PRO 379 Ca 0.08 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 1ptw h PRO 379 Cb 0.47 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.39 1ptw h PRO 379 CO 0.02 0.57 -0.12 1.25 -0.21 0.00 0.00 178.00 179.52 1ptw h LEU 380 N 0.89 -0.27 -1.13 2.35 5.85 -1.22 -2.41 115.31 119.37 1ptw h LEU 380 Ca 0.34 -0.23 -0.08 0.00 0.84 0.00 0.00 57.88 58.76 1ptw h LEU 380 Cb 0.21 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 1ptw h LEU 380 CO -0.12 0.11 -0.38 -0.50 -0.34 0.00 0.00 178.44 177.22 1ptw h TRP 381 N -0.70 0.00 -0.21 1.25 4.06 -0.94 -0.02 115.95 119.40 1ptw h TRP 381 Ca -0.03 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.88 1ptw h TRP 381 Cb 0.48 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.64 1ptw h TRP 381 CO 0.03 0.38 -0.02 1.49 -3.56 0.00 0.00 178.44 176.76 1ptw h GLU 382 N 0.00 0.38 -0.53 0.49 4.81 -0.81 0.78 114.58 119.70 1ptw h GLU 382 Ca -0.00 -0.13 -0.07 0.00 -0.13 0.00 0.00 59.36 59.03 1ptw h GLU 382 Cb 0.79 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.12 1ptw h GLU 382 CO 0.05 0.60 0.06 1.15 -0.73 0.00 0.00 179.01 180.14 1ptw h THR 383 N 0.12 1.24 -0.25 0.32 2.02 -1.19 -0.44 112.91 114.73 1ptw h THR 383 Ca 0.06 -0.94 -0.14 0.00 0.77 0.00 0.00 66.41 66.16 1ptw h THR 383 Cb 0.44 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 1ptw h THR 383 CO 0.01 0.34 -0.41 -0.25 0.37 0.00 0.00 175.52 175.58 1ptw h TRP 384 N 0.81 0.71 -0.24 3.16 2.91 -0.62 -1.91 115.95 120.77 1ptw h TRP 384 Ca 0.16 -0.21 -0.07 0.00 1.13 0.00 0.00 58.89 59.91 1ptw h TRP 384 Cb 0.39 -0.15 -0.01 0.00 -0.51 0.00 0.00 29.16 28.88 1ptw h TRP 384 CO 0.02 0.91 -0.14 0.00 -1.03 0.00 0.00 178.44 178.20 1ptw h ALA 385 N 1.06 1.31 0.01 2.65 0.00 0.11 -2.57 119.26 121.83 1ptw h ALA 385 Ca 0.04 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1ptw h ALA 385 Cb 0.93 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1ptw h ALA 385 CO 0.08 0.46 -0.01 -0.44 0.00 0.00 0.00 179.25 179.35 1ptw h ASP 386 N 0.38 -0.02 -0.63 0.00 3.45 -0.70 0.38 116.42 119.28 1ptw h ASP 386 Ca 0.07 -0.25 0.11 0.00 0.43 0.00 0.00 57.03 57.39 1ptw h ASP 386 Cb 0.48 0.00 -0.08 0.00 -0.56 0.00 0.00 39.33 39.18 1ptw h ASP 386 CO 0.03 0.24 0.21 0.25 -1.57 0.00 0.00 179.24 178.41 1ptw h LEU 387 N -0.27 0.18 -3.08 1.55 5.85 -1.04 -2.85 115.31 115.65 1ptw h LEU 387 Ca -0.00 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.81 1ptw h LEU 387 Cb 0.26 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.38 1ptw h LEU 387 CO 0.00 0.10 0.00 1.33 -0.34 0.00 0.00 178.44 179.53 1ptw n VAL 388 N -5.03 1.65 -1.52 1.05 0.24 -1.00 -4.97 118.33 108.75 1ptw n VAL 388 Ca 0.10 -1.41 -0.45 0.00 -2.04 0.00 0.00 64.34 60.53 1ptw n VAL 388 Cb 0.31 0.13 -0.02 0.00 -1.47 0.00 0.00 33.84 32.79 1ptw n VAL 388 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 1ptw n HIS 389 N 0.08 0.58 1.17 6.34 -0.00 0.13 -1.75 115.22 121.78 1ptw n HIS 389 Ca 0.17 0.76 0.13 0.00 -0.00 0.00 0.00 57.72 58.78 1ptw n HIS 389 Cb 0.67 -2.14 0.43 0.00 -0.00 0.00 0.00 29.99 28.95 1ptw n HIS 389 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 1ptw n PRO 390 N 0.76 0.39 -0.17 1.57 -0.04 -1.26 -4.97 135.00 131.28 1ptw n PRO 390 Ca 0.12 -0.18 0.15 0.00 -0.04 0.00 0.00 63.50 63.55 1ptw n PRO 390 Cb 0.31 -1.50 0.27 0.00 -0.04 0.00 0.00 33.50 32.54 1ptw n PRO 390 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1ptw n ASP 391 N -1.14 0.11 -1.70 3.54 9.92 -0.71 -0.28 116.55 126.28 1ptw n ASP 391 Ca 0.10 0.61 -0.16 0.00 -0.53 0.00 0.00 54.79 54.81 1ptw n ASP 391 Cb 0.32 -0.30 0.16 0.00 -0.64 0.00 0.00 41.12 40.67 1ptw n ASP 391 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ptw n ALA 392 N -2.62 5.03 -0.03 2.24 0.00 -1.26 -4.70 120.51 119.17 1ptw n ALA 392 Ca 0.16 -3.18 -0.13 0.00 0.00 0.00 0.00 53.44 50.29 1ptw n ALA 392 Cb 0.61 -1.04 -0.09 0.00 0.00 0.00 0.00 19.45 18.92 1ptw n ALA 392 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1ptw h GLN 393 N 1.23 0.10 -0.93 0.00 5.75 -1.00 -2.51 115.11 117.74 1ptw h GLN 393 Ca 0.41 -0.06 0.04 0.00 -0.15 0.00 0.00 58.65 58.89 1ptw h GLN 393 Cb 1.90 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 30.40 1ptw h GLN 393 CO 0.79 0.60 0.61 -0.44 -2.65 0.00 0.00 178.83 177.74 1ptw h ASP 394 N -0.40 1.01 -0.50 -0.69 3.32 -1.84 0.69 116.42 118.01 1ptw h ASP 394 Ca 0.00 -0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.93 1ptw h ASP 394 Cb 0.59 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 1ptw h ASP 394 CO 0.01 0.69 -0.12 0.40 -1.72 0.00 0.00 179.24 178.50 1ptw h ILE 395 N 1.17 1.27 -0.41 0.35 2.04 -1.90 -0.53 117.51 119.50 1ptw h ILE 395 Ca 0.37 -1.27 -0.12 0.00 1.00 0.00 0.00 64.86 64.84 1ptw h ILE 395 Cb 0.01 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 1ptw h ILE 395 CO -0.11 0.45 -0.23 0.25 0.00 0.00 0.00 178.15 178.50 1ptw h LEU 396 N 0.88 0.85 0.09 1.44 5.85 -0.92 -2.19 115.31 121.31 1ptw h LEU 396 Ca 0.14 -0.32 -0.00 0.00 0.84 0.00 0.00 57.88 58.53 1ptw h LEU 396 Cb 0.68 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.48 1ptw h LEU 396 CO 0.05 1.05 -0.04 0.44 -0.34 0.00 0.00 178.44 179.60 1ptw h ASP 397 N 0.72 -0.10 -0.63 1.25 3.32 -0.64 -0.36 116.42 119.98 1ptw h ASP 397 Ca 0.10 -0.13 0.10 0.00 0.02 0.00 0.00 57.03 57.12 1ptw h ASP 397 Cb 0.77 0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.30 1ptw h ASP 397 CO 0.06 0.07 0.42 0.74 -1.72 0.00 0.00 179.24 178.81 1ptw h THR 398 N -0.26 0.89 -0.08 0.35 2.02 -1.02 0.36 112.91 115.16 1ptw h THR 398 Ca -0.01 -0.15 -0.05 0.00 0.77 0.00 0.00 66.41 66.98 1ptw h THR 398 Cb 0.22 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 67.05 1ptw h THR 398 CO 0.02 0.08 -0.12 0.25 0.37 0.00 0.00 175.52 176.11 1ptw h LEU 399 N 0.43 0.26 -0.95 2.58 5.85 -0.96 -0.55 115.31 121.97 1ptw h LEU 399 Ca 0.29 -0.53 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 1ptw h LEU 399 Cb 0.58 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.49 1ptw h LEU 399 CO -0.08 0.73 0.59 -0.33 -0.34 0.00 0.00 178.44 179.01 1ptw h GLU 400 N -0.21 1.28 -0.28 1.25 5.08 0.09 -1.79 114.58 120.00 1ptw h GLU 400 Ca 0.01 -0.10 -0.12 0.00 -1.00 0.00 0.00 59.36 58.15 1ptw h GLU 400 Cb 0.68 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 1ptw h GLU 400 CO 0.03 0.88 -0.32 -0.44 -1.00 0.00 0.00 179.01 178.15 1ptw h ASP 401 N 1.30 0.61 1.09 1.42 5.19 -0.28 -2.62 116.42 123.13 1ptw h ASP 401 Ca 0.34 -0.24 -0.02 0.00 -0.62 0.00 0.00 57.03 56.49 1ptw h ASP 401 Cb -0.09 -0.17 -0.00 0.00 0.18 0.00 0.00 39.33 39.25 1ptw h ASP 401 CO -0.07 0.90 -0.10 0.78 -3.12 0.00 0.00 179.24 177.63 1ptw h ASN 402 N 0.50 0.00 -0.00 6.45 2.35 -0.48 -2.55 115.58 121.84 1ptw h ASN 402 Ca 0.06 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1ptw h ASN 402 Cb 0.81 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.18 1ptw h ASN 402 CO 0.07 0.10 -0.01 -0.09 -1.65 0.00 0.00 177.43 175.85 1ptw h ARG 403 N 0.00 0.01 0.32 0.81 2.43 -0.98 -2.63 114.38 114.33 1ptw h ARG 403 Ca -0.00 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1ptw h ARG 403 Cb 0.67 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.19 1ptw h ARG 403 CO 0.01 0.59 -0.47 0.93 -1.51 0.00 0.00 179.97 179.52 1ptw h GLU 404 N -0.57 -0.79 -0.98 0.20 4.39 -1.40 -0.86 114.58 114.57 1ptw h GLU 404 Ca 0.00 0.05 0.29 0.00 0.34 0.00 0.00 59.36 60.04 1ptw h GLU 404 Cb 0.59 0.18 -0.18 0.00 -0.10 0.00 0.00 28.75 29.23 1ptw h GLU 404 CO 0.00 -0.53 0.09 1.87 -1.16 0.00 0.00 179.01 179.29 1ptw n TRP 405 N -5.21 0.70 0.20 4.33 -0.00 -0.97 0.24 117.44 116.73 1ptw n TRP 405 Ca -0.10 1.18 0.07 0.00 -0.00 0.00 0.00 57.50 58.65 1ptw n TRP 405 Cb 0.40 -1.28 0.39 0.00 -0.00 0.00 0.00 31.31 30.82 1ptw n TRP 405 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 177.69 179.57 1ptw h TYR 406 N 0.00 0.00 -0.31 5.87 0.05 -0.93 -2.79 116.97 118.86 1ptw h TYR 406 Ca 0.63 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 59.38 1ptw h TYR 406 Cb 1.36 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.09 1ptw h TYR 406 CO -0.43 0.32 0.08 1.96 -1.05 0.00 0.00 178.16 179.04 1ptw h GLN 407 N 0.00 0.49 0.20 4.88 1.08 0.44 -2.78 115.11 119.42 1ptw h GLN 407 Ca -0.00 -0.11 -0.01 0.00 -1.45 0.00 0.00 58.65 57.08 1ptw h GLN 407 Cb 0.81 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 28.17 1ptw h GLN 407 CO 0.04 0.55 -0.21 0.77 -0.95 0.00 0.00 178.83 179.03 1ptw h SER 408 N 0.34 -0.57 -1.43 1.46 0.02 -1.20 -2.14 113.55 110.03 1ptw h SER 408 Ca 0.10 0.05 0.42 0.00 -0.84 0.00 0.00 61.79 61.51 1ptw h SER 408 Cb 0.27 0.19 -0.06 0.00 0.14 0.00 0.00 62.40 62.95 1ptw h SER 408 CO -0.00 -0.27 1.22 0.41 -1.14 0.00 0.00 176.83 177.05 1ptw n THR 409 N -3.59 0.00 -1.57 -2.27 -1.04 -1.07 -4.40 114.28 100.34 1ptw n THR 409 Ca -0.05 1.26 -0.40 0.00 -2.04 0.00 0.00 64.05 62.82 1ptw n THR 409 Cb 0.19 -2.16 -0.04 0.00 -1.82 0.00 0.00 70.33 66.50 1ptw n THR 409 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1ptw n ILE 410 N -3.45 0.13 -1.98 12.58 5.41 -0.81 -4.91 119.36 126.34 1ptw n ILE 410 Ca 0.32 -0.60 -0.42 0.00 1.00 0.00 0.00 62.75 63.06 1ptw n ILE 410 Cb 1.65 -2.58 -0.03 0.00 -0.71 0.00 0.00 39.64 37.97 1ptw n ILE 410 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1ptw s PRO 411 N 7.28 4.24 0.00 0.38 0.04 -1.26 -5.06 135.00 140.62 1ptw s PRO 411 Ca 1.01 2.31 0.00 0.00 0.04 0.00 0.00 61.00 64.36 1ptw s PRO 411 Cb -0.31 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.07 1ptw s PRO 411 CO 0.32 -0.55 0.51 1.04 0.04 0.00 0.00 177.00 178.37