#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dqs n PRO 68 N 0.00 2.26 -1.18 1.61 -0.02 -1.26 -4.86 135.00 131.54 3dqs n PRO 68 Ca 0.00 0.81 -0.26 0.00 -2.02 0.00 0.00 63.50 62.03 3dqs n PRO 68 Cb 0.00 -2.54 -0.10 0.00 -0.02 0.00 0.00 33.50 30.85 3dqs n PRO 68 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3dqs n LYS 69 N 2.62 2.87 -4.10 -0.52 5.02 -1.26 -4.79 118.16 118.00 3dqs n LYS 69 Ca 0.13 -1.65 -0.09 0.00 -2.02 0.00 0.00 58.31 54.68 3dqs n LYS 69 Cb 0.32 -2.39 -0.10 0.00 -0.02 0.00 0.00 35.03 32.84 3dqs n LYS 69 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 3dqs s PHE 70 N 1.41 0.66 0.22 2.13 0.40 -1.26 -5.12 117.98 116.43 3dqs s PHE 70 Ca 0.68 -1.11 -0.32 0.00 -0.60 0.00 0.00 56.93 55.58 3dqs s PHE 70 Cb 0.25 -0.40 -0.13 0.00 0.51 0.00 0.00 43.02 43.26 3dqs s PHE 70 CO -0.04 -0.48 1.61 -2.30 0.70 0.00 0.00 175.22 174.72 3dqs n PRO 71 N -0.02 2.48 -3.34 0.24 -0.02 -1.25 -4.78 135.00 128.32 3dqs n PRO 71 Ca -0.09 0.89 -0.38 0.00 -2.02 0.00 0.00 63.50 61.89 3dqs n PRO 71 Cb 0.62 -2.67 -0.07 0.00 -0.02 0.00 0.00 33.50 31.36 3dqs n PRO 71 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 3dqs s ARG 72 N 0.47 4.21 -0.13 -0.52 3.52 -1.26 -1.45 118.95 123.78 3dqs s ARG 72 Ca 0.72 0.30 -0.00 0.00 -0.13 0.00 0.00 55.73 56.63 3dqs s ARG 72 Cb -0.57 -3.53 -0.01 0.00 -1.56 0.00 0.00 34.95 29.28 3dqs s ARG 72 CO 0.40 -0.03 -0.13 0.08 -0.81 0.00 0.00 175.30 174.81 3dqs s VAL 73 N 1.28 3.05 0.04 7.11 1.01 0.72 -4.99 120.40 128.62 3dqs s VAL 73 Ca 0.22 -0.66 0.09 0.00 0.00 0.00 0.00 61.98 61.62 3dqs s VAL 73 Cb -0.15 -2.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 3dqs s VAL 73 CO 0.09 0.53 -0.26 -0.75 0.00 0.00 0.00 175.10 174.70 3dqs s LYS 74 N 0.33 1.83 -0.30 2.72 2.20 -1.26 -1.38 119.74 123.88 3dqs s LYS 74 Ca -0.11 -1.08 -0.09 0.00 -0.36 0.00 0.00 55.97 54.34 3dqs s LYS 74 Cb -0.16 -1.97 -0.01 0.00 -1.51 0.00 0.00 37.83 34.18 3dqs s LYS 74 CO 0.06 0.51 0.13 1.21 -0.36 0.00 0.00 175.35 176.90 3dqs s ASN 75 N -1.14 5.45 0.03 1.43 3.84 -0.50 -1.11 114.94 122.93 3dqs s ASN 75 Ca 0.11 -0.45 0.27 0.00 0.21 0.00 0.00 52.86 53.01 3dqs s ASN 75 Cb -0.10 -1.98 1.13 0.00 -0.55 0.00 0.00 41.25 39.75 3dqs s ASN 75 CO 0.02 -0.15 1.87 0.79 -2.79 0.00 0.00 177.10 176.83 3dqs n TRP 76 N 4.96 0.14 -0.02 0.43 7.02 0.38 -0.14 117.44 130.21 3dqs n TRP 76 Ca -0.14 0.04 -0.19 0.00 -1.02 0.00 0.00 57.50 56.19 3dqs n TRP 76 Cb 0.50 -0.57 -0.13 0.00 -2.42 0.00 0.00 31.31 28.68 3dqs n TRP 76 CO 0.00 0.00 0.00 1.49 -2.02 0.00 0.00 177.69 177.16 3dqs h GLU 77 N 0.00 0.15 0.00 -0.99 4.81 -1.95 -3.38 114.58 113.22 3dqs h GLU 77 Ca 0.00 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 58.98 3dqs h GLU 77 Cb 0.51 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.98 3dqs h GLU 77 CO 0.00 1.12 -1.05 1.28 -0.73 0.00 0.00 179.01 179.63 3dqs n LEU 78 N -4.26 0.64 -0.06 1.64 4.77 -1.23 -4.97 117.00 113.53 3dqs n LEU 78 Ca -0.19 0.13 -0.01 0.00 -0.03 0.00 0.00 56.01 55.92 3dqs n LEU 78 Cb 0.72 -0.09 -0.00 0.00 -2.33 0.00 0.00 43.42 41.72 3dqs n LEU 78 CO 0.37 -0.05 -0.01 0.61 -1.33 0.00 0.00 177.39 176.99 3dqs n GLY 79 N 1.29 0.41 3.86 -0.72 0.00 0.80 -5.01 105.19 105.82 3dqs n GLY 79 Ca 0.01 -0.09 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 3dqs n GLY 79 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dqs s SER 80 N -2.11 6.59 0.02 1.61 1.04 -1.19 -4.86 113.70 114.79 3dqs s SER 80 Ca 0.00 1.34 0.05 0.00 0.48 0.00 0.00 55.95 57.82 3dqs s SER 80 Cb 0.00 -2.41 -0.02 0.00 0.10 0.00 0.00 66.02 63.69 3dqs s SER 80 CO 0.00 -0.47 -0.16 -0.63 0.98 0.00 0.00 173.24 172.97 3dqs s ILE 81 N -2.45 1.25 0.13 -1.02 -1.09 -1.26 -1.41 121.20 115.34 3dqs s ILE 81 Ca 0.55 -0.91 -0.04 0.00 -2.23 0.00 0.00 60.65 58.02 3dqs s ILE 81 Cb -0.10 -1.09 -0.03 0.00 -1.58 0.00 0.00 42.46 39.66 3dqs s ILE 81 CO 0.30 0.17 0.13 0.42 -1.23 0.00 0.00 174.94 174.72 3dqs s THR 82 N -0.66 0.11 -0.04 2.92 -4.23 -0.48 -5.00 115.64 108.27 3dqs s THR 82 Ca 0.04 -1.67 0.06 0.00 -1.18 0.00 0.00 61.69 58.94 3dqs s THR 82 Cb -0.07 -1.85 -0.01 0.00 1.34 0.00 0.00 72.50 71.91 3dqs s THR 82 CO 0.01 -0.50 -0.22 -0.31 -0.54 0.00 0.00 174.62 173.06 3dqs s TYR 83 N -3.99 2.10 -0.35 3.99 1.51 -1.26 -0.20 117.35 119.15 3dqs s TYR 83 Ca 0.18 -0.56 -0.18 0.00 -1.01 0.00 0.00 57.07 55.50 3dqs s TYR 83 Cb 0.06 -1.38 -0.00 0.00 -0.11 0.00 0.00 41.96 40.53 3dqs s TYR 83 CO -0.02 -0.15 0.51 0.34 -1.11 0.00 0.00 175.55 175.12 3dqs s ASP 84 N -0.19 6.32 -0.01 2.29 -1.08 -0.53 -4.70 116.67 118.77 3dqs s ASP 84 Ca -0.01 -0.01 0.14 0.00 -0.52 0.00 0.00 52.55 52.16 3dqs s ASP 84 Cb -0.12 -2.27 -0.18 0.00 -1.46 0.00 0.00 42.92 38.89 3dqs s ASP 84 CO 0.02 -0.47 0.50 0.35 0.52 0.00 0.00 175.17 176.09 3dqs n THR 85 N 5.41 0.00 0.17 1.71 -2.24 0.17 -3.89 114.28 115.60 3dqs n THR 85 Ca -0.05 -0.23 0.03 0.00 -2.27 0.00 0.00 64.05 61.54 3dqs n THR 85 Cb 0.49 0.69 0.41 0.00 -2.10 0.00 0.00 70.33 69.83 3dqs n THR 85 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3dqs h LEU 86 N 0.00 0.11 -2.57 3.22 5.85 -1.64 -2.65 115.31 117.62 3dqs h LEU 86 Ca 0.00 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.70 3dqs h LEU 86 Cb 0.46 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.46 3dqs h LEU 86 CO 0.00 0.33 0.14 0.00 -0.34 0.00 0.00 178.44 178.56 3dqs h ALA 88 N 1.73 1.00 -0.00 0.00 0.00 -1.79 -1.87 119.26 118.33 3dqs h ALA 88 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dqs h ALA 88 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3dqs h ALA 88 CO -0.00 0.00 -0.15 1.04 0.00 0.00 0.00 179.25 180.14 3dqs n GLN 89 N -3.00 0.49 -2.19 0.00 6.02 0.25 -4.88 117.38 114.07 3dqs n GLN 89 Ca -0.01 -0.17 -0.42 0.00 -0.01 0.00 0.00 57.00 56.39 3dqs n GLN 89 Cb 0.22 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 29.95 3dqs n GLN 89 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3dqs s SER 90 N -2.62 6.84 0.00 1.08 0.15 -0.71 -4.91 113.70 113.53 3dqs s SER 90 Ca 0.24 2.26 0.05 0.00 0.70 0.00 0.00 55.95 59.21 3dqs s SER 90 Cb 0.20 -2.58 0.12 0.00 -1.71 0.00 0.00 66.02 62.05 3dqs s SER 90 CO 0.51 -0.66 0.99 0.00 1.20 0.00 0.00 173.24 175.28 3dqs n GLN 91 N 4.32 1.97 -4.47 5.44 6.02 -1.26 -4.98 117.38 124.43 3dqs n GLN 91 Ca 0.12 -1.49 -0.22 0.00 -0.01 0.00 0.00 57.00 55.40 3dqs n GLN 91 Cb 0.43 -1.13 -0.16 0.00 1.02 0.00 0.00 30.24 30.40 3dqs n GLN 91 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 3dqs s GLN 92 N -0.84 1.19 0.32 -1.09 0.74 -1.26 -5.14 119.66 113.58 3dqs s GLN 92 Ca 0.10 -0.35 -0.25 0.00 0.05 0.00 0.00 55.36 54.90 3dqs s GLN 92 Cb 0.06 -1.07 -0.10 0.00 1.10 0.00 0.00 33.01 33.00 3dqs s GLN 92 CO 0.08 0.10 0.93 -0.51 -0.55 0.00 0.00 175.29 175.34 3dqs s ASP 93 N 0.30 7.31 0.11 6.67 1.01 -1.26 -4.29 116.67 126.53 3dqs s ASP 93 Ca -0.06 1.80 0.00 0.00 0.71 0.00 0.00 52.55 55.00 3dqs s ASP 93 Cb -0.11 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.26 3dqs s ASP 93 CO 0.01 -0.06 0.00 0.61 0.21 0.00 0.00 175.17 175.94 3dqs n GLY 94 N 0.56 0.78 0.01 0.21 0.00 -1.26 -4.99 105.19 100.50 3dqs n GLY 94 Ca 0.02 -1.89 0.12 0.00 0.00 0.00 0.00 46.02 44.27 3dqs n GLY 94 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dqs n PRO 95 N -0.28 0.06 -2.33 1.61 -0.04 -1.26 -4.98 135.00 127.79 3dqs n PRO 95 Ca 0.00 0.02 -0.27 0.00 -0.04 0.00 0.00 63.50 63.20 3dqs n PRO 95 Cb 0.00 -1.54 0.03 0.00 -0.04 0.00 0.00 33.50 31.95 3dqs n PRO 95 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dqs s THR 97 N -3.02 0.05 0.64 0.00 -4.23 -1.02 -5.02 115.64 103.04 3dqs s THR 97 Ca 0.54 -1.44 0.38 0.00 -1.18 0.00 0.00 61.69 59.98 3dqs s THR 97 Cb -0.11 -1.94 0.40 0.00 1.34 0.00 0.00 72.50 72.19 3dqs s THR 97 CO 0.46 -0.24 2.26 -0.65 -0.54 0.00 0.00 174.62 175.92 3dqs h PRO 98 N 2.51 0.00 0.00 3.99 0.11 -2.05 -2.32 132.00 134.25 3dqs h PRO 98 Ca -0.31 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.58 3dqs h PRO 98 Cb 1.23 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 3dqs h PRO 98 CO 0.47 0.00 -1.08 -0.09 -0.21 0.00 0.00 178.00 177.09 3dqs h ARG 99 N 0.00 0.00 -1.83 1.05 2.43 -2.02 -3.47 114.38 110.54 3dqs h ARG 99 Ca 0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 3dqs h ARG 99 Cb 0.15 0.00 -0.23 0.00 -0.42 0.00 0.00 29.97 29.46 3dqs h ARG 99 CO -0.00 0.93 0.27 -0.98 -1.51 0.00 0.00 179.97 178.68 3dqs s ARG 100 N -2.70 0.69 -0.19 0.20 3.03 -0.87 -5.14 118.95 113.97 3dqs s ARG 100 Ca 0.00 0.83 -0.18 0.00 2.03 0.00 0.00 55.73 58.41 3dqs s ARG 100 Cb 0.10 0.33 -0.03 0.00 -1.03 0.00 0.00 34.95 34.32 3dqs s ARG 100 CO 0.82 -0.08 0.50 0.00 -1.13 0.00 0.00 175.30 175.41 3dqs n LEU 102 N 4.65 3.69 0.33 0.00 4.77 -1.26 -4.77 117.00 124.40 3dqs n LEU 102 Ca -0.05 -3.62 0.22 0.00 -0.03 0.00 0.00 56.01 52.52 3dqs n LEU 102 Cb 0.51 -0.59 1.17 0.00 -2.33 0.00 0.00 43.42 42.18 3dqs n LEU 102 CO 0.42 1.15 1.16 1.23 -1.33 0.00 0.00 177.39 180.02 3dqs h GLY 103 N 1.03 0.00 -0.71 -0.72 0.00 -1.94 -2.20 103.07 98.53 3dqs h GLY 103 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 3dqs h GLY 103 CO 0.26 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.66 3dqs n SER 104 N -3.01 1.68 -4.72 0.19 3.41 -1.26 -4.89 113.62 105.01 3dqs n SER 104 Ca -0.03 -1.62 -0.41 0.00 -0.26 0.00 0.00 58.87 56.55 3dqs n SER 104 Cb 0.08 -0.05 -0.04 0.00 -0.26 0.00 0.00 64.21 63.94 3dqs n SER 104 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3dqs s LEU 105 N -1.81 4.44 0.15 1.04 1.02 -0.83 -4.95 118.68 117.74 3dqs s LEU 105 Ca 0.35 1.65 -0.13 0.00 0.02 0.00 0.00 54.13 56.03 3dqs s LEU 105 Cb 0.20 -3.49 0.03 0.00 0.02 0.00 0.00 46.19 42.94 3dqs s LEU 105 CO 0.30 -0.12 1.64 0.58 0.02 0.00 0.00 176.35 178.77 3dqs h VAL 106 N 4.36 1.25 -3.54 -1.59 2.07 -1.90 -3.43 116.25 113.46 3dqs h VAL 106 Ca -0.42 -0.93 -0.67 0.00 0.82 0.00 0.00 66.70 65.50 3dqs h VAL 106 Cb 1.21 0.87 -0.21 0.00 -1.52 0.00 0.00 31.29 31.64 3dqs h VAL 106 CO 0.73 0.33 -0.70 -0.76 0.02 0.00 0.00 177.57 177.19 3dqs s LEU 107 N -9.53 3.09 0.00 2.57 1.43 -1.26 -5.16 118.68 109.82 3dqs s LEU 107 Ca -0.13 -0.11 0.00 0.00 -1.03 0.00 0.00 54.13 52.86 3dqs s LEU 107 Cb 0.12 -1.69 0.00 0.00 0.03 0.00 0.00 46.19 44.64 3dqs s LEU 107 CO 0.80 0.28 0.00 -0.81 0.23 0.00 0.00 176.35 176.86 3dqs n PRO 108 N 2.77 0.00 0.00 1.29 -0.04 -1.26 -5.11 135.00 132.65 3dqs n PRO 108 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 3dqs n PRO 108 Cb 0.53 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.99 3dqs n PRO 108 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3dqs n PRO 120 N 0.00 0.00 -1.51 0.54 -0.04 -1.26 -5.10 135.00 127.63 3dqs n PRO 120 Ca 0.00 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.06 3dqs n PRO 120 Cb 0.00 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.32 3dqs n PRO 120 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 3dqs n PRO 121 N -1.20 0.13 -0.52 0.54 -0.02 -1.26 -4.68 135.00 127.98 3dqs n PRO 121 Ca 0.00 -0.01 0.45 0.00 -2.02 0.00 0.00 63.50 61.92 3dqs n PRO 121 Cb 0.00 -1.73 0.79 0.00 -0.02 0.00 0.00 33.50 32.54 3dqs n PRO 121 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dqs h ALA 122 N 12.88 3.52 0.60 3.55 0.00 -1.98 0.22 119.26 138.06 3dqs h ALA 122 Ca -0.07 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 3dqs h ALA 122 Cb 1.30 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 3dqs h ALA 122 CO 1.37 -1.98 -0.50 1.05 0.00 0.00 0.00 179.25 179.19 3dqs h GLU 123 N 0.00 -1.03 -0.41 0.00 4.11 -1.99 -0.94 114.58 114.32 3dqs h GLU 123 Ca 0.76 0.07 -0.13 0.00 0.07 0.00 0.00 59.36 60.12 3dqs h GLU 123 Cb 3.06 0.24 -0.01 0.00 0.50 0.00 0.00 28.75 32.53 3dqs h GLU 123 CO -0.01 -0.69 -0.28 0.37 0.07 0.00 0.00 179.01 178.47 3dqs h GLN 124 N -1.07 0.87 -0.21 1.06 4.15 -0.96 -3.10 115.11 115.85 3dqs h GLN 124 Ca -0.08 -0.39 0.03 0.00 0.77 0.00 0.00 58.65 58.97 3dqs h GLN 124 Cb 0.90 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.55 3dqs h GLN 124 CO -0.00 1.04 0.05 1.25 -1.93 0.00 0.00 178.83 179.24 3dqs h LEU 125 N 0.74 0.03 -0.73 -2.39 5.85 -1.28 -2.05 115.31 115.48 3dqs h LEU 125 Ca 0.09 0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.90 3dqs h LEU 125 Cb 0.84 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.84 3dqs h LEU 125 CO 0.07 0.05 0.41 0.25 -0.34 0.00 0.00 178.44 178.88 3dqs h LEU 126 N 0.14 0.61 -0.89 2.25 7.12 -1.15 0.43 115.31 123.81 3dqs h LEU 126 Ca 0.09 0.03 -0.08 0.00 0.13 0.00 0.00 57.88 58.06 3dqs h LEU 126 Cb 0.08 -0.09 -0.02 0.00 -0.53 0.00 0.00 40.66 40.11 3dqs h LEU 126 CO -0.12 0.38 -0.06 0.77 -0.13 0.00 0.00 178.44 179.28 3dqs h SER 127 N 0.74 0.73 -0.13 1.25 4.64 -1.40 0.26 113.55 119.63 3dqs h SER 127 Ca 0.33 -0.20 -0.17 0.00 -0.47 0.00 0.00 61.79 61.28 3dqs h SER 127 Cb 0.23 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 62.12 3dqs h SER 127 CO -0.20 0.84 -0.55 1.56 -0.87 0.00 0.00 176.83 177.61 3dqs h GLN 128 N 0.69 0.72 -0.50 4.77 4.20 -0.60 -1.66 115.11 122.73 3dqs h GLN 128 Ca 0.13 -0.46 -0.08 0.00 0.06 0.00 0.00 58.65 58.30 3dqs h GLN 128 Cb 0.52 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.33 3dqs h GLN 128 CO 0.03 1.08 -0.01 0.00 -0.67 0.00 0.00 178.83 179.26 3dqs h ALA 129 N 0.83 0.68 -0.52 3.87 0.00 0.26 -1.34 119.26 123.03 3dqs h ALA 129 Ca 0.01 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 3dqs h ALA 129 Cb 1.12 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 3dqs h ALA 129 CO 0.11 0.50 0.06 0.00 0.00 0.00 0.00 179.25 179.92 3dqs h ARG 130 N 0.76 0.88 -0.74 0.00 3.08 -0.42 -0.76 114.38 117.18 3dqs h ARG 130 Ca 0.14 -0.25 0.02 0.00 0.07 0.00 0.00 59.98 59.95 3dqs h ARG 130 Cb 0.54 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.45 3dqs h ARG 130 CO 0.03 0.88 0.48 0.22 -1.07 0.00 0.00 179.97 180.51 3dqs h ASP 131 N 0.76 0.82 -0.37 7.04 3.58 -1.13 -0.34 116.42 126.78 3dqs h ASP 131 Ca 0.15 -0.02 -0.05 0.00 0.42 0.00 0.00 57.03 57.54 3dqs h ASP 131 Cb 0.45 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.28 3dqs h ASP 131 CO 0.02 0.59 0.04 0.15 -2.88 0.00 0.00 179.24 177.15 3dqs h PHE 132 N 0.97 0.68 -0.62 0.28 3.57 -0.88 -1.30 116.94 119.64 3dqs h PHE 132 Ca 0.28 -0.10 -0.04 0.00 3.53 0.00 0.00 57.97 61.64 3dqs h PHE 132 Cb -0.07 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.46 3dqs h PHE 132 CO -0.03 0.70 0.24 0.82 -2.23 0.00 0.00 178.31 177.81 3dqs h ILE 133 N 0.46 1.22 -0.64 1.41 1.08 -0.84 0.56 117.51 120.77 3dqs h ILE 133 Ca 0.11 -0.70 -0.09 0.00 -0.39 0.00 0.00 64.86 63.80 3dqs h ILE 133 Cb 0.40 0.49 -0.02 0.00 -3.07 0.00 0.00 36.82 34.61 3dqs h ILE 133 CO 0.01 0.28 0.06 0.78 -0.69 0.00 0.00 178.15 178.59 3dqs h ASN 134 N 0.89 1.05 -0.45 1.72 2.35 -0.87 -0.34 115.58 119.93 3dqs h ASN 134 Ca 0.21 -0.27 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 3dqs h ASN 134 Cb 0.18 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 3dqs h ASN 134 CO -0.02 1.07 0.29 1.56 -1.65 0.00 0.00 177.43 178.68 3dqs h GLN 135 N 1.00 0.61 0.15 0.81 4.20 -0.35 -0.28 115.11 121.26 3dqs h GLN 135 Ca 0.19 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.85 3dqs h GLN 135 Cb 0.50 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.14 3dqs h GLN 135 CO 0.02 0.42 -0.07 -0.92 -0.67 0.00 0.00 178.83 177.61 3dqs h TYR 136 N 0.61 -0.19 -0.02 2.96 3.20 -0.58 -1.19 116.97 121.76 3dqs h TYR 136 Ca 0.17 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.98 3dqs h TYR 136 Cb -0.04 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.28 3dqs h TYR 136 CO -0.04 -0.07 -0.22 1.88 -1.64 0.00 0.00 178.16 178.08 3dqs h TYR 137 N -0.27 0.04 -0.44 -3.82 -1.99 -0.93 -1.90 116.97 107.66 3dqs h TYR 137 Ca -0.02 -0.00 -0.12 0.00 2.00 0.00 0.00 58.73 60.58 3dqs h TYR 137 Cb 0.21 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 38.91 3dqs h TYR 137 CO -0.05 0.25 -0.20 0.77 -0.00 0.00 0.00 178.16 178.93 3dqs h SER 138 N 0.03 0.90 0.52 3.88 0.02 -0.84 -0.07 113.55 117.99 3dqs h SER 138 Ca 0.00 -0.33 -0.03 0.00 -0.84 0.00 0.00 61.79 60.60 3dqs h SER 138 Cb 0.40 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.69 3dqs h SER 138 CO 0.03 1.07 -0.15 0.77 -1.14 0.00 0.00 176.83 177.41 3dqs h SER 139 N 0.77 0.00 -0.54 3.07 4.64 -0.43 -1.81 113.55 119.26 3dqs h SER 139 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3dqs h SER 139 Cb 0.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 3dqs h SER 139 CO 0.06 0.15 0.00 2.30 -0.87 0.00 0.00 176.83 178.47 3dqs n ILE 140 N -3.57 1.11 -3.50 0.95 -5.35 -0.96 -4.98 119.36 103.05 3dqs n ILE 140 Ca -0.01 -1.05 -0.22 0.00 -0.27 0.00 0.00 62.75 61.20 3dqs n ILE 140 Cb 0.29 0.45 0.07 0.00 -1.74 0.00 0.00 39.64 38.71 3dqs n ILE 140 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 3dqs n LYS 141 N 1.03 -7.32 -1.41 6.28 4.76 -0.68 -4.92 118.16 115.89 3dqs n LYS 141 Ca 0.19 0.77 0.02 0.00 -2.87 0.00 0.00 58.31 56.41 3dqs n LYS 141 Cb 0.57 -5.63 0.09 0.00 -1.84 0.00 0.00 35.03 28.21 3dqs n LYS 141 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3dqs n ARG 142 N -4.63 1.04 -2.12 1.97 5.12 -0.12 -5.03 116.66 112.90 3dqs n ARG 142 Ca -0.01 -2.80 -0.42 0.00 -1.93 0.00 0.00 57.85 52.69 3dqs n ARG 142 Cb 0.56 -0.92 -0.03 0.00 -1.16 0.00 0.00 32.46 30.91 3dqs n ARG 142 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3dqs s SER 143 N -2.76 6.77 0.00 0.55 0.15 -1.21 -2.08 113.70 115.11 3dqs s SER 143 Ca 0.36 2.25 0.00 0.00 0.70 0.00 0.00 55.95 59.26 3dqs s SER 143 Cb 0.38 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 62.12 3dqs s SER 143 CO -0.10 -0.77 0.00 0.61 1.20 0.00 0.00 173.24 174.18 3dqs n GLY 144 N 3.75 0.80 3.73 9.45 0.00 -1.26 -5.05 105.19 116.61 3dqs n GLY 144 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 3dqs n GLY 144 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dqs s SER 145 N -2.70 2.99 0.18 1.61 1.04 -0.88 -4.82 113.70 111.12 3dqs s SER 145 Ca 0.00 1.02 -0.13 0.00 0.48 0.00 0.00 55.95 57.32 3dqs s SER 145 Cb 0.00 -1.61 0.08 0.00 0.10 0.00 0.00 66.02 64.59 3dqs s SER 145 CO 0.00 -2.88 1.82 -0.61 0.98 0.00 0.00 173.24 172.55 3dqs h GLN 146 N -1.72 0.80 -0.73 4.02 4.15 -1.97 -1.34 115.11 118.32 3dqs h GLN 146 Ca -0.52 -0.07 -0.05 0.00 0.77 0.00 0.00 58.65 58.78 3dqs h GLN 146 Cb 1.33 -0.17 -0.03 0.00 0.21 0.00 0.00 27.48 28.82 3dqs h GLN 146 CO 0.59 0.58 0.27 0.00 -1.93 0.00 0.00 178.83 178.33 3dqs h ALA 147 N 1.18 1.10 -0.02 3.38 0.00 -1.93 0.49 119.26 123.46 3dqs h ALA 147 Ca 0.21 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3dqs h ALA 147 Cb -0.02 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 3dqs h ALA 147 CO -0.04 0.63 0.01 1.25 0.00 0.00 0.00 179.25 181.10 3dqs h HIS 148 N 1.06 0.03 -0.54 0.00 -0.00 -1.68 0.24 115.15 114.26 3dqs h HIS 148 Ca 0.24 -0.00 -0.07 0.00 -0.00 0.00 0.00 60.37 60.54 3dqs h HIS 148 Cb 0.23 -0.01 -0.02 0.00 -0.00 0.00 0.00 27.41 27.61 3dqs h HIS 148 CO 0.02 0.14 0.07 0.93 -0.00 0.00 0.00 177.93 179.10 3dqs h GLU 149 N -0.10 0.87 -0.59 5.26 4.39 -1.04 -1.82 114.58 121.56 3dqs h GLU 149 Ca 0.01 -0.21 -0.09 0.00 0.34 0.00 0.00 59.36 59.40 3dqs h GLU 149 Cb 0.13 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 3dqs h GLU 149 CO -0.00 0.82 0.00 0.93 -1.16 0.00 0.00 179.01 179.60 3dqs h GLU 150 N 0.82 1.03 -0.53 2.33 5.08 -0.70 -1.54 114.58 121.07 3dqs h GLU 150 Ca 0.17 -0.33 -0.06 0.00 -1.00 0.00 0.00 59.36 58.14 3dqs h GLU 150 Cb 0.39 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 3dqs h GLU 150 CO 0.01 1.02 0.11 -0.09 -1.00 0.00 0.00 179.01 179.06 3dqs h ARG 151 N 0.93 0.87 -0.84 2.33 9.65 -0.67 0.05 114.38 126.69 3dqs h ARG 151 Ca 0.17 -0.22 0.02 0.00 -1.10 0.00 0.00 59.98 58.84 3dqs h ARG 151 Cb 0.55 -0.11 -0.05 0.00 -1.39 0.00 0.00 29.97 28.98 3dqs h ARG 151 CO 0.03 0.83 0.55 -0.07 2.80 0.00 0.00 179.97 184.11 3dqs h LEU 152 N 0.76 0.94 -0.82 3.80 3.38 -1.12 0.32 115.31 122.56 3dqs h LEU 152 Ca 0.16 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 58.01 3dqs h LEU 152 Cb 0.37 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3dqs h LEU 152 CO 0.01 0.66 -0.25 1.56 0.09 0.00 0.00 178.44 180.51 3dqs h GLN 153 N 1.10 0.61 -0.34 1.13 4.20 -0.95 -2.08 115.11 118.77 3dqs h GLN 153 Ca 0.32 -0.24 -0.04 0.00 0.06 0.00 0.00 58.65 58.75 3dqs h GLN 153 Cb -0.07 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 3dqs h GLN 153 CO -0.09 0.80 0.06 1.49 -0.67 0.00 0.00 178.83 180.43 3dqs h GLU 154 N 0.53 0.56 -0.47 1.46 4.81 -0.13 -1.38 114.58 119.96 3dqs h GLU 154 Ca 0.07 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 59.11 3dqs h GLU 154 Cb 0.71 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.00 3dqs h GLU 154 CO 0.05 0.64 0.13 0.28 -0.73 0.00 0.00 179.01 179.38 3dqs h VAL 155 N 0.40 1.23 -0.62 0.32 2.07 -0.80 -1.24 116.25 117.61 3dqs h VAL 155 Ca 0.10 -0.80 -0.01 0.00 0.82 0.00 0.00 66.70 66.82 3dqs h VAL 155 Cb 0.34 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 3dqs h VAL 155 CO 0.01 0.29 0.34 -0.33 0.02 0.00 0.00 177.57 177.89 3dqs h GLU 156 N 0.63 0.87 -0.45 1.57 5.08 -1.31 -0.81 114.58 120.16 3dqs h GLU 156 Ca 0.15 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 3dqs h GLU 156 Cb 0.30 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 3dqs h GLU 156 CO -0.00 0.66 0.16 0.00 -1.00 0.00 0.00 179.01 178.83 3dqs h ALA 157 N 1.16 0.59 -0.66 3.43 0.00 -1.06 0.38 119.26 123.10 3dqs h ALA 157 Ca 0.22 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3dqs h ALA 157 Cb 0.05 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3dqs h ALA 157 CO -0.03 0.21 0.23 1.49 0.00 0.00 0.00 179.25 181.15 3dqs h GLU 158 N 0.59 1.01 -0.37 0.00 4.81 -0.96 -1.09 114.58 118.57 3dqs h GLU 158 Ca 0.15 -0.20 -0.15 0.00 -0.13 0.00 0.00 59.36 59.03 3dqs h GLU 158 Cb 0.23 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 3dqs h GLU 158 CO -0.01 0.87 -0.35 0.28 -0.73 0.00 0.00 179.01 179.07 3dqs h VAL 159 N 0.94 1.28 -0.28 0.32 2.07 -0.76 -0.37 116.25 119.46 3dqs h VAL 159 Ca 0.21 -1.52 0.07 0.00 0.82 0.00 0.00 66.70 66.28 3dqs h VAL 159 Cb 0.26 1.41 -0.07 0.00 -1.52 0.00 0.00 31.29 31.38 3dqs h VAL 159 CO -0.01 0.51 -0.20 0.00 0.02 0.00 0.00 177.57 177.88 3dqs h ALA 160 N 0.76 -0.03 0.00 1.67 0.00 0.18 0.40 119.26 122.24 3dqs h ALA 160 Ca 0.06 0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 3dqs h ALA 160 Cb 0.94 0.45 -0.02 0.00 0.00 0.00 0.00 17.79 19.16 3dqs h ALA 160 CO 0.09 -0.61 -0.81 0.66 0.00 0.00 0.00 179.25 178.58 3dqs h SER 161 N -0.18 0.00 0.00 0.00 4.64 -1.18 -3.40 113.55 113.42 3dqs h SER 161 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 3dqs h SER 161 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 3dqs h SER 161 CO -0.39 0.51 -0.84 0.35 -0.87 0.00 0.00 176.83 175.59 3dqs n THR 162 N -3.10 0.00 0.00 2.95 -2.24 -0.15 -5.02 114.28 106.71 3dqs n THR 162 Ca -0.02 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 3dqs n THR 162 Cb 0.76 0.58 0.00 0.00 -2.10 0.00 0.00 70.33 69.57 3dqs n THR 162 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dqs n GLY 163 N 2.16 1.85 0.35 3.38 0.00 0.14 -5.00 105.19 108.07 3dqs n GLY 163 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 3dqs n GLY 163 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3dqs n THR 164 N -2.00 0.00 -3.91 2.61 5.66 -1.26 -4.67 114.28 110.70 3dqs n THR 164 Ca 0.00 -0.23 -0.09 0.00 -3.05 0.00 0.00 64.05 60.68 3dqs n THR 164 Cb 0.00 0.12 -0.02 0.00 -1.55 0.00 0.00 70.33 68.89 3dqs n THR 164 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 3dqs s TYR 165 N -3.21 0.25 0.08 1.09 -0.85 -1.26 -2.36 117.35 111.09 3dqs s TYR 165 Ca 0.04 -0.72 0.07 0.00 -0.52 0.00 0.00 57.07 55.93 3dqs s TYR 165 Cb 0.00 0.50 -0.03 0.00 0.38 0.00 0.00 41.96 42.81 3dqs s TYR 165 CO 0.03 -1.28 -0.18 -1.01 -1.52 0.00 0.00 175.55 171.59 3dqs s HIS 166 N -3.26 1.51 0.24 -3.49 3.76 -1.26 -5.04 115.29 107.75 3dqs s HIS 166 Ca 0.18 -0.43 -0.12 0.00 -0.15 0.00 0.00 55.06 54.55 3dqs s HIS 166 Cb -0.04 -0.85 -0.08 0.00 1.11 0.00 0.00 32.58 32.73 3dqs s HIS 166 CO 0.11 0.12 0.59 -0.51 -0.85 0.00 0.00 174.74 174.21 3dqs s LEU 167 N -1.72 4.17 0.68 0.89 1.43 -1.26 -5.06 118.68 117.81 3dqs s LEU 167 Ca 0.03 1.03 -0.11 0.00 -1.03 0.00 0.00 54.13 54.05 3dqs s LEU 167 Cb -0.10 -3.71 -0.00 0.00 0.03 0.00 0.00 46.19 42.41 3dqs s LEU 167 CO 0.03 -0.07 1.06 -0.13 0.23 0.00 0.00 176.35 177.47 3dqs s ARG 168 N -2.71 3.11 0.15 1.70 0.52 -1.26 -4.85 118.95 115.61 3dqs s ARG 168 Ca 0.47 0.69 -0.24 0.00 -0.52 0.00 0.00 55.73 56.13 3dqs s ARG 168 Cb -0.12 -2.03 0.02 0.00 0.52 0.00 0.00 34.95 33.35 3dqs s ARG 168 CO 0.20 -0.91 1.61 1.49 0.02 0.00 0.00 175.30 177.72 3dqs h GLU 169 N -0.57 -0.29 0.00 3.54 4.81 -2.00 -1.55 114.58 118.52 3dqs h GLU 169 Ca -0.45 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 58.76 3dqs h GLU 169 Cb 1.22 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.66 3dqs h GLU 169 CO 0.61 -0.19 -0.19 0.66 -0.73 0.00 0.00 179.01 179.17 3dqs h SER 170 N -0.30 0.00 -0.43 1.04 4.64 -2.00 -2.08 113.55 114.42 3dqs h SER 170 Ca 0.14 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.31 3dqs h SER 170 Cb 0.51 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 3dqs h SER 170 CO -0.42 0.19 -0.30 -0.33 -0.87 0.00 0.00 176.83 175.10 3dqs h GLU 171 N 0.00 0.97 -0.45 4.77 5.08 -1.72 -1.32 114.58 121.91 3dqs h GLU 171 Ca -0.00 -0.46 -0.03 0.00 -1.00 0.00 0.00 59.36 57.86 3dqs h GLU 171 Cb 0.36 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 3dqs h GLU 171 CO 0.02 1.13 0.15 1.25 -1.00 0.00 0.00 179.01 180.56 3dqs h LEU 172 N 0.81 0.64 -0.11 1.33 5.85 -0.67 0.58 115.31 123.75 3dqs h LEU 172 Ca 0.09 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.62 3dqs h LEU 172 Cb 0.89 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 3dqs h LEU 172 CO 0.08 0.67 0.03 0.58 -0.34 0.00 0.00 178.44 179.46 3dqs h VAL 173 N 0.58 0.97 -0.62 1.05 2.07 -1.31 -0.09 116.25 118.92 3dqs h VAL 173 Ca 0.15 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.64 3dqs h VAL 173 Cb 0.25 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 3dqs h VAL 173 CO -0.01 0.02 0.38 0.15 0.02 0.00 0.00 177.57 178.13 3dqs h PHE 174 N 0.09 0.81 -0.57 1.57 3.57 -1.09 -2.48 116.94 118.83 3dqs h PHE 174 Ca 0.04 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 3dqs h PHE 174 Cb 0.02 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.47 3dqs h PHE 174 CO -0.10 0.54 0.22 0.78 -2.23 0.00 0.00 178.31 177.52 3dqs h GLY 175 N 0.84 0.92 0.96 2.40 0.00 -0.51 -0.88 103.07 106.81 3dqs h GLY 175 Ca 0.22 -0.50 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 3dqs h GLY 175 CO -0.04 0.47 0.20 0.00 0.00 0.00 0.00 176.54 177.17 3dqs h ALA 176 N 1.07 0.61 -0.67 3.60 0.00 -0.90 -0.98 119.26 122.00 3dqs h ALA 176 Ca 0.19 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 3dqs h ALA 176 Cb 0.21 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3dqs h ALA 176 CO -0.01 0.21 0.12 0.87 0.00 0.00 0.00 179.25 180.43 3dqs h LYS 177 N 0.62 1.10 -0.66 0.00 1.57 -1.30 -2.62 116.57 115.27 3dqs h LYS 177 Ca 0.16 -0.29 -0.05 0.00 -1.87 0.00 0.00 60.65 58.60 3dqs h LYS 177 Cb 0.17 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 3dqs h LYS 177 CO -0.01 1.00 0.21 1.96 -0.57 0.00 0.00 179.45 182.03 3dqs h GLN 178 N 1.03 1.00 -0.81 3.15 1.08 -0.86 -0.18 115.11 119.52 3dqs h GLN 178 Ca 0.20 -0.20 -0.02 0.00 -1.45 0.00 0.00 58.65 57.19 3dqs h GLN 178 Cb 0.43 -0.15 -0.04 0.00 -0.05 0.00 0.00 27.48 27.67 3dqs h GLN 178 CO 0.01 0.85 0.41 0.00 -0.95 0.00 0.00 178.83 179.16 3dqs h ALA 179 N 1.26 1.21 0.03 3.87 0.00 -0.92 0.46 119.26 125.16 3dqs h ALA 179 Ca 0.22 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3dqs h ALA 179 Cb 0.27 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3dqs h ALA 179 CO -0.01 0.62 -0.01 2.35 0.00 0.00 0.00 179.25 182.20 3dqs h TRP 180 N 1.14 -0.03 -0.91 0.00 7.01 -1.10 -2.48 115.95 119.57 3dqs h TRP 180 Ca 0.28 -0.00 0.18 0.00 2.11 0.00 0.00 58.89 61.46 3dqs h TRP 180 Cb 0.07 0.01 -0.07 0.00 -2.10 0.00 0.00 29.16 27.07 3dqs h TRP 180 CO 0.01 0.39 0.59 -0.09 -2.79 0.00 0.00 178.44 176.56 3dqs h ARG 181 N -0.47 0.56 0.00 2.65 2.43 -0.59 -1.63 114.38 117.34 3dqs h ARG 181 Ca -0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3dqs h ARG 181 Cb 0.44 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 3dqs h ARG 181 CO 0.01 0.37 -0.11 0.09 -1.51 0.00 0.00 179.97 178.82 3dqs n ASN 182 N -4.57 0.63 -4.56 -3.80 3.02 0.16 -4.85 115.26 101.28 3dqs n ASN 182 Ca 0.19 0.47 -0.38 0.00 -0.03 0.00 0.00 54.58 54.82 3dqs n ASN 182 Cb 0.58 -0.57 -0.03 0.00 -0.61 0.00 0.00 39.78 39.16 3dqs n ASN 182 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3dqs s ALA 183 N -3.09 2.03 0.59 5.41 0.00 -0.61 -4.71 121.76 121.38 3dqs s ALA 183 Ca 0.11 0.02 0.29 0.00 0.00 0.00 0.00 51.96 52.38 3dqs s ALA 183 Cb 0.14 -4.26 1.74 0.00 0.00 0.00 0.00 23.12 20.73 3dqs s ALA 183 CO 0.60 -3.92 2.18 -1.35 0.00 0.00 0.00 175.76 173.28 3dqs h PRO 184 N 17.29 0.00 -0.05 0.00 0.11 -1.89 -2.81 132.00 144.65 3dqs h PRO 184 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3dqs h PRO 184 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3dqs h PRO 184 CO 1.13 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 179.46 3dqs n ARG 185 N -3.83 1.94 -3.45 1.05 1.74 -1.26 -0.71 116.66 112.14 3dqs n ARG 185 Ca -0.01 -1.37 -0.39 0.00 -0.77 0.00 0.00 57.85 55.31 3dqs n ARG 185 Cb 0.20 -1.47 -0.10 0.00 -1.02 0.00 0.00 32.46 30.08 3dqs n ARG 185 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3dqs n VAL 187 N 5.06 0.00 -0.30 0.00 3.14 -1.26 -3.90 118.33 121.07 3dqs n VAL 187 Ca -0.10 -0.03 0.06 0.00 -2.96 0.00 0.00 64.34 61.31 3dqs n VAL 187 Cb 0.51 -0.06 0.30 0.00 -1.06 0.00 0.00 33.84 33.53 3dqs n VAL 187 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3dqs n GLY 188 N 1.40 2.41 0.00 7.55 0.00 -1.26 -4.47 105.19 110.81 3dqs n GLY 188 Ca 0.10 -0.69 0.04 0.00 0.00 0.00 0.00 46.02 45.48 3dqs n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dqs n ARG 189 N 0.65 0.11 0.24 1.61 1.74 -1.25 -2.10 116.66 117.66 3dqs n ARG 189 Ca 0.21 0.22 0.08 0.00 -0.77 0.00 0.00 57.85 57.59 3dqs n ARG 189 Cb 0.86 -1.50 0.63 0.00 -1.02 0.00 0.00 32.46 31.43 3dqs n ARG 189 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 3dqs h ILE 190 N 0.00 1.01 -0.00 0.55 6.09 -1.85 -1.35 117.51 121.96 3dqs h ILE 190 Ca 0.00 -0.01 0.00 0.00 -1.37 0.00 0.00 64.86 63.48 3dqs h ILE 190 Cb 0.09 0.97 0.00 0.00 0.47 0.00 0.00 36.82 38.35 3dqs h ILE 190 CO 0.00 0.01 -0.02 0.00 -3.07 0.00 0.00 178.15 175.07 3dqs n GLN 191 N -4.54 0.99 -0.33 2.19 1.13 -0.89 -4.54 117.38 111.38 3dqs n GLN 191 Ca -0.03 -0.21 0.29 0.00 -1.94 0.00 0.00 57.00 55.12 3dqs n GLN 191 Cb 0.09 -1.50 0.62 0.00 0.11 0.00 0.00 30.24 29.56 3dqs n GLN 191 CO 0.00 0.00 0.00 0.11 -1.44 0.00 0.00 177.06 175.73 3dqs h TRP 192 N 0.51 0.38 0.00 1.08 5.08 -1.43 0.83 115.95 122.40 3dqs h TRP 192 Ca 0.00 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.98 3dqs h TRP 192 Cb 0.19 -0.11 0.00 0.00 -3.00 0.00 0.00 29.16 26.24 3dqs h TRP 192 CO 0.00 0.01 0.00 0.41 -1.28 0.00 0.00 178.44 177.58 3dqs n GLY 193 N -1.60 -1.45 3.13 11.11 0.00 -1.26 -4.33 105.19 110.79 3dqs n GLY 193 Ca 0.26 0.02 -0.38 0.00 0.00 0.00 0.00 46.02 45.92 3dqs n GLY 193 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dqs s LYS 194 N -3.18 2.66 -0.05 1.61 2.20 0.28 -5.01 119.74 118.25 3dqs s LYS 194 Ca 0.08 -2.44 -0.02 0.00 -0.36 0.00 0.00 55.97 53.22 3dqs s LYS 194 Cb 0.11 -3.82 0.04 0.00 -1.51 0.00 0.00 37.83 32.65 3dqs s LYS 194 CO 0.48 -1.18 0.10 -1.17 -0.36 0.00 0.00 175.35 173.21 3dqs s LEU 195 N 0.11 0.40 -0.35 5.43 2.96 -1.26 -4.64 118.68 121.32 3dqs s LEU 195 Ca 0.16 0.19 -0.27 0.00 -0.22 0.00 0.00 54.13 53.99 3dqs s LEU 195 Cb -0.19 0.09 0.01 0.00 0.50 0.00 0.00 46.19 46.60 3dqs s LEU 195 CO -0.04 -0.20 0.98 -1.58 -1.32 0.00 0.00 176.35 174.18 3dqs s GLN 196 N 1.77 3.94 -0.43 1.98 2.00 -0.74 -4.98 119.66 123.19 3dqs s GLN 196 Ca -0.01 0.77 -0.14 0.00 -2.00 0.00 0.00 55.36 53.97 3dqs s GLN 196 Cb -0.12 -3.77 0.05 0.00 0.80 0.00 0.00 33.01 29.96 3dqs s GLN 196 CO -0.04 -0.92 0.32 0.08 -0.50 0.00 0.00 175.29 174.23 3dqs s VAL 197 N 3.53 5.03 -0.29 1.34 1.01 -1.26 -1.59 120.40 128.17 3dqs s VAL 197 Ca 0.41 -0.94 -0.21 0.00 0.00 0.00 0.00 61.98 61.23 3dqs s VAL 197 Cb -0.12 -3.91 -0.01 0.00 0.00 0.00 0.00 36.38 32.34 3dqs s VAL 197 CO 0.17 -0.43 0.69 -0.36 0.00 0.00 0.00 175.10 175.17 3dqs s PHE 198 N 1.62 3.24 -0.41 5.22 0.08 0.66 -4.99 117.98 123.38 3dqs s PHE 198 Ca 0.04 0.75 -0.24 0.00 0.12 0.00 0.00 56.93 57.59 3dqs s PHE 198 Cb -0.22 -3.02 0.02 0.00 -0.57 0.00 0.00 43.02 39.24 3dqs s PHE 198 CO 0.07 -0.45 0.85 0.34 -0.10 0.00 0.00 175.22 175.93 3dqs s ASP 199 N 1.57 6.53 -0.24 1.36 3.68 -1.26 -0.85 116.67 127.45 3dqs s ASP 199 Ca 0.28 0.22 0.09 0.00 2.13 0.00 0.00 52.55 55.27 3dqs s ASP 199 Cb -0.15 -2.42 0.44 0.00 -1.45 0.00 0.00 42.92 39.34 3dqs s ASP 199 CO 0.11 -0.89 1.21 0.00 0.13 0.00 0.00 175.17 175.73 3dqs n ALA 200 N 6.76 4.25 1.34 3.66 0.00 0.12 -4.77 120.51 131.87 3dqs n ALA 200 Ca 0.04 -3.51 0.09 0.00 0.00 0.00 0.00 53.44 50.06 3dqs n ALA 200 Cb 0.48 -0.34 0.51 0.00 0.00 0.00 0.00 19.45 20.10 3dqs n ALA 200 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3dqs n ARG 201 N -0.95 0.67 0.00 0.00 1.74 -1.04 -1.96 116.66 115.13 3dqs n ARG 201 Ca 0.30 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.48 3dqs n ARG 201 Cb 0.81 -1.40 -0.09 0.00 -1.02 0.00 0.00 32.46 30.76 3dqs n ARG 201 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3dqs n ASP 202 N -0.90 1.18 -4.66 0.55 5.75 -1.26 -4.51 116.55 112.69 3dqs n ASP 202 Ca 0.13 -1.08 -0.47 0.00 -0.01 0.00 0.00 54.79 53.36 3dqs n ASP 202 Cb 0.06 0.89 -0.04 0.00 -1.03 0.00 0.00 41.12 40.99 3dqs n ASP 202 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3dqs n SER 204 N 3.63 1.12 -3.61 0.00 3.41 -1.26 -4.74 113.62 112.16 3dqs n SER 204 Ca 0.18 -1.90 -0.11 0.00 -0.26 0.00 0.00 58.87 56.78 3dqs n SER 204 Cb 0.28 -0.11 -0.04 0.00 -0.26 0.00 0.00 64.21 64.08 3dqs n SER 204 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3dqs s SER 205 N -1.05 -0.32 0.22 4.04 1.04 -1.26 -4.97 113.70 111.40 3dqs s SER 205 Ca 0.06 -0.29 -0.06 0.00 0.48 0.00 0.00 55.95 56.14 3dqs s SER 205 Cb 0.05 0.53 0.20 0.00 0.10 0.00 0.00 66.02 66.90 3dqs s SER 205 CO 0.01 -0.93 1.74 0.00 0.98 0.00 0.00 173.24 175.03 3dqs h ALA 206 N 2.24 1.02 -0.73 5.32 0.00 -1.92 -1.20 119.26 123.99 3dqs h ALA 206 Ca -0.33 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.35 3dqs h ALA 206 Cb 1.27 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 3dqs h ALA 206 CO 0.42 0.64 0.48 0.37 0.00 0.00 0.00 179.25 181.16 3dqs h GLN 207 N 1.00 0.96 -0.29 0.00 5.75 -1.96 -1.25 115.11 119.32 3dqs h GLN 207 Ca 0.21 -0.06 -0.13 0.00 -0.15 0.00 0.00 58.65 58.51 3dqs h GLN 207 Cb 0.36 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 28.69 3dqs h GLN 207 CO 0.00 0.64 -0.36 1.49 -2.65 0.00 0.00 178.83 177.96 3dqs h GLU 208 N 0.99 0.66 -0.99 1.69 4.81 -1.89 -2.15 114.58 117.71 3dqs h GLU 208 Ca 0.27 -0.32 0.08 0.00 -0.13 0.00 0.00 59.36 59.26 3dqs h GLU 208 Cb -0.10 -0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.20 3dqs h GLU 208 CO -0.06 0.92 0.63 0.52 -0.73 0.00 0.00 179.01 180.29 3dqs h MET 209 N 0.55 1.06 -0.68 1.92 2.86 -0.47 -0.60 114.93 119.57 3dqs h MET 209 Ca 0.06 -0.06 -0.05 0.00 -2.06 0.00 0.00 59.70 57.58 3dqs h MET 209 Cb 0.87 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 32.26 3dqs h MET 209 CO 0.08 0.70 0.22 0.35 1.06 0.00 0.00 176.91 179.32 3dqs h PHE 210 N 1.09 1.09 -0.01 -0.22 3.04 -0.74 -0.62 116.94 120.58 3dqs h PHE 210 Ca 0.45 -0.11 0.00 0.00 3.98 0.00 0.00 57.97 62.29 3dqs h PHE 210 Cb 0.28 -0.32 -0.00 0.00 2.56 0.00 0.00 35.95 38.47 3dqs h PHE 210 CO -0.01 0.87 0.00 1.15 -2.02 0.00 0.00 178.31 178.31 3dqs h THR 211 N 0.99 1.00 -0.72 4.41 2.02 -0.57 -0.95 112.91 119.10 3dqs h THR 211 Ca 0.22 -0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.44 3dqs h THR 211 Cb 0.29 0.99 -0.05 0.00 -1.74 0.00 0.00 68.15 67.64 3dqs h THR 211 CO -0.01 0.00 0.44 1.88 0.37 0.00 0.00 175.52 178.20 3dqs h TYR 212 N 0.01 0.81 -0.60 3.16 -1.99 -0.95 -1.47 116.97 115.93 3dqs h TYR 212 Ca 0.00 0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.72 3dqs h TYR 212 Cb 0.00 -0.26 -0.03 0.00 2.00 0.00 0.00 36.73 38.44 3dqs h TYR 212 CO -0.08 0.43 0.23 0.82 -0.00 0.00 0.00 178.16 179.56 3dqs h ILE 213 N 0.83 1.23 -0.70 -2.88 2.04 -0.82 -0.50 117.51 116.71 3dqs h ILE 213 Ca 0.30 -0.74 -0.05 0.00 1.00 0.00 0.00 64.86 65.37 3dqs h ILE 213 Cb 0.09 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 36.73 3dqs h ILE 213 CO -0.14 0.29 0.23 0.00 0.00 0.00 0.00 178.15 178.53 3dqs h ASN 215 N 1.03 0.87 0.24 0.00 2.35 -0.95 -1.51 115.58 117.63 3dqs h ASN 215 Ca 0.23 -0.30 -0.01 0.00 -0.55 0.00 0.00 56.30 55.67 3dqs h ASN 215 Cb 0.27 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 3dqs h ASN 215 CO -0.01 1.03 -0.16 -0.74 -1.65 0.00 0.00 177.43 175.90 3dqs h HIS 216 N 0.76 -0.42 -0.89 1.19 2.76 -0.51 -0.08 115.15 117.96 3dqs h HIS 216 Ca 0.11 -0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.35 3dqs h HIS 216 Cb 0.70 0.15 -0.06 0.00 1.55 0.00 0.00 27.41 29.75 3dqs h HIS 216 CO 0.04 -0.25 0.55 0.82 -1.30 0.00 0.00 177.93 177.79 3dqs h ILE 217 N -0.40 1.04 -0.12 6.26 2.04 -1.05 0.27 117.51 125.55 3dqs h ILE 217 Ca -0.02 -0.34 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 3dqs h ILE 217 Cb 0.34 -0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 36.36 3dqs h ILE 217 CO 0.01 0.18 0.02 0.11 0.00 0.00 0.00 178.15 178.47 3dqs h LYS 218 N 1.00 0.21 -0.18 2.37 1.57 -0.94 -0.68 116.57 119.92 3dqs h LYS 218 Ca 0.39 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 59.10 3dqs h LYS 218 Cb 0.20 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 3dqs h LYS 218 CO -0.18 0.41 0.07 -0.92 -0.57 0.00 0.00 179.45 178.26 3dqs h TYR 219 N -0.03 0.28 -0.61 -1.35 5.03 -0.52 -1.42 116.97 118.35 3dqs h TYR 219 Ca 0.04 -0.02 -0.07 0.00 2.58 0.00 0.00 58.73 61.25 3dqs h TYR 219 Cb 0.31 -0.08 -0.02 0.00 1.55 0.00 0.00 36.73 38.48 3dqs h TYR 219 CO 0.02 0.34 0.10 0.00 -1.32 0.00 0.00 178.16 177.29 3dqs h ALA 220 N 0.91 0.81 -0.21 1.82 0.00 -0.48 -3.18 119.26 118.93 3dqs h ALA 220 Ca 0.06 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 3dqs h ALA 220 Cb 0.18 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 3dqs h ALA 220 CO -0.00 0.57 -0.15 1.15 0.00 0.00 0.00 179.25 180.81 3dqs h THR 221 N 0.92 1.32 -7.10 0.00 2.02 -1.11 0.29 112.91 109.25 3dqs h THR 221 Ca 0.18 -1.28 -0.62 0.00 0.77 0.00 0.00 66.41 65.47 3dqs h THR 221 Cb 0.43 1.70 -0.24 0.00 -1.74 0.00 0.00 68.15 68.30 3dqs h THR 221 CO 0.01 0.39 -0.95 -3.20 0.37 0.00 0.00 175.52 172.14 3dqs n ASN 222 N -4.49 0.42 -2.82 4.18 5.15 -0.54 -0.24 115.26 116.92 3dqs n ASN 222 Ca -0.05 -1.27 -0.20 0.00 -0.60 0.00 0.00 54.58 52.46 3dqs n ASN 222 Cb 0.37 -1.58 0.01 0.00 -0.53 0.00 0.00 39.78 38.05 3dqs n ASN 222 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3dqs n ARG 223 N -4.46 -3.34 0.00 1.20 1.74 -1.26 -2.39 116.66 108.14 3dqs n ARG 223 Ca -0.24 0.80 0.00 0.00 -0.77 0.00 0.00 57.85 57.64 3dqs n ARG 223 Cb 0.65 -5.54 0.00 0.00 -1.02 0.00 0.00 32.46 26.54 3dqs n ARG 223 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dqs n GLY 224 N -1.20 2.83 3.15 -0.13 0.00 0.67 -4.91 105.19 105.60 3dqs n GLY 224 Ca -0.14 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.45 3dqs n GLY 224 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3dqs n ASN 225 N 0.00 5.93 -4.63 1.61 5.15 -1.01 -0.26 115.26 122.06 3dqs n ASN 225 Ca 0.00 -3.23 -0.41 0.00 -0.60 0.00 0.00 54.58 50.35 3dqs n ASN 225 Cb 0.00 -1.35 0.02 0.00 -0.53 0.00 0.00 39.78 37.92 3dqs n ASN 225 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3dqs n LEU 226 N 2.27 3.04 -3.99 1.20 4.32 -1.24 -4.57 117.00 118.03 3dqs n LEU 226 Ca 0.27 1.00 -0.23 0.00 -0.02 0.00 0.00 56.01 57.04 3dqs n LEU 226 Cb 0.36 -1.38 -0.16 0.00 -1.62 0.00 0.00 43.42 40.61 3dqs n LEU 226 CO 0.63 -1.42 -0.45 -0.13 -1.22 0.00 0.00 177.39 174.81 3dqs s ARG 227 N -2.18 1.34 0.28 3.23 0.52 0.09 -5.00 118.95 117.22 3dqs s ARG 227 Ca 0.65 -0.31 -0.30 0.00 -0.52 0.00 0.00 55.73 55.25 3dqs s ARG 227 Cb -0.52 -1.17 -0.10 0.00 0.52 0.00 0.00 34.95 33.68 3dqs s ARG 227 CO 0.55 0.02 1.44 -1.12 0.02 0.00 0.00 175.30 176.21 3dqs s SER 228 N 0.65 6.61 0.08 0.23 0.01 -1.26 -4.44 113.70 115.57 3dqs s SER 228 Ca -0.12 2.74 -0.22 0.00 1.31 0.00 0.00 55.95 59.66 3dqs s SER 228 Cb -0.14 -2.63 0.05 0.00 0.21 0.00 0.00 66.02 63.51 3dqs s SER 228 CO 0.02 -0.72 0.53 0.00 0.41 0.00 0.00 173.24 173.48 3dqs s ALA 229 N -0.27 -1.35 -0.01 1.44 0.00 -0.54 -1.80 121.76 119.24 3dqs s ALA 229 Ca 0.58 0.50 -0.02 0.00 0.00 0.00 0.00 51.96 53.02 3dqs s ALA 229 Cb -0.43 0.54 0.00 0.00 0.00 0.00 0.00 23.12 23.23 3dqs s ALA 229 CO 0.47 -0.59 0.05 -1.50 0.00 0.00 0.00 175.76 174.20 3dqs s ILE 230 N -2.92 0.02 -0.16 0.00 2.07 -0.62 -0.23 121.20 119.36 3dqs s ILE 230 Ca -0.03 -0.18 0.01 0.00 -1.41 0.00 0.00 60.65 59.04 3dqs s ILE 230 Cb -0.00 -0.14 0.01 0.00 0.13 0.00 0.00 42.46 42.45 3dqs s ILE 230 CO -0.06 -0.10 -0.19 -0.89 -1.91 0.00 0.00 174.94 171.79 3dqs s THR 231 N -0.29 2.24 -0.29 4.00 2.01 -0.48 -0.25 115.64 122.58 3dqs s THR 231 Ca -0.03 -0.90 -0.10 0.00 0.31 0.00 0.00 61.69 60.97 3dqs s THR 231 Cb -0.02 -1.93 -0.02 0.00 0.01 0.00 0.00 72.50 70.54 3dqs s THR 231 CO 0.00 0.53 0.15 -0.69 -0.69 0.00 0.00 174.62 173.92 3dqs s VAL 232 N 1.03 4.73 0.58 3.82 1.01 -0.03 -3.09 120.40 128.45 3dqs s VAL 232 Ca -0.01 -0.23 -0.00 0.00 0.00 0.00 0.00 61.98 61.73 3dqs s VAL 232 Cb -0.14 -3.34 0.04 0.00 0.00 0.00 0.00 36.38 32.94 3dqs s VAL 232 CO -0.06 0.16 0.82 -0.36 0.00 0.00 0.00 175.10 175.66 3dqs s PHE 233 N 1.65 2.89 0.21 5.22 0.08 -0.74 0.16 117.98 127.45 3dqs s PHE 233 Ca 0.06 0.09 -0.31 0.00 0.12 0.00 0.00 56.93 56.88 3dqs s PHE 233 Cb -0.16 -2.82 -0.15 0.00 -0.57 0.00 0.00 43.02 39.31 3dqs s PHE 233 CO 0.07 -0.96 1.12 -2.30 -0.10 0.00 0.00 175.22 173.05 3dqs n PRO 234 N -2.45 1.25 -0.95 0.24 -0.02 -1.25 -4.70 135.00 127.11 3dqs n PRO 234 Ca 0.08 0.44 -0.30 0.00 -2.02 0.00 0.00 63.50 61.70 3dqs n PRO 234 Cb 0.60 -1.90 0.16 0.00 -0.02 0.00 0.00 33.50 32.34 3dqs n PRO 234 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 3dqs s GLN 235 N -0.71 0.85 0.29 -0.52 -2.07 -1.26 -4.62 119.66 111.62 3dqs s GLN 235 Ca 0.69 1.04 -0.29 0.00 -1.82 0.00 0.00 55.36 54.97 3dqs s GLN 235 Cb -0.80 -1.74 -0.10 0.00 -1.09 0.00 0.00 33.01 29.27 3dqs s GLN 235 CO 0.54 -2.59 1.42 1.03 -1.32 0.00 0.00 175.29 174.37 3dqs s ARG 236 N -4.76 4.26 -0.01 9.60 0.52 0.74 -4.91 118.95 124.39 3dqs s ARG 236 Ca 0.65 2.33 0.08 0.00 -0.52 0.00 0.00 55.73 58.27 3dqs s ARG 236 Cb -0.20 -3.08 -0.02 0.00 0.52 0.00 0.00 34.95 32.17 3dqs s ARG 236 CO 0.59 -0.38 -0.25 0.00 0.02 0.00 0.00 175.30 175.28 3dqs s ALA 237 N -0.45 2.25 0.23 2.13 0.00 -1.26 -4.79 121.76 119.86 3dqs s ALA 237 Ca 0.56 -1.14 -0.31 0.00 0.00 0.00 0.00 51.96 51.07 3dqs s ALA 237 Cb -0.42 -0.58 -0.11 0.00 0.00 0.00 0.00 23.12 22.01 3dqs s ALA 237 CO 0.49 0.54 1.60 -1.25 0.00 0.00 0.00 175.76 177.13 3dqs s PRO 238 N -0.79 4.17 -0.81 0.00 0.04 -1.26 -2.91 135.00 133.44 3dqs s PRO 238 Ca 0.11 2.48 -0.00 0.00 0.04 0.00 0.00 61.00 63.63 3dqs s PRO 238 Cb -0.10 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.35 3dqs s PRO 238 CO 0.00 -0.63 0.68 0.41 0.04 0.00 0.00 177.00 177.50 3dqs n GLY 239 N 3.14 -0.09 3.61 0.56 0.00 -1.26 -5.04 105.19 106.11 3dqs n GLY 239 Ca 0.12 -0.09 -0.09 0.00 0.00 0.00 0.00 46.02 45.96 3dqs n GLY 239 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3dqs s ARG 240 N -4.98 0.50 0.77 1.61 3.52 -1.15 -5.17 118.95 114.05 3dqs s ARG 240 Ca 0.03 0.28 -0.11 0.00 -0.13 0.00 0.00 55.73 55.80 3dqs s ARG 240 Cb -0.01 0.24 0.05 0.00 -1.56 0.00 0.00 34.95 33.67 3dqs s ARG 240 CO 0.49 -0.12 1.10 0.20 -0.81 0.00 0.00 175.30 176.15 3dqs s GLY 241 N -0.58 1.73 0.54 8.12 0.00 -1.26 -4.56 107.32 111.30 3dqs s GLY 241 Ca 0.01 0.31 -0.10 0.00 0.00 0.00 0.00 44.72 44.95 3dqs s GLY 241 CO -0.03 0.66 0.92 0.99 0.00 0.00 0.00 173.10 175.64 3dqs s ASP 242 N -3.28 6.31 0.01 1.64 -0.00 -1.26 -4.40 116.67 115.69 3dqs s ASP 242 Ca 0.62 1.25 -0.19 0.00 -0.00 0.00 0.00 52.55 54.22 3dqs s ASP 242 Cb -0.18 -2.39 -0.06 0.00 -0.00 0.00 0.00 42.92 40.30 3dqs s ASP 242 CO 0.55 -0.70 0.55 -0.36 -0.00 0.00 0.00 175.17 175.21 3dqs s PHE 243 N -2.90 3.72 -0.07 4.23 0.40 -1.26 -3.61 117.98 118.48 3dqs s PHE 243 Ca 0.53 1.17 -0.10 0.00 -0.60 0.00 0.00 56.93 57.93 3dqs s PHE 243 Cb -0.11 -2.53 0.02 0.00 0.51 0.00 0.00 43.02 40.92 3dqs s PHE 243 CO 0.47 0.45 0.25 1.03 0.70 0.00 0.00 175.22 178.12 3dqs s ARG 244 N -0.53 0.38 -0.23 0.44 1.81 -0.11 -3.53 118.95 117.18 3dqs s ARG 244 Ca 0.29 0.19 -0.06 0.00 -1.72 0.00 0.00 55.73 54.43 3dqs s ARG 244 Cb -0.18 0.18 -0.03 0.00 -0.45 0.00 0.00 34.95 34.47 3dqs s ARG 244 CO 0.17 -0.07 0.04 0.42 -0.68 0.00 0.00 175.30 175.18 3dqs s ILE 245 N -0.25 4.13 0.18 1.52 1.01 -1.26 -0.67 121.20 125.86 3dqs s ILE 245 Ca -0.04 -0.24 -0.06 0.00 0.00 0.00 0.00 60.65 60.32 3dqs s ILE 245 Cb -0.03 -2.91 -0.04 0.00 0.01 0.00 0.00 42.46 39.49 3dqs s ILE 245 CO 0.01 0.38 1.50 -0.50 0.00 0.00 0.00 174.94 176.33 3dqs h TRP 246 N 7.95 0.85 -4.10 3.97 4.06 -1.29 -3.42 115.95 123.97 3dqs h TRP 246 Ca -0.38 -0.28 -0.54 0.00 2.06 0.00 0.00 58.89 59.75 3dqs h TRP 246 Cb 1.17 -0.17 0.13 0.00 -1.00 0.00 0.00 29.16 29.29 3dqs h TRP 246 CO 0.63 1.04 0.49 -0.80 -3.56 0.00 0.00 178.44 176.24 3dqs s ASN 247 N -6.89 4.97 0.32 -3.49 -0.87 -1.26 -4.94 114.94 102.77 3dqs s ASN 247 Ca -0.09 2.48 0.17 0.00 -1.57 0.00 0.00 52.86 53.85 3dqs s ASN 247 Cb 0.11 -2.61 0.18 0.00 -0.02 0.00 0.00 41.25 38.91 3dqs s ASN 247 CO 0.85 -1.75 1.50 0.77 -2.57 0.00 0.00 177.10 175.91 3dqs h SER 248 N 0.77 0.00 -5.08 -1.22 4.64 -1.90 -3.33 113.55 107.43 3dqs h SER 248 Ca -0.51 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.67 3dqs h SER 248 Cb 1.31 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 63.22 3dqs h SER 248 CO 0.54 0.41 -0.64 -1.10 -0.87 0.00 0.00 176.83 175.17 3dqs s GLN 249 N -3.06 0.47 0.37 4.77 -0.21 -1.26 -0.93 119.66 119.82 3dqs s GLN 249 Ca 0.04 -0.80 0.09 0.00 0.02 0.00 0.00 55.36 54.71 3dqs s GLN 249 Cb 0.07 0.17 0.73 0.00 1.00 0.00 0.00 33.01 34.99 3dqs s GLN 249 CO 0.73 -0.09 1.88 -0.07 -2.12 0.00 0.00 175.29 175.61 3dqs h LEU 250 N 3.99 0.22 -8.05 2.90 3.38 -1.27 -3.40 115.31 113.08 3dqs h LEU 250 Ca -0.33 -0.05 -0.61 0.00 0.09 0.00 0.00 57.88 56.99 3dqs h LEU 250 Cb 1.18 -0.06 -0.34 0.00 0.09 0.00 0.00 40.66 41.53 3dqs h LEU 250 CO 0.50 0.42 -0.84 -0.69 0.09 0.00 0.00 178.44 177.92 3dqs s VAL 251 N -4.61 1.62 0.03 1.22 1.01 -1.26 -4.92 120.40 113.48 3dqs s VAL 251 Ca -0.05 -0.72 -0.24 0.00 0.00 0.00 0.00 61.98 60.97 3dqs s VAL 251 Cb 0.15 -1.47 0.05 0.00 0.00 0.00 0.00 36.38 35.11 3dqs s VAL 251 CO 0.74 0.47 0.54 -0.13 0.00 0.00 0.00 175.10 176.72 3dqs s ARG 252 N 0.96 1.02 0.00 2.72 0.52 -1.26 -4.87 118.95 118.05 3dqs s ARG 252 Ca -0.06 -0.13 -0.13 0.00 -0.52 0.00 0.00 55.73 54.89 3dqs s ARG 252 Cb -0.15 0.47 -0.06 0.00 0.52 0.00 0.00 34.95 35.74 3dqs s ARG 252 CO -0.02 -0.36 0.38 0.71 0.02 0.00 0.00 175.30 176.03 3dqs s TYR 253 N -2.13 3.69 0.69 -0.53 2.02 -1.26 -0.82 117.35 119.01 3dqs s TYR 253 Ca -0.07 0.91 -0.16 0.00 -0.37 0.00 0.00 57.07 57.38 3dqs s TYR 253 Cb -0.01 -2.23 0.02 0.00 -0.40 0.00 0.00 41.96 39.34 3dqs s TYR 253 CO 0.01 0.63 1.19 0.00 -1.57 0.00 0.00 175.55 175.81 3dqs s ALA 254 N -1.13 2.26 -0.18 3.71 0.00 0.66 -4.32 121.76 122.76 3dqs s ALA 254 Ca 0.24 0.84 0.00 0.00 0.00 0.00 0.00 51.96 53.04 3dqs s ALA 254 Cb -0.16 -3.44 0.04 0.00 0.00 0.00 0.00 23.12 19.57 3dqs s ALA 254 CO 0.13 -1.64 -0.07 0.20 0.00 0.00 0.00 175.76 174.38 3dqs s GLY 255 N -2.06 1.07 -0.30 0.00 0.00 -1.25 -1.68 107.32 103.10 3dqs s GLY 255 Ca 0.73 -0.97 -0.09 0.00 0.00 0.00 0.00 44.72 44.40 3dqs s GLY 255 CO 0.42 0.84 0.13 -0.19 0.00 0.00 0.00 173.10 174.30 3dqs s TYR 256 N 1.54 3.16 0.09 1.90 1.51 -0.03 -4.29 117.35 121.23 3dqs s TYR 256 Ca 0.00 -0.59 -0.31 0.00 -1.01 0.00 0.00 57.07 55.16 3dqs s TYR 256 Cb -0.15 -2.32 -0.08 0.00 -0.11 0.00 0.00 41.96 39.29 3dqs s TYR 256 CO -0.08 -0.45 1.57 0.50 -1.11 0.00 0.00 175.55 175.98 3dqs s ARG 257 N 1.60 4.23 0.68 -0.62 6.06 -1.26 -1.53 118.95 128.10 3dqs s ARG 257 Ca 0.05 2.26 -0.01 0.00 -2.50 0.00 0.00 55.73 55.53 3dqs s ARG 257 Cb -0.17 -3.46 0.10 0.00 0.06 0.00 0.00 34.95 31.48 3dqs s ARG 257 CO 0.05 -0.65 0.94 -0.65 -2.50 0.00 0.00 175.30 172.49 3dqs s GLN 258 N 2.12 1.94 0.06 5.12 -1.52 0.23 -4.95 119.66 122.65 3dqs s GLN 258 Ca 0.71 -0.95 -0.30 0.00 -1.95 0.00 0.00 55.36 52.86 3dqs s GLN 258 Cb -0.39 -2.36 -0.18 0.00 -0.22 0.00 0.00 33.01 29.86 3dqs s GLN 258 CO 0.31 -1.24 1.56 1.96 -0.25 0.00 0.00 175.29 177.63 3dqs h GLN 259 N -0.38 -0.69 0.00 2.91 1.08 -1.94 -2.54 115.11 113.55 3dqs h GLN 259 Ca -0.39 0.05 0.00 0.00 -1.45 0.00 0.00 58.65 56.86 3dqs h GLN 259 Cb 1.28 0.16 0.00 0.00 -0.05 0.00 0.00 27.48 28.87 3dqs h GLN 259 CO 0.45 -0.43 0.00 -0.40 -0.95 0.00 0.00 178.83 177.50 3dqs n ASP 260 N -5.37 0.00 0.00 1.46 5.68 -1.26 -4.80 116.55 112.26 3dqs n ASP 260 Ca -0.12 -0.11 0.00 0.00 -0.50 0.00 0.00 54.79 54.06 3dqs n ASP 260 Cb 0.31 -0.06 0.00 0.00 -1.14 0.00 0.00 41.12 40.22 3dqs n ASP 260 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3dqs n GLY 261 N -0.64 0.86 0.00 6.12 0.00 -0.95 -5.05 105.19 105.51 3dqs n GLY 261 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3dqs n GLY 261 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3dqs n SER 262 N 0.00 -0.11 -3.83 1.61 3.41 -1.26 -4.70 113.62 108.74 3dqs n SER 262 Ca 0.00 -0.94 -0.15 0.00 -0.26 0.00 0.00 58.87 57.53 3dqs n SER 262 Cb 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 63.80 3dqs n SER 262 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3dqs s VAL 263 N -0.99 0.06 -0.22 -3.33 1.01 -1.26 -0.60 120.40 115.06 3dqs s VAL 263 Ca 0.00 0.08 -0.08 0.00 0.00 0.00 0.00 61.98 61.98 3dqs s VAL 263 Cb 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 36.38 36.20 3dqs s VAL 263 CO 0.00 0.08 0.10 -0.60 0.00 0.00 0.00 175.10 174.68 3dqs s ARG 264 N 0.64 3.90 0.00 2.72 3.52 -0.58 -4.91 118.95 124.24 3dqs s ARG 264 Ca -0.06 -0.36 0.00 0.00 -0.13 0.00 0.00 55.73 55.18 3dqs s ARG 264 Cb -0.08 -3.36 0.00 0.00 -1.56 0.00 0.00 34.95 29.95 3dqs s ARG 264 CO -0.02 0.05 0.00 0.41 -0.81 0.00 0.00 175.30 174.94 3dqs n GLY 265 N 4.23 0.12 3.55 8.12 0.00 -1.26 -0.85 105.19 119.10 3dqs n GLY 265 Ca -0.16 -1.84 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 3dqs n GLY 265 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dqs s ASP 266 N -4.00 6.40 0.66 1.61 3.68 -0.68 -4.75 116.67 119.59 3dqs s ASP 266 Ca 0.00 -0.04 0.44 0.00 2.13 0.00 0.00 52.55 55.08 3dqs s ASP 266 Cb 0.00 -2.34 2.38 0.00 -1.45 0.00 0.00 42.92 41.51 3dqs s ASP 266 CO 0.00 -0.72 2.36 -0.65 0.13 0.00 0.00 175.17 176.29 3dqs h PRO 267 N 8.69 0.00 0.00 4.34 0.11 -1.82 -1.81 132.00 141.50 3dqs h PRO 267 Ca -0.26 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.82 3dqs h PRO 267 Cb 1.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 3dqs h PRO 267 CO 0.88 0.00 -0.18 0.00 -0.21 0.00 0.00 178.00 178.49 3dqs h ALA 268 N 2.00 1.07 -0.52 -0.75 0.00 -1.92 -3.23 119.26 115.91 3dqs h ALA 268 Ca -0.00 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.64 3dqs h ALA 268 Cb 0.02 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.72 3dqs h ALA 268 CO 0.00 0.23 0.10 0.09 0.00 0.00 0.00 179.25 179.66 3dqs n ASN 269 N -3.40 4.50 0.00 0.00 3.02 -0.68 -4.67 115.26 114.02 3dqs n ASN 269 Ca -0.00 -3.16 -0.11 0.00 -0.03 0.00 0.00 54.58 51.27 3dqs n ASN 269 Cb 0.38 -0.66 -0.06 0.00 -0.61 0.00 0.00 39.78 38.83 3dqs n ASN 269 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3dqs h VAL 270 N 2.51 1.06 -0.14 2.41 2.07 -1.69 -1.14 116.25 121.32 3dqs h VAL 270 Ca 0.12 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 3dqs h VAL 270 Cb 1.92 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.71 3dqs h VAL 270 CO 0.49 0.05 0.05 -0.08 0.02 0.00 0.00 177.57 178.11 3dqs h GLU 271 N 0.06 0.22 -0.42 1.57 4.81 -1.89 -1.68 114.58 117.26 3dqs h GLU 271 Ca 0.03 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 3dqs h GLU 271 Cb 0.04 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 3dqs h GLU 271 CO -0.01 0.33 0.11 0.97 -0.73 0.00 0.00 179.01 179.69 3dqs h ILE 272 N 0.06 1.19 -0.66 2.32 6.09 -1.89 -0.80 117.51 123.82 3dqs h ILE 272 Ca 0.05 -0.65 -0.07 0.00 -1.37 0.00 0.00 64.86 62.82 3dqs h ILE 272 Cb 0.20 0.74 -0.03 0.00 0.47 0.00 0.00 36.82 38.21 3dqs h ILE 272 CO -0.00 0.24 0.14 0.74 -3.07 0.00 0.00 178.15 176.19 3dqs h THR 273 N 0.61 1.26 -0.09 2.19 2.02 -0.98 -0.82 112.91 117.11 3dqs h THR 273 Ca 0.14 -0.99 -0.15 0.00 0.77 0.00 0.00 66.41 66.18 3dqs h THR 273 Cb 0.22 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 3dqs h THR 273 CO -0.01 0.37 -0.61 -0.33 0.37 0.00 0.00 175.52 175.32 3dqs h GLU 274 N 1.00 0.32 -0.43 6.66 5.08 -0.79 -2.13 114.58 124.28 3dqs h GLU 274 Ca 0.21 -0.22 -0.08 0.00 -1.00 0.00 0.00 59.36 58.26 3dqs h GLU 274 Cb 0.40 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 3dqs h GLU 274 CO 0.01 0.83 -0.08 -0.07 -1.00 0.00 0.00 179.01 178.70 3dqs h LEU 275 N 0.23 0.73 -0.69 1.33 3.38 -0.86 0.27 115.31 119.70 3dqs h LEU 275 Ca -0.01 -0.20 -0.09 0.00 0.09 0.00 0.00 57.88 57.67 3dqs h LEU 275 Cb 1.13 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 3dqs h LEU 275 CO 0.10 0.85 -0.02 0.00 0.09 0.00 0.00 178.44 179.46 3dqs h ILE 277 N 0.91 1.32 -0.11 0.00 2.04 -0.97 -0.74 117.51 119.96 3dqs h ILE 277 Ca 0.16 -1.03 0.03 0.00 1.00 0.00 0.00 64.86 65.03 3dqs h ILE 277 Cb 0.55 1.87 -0.00 0.00 -0.74 0.00 0.00 36.82 38.50 3dqs h ILE 277 CO 0.03 0.28 0.32 1.56 0.00 0.00 0.00 178.15 180.34 3dqs h GLN 278 N -0.24 0.00 -0.56 2.37 4.20 -0.28 -0.45 115.11 120.15 3dqs h GLN 278 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 3dqs h GLN 278 Cb 0.47 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.25 3dqs h GLN 278 CO 0.01 0.00 0.00 0.72 -0.67 0.00 0.00 178.83 178.89 3dqs n HIS 279 N -3.19 1.90 -0.12 2.96 8.25 -0.67 -4.93 115.22 119.43 3dqs n HIS 279 Ca 0.00 -0.73 0.00 0.00 -0.26 0.00 0.00 57.72 56.74 3dqs n HIS 279 Cb 0.41 -0.46 0.00 0.00 1.12 0.00 0.00 29.99 31.06 3dqs n HIS 279 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dqs n GLY 280 N 0.60 0.58 3.72 -1.41 0.00 -0.18 -4.85 105.19 103.65 3dqs n GLY 280 Ca 0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.87 3dqs n GLY 280 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3dqs s TRP 281 N -2.22 3.56 -0.56 1.61 -0.00 -0.33 -4.97 118.94 116.02 3dqs s TRP 281 Ca 0.00 1.51 -0.23 0.00 -0.00 0.00 0.00 56.10 57.38 3dqs s TRP 281 Cb 0.00 -3.28 0.05 0.00 -0.00 0.00 0.00 33.47 30.24 3dqs s TRP 281 CO 0.00 -0.67 0.89 0.99 -0.00 0.00 0.00 176.95 178.16 3dqs s THR 282 N 0.68 4.46 0.53 5.86 2.01 -1.26 -4.41 115.64 123.51 3dqs s THR 282 Ca 0.54 0.03 -0.22 0.00 0.31 0.00 0.00 61.69 62.35 3dqs s THR 282 Cb -0.27 -4.52 -0.05 0.00 0.01 0.00 0.00 72.50 67.66 3dqs s THR 282 CO 0.30 -1.12 1.29 -2.16 -0.69 0.00 0.00 174.62 172.24 3dqs s PRO 283 N 3.75 3.29 0.00 4.92 0.04 -1.26 -5.06 135.00 140.67 3dqs s PRO 283 Ca 0.26 2.08 0.00 0.00 0.04 0.00 0.00 61.00 63.38 3dqs s PRO 283 Cb -0.14 -2.27 0.00 0.00 0.04 0.00 0.00 34.50 32.12 3dqs s PRO 283 CO 0.16 -1.02 0.00 0.41 0.04 0.00 0.00 177.00 176.59 3dqs n GLY 284 N 0.64 0.58 1.32 0.56 0.00 -1.26 -5.07 105.19 101.96 3dqs n GLY 284 Ca 0.10 -1.79 -0.01 0.00 0.00 0.00 0.00 46.02 44.32 3dqs n GLY 284 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3dqs n ASN 285 N 0.00 0.18 -4.02 1.61 6.94 -1.26 -5.09 115.26 113.62 3dqs n ASN 285 Ca 0.00 -2.00 -0.15 0.00 -0.02 0.00 0.00 54.58 52.41 3dqs n ASN 285 Cb 0.00 -0.05 0.03 0.00 -2.36 0.00 0.00 39.78 37.40 3dqs n ASN 285 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3dqs n GLY 286 N 0.27 2.25 0.12 4.83 0.00 -1.26 -5.03 105.19 106.37 3dqs n GLY 286 Ca -0.08 -2.22 0.08 0.00 0.00 0.00 0.00 46.02 43.81 3dqs n GLY 286 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3dqs h ARG 287 N 0.00 0.00 -1.66 1.61 3.08 -1.93 -3.38 114.38 112.10 3dqs h ARG 287 Ca -0.21 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.36 3dqs h ARG 287 Cb 0.87 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 30.51 3dqs h ARG 287 CO 0.31 0.09 -1.00 1.19 -1.07 0.00 0.00 179.97 179.49 3dqs n PHE 288 N -2.78 1.87 -2.96 3.04 3.01 -1.26 -4.21 117.46 114.18 3dqs n PHE 288 Ca -0.02 -3.41 -0.41 0.00 1.01 0.00 0.00 57.45 54.62 3dqs n PHE 288 Cb 0.63 -0.36 -0.05 0.00 -0.01 0.00 0.00 39.48 39.70 3dqs n PHE 288 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3dqs s ASP 289 N -3.06 6.82 0.14 4.37 1.01 -1.26 -4.93 116.67 119.76 3dqs s ASP 289 Ca 0.39 1.01 -0.31 0.00 0.71 0.00 0.00 52.55 54.35 3dqs s ASP 289 Cb 0.38 -2.42 -0.09 0.00 1.01 0.00 0.00 42.92 41.81 3dqs s ASP 289 CO -0.08 -0.41 1.45 -0.69 0.21 0.00 0.00 175.17 175.65 3dqs s VAL 290 N 2.39 3.04 0.55 -1.27 1.01 -1.26 -0.24 120.40 124.61 3dqs s VAL 290 Ca 0.34 0.76 -0.15 0.00 0.00 0.00 0.00 61.98 62.93 3dqs s VAL 290 Cb -0.16 -3.48 -0.06 0.00 0.00 0.00 0.00 36.38 32.67 3dqs s VAL 290 CO 0.10 0.06 1.00 -0.76 0.00 0.00 0.00 175.10 175.51 3dqs s LEU 291 N 0.98 3.50 0.65 3.92 1.43 -0.00 -4.83 118.68 124.32 3dqs s LEU 291 Ca 0.66 1.54 -0.06 0.00 -1.03 0.00 0.00 54.13 55.24 3dqs s LEU 291 Cb -0.39 -4.50 0.03 0.00 0.03 0.00 0.00 46.19 41.36 3dqs s LEU 291 CO 0.32 -0.72 0.96 -2.16 0.23 0.00 0.00 176.35 174.98 3dqs s PRO 292 N -4.40 2.58 -0.12 1.29 0.04 -1.26 -4.71 135.00 128.42 3dqs s PRO 292 Ca 0.58 -0.10 -0.09 0.00 0.04 0.00 0.00 61.00 61.43 3dqs s PRO 292 Cb -0.11 -2.21 -0.04 0.00 0.04 0.00 0.00 34.50 32.18 3dqs s PRO 292 CO 0.38 -0.97 0.19 -0.51 0.04 0.00 0.00 177.00 176.14 3dqs s LEU 293 N -5.13 4.35 -0.40 -3.56 1.43 0.85 -4.91 118.68 111.31 3dqs s LEU 293 Ca 0.57 0.50 -0.10 0.00 -1.03 0.00 0.00 54.13 54.07 3dqs s LEU 293 Cb -0.11 -2.17 0.06 0.00 0.03 0.00 0.00 46.19 44.00 3dqs s LEU 293 CO 0.45 0.33 0.24 -0.76 0.23 0.00 0.00 176.35 176.83 3dqs s LEU 294 N -0.64 4.98 -0.12 1.79 1.43 -1.26 -1.07 118.68 123.80 3dqs s LEU 294 Ca 0.15 -1.34 -0.03 0.00 -1.03 0.00 0.00 54.13 51.88 3dqs s LEU 294 Cb -0.13 -1.99 -0.03 0.00 0.03 0.00 0.00 46.19 44.07 3dqs s LEU 294 CO 0.04 -0.48 -0.00 -0.76 0.23 0.00 0.00 176.35 175.37 3dqs s LEU 295 N 1.46 3.50 -0.15 1.79 1.43 0.18 -0.80 118.68 126.10 3dqs s LEU 295 Ca 0.02 0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.17 3dqs s LEU 295 Cb -0.22 -1.82 0.03 0.00 0.03 0.00 0.00 46.19 44.20 3dqs s LEU 295 CO 0.03 0.28 -0.12 -1.58 0.23 0.00 0.00 176.35 175.20 3dqs s GLN 296 N -0.32 2.04 0.50 1.70 0.74 0.15 0.07 119.66 124.54 3dqs s GLN 296 Ca 0.06 -0.53 -0.03 0.00 0.05 0.00 0.00 55.36 54.92 3dqs s GLN 296 Cb -0.12 -2.03 -0.01 0.00 1.10 0.00 0.00 33.01 31.95 3dqs s GLN 296 CO 0.02 -0.28 0.77 0.00 -0.55 0.00 0.00 175.29 175.25 3dqs s ALA 297 N 1.53 3.52 0.16 1.58 0.00 -1.26 -0.93 121.76 126.36 3dqs s ALA 297 Ca 0.04 -0.81 -0.33 0.00 0.00 0.00 0.00 51.96 50.85 3dqs s ALA 297 Cb -0.13 -2.39 -0.16 0.00 0.00 0.00 0.00 23.12 20.44 3dqs s ALA 297 CO -0.10 -0.51 1.24 -2.30 0.00 0.00 0.00 175.76 174.09 3dqs n PRO 298 N -2.28 1.29 -3.17 0.00 -0.02 -1.24 -2.65 135.00 126.93 3dqs n PRO 298 Ca 0.02 0.46 -0.20 0.00 -2.02 0.00 0.00 63.50 61.76 3dqs n PRO 298 Cb 0.57 -2.01 -0.01 0.00 -0.02 0.00 0.00 33.50 32.03 3dqs n PRO 298 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3dqs n ASP 299 N 2.17 -3.47 -4.21 2.55 8.00 -1.26 -4.83 116.55 115.50 3dqs n ASP 299 Ca 0.15 -0.24 -0.15 0.00 0.71 0.00 0.00 54.79 55.27 3dqs n ASP 299 Cb 0.24 -2.90 -0.11 0.00 -0.02 0.00 0.00 41.12 38.34 3dqs n ASP 299 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3dqs s GLU 300 N -5.79 0.93 0.59 -1.24 2.02 -1.08 -5.05 118.70 109.07 3dqs s GLU 300 Ca 0.31 -1.27 -0.16 0.00 0.02 0.00 0.00 54.97 53.87 3dqs s GLU 300 Cb -0.16 -0.59 -0.04 0.00 0.10 0.00 0.00 34.13 33.44 3dqs s GLU 300 CO 0.38 0.09 1.07 0.00 0.02 0.00 0.00 175.26 176.82 3dqs s ALA 301 N -2.73 2.69 0.45 5.21 0.00 -1.26 -4.60 121.76 121.52 3dqs s ALA 301 Ca 0.10 0.50 -0.24 0.00 0.00 0.00 0.00 51.96 52.32 3dqs s ALA 301 Cb -0.01 -3.27 -0.07 0.00 0.00 0.00 0.00 23.12 19.77 3dqs s ALA 301 CO 0.00 -0.86 1.25 -1.25 0.00 0.00 0.00 175.76 174.91 3dqs s PRO 302 N -3.90 3.72 0.06 0.00 0.04 -1.26 -4.73 135.00 128.94 3dqs s PRO 302 Ca 0.66 2.01 0.03 0.00 0.04 0.00 0.00 61.00 63.74 3dqs s PRO 302 Cb -0.18 -2.52 -0.04 0.00 0.04 0.00 0.00 34.50 31.80 3dqs s PRO 302 CO 0.35 -0.65 0.03 -1.21 0.04 0.00 0.00 177.00 175.56 3dqs s GLU 303 N -2.55 2.74 -0.13 4.56 2.02 0.11 -4.86 118.70 120.59 3dqs s GLU 303 Ca 0.62 -0.72 -0.11 0.00 0.02 0.00 0.00 54.97 54.78 3dqs s GLU 303 Cb -0.34 -2.65 -0.05 0.00 0.10 0.00 0.00 34.13 31.19 3dqs s GLU 303 CO 0.43 0.57 0.23 -1.17 0.02 0.00 0.00 175.26 175.34 3dqs s LEU 304 N -2.14 4.31 -0.03 1.80 2.96 -1.26 -0.64 118.68 123.68 3dqs s LEU 304 Ca 0.25 0.51 0.00 0.00 -0.22 0.00 0.00 54.13 54.67 3dqs s LEU 304 Cb -0.12 -2.26 0.03 0.00 0.50 0.00 0.00 46.19 44.34 3dqs s LEU 304 CO 0.17 0.24 0.01 -0.36 -1.32 0.00 0.00 176.35 175.09 3dqs s PHE 305 N -0.21 0.26 -0.11 5.38 0.40 -0.23 -4.98 117.98 118.50 3dqs s PHE 305 Ca 0.15 0.03 -0.18 0.00 -0.60 0.00 0.00 56.93 56.34 3dqs s PHE 305 Cb -0.13 -0.41 -0.04 0.00 0.51 0.00 0.00 43.02 42.95 3dqs s PHE 305 CO 0.04 -0.14 0.46 0.08 0.70 0.00 0.00 175.22 176.36 3dqs s VAL 306 N 1.16 5.18 0.03 -0.44 1.01 -1.26 -0.11 120.40 125.97 3dqs s VAL 306 Ca -0.08 0.92 -0.30 0.00 0.00 0.00 0.00 61.98 62.52 3dqs s VAL 306 Cb -0.13 -3.80 -0.05 0.00 0.00 0.00 0.00 36.38 32.40 3dqs s VAL 306 CO -0.02 0.35 1.13 -0.76 0.00 0.00 0.00 175.10 175.80 3dqs s LEU 307 N 0.46 4.36 0.18 3.92 1.43 -1.26 -4.97 118.68 122.80 3dqs s LEU 307 Ca 0.25 1.88 -0.32 0.00 -1.03 0.00 0.00 54.13 54.92 3dqs s LEU 307 Cb -0.15 -3.57 -0.11 0.00 0.03 0.00 0.00 46.19 42.38 3dqs s LEU 307 CO 0.10 -0.42 1.74 -2.84 0.23 0.00 0.00 176.35 175.16 3dqs s PRO 308 N 1.17 4.14 0.42 1.29 0.02 -1.26 -4.85 135.00 135.93 3dqs s PRO 308 Ca 0.56 2.58 0.21 0.00 0.02 0.00 0.00 61.00 64.37 3dqs s PRO 308 Cb -0.26 -3.24 1.18 0.00 0.02 0.00 0.00 34.50 32.19 3dqs s PRO 308 CO 0.28 -0.77 1.77 -1.35 -0.33 0.00 0.00 177.00 176.61 3dqs h PRO 309 N 7.35 0.31 0.00 5.54 0.11 -1.94 0.12 132.00 143.49 3dqs h PRO 309 Ca -0.44 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 3dqs h PRO 309 Cb 1.21 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 3dqs h PRO 309 CO 0.95 0.21 -0.01 0.93 -0.21 0.00 0.00 178.00 179.87 3dqs h GLU 310 N 0.32 0.00 0.00 1.05 5.08 -2.04 -2.60 114.58 116.39 3dqs h GLU 310 Ca 0.60 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.79 3dqs h GLU 310 Cb 1.64 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.87 3dqs h GLU 310 CO -0.26 0.01 -1.03 -0.07 -1.00 0.00 0.00 179.01 176.66 3dqs h LEU 311 N 0.00 0.00 -8.04 1.33 3.38 -1.12 -3.43 115.31 107.43 3dqs h LEU 311 Ca -0.00 0.00 -0.71 0.00 0.09 0.00 0.00 57.88 57.26 3dqs h LEU 311 Cb 0.12 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 40.67 3dqs h LEU 311 CO 0.00 0.67 0.42 -0.69 0.09 0.00 0.00 178.44 178.93 3dqs s VAL 312 N -2.87 4.89 -0.05 1.22 1.01 -0.98 -4.84 120.40 118.78 3dqs s VAL 312 Ca 0.00 -1.43 -0.30 0.00 0.00 0.00 0.00 61.98 60.25 3dqs s VAL 312 Cb 0.08 -4.61 -0.04 0.00 0.00 0.00 0.00 36.38 31.81 3dqs s VAL 312 CO 0.79 -1.28 1.33 -0.22 0.00 0.00 0.00 175.10 175.72 3dqs s LEU 313 N 2.34 4.28 0.23 3.92 2.96 -1.26 -4.98 118.68 126.16 3dqs s LEU 313 Ca 0.21 1.95 0.11 0.00 -0.22 0.00 0.00 54.13 56.19 3dqs s LEU 313 Cb -0.14 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 42.95 3dqs s LEU 313 CO -0.02 -0.70 -0.21 -1.61 -1.32 0.00 0.00 176.35 172.49 3dqs s GLU 314 N 2.66 1.56 -0.21 1.98 2.02 -1.26 -0.45 118.70 124.99 3dqs s GLU 314 Ca 0.60 -1.63 0.01 0.00 0.02 0.00 0.00 54.97 53.98 3dqs s GLU 314 Cb -0.28 -1.73 0.04 0.00 0.10 0.00 0.00 34.13 32.27 3dqs s GLU 314 CO 0.23 0.34 -0.13 0.08 0.02 0.00 0.00 175.26 175.81 3dqs s VAL 315 N -2.16 1.85 0.27 2.63 1.01 0.10 -4.88 120.40 119.22 3dqs s VAL 315 Ca 0.25 -1.13 -0.29 0.00 0.00 0.00 0.00 61.98 60.81 3dqs s VAL 315 Cb -0.06 -1.87 -0.09 0.00 0.00 0.00 0.00 36.38 34.36 3dqs s VAL 315 CO 0.12 0.21 1.13 -2.16 0.00 0.00 0.00 175.10 174.40 3dqs s PRO 316 N 1.31 4.60 -0.11 2.72 0.04 -1.26 -2.02 135.00 140.27 3dqs s PRO 316 Ca -0.01 1.85 -0.18 0.00 0.04 0.00 0.00 61.00 62.69 3dqs s PRO 316 Cb -0.16 -3.19 -0.04 0.00 0.04 0.00 0.00 34.50 31.15 3dqs s PRO 316 CO -0.09 0.14 0.46 -0.51 0.04 0.00 0.00 177.00 177.04 3dqs s LEU 317 N -1.29 4.29 0.09 -3.56 1.43 -0.46 -4.86 118.68 114.32 3dqs s LEU 317 Ca 0.46 0.81 -0.00 0.00 -1.03 0.00 0.00 54.13 54.37 3dqs s LEU 317 Cb -0.33 -2.67 -0.04 0.00 0.03 0.00 0.00 46.19 43.18 3dqs s LEU 317 CO 0.41 0.03 -0.01 -1.83 0.23 0.00 0.00 176.35 175.19 3dqs s GLU 318 N 0.47 0.79 -0.02 1.70 -1.05 -1.26 -4.07 118.70 115.25 3dqs s GLU 318 Ca 0.25 -1.33 0.01 0.00 -0.15 0.00 0.00 54.97 53.75 3dqs s GLU 318 Cb -0.15 0.10 -0.03 0.00 -0.44 0.00 0.00 34.13 33.61 3dqs s GLU 318 CO 0.10 -0.14 -0.01 -1.58 0.95 0.00 0.00 175.26 174.58 3dqs s HIS 319 N -3.88 3.05 0.43 4.83 5.65 -1.26 -4.34 115.29 119.76 3dqs s HIS 319 Ca 0.14 0.08 0.12 0.00 0.25 0.00 0.00 55.06 55.65 3dqs s HIS 319 Cb 0.07 -1.69 0.98 0.00 -1.18 0.00 0.00 32.58 30.76 3dqs s HIS 319 CO -0.04 0.44 2.01 -1.00 -0.65 0.00 0.00 174.74 175.50 3dqs h PRO 320 N 4.60 0.44 0.00 2.88 0.13 -1.92 -3.36 132.00 134.77 3dqs h PRO 320 Ca -0.49 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 3dqs h PRO 320 Cb 1.18 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.21 3dqs h PRO 320 CO 0.56 0.29 -0.84 0.25 -0.23 0.00 0.00 178.00 178.03 3dqs n THR 321 N -4.47 0.00 -2.59 1.56 -2.24 -1.26 -4.93 114.28 100.34 3dqs n THR 321 Ca 0.07 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.44 3dqs n THR 321 Cb 0.25 -0.76 -0.03 0.00 -2.10 0.00 0.00 70.33 67.70 3dqs n THR 321 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3dqs s LEU 322 N -3.73 3.44 0.55 3.22 1.43 -1.26 -4.87 118.68 117.46 3dqs s LEU 322 Ca 0.00 -0.87 0.23 0.00 -1.03 0.00 0.00 54.13 52.46 3dqs s LEU 322 Cb 0.00 -2.55 1.49 0.00 0.03 0.00 0.00 46.19 45.16 3dqs s LEU 322 CO 0.00 -1.67 2.15 -0.33 0.23 0.00 0.00 176.35 176.73 3dqs h GLU 323 N 9.88 0.00 0.00 1.70 5.08 -1.92 -2.43 114.58 126.89 3dqs h GLU 323 Ca -0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 3dqs h GLU 323 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 3dqs h GLU 323 CO 1.31 0.00 0.00 -2.67 -1.00 0.00 0.00 179.01 176.65 3dqs n TRP 324 N -4.23 0.80 -0.23 4.33 4.27 -1.26 -3.77 117.44 117.34 3dqs n TRP 324 Ca -0.01 0.26 -0.02 0.00 -3.89 0.00 0.00 57.50 53.85 3dqs n TRP 324 Cb 0.18 -0.93 0.10 0.00 -1.36 0.00 0.00 31.31 29.30 3dqs n TRP 324 CO 0.00 0.00 0.00 0.35 -2.29 0.00 0.00 177.69 175.75 3dqs h PHE 325 N 0.00 0.70 -0.60 -2.67 3.57 -1.80 -0.88 116.94 115.26 3dqs h PHE 325 Ca 0.00 0.02 0.12 0.00 3.53 0.00 0.00 57.97 61.65 3dqs h PHE 325 Cb 0.56 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 3dqs h PHE 325 CO 0.00 0.34 0.41 0.00 -2.23 0.00 0.00 178.31 176.83 3dqs h ALA 326 N 1.34 2.18 0.00 2.41 0.00 -1.71 -0.34 119.26 123.15 3dqs h ALA 326 Ca 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3dqs h ALA 326 Cb 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3dqs h ALA 326 CO -0.18 -0.33 0.00 0.00 0.00 0.00 0.00 179.25 178.74 3dqs n ALA 327 N -2.56 1.49 0.33 0.00 0.00 -0.34 -2.08 120.51 117.36 3dqs n ALA 327 Ca 0.10 0.08 0.15 0.00 0.00 0.00 0.00 53.44 53.78 3dqs n ALA 327 Cb 0.47 -1.32 0.60 0.00 0.00 0.00 0.00 19.45 19.20 3dqs n ALA 327 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3dqs h LEU 328 N 0.00 0.00 1.75 0.00 4.07 -1.08 -3.47 115.31 116.59 3dqs h LEU 328 Ca 0.00 0.00 -0.29 0.00 0.08 0.00 0.00 57.88 57.67 3dqs h LEU 328 Cb 0.25 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.95 3dqs h LEU 328 CO 0.00 0.00 -0.34 0.61 -1.08 0.00 0.00 178.44 177.63 3dqs n GLY 329 N 0.06 0.12 3.89 0.83 0.00 -0.88 -5.00 105.19 104.20 3dqs n GLY 329 Ca 0.01 -0.30 -0.29 0.00 0.00 0.00 0.00 46.02 45.44 3dqs n GLY 329 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dqs s LEU 330 N -3.92 3.62 0.18 0.99 1.43 -1.26 -4.98 118.68 114.74 3dqs s LEU 330 Ca 0.00 1.10 -0.24 0.00 -1.03 0.00 0.00 54.13 53.96 3dqs s LEU 330 Cb 0.00 -4.05 0.05 0.00 0.03 0.00 0.00 46.19 42.23 3dqs s LEU 330 CO 0.00 -0.58 0.87 0.00 0.23 0.00 0.00 176.35 176.87 3dqs s ARG 331 N -4.54 1.34 0.02 1.70 1.70 -1.26 -1.36 118.95 116.55 3dqs s ARG 331 Ca 0.50 -0.72 -0.21 0.00 -0.47 0.00 0.00 55.73 54.84 3dqs s ARG 331 Cb -0.10 0.47 0.04 0.00 -0.57 0.00 0.00 34.95 34.79 3dqs s ARG 331 CO 0.42 -0.61 0.47 -0.46 -1.08 0.00 0.00 175.30 174.04 3dqs s TRP 332 N -3.47 -0.36 0.50 5.89 -0.11 -0.86 -4.93 118.94 115.59 3dqs s TRP 332 Ca 0.11 0.46 -0.16 0.00 1.22 0.00 0.00 56.10 57.72 3dqs s TRP 332 Cb -0.03 0.26 -0.08 0.00 -1.50 0.00 0.00 33.47 32.13 3dqs s TRP 332 CO 0.02 -0.57 0.96 1.52 -4.62 0.00 0.00 176.95 174.27 3dqs s TYR 333 N -2.03 3.44 0.17 5.86 -0.85 -1.26 0.00 117.35 122.68 3dqs s TYR 333 Ca -0.08 1.44 -0.02 0.00 -0.52 0.00 0.00 57.07 57.89 3dqs s TYR 333 Cb -0.01 -2.76 0.05 0.00 0.38 0.00 0.00 41.96 39.61 3dqs s TYR 333 CO 0.01 -0.32 1.43 0.00 -1.52 0.00 0.00 175.55 175.15 3dqs h ALA 334 N 1.04 0.58 -2.61 9.51 0.00 -1.10 -3.46 119.26 123.22 3dqs h ALA 334 Ca -0.47 -0.61 -0.69 0.00 0.00 0.00 0.00 54.91 53.14 3dqs h ALA 334 Cb 1.18 -0.06 -0.20 0.00 0.00 0.00 0.00 17.79 18.72 3dqs h ALA 334 CO 0.62 0.76 -0.44 -1.17 0.00 0.00 0.00 179.25 179.02 3dqs s LEU 335 N -7.97 4.77 -0.48 0.00 2.96 -1.26 -4.52 118.68 112.18 3dqs s LEU 335 Ca -0.06 -0.61 -0.24 0.00 -0.22 0.00 0.00 54.13 53.00 3dqs s LEU 335 Cb 0.10 -2.17 0.03 0.00 0.50 0.00 0.00 46.19 44.66 3dqs s LEU 335 CO 0.84 -0.34 0.84 -2.16 -1.32 0.00 0.00 176.35 174.21 3dqs s PRO 336 N 1.73 3.40 -0.30 0.98 0.04 -1.26 -4.70 135.00 134.89 3dqs s PRO 336 Ca 0.06 -0.13 0.00 0.00 0.04 0.00 0.00 61.00 60.97 3dqs s PRO 336 Cb -0.18 -3.97 0.09 0.00 0.04 0.00 0.00 34.50 30.48 3dqs s PRO 336 CO 0.10 -1.23 0.07 0.00 0.04 0.00 0.00 177.00 175.98 3dqs s ALA 337 N 3.50 1.81 -0.05 8.56 0.00 -1.26 -2.91 121.76 131.42 3dqs s ALA 337 Ca 0.31 -1.73 -0.30 0.00 0.00 0.00 0.00 51.96 50.23 3dqs s ALA 337 Cb -0.12 -1.64 -0.04 0.00 0.00 0.00 0.00 23.12 21.33 3dqs s ALA 337 CO 0.22 -1.58 1.25 0.08 0.00 0.00 0.00 175.76 175.73 3dqs s VAL 338 N 1.47 4.13 0.00 0.00 1.01 -0.29 -0.75 120.40 125.97 3dqs s VAL 338 Ca 0.07 1.47 0.00 0.00 0.00 0.00 0.00 61.98 63.52 3dqs s VAL 338 Cb -0.18 -3.94 0.00 0.00 0.00 0.00 0.00 36.38 32.26 3dqs s VAL 338 CO -0.18 -0.01 0.61 -1.54 0.00 0.00 0.00 175.10 173.98 3dqs n SER 339 N 5.32 1.18 -0.40 3.32 3.41 -0.10 -1.86 113.62 124.48 3dqs n SER 339 Ca 0.12 -1.31 0.04 0.00 -0.26 0.00 0.00 58.87 57.46 3dqs n SER 339 Cb 0.46 0.00 0.11 0.00 -0.26 0.00 0.00 64.21 64.51 3dqs n SER 339 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3dqs n ASN 340 N -0.16 2.65 -4.89 4.04 2.04 -1.23 -4.43 115.26 113.29 3dqs n ASN 340 Ca 0.00 -2.15 -0.30 0.00 -0.44 0.00 0.00 54.58 51.69 3dqs n ASN 340 Cb 0.12 -0.19 -0.04 0.00 -2.53 0.00 0.00 39.78 37.14 3dqs n ASN 340 CO 0.00 0.00 0.00 -0.04 -0.44 0.00 0.00 177.26 176.78 3dqs s MET 341 N -1.27 3.68 -0.18 -3.83 -1.94 -1.26 -4.35 119.30 110.15 3dqs s MET 341 Ca 0.17 0.11 -0.11 0.00 -1.71 0.00 0.00 55.69 54.15 3dqs s MET 341 Cb 0.11 -2.63 -0.05 0.00 2.01 0.00 0.00 34.83 34.27 3dqs s MET 341 CO 0.09 0.22 0.18 -1.17 -0.01 0.00 0.00 175.02 174.33 3dqs s LEU 342 N -3.39 4.24 -0.33 -0.03 0.20 0.32 -4.42 118.68 115.27 3dqs s LEU 342 Ca 0.45 0.33 -0.13 0.00 0.69 0.00 0.00 54.13 55.47 3dqs s LEU 342 Cb -0.11 -2.17 -0.02 0.00 -0.43 0.00 0.00 46.19 43.46 3dqs s LEU 342 CO 0.28 0.18 0.27 -0.22 -0.29 0.00 0.00 176.35 176.57 3dqs s LEU 343 N 0.25 4.39 -0.20 -0.68 2.96 -0.54 -0.14 118.68 124.72 3dqs s LEU 343 Ca 0.11 -0.26 -0.05 0.00 -0.22 0.00 0.00 54.13 53.71 3dqs s LEU 343 Cb -0.12 -2.21 -0.03 0.00 0.50 0.00 0.00 46.19 44.34 3dqs s LEU 343 CO 0.00 -0.23 0.00 -0.70 -1.32 0.00 0.00 176.35 174.10 3dqs s GLU 344 N 1.83 3.64 -0.09 1.98 -6.30 0.29 -0.45 118.70 119.61 3dqs s GLU 344 Ca 0.08 -0.51 -0.02 0.00 -2.50 0.00 0.00 54.97 52.03 3dqs s GLU 344 Cb -0.17 -3.08 0.03 0.00 0.00 0.00 0.00 34.13 30.91 3dqs s GLU 344 CO 0.11 0.04 0.01 0.42 0.02 0.00 0.00 175.26 175.86 3dqs s ILE 345 N 0.94 0.34 -1.48 -3.70 1.01 -0.38 -1.74 121.20 116.19 3dqs s ILE 345 Ca 0.01 0.05 -0.12 0.00 0.00 0.00 0.00 60.65 60.59 3dqs s ILE 345 Cb -0.14 -0.57 0.08 0.00 0.01 0.00 0.00 42.46 41.84 3dqs s ILE 345 CO 0.02 0.17 0.78 0.61 0.00 0.00 0.00 174.94 176.53 3dqs n GLY 346 N 5.15 -0.49 2.37 6.18 0.00 -1.26 -0.68 105.19 116.46 3dqs n GLY 346 Ca -0.07 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3dqs n GLY 346 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dqs n GLY 347 N -1.49 3.09 3.78 -0.02 0.00 -1.26 -3.25 105.19 106.04 3dqs n GLY 347 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 3dqs n GLY 347 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dqs s LEU 348 N 0.00 4.28 -0.21 0.99 1.43 0.15 -5.04 118.68 120.27 3dqs s LEU 348 Ca 0.00 1.90 0.02 0.00 -1.03 0.00 0.00 54.13 55.02 3dqs s LEU 348 Cb 0.00 -4.07 0.04 0.00 0.03 0.00 0.00 46.19 42.19 3dqs s LEU 348 CO 0.00 -0.20 -0.14 -1.61 0.23 0.00 0.00 176.35 174.63 3dqs s GLU 349 N -2.20 2.49 -0.69 1.70 2.02 -1.26 -1.25 118.70 119.50 3dqs s GLU 349 Ca 0.52 -1.02 -0.15 0.00 0.02 0.00 0.00 54.97 54.34 3dqs s GLU 349 Cb -0.20 -2.65 0.17 0.00 0.10 0.00 0.00 34.13 31.56 3dqs s GLU 349 CO 0.25 -0.39 0.65 -0.06 0.02 0.00 0.00 175.26 175.72 3dqs s PHE 350 N 1.25 3.50 0.30 1.61 0.08 0.41 -0.19 117.98 124.94 3dqs s PHE 350 Ca -0.02 -1.63 0.31 0.00 0.12 0.00 0.00 56.93 55.72 3dqs s PHE 350 Cb -0.16 -3.82 1.47 0.00 -0.57 0.00 0.00 43.02 39.94 3dqs s PHE 350 CO -0.09 -1.02 2.04 0.66 -0.10 0.00 0.00 175.22 176.72 3dqs h SER 351 N 8.35 0.00 -3.51 1.36 4.64 -1.82 -1.42 113.55 121.15 3dqs h SER 351 Ca -0.09 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.65 3dqs h SER 351 Cb 1.07 0.00 -0.38 0.00 -0.31 0.00 0.00 62.40 62.77 3dqs h SER 351 CO 0.90 0.09 -0.78 0.00 -0.87 0.00 0.00 176.83 176.16 3dqs s ALA 352 N -3.92 1.68 -0.47 5.18 0.00 -1.23 -4.68 121.76 118.31 3dqs s ALA 352 Ca -0.01 -1.14 0.05 0.00 0.00 0.00 0.00 51.96 50.86 3dqs s ALA 352 Cb 0.11 -1.33 0.24 0.00 0.00 0.00 0.00 23.12 22.13 3dqs s ALA 352 CO 0.56 -1.13 0.91 0.00 0.00 0.00 0.00 175.76 176.09 3dqs n ALA 353 N 4.78 -1.82 -1.79 0.00 0.00 -1.26 -1.80 120.51 118.63 3dqs n ALA 353 Ca -0.11 -1.17 -0.41 0.00 0.00 0.00 0.00 53.44 51.75 3dqs n ALA 353 Cb 0.45 -1.64 -0.01 0.00 0.00 0.00 0.00 19.45 18.25 3dqs n ALA 353 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3dqs s PRO 354 N 0.67 4.20 0.07 0.00 0.04 -1.18 -4.71 135.00 134.08 3dqs s PRO 354 Ca 0.31 2.44 0.05 0.00 0.04 0.00 0.00 61.00 63.84 3dqs s PRO 354 Cb 0.19 -3.02 -0.03 0.00 0.04 0.00 0.00 34.50 31.68 3dqs s PRO 354 CO -0.19 -0.44 -0.13 -0.59 0.04 0.00 0.00 177.00 175.69 3dqs s PHE 355 N -0.83 1.12 0.08 0.56 -0.12 -0.78 -1.39 117.98 116.62 3dqs s PHE 355 Ca 0.54 -0.49 -0.10 0.00 -0.05 0.00 0.00 56.93 56.83 3dqs s PHE 355 Cb -0.44 -0.63 0.01 0.00 -0.63 0.00 0.00 43.02 41.32 3dqs s PHE 355 CO 0.56 0.03 0.22 -1.54 -0.05 0.00 0.00 175.22 174.44 3dqs s SER 356 N -1.81 0.04 0.00 1.98 1.04 0.68 -1.14 113.70 114.48 3dqs s SER 356 Ca -0.02 -0.50 0.00 0.00 0.48 0.00 0.00 55.95 55.91 3dqs s SER 356 Cb -0.09 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.37 3dqs s SER 356 CO 0.02 -0.69 0.00 0.61 0.98 0.00 0.00 173.24 174.16 3dqs n GLY 357 N 0.16 4.55 3.06 7.32 0.00 -1.14 -1.46 105.19 117.68 3dqs n GLY 357 Ca -0.16 -0.58 -0.08 0.00 0.00 0.00 0.00 46.02 45.19 3dqs n GLY 357 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3dqs s TRP 358 N 3.38 0.40 0.59 1.61 -2.14 -1.26 -4.45 118.94 117.07 3dqs s TRP 358 Ca 0.00 -0.85 -0.16 0.00 2.66 0.00 0.00 56.10 57.75 3dqs s TRP 358 Cb 0.00 -0.30 -0.04 0.00 -3.10 0.00 0.00 33.47 30.03 3dqs s TRP 358 CO 0.00 -0.32 1.07 0.71 -2.66 0.00 0.00 176.95 175.75 3dqs s TYR 359 N -3.06 2.89 -0.17 1.66 2.02 -1.26 -4.92 117.35 114.50 3dqs s TYR 359 Ca -0.01 1.53 -0.07 0.00 -0.37 0.00 0.00 57.07 58.15 3dqs s TYR 359 Cb 0.02 -3.07 -0.04 0.00 -0.40 0.00 0.00 41.96 38.47 3dqs s TYR 359 CO -0.07 -1.24 0.04 1.41 -1.57 0.00 0.00 175.55 174.12 3dqs s MET 360 N -3.91 3.90 0.50 -0.62 -2.45 -1.26 -1.70 119.30 113.76 3dqs s MET 360 Ca 0.65 -0.38 0.29 0.00 -1.25 0.00 0.00 55.69 55.01 3dqs s MET 360 Cb -0.18 -3.15 1.40 0.00 1.25 0.00 0.00 34.83 34.15 3dqs s MET 360 CO 0.35 0.28 1.84 0.66 1.05 0.00 0.00 175.02 179.21 3dqs h SER 361 N 6.64 0.12 0.77 1.11 4.64 -1.25 -1.20 113.55 124.37 3dqs h SER 361 Ca -0.36 0.02 -0.03 0.00 -0.47 0.00 0.00 61.79 60.95 3dqs h SER 361 Cb 1.17 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3dqs h SER 361 CO 0.69 0.03 -0.12 0.71 -0.87 0.00 0.00 176.83 177.26 3dqs h THR 362 N 0.11 0.37 -0.85 2.95 1.35 -1.94 -0.57 112.91 114.32 3dqs h THR 362 Ca 0.50 -0.75 -0.02 0.00 -0.55 0.00 0.00 66.41 65.59 3dqs h THR 362 Cb 1.77 1.55 -0.04 0.00 -1.73 0.00 0.00 68.15 69.70 3dqs h THR 362 CO -0.07 0.12 0.45 -0.33 -0.25 0.00 0.00 175.52 175.44 3dqs h GLU 363 N 0.00 1.20 0.00 4.72 5.08 -1.63 -0.79 114.58 123.16 3dqs h GLU 363 Ca -0.00 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.18 3dqs h GLU 363 Cb 0.54 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 3dqs h GLU 363 CO 0.02 0.89 -0.32 0.82 -1.00 0.00 0.00 179.01 179.42 3dqs h ILE 364 N 1.19 0.38 -0.12 3.13 2.04 -1.62 -1.54 117.51 120.97 3dqs h ILE 364 Ca 0.30 -1.35 -0.08 0.00 1.00 0.00 0.00 64.86 64.73 3dqs h ILE 364 Cb 0.05 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 3dqs h ILE 364 CO -0.05 0.13 -0.27 1.23 0.00 0.00 0.00 178.15 179.19 3dqs h GLY 365 N -1.00 0.24 0.00 5.37 0.00 -1.20 -1.40 103.07 105.09 3dqs h GLY 365 Ca -0.04 -0.18 -0.19 0.00 0.00 0.00 0.00 47.33 46.91 3dqs h GLY 365 CO -0.03 0.17 -1.58 2.41 0.00 0.00 0.00 176.54 177.51 3dqs n THR 366 N -4.15 1.41 0.07 4.70 -1.04 -0.37 -4.11 114.28 110.80 3dqs n THR 366 Ca -0.01 -0.07 -0.04 0.00 -2.04 0.00 0.00 64.05 61.89 3dqs n THR 366 Cb 0.37 -2.06 -0.02 0.00 -1.82 0.00 0.00 70.33 66.80 3dqs n THR 366 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 3dqs h ARG 367 N -0.88 -0.22 -0.81 -2.82 2.47 -1.44 -1.69 114.38 108.98 3dqs h ARG 367 Ca -0.29 0.02 0.06 0.00 -1.26 0.00 0.00 59.98 58.50 3dqs h ARG 367 Cb 1.19 0.05 -0.06 0.00 -1.65 0.00 0.00 29.97 29.51 3dqs h ARG 367 CO -0.18 -0.15 0.50 -0.91 0.56 0.00 0.00 179.97 179.79 3dqs h ASN 368 N -0.57 0.78 0.35 7.04 2.35 -1.30 -0.34 115.58 123.90 3dqs h ASN 368 Ca -0.02 0.02 -0.32 0.00 -0.55 0.00 0.00 56.30 55.42 3dqs h ASN 368 Cb 0.18 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.37 3dqs h ASN 368 CO 0.04 0.51 -1.76 -0.07 -1.65 0.00 0.00 177.43 174.49 3dqs h LEU 369 N 0.92 0.25 0.00 1.61 3.38 -1.42 -2.59 115.31 117.46 3dqs h LEU 369 Ca 0.35 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.83 3dqs h LEU 369 Cb 0.15 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.82 3dqs h LEU 369 CO -0.17 1.43 -0.90 0.00 0.09 0.00 0.00 178.44 178.90 3dqs n ASP 371 N -1.47 2.91 0.25 0.00 10.43 -0.14 -4.56 116.55 123.98 3dqs n ASP 371 Ca 0.03 1.20 0.09 0.00 2.57 0.00 0.00 54.79 58.68 3dqs n ASP 371 Cb 0.28 -1.51 0.64 0.00 1.84 0.00 0.00 41.12 42.38 3dqs n ASP 371 CO 0.00 0.00 0.00 1.55 -1.07 0.00 0.00 177.20 177.68 3dqs h PRO 372 N 2.57 0.00 -0.63 -0.24 0.13 -1.93 -1.92 132.00 129.97 3dqs h PRO 372 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3dqs h PRO 372 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 3dqs h PRO 372 CO 0.62 0.09 0.00 -2.39 -0.23 0.00 0.00 178.00 176.10 3dqs n HIS 373 N -4.20 1.16 0.00 1.56 1.44 -1.26 -4.58 115.22 109.34 3dqs n HIS 373 Ca -0.03 -0.48 0.00 0.00 -2.01 0.00 0.00 57.72 55.20 3dqs n HIS 373 Cb 0.17 -0.16 0.00 0.00 0.12 0.00 0.00 29.99 30.12 3dqs n HIS 373 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 3dqs n ARG 374 N 1.03 2.32 0.31 -1.40 5.12 -0.75 -4.39 116.66 118.90 3dqs n ARG 374 Ca 0.22 0.00 0.19 0.00 -1.93 0.00 0.00 57.85 56.32 3dqs n ARG 374 Cb 0.71 0.00 1.02 0.00 -1.16 0.00 0.00 32.46 33.02 3dqs n ARG 374 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 3dqs h TYR 375 N 0.00 0.00 -6.67 -1.55 -1.99 -1.62 -3.43 116.97 101.71 3dqs h TYR 375 Ca 0.00 0.00 -0.54 0.00 2.00 0.00 0.00 58.73 60.19 3dqs h TYR 375 Cb 0.00 0.00 -0.08 0.00 2.00 0.00 0.00 36.73 38.65 3dqs h TYR 375 CO 0.00 0.02 -0.93 -1.71 -0.00 0.00 0.00 178.16 175.54 3dqs n ASN 376 N -3.40 -0.96 -0.72 3.88 4.05 -0.91 -4.88 115.26 112.32 3dqs n ASN 376 Ca -0.03 -1.12 0.11 0.00 0.45 0.00 0.00 54.58 54.00 3dqs n ASN 376 Cb 0.12 -2.54 0.32 0.00 1.23 0.00 0.00 39.78 38.90 3dqs n ASN 376 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 177.26 176.51 3dqs n ILE 377 N -4.50 0.30 -0.05 -1.44 -5.35 -0.23 -4.54 119.36 103.55 3dqs n ILE 377 Ca -0.27 -0.46 -0.08 0.00 -0.27 0.00 0.00 62.75 61.67 3dqs n ILE 377 Cb 0.67 0.54 -0.02 0.00 -1.74 0.00 0.00 39.64 39.09 3dqs n ILE 377 CO 0.00 0.00 0.00 0.25 -1.76 0.00 0.00 176.55 175.04 3dqs h LEU 378 N 2.84 -0.57 -0.70 7.28 5.85 -1.85 -1.80 115.31 126.36 3dqs h LEU 378 Ca 0.00 0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 3dqs h LEU 378 Cb 0.62 0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.91 3dqs h LEU 378 CO 0.00 -0.22 0.38 -0.08 -0.34 0.00 0.00 178.44 178.18 3dqs h GLU 379 N -0.17 0.98 -0.23 1.25 4.81 -1.98 -0.09 114.58 119.16 3dqs h GLU 379 Ca 0.13 -0.12 0.03 0.00 -0.13 0.00 0.00 59.36 59.27 3dqs h GLU 379 Cb 0.37 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.54 3dqs h GLU 379 CO -0.33 0.74 0.07 -0.44 -0.73 0.00 0.00 179.01 178.32 3dqs h ASP 380 N 0.97 0.06 -0.31 1.04 3.32 -1.76 0.09 116.42 119.82 3dqs h ASP 380 Ca 0.25 0.03 -0.09 0.00 0.02 0.00 0.00 57.03 57.24 3dqs h ASP 380 Cb 0.05 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 3dqs h ASP 380 CO -0.04 0.07 -0.10 0.58 -1.72 0.00 0.00 179.24 178.03 3dqs h VAL 381 N 0.17 1.25 -0.57 -1.35 2.07 -1.09 -1.77 116.25 114.97 3dqs h VAL 381 Ca 0.10 -1.13 -0.07 0.00 0.82 0.00 0.00 66.70 66.42 3dqs h VAL 381 Cb 0.08 1.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 3dqs h VAL 381 CO -0.11 0.38 0.10 0.00 0.02 0.00 0.00 177.57 177.96 3dqs h ALA 382 N 1.22 0.75 -0.53 1.67 0.00 -0.63 -0.83 119.26 120.91 3dqs h ALA 382 Ca 0.12 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3dqs h ALA 382 Cb 0.56 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 3dqs h ALA 382 CO 0.03 0.49 0.34 0.28 0.00 0.00 0.00 179.25 180.40 3dqs h VAL 383 N 0.83 1.15 -0.81 0.00 2.07 -0.72 -0.80 116.25 117.98 3dqs h VAL 383 Ca 0.17 -0.31 0.02 0.00 0.82 0.00 0.00 66.70 67.40 3dqs h VAL 383 Cb 0.41 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 30.53 3dqs h VAL 383 CO 0.01 0.15 0.54 0.00 0.02 0.00 0.00 177.57 178.29 3dqs n MET 385 N -4.42 0.79 -3.31 0.00 2.81 -0.35 -4.93 117.12 107.71 3dqs n MET 385 Ca 0.09 -0.07 -0.17 0.00 -1.81 0.00 0.00 57.70 55.74 3dqs n MET 385 Cb 0.05 -1.50 0.07 0.00 -0.71 0.00 0.00 33.22 31.13 3dqs n MET 385 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3dqs n ASP 386 N -1.04 -4.08 -4.94 7.83 2.03 -0.16 -5.02 116.55 111.17 3dqs n ASP 386 Ca 0.19 -0.48 -0.24 0.00 0.52 0.00 0.00 54.79 54.78 3dqs n ASP 386 Cb 0.19 -4.30 -0.01 0.00 -0.72 0.00 0.00 41.12 36.28 3dqs n ASP 386 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3dqs s LEU 387 N -5.97 3.87 -0.85 -2.67 1.43 -0.57 -5.01 118.68 108.92 3dqs s LEU 387 Ca 0.28 0.53 -0.23 0.00 -1.03 0.00 0.00 54.13 53.67 3dqs s LEU 387 Cb -0.12 -3.41 0.06 0.00 0.03 0.00 0.00 46.19 42.75 3dqs s LEU 387 CO 0.61 -0.43 1.25 -0.62 0.23 0.00 0.00 176.35 177.39 3dqs s ASP 388 N -4.08 6.35 -0.00 2.29 -1.08 -1.26 -4.77 116.67 114.11 3dqs s ASP 388 Ca 0.43 -1.14 0.05 0.00 -0.52 0.00 0.00 52.55 51.37 3dqs s ASP 388 Cb -0.10 -2.51 0.15 0.00 -1.46 0.00 0.00 42.92 39.01 3dqs s ASP 388 CO 0.38 -1.53 1.11 0.35 0.52 0.00 0.00 175.17 176.00 3dqs n THR 389 N 6.31 0.25 0.09 1.71 -2.24 -1.26 -3.70 114.28 115.44 3dqs n THR 389 Ca 0.15 -0.23 0.05 0.00 -2.27 0.00 0.00 64.05 61.74 3dqs n THR 389 Cb 0.49 0.09 -0.02 0.00 -2.10 0.00 0.00 70.33 68.79 3dqs n THR 389 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 3dqs h ARG 390 N 1.00 0.00 -4.98 -0.78 3.08 -2.05 -3.46 114.38 107.18 3dqs h ARG 390 Ca 0.00 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 59.58 3dqs h ARG 390 Cb 0.26 0.00 -0.30 0.00 0.08 0.00 0.00 29.97 30.01 3dqs h ARG 390 CO 0.01 0.22 -0.80 -0.08 -1.07 0.00 0.00 179.97 178.24 3dqs s THR 391 N -3.08 1.01 0.24 2.04 -1.32 -1.24 -5.03 115.64 108.25 3dqs s THR 391 Ca -0.00 -0.51 -0.06 0.00 -1.21 0.00 0.00 61.69 59.91 3dqs s THR 391 Cb 0.08 -0.86 0.19 0.00 -1.51 0.00 0.00 72.50 70.40 3dqs s THR 391 CO 0.78 0.30 1.84 0.71 -2.21 0.00 0.00 174.62 176.04 3dqs h THR 392 N 5.10 1.25 0.00 5.08 1.35 -1.89 -3.04 112.91 120.76 3dqs h THR 392 Ca -0.33 -0.70 0.00 0.00 -0.55 0.00 0.00 66.41 64.83 3dqs h THR 392 Cb 1.17 0.22 0.00 0.00 -1.73 0.00 0.00 68.15 67.81 3dqs h THR 392 CO 0.49 0.30 0.00 -1.54 -0.25 0.00 0.00 175.52 174.52 3dqs n SER 393 N -4.31 0.00 0.11 5.36 3.41 -1.26 -0.92 113.62 116.01 3dqs n SER 393 Ca 0.08 0.33 0.13 0.00 -0.26 0.00 0.00 58.87 59.15 3dqs n SER 393 Cb 0.14 -0.37 0.41 0.00 -0.26 0.00 0.00 64.21 64.13 3dqs n SER 393 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3dqs n SER 394 N -1.37 0.82 -2.47 4.04 3.41 -1.15 -4.91 113.62 111.99 3dqs n SER 394 Ca 0.02 0.59 -0.19 0.00 -0.26 0.00 0.00 58.87 59.02 3dqs n SER 394 Cb 0.04 -0.80 0.02 0.00 -0.26 0.00 0.00 64.21 63.20 3dqs n SER 394 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3dqs n LEU 395 N -2.28 -2.28 -0.04 1.04 4.77 -0.10 -4.90 117.00 113.22 3dqs n LEU 395 Ca 0.05 -0.16 0.01 0.00 -0.03 0.00 0.00 56.01 55.88 3dqs n LEU 395 Cb 0.41 -2.70 0.32 0.00 -2.33 0.00 0.00 43.42 39.12 3dqs n LEU 395 CO 0.29 0.05 1.04 4.11 -1.33 0.00 0.00 177.39 181.55 3dqs h TRP 396 N -0.74 0.61 -0.29 -1.77 5.08 -1.84 -1.32 115.95 115.69 3dqs h TRP 396 Ca -0.46 -0.03 -0.03 0.00 1.08 0.00 0.00 58.89 59.45 3dqs h TRP 396 Cb 1.33 -0.19 -0.01 0.00 -3.00 0.00 0.00 29.16 27.29 3dqs h TRP 396 CO 0.48 0.50 0.07 0.87 -1.28 0.00 0.00 178.44 179.08 3dqs h LYS 397 N 0.61 0.46 -0.78 0.12 1.57 -1.90 -1.36 116.57 115.29 3dqs h LYS 397 Ca 0.15 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 3dqs h LYS 397 Cb 0.16 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.38 3dqs h LYS 397 CO -0.01 0.54 0.36 -0.44 -0.57 0.00 0.00 179.45 179.33 3dqs h ASP 398 N 0.30 1.03 -0.20 0.86 5.19 -1.85 -1.03 116.42 120.72 3dqs h ASP 398 Ca 0.09 -0.14 -0.03 0.00 -0.62 0.00 0.00 57.03 56.33 3dqs h ASP 398 Cb 0.28 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 39.52 3dqs h ASP 398 CO 0.00 0.88 0.02 0.11 -3.12 0.00 0.00 179.24 177.14 3dqs h LYS 399 N 1.11 0.34 -0.48 3.56 1.57 -1.12 -2.32 116.57 119.23 3dqs h LYS 399 Ca 0.27 -0.10 -0.07 0.00 -1.87 0.00 0.00 60.65 58.88 3dqs h LYS 399 Cb 0.14 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 3dqs h LYS 399 CO -0.03 0.51 0.03 0.00 -0.57 0.00 0.00 179.45 179.39 3dqs h ALA 400 N 0.82 0.64 -0.74 3.86 0.00 -1.09 -2.79 119.26 119.95 3dqs h ALA 400 Ca 0.06 -0.26 0.06 0.00 0.00 0.00 0.00 54.91 54.77 3dqs h ALA 400 Cb 0.34 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 3dqs h ALA 400 CO 0.01 0.42 0.43 0.00 0.00 0.00 0.00 179.25 180.11 3dqs h ALA 401 N 0.94 1.00 -0.50 0.00 0.00 -1.15 -0.29 119.26 119.26 3dqs h ALA 401 Ca 0.14 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 3dqs h ALA 401 Cb 0.47 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3dqs h ALA 401 CO 0.02 0.14 0.31 0.28 0.00 0.00 0.00 179.25 180.00 3dqs h VAL 402 N 0.80 1.15 -0.28 0.00 2.07 -1.23 -1.36 116.25 117.39 3dqs h VAL 402 Ca 0.33 -0.31 -0.10 0.00 0.82 0.00 0.00 66.70 67.44 3dqs h VAL 402 Cb 0.17 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 3dqs h VAL 402 CO -0.17 0.15 -0.25 -0.33 0.02 0.00 0.00 177.57 176.98 3dqs h GLU 403 N 0.67 0.54 -0.54 1.57 4.39 -1.13 -0.85 114.58 119.24 3dqs h GLU 403 Ca 0.18 -0.21 -0.10 0.00 0.34 0.00 0.00 59.36 59.58 3dqs h GLU 403 Cb -0.03 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.57 3dqs h GLU 403 CO -0.04 0.74 -0.05 0.82 -1.16 0.00 0.00 179.01 179.32 3dqs h ILE 404 N 0.47 1.27 -0.61 3.13 2.04 -0.76 -1.01 117.51 122.04 3dqs h ILE 404 Ca 0.07 -1.19 -0.09 0.00 1.00 0.00 0.00 64.86 64.65 3dqs h ILE 404 Cb 0.68 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 37.68 3dqs h ILE 404 CO 0.05 0.42 0.03 0.78 0.00 0.00 0.00 178.15 179.43 3dqs h ASN 405 N 0.86 1.02 -0.75 1.72 2.35 -0.98 -2.08 115.58 117.72 3dqs h ASN 405 Ca 0.15 -0.28 -0.06 0.00 -0.55 0.00 0.00 56.30 55.56 3dqs h ASN 405 Cb 0.60 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.67 3dqs h ASN 405 CO 0.04 1.06 0.25 0.25 -1.65 0.00 0.00 177.43 177.38 3dqs h LEU 406 N 0.97 1.07 -0.61 1.61 5.85 -0.97 -2.18 115.31 121.05 3dqs h LEU 406 Ca 0.18 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 3dqs h LEU 406 Cb 0.52 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 3dqs h LEU 406 CO 0.03 0.99 0.34 0.00 -0.34 0.00 0.00 178.44 179.46 3dqs h ALA 407 N 1.13 0.78 -0.36 1.25 0.00 -0.91 0.05 119.26 121.20 3dqs h ALA 407 Ca 0.24 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.07 3dqs h ALA 407 Cb 0.29 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3dqs h ALA 407 CO -0.01 0.28 0.23 0.28 0.00 0.00 0.00 179.25 180.03 3dqs h VAL 408 N 0.82 1.07 0.02 0.00 2.07 -0.98 0.12 116.25 119.37 3dqs h VAL 408 Ca 0.22 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.58 3dqs h VAL 408 Cb 0.02 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 3dqs h VAL 408 CO -0.04 0.08 -0.01 -0.07 0.02 0.00 0.00 177.57 177.56 3dqs h LEU 409 N 0.46 -0.02 -0.42 2.57 3.38 -1.09 -1.72 115.31 118.46 3dqs h LEU 409 Ca 0.14 -0.12 0.04 0.00 0.09 0.00 0.00 57.88 58.03 3dqs h LEU 409 Cb -0.03 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 3dqs h LEU 409 CO -0.05 0.10 0.20 -0.74 0.09 0.00 0.00 178.44 178.04 3dqs h HIS 410 N -0.15 0.37 -0.32 1.13 2.76 -0.82 -0.28 115.15 117.83 3dqs h HIS 410 Ca -0.00 0.02 -0.05 0.00 -2.20 0.00 0.00 60.37 58.14 3dqs h HIS 410 Cb 0.14 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 28.98 3dqs h HIS 410 CO -0.04 0.18 0.02 0.77 -1.30 0.00 0.00 177.93 177.56 3dqs h SER 411 N 0.41 0.54 -0.70 3.26 0.02 -0.66 0.12 113.55 116.53 3dqs h SER 411 Ca 0.18 -0.29 -0.05 0.00 -0.84 0.00 0.00 61.79 60.79 3dqs h SER 411 Cb 0.11 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.47 3dqs h SER 411 CO -0.14 0.70 0.24 -0.26 -1.14 0.00 0.00 176.83 176.23 3dqs h PHE 412 N 0.37 1.10 -0.48 3.45 0.04 -1.19 -0.19 116.94 120.04 3dqs h PHE 412 Ca 0.09 -0.10 -0.02 0.00 2.80 0.00 0.00 57.97 60.74 3dqs h PHE 412 Cb 0.41 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 38.22 3dqs h PHE 412 CO 0.03 0.87 0.22 1.96 -0.60 0.00 0.00 178.31 180.79 3dqs h GLN 413 N 1.01 0.70 -0.02 1.51 4.20 -0.87 0.27 115.11 121.90 3dqs h GLN 413 Ca 0.23 -0.11 0.02 0.00 0.06 0.00 0.00 58.65 58.84 3dqs h GLN 413 Cb 0.27 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 3dqs h GLN 413 CO -0.01 0.61 -0.06 1.25 -0.67 0.00 0.00 178.83 179.94 3dqs h LEU 414 N 0.63 -0.19 0.00 1.46 6.46 -0.31 -1.46 115.31 121.91 3dqs h LEU 414 Ca 0.16 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.96 3dqs h LEU 414 Cb 0.15 0.09 0.00 0.00 -0.73 0.00 0.00 40.66 40.16 3dqs h LEU 414 CO -0.02 -0.09 0.00 0.00 -0.62 0.00 0.00 178.44 177.71 3dqs n ALA 415 N -2.28 2.34 -3.73 1.25 0.00 -0.12 -4.89 120.51 113.08 3dqs n ALA 415 Ca -0.06 -0.11 -0.25 0.00 0.00 0.00 0.00 53.44 53.02 3dqs n ALA 415 Cb 0.11 -1.28 0.05 0.00 0.00 0.00 0.00 19.45 18.33 3dqs n ALA 415 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3dqs n LYS 416 N -0.87 -6.12 -4.52 0.00 5.02 -0.39 -4.97 118.16 106.30 3dqs n LYS 416 Ca 0.13 0.69 -0.33 0.00 -2.02 0.00 0.00 58.31 56.78 3dqs n LYS 416 Cb 0.06 -5.56 -0.13 0.00 -0.02 0.00 0.00 35.03 29.39 3dqs n LYS 416 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3dqs s VAL 417 N -3.40 3.67 0.29 -0.18 1.01 -0.05 -4.33 120.40 117.41 3dqs s VAL 417 Ca 0.41 -0.45 -0.30 0.00 0.00 0.00 0.00 61.98 61.64 3dqs s VAL 417 Cb -0.20 -2.58 -0.12 0.00 0.00 0.00 0.00 36.38 33.49 3dqs s VAL 417 CO 0.79 0.51 1.54 0.41 0.00 0.00 0.00 175.10 178.35 3dqs n THR 418 N 3.36 1.15 -3.48 3.92 -1.04 0.65 -4.39 114.28 114.44 3dqs n THR 418 Ca -0.18 -0.29 -0.15 0.00 -2.04 0.00 0.00 64.05 61.40 3dqs n THR 418 Cb 0.53 -1.85 -0.04 0.00 -1.82 0.00 0.00 70.33 67.14 3dqs n THR 418 CO 0.00 0.00 0.00 -0.51 -0.64 0.00 0.00 175.07 173.92 3dqs s ILE 419 N -0.17 0.00 -0.05 12.58 2.07 -1.26 -4.42 121.20 129.95 3dqs s ILE 419 Ca 0.63 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.89 3dqs s ILE 419 Cb -0.53 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.08 3dqs s ILE 419 CO 0.51 0.00 -0.08 0.54 -1.91 0.00 0.00 174.94 174.00 3dqs s VAL 420 N -2.28 0.79 0.82 4.00 0.11 -0.69 -4.99 120.40 118.16 3dqs s VAL 420 Ca -0.05 -0.28 -0.11 0.00 -2.93 0.00 0.00 61.98 58.61 3dqs s VAL 420 Cb -0.00 -0.76 0.08 0.00 -1.53 0.00 0.00 36.38 34.17 3dqs s VAL 420 CO -0.00 0.28 1.09 1.51 -3.33 0.00 0.00 175.10 174.64 3dqs s ASP 421 N 0.77 4.23 0.55 3.54 -4.77 -1.26 -0.76 116.67 118.98 3dqs s ASP 421 Ca -0.13 1.43 0.32 0.00 -3.30 0.00 0.00 52.55 50.88 3dqs s ASP 421 Cb -0.15 -2.16 1.58 0.00 -1.09 0.00 0.00 42.92 41.10 3dqs s ASP 421 CO 0.02 -2.15 2.09 1.12 0.70 0.00 0.00 175.17 176.94 3dqs h HIS 422 N -1.21 0.00 0.01 2.11 2.07 -1.96 -1.81 115.15 114.36 3dqs h HIS 422 Ca -0.47 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.05 3dqs h HIS 422 Cb 1.27 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.25 3dqs h HIS 422 CO 0.47 0.07 -0.01 0.45 -3.07 0.00 0.00 177.93 175.85 3dqs h HIS 423 N 0.00 -0.02 -0.66 6.12 3.86 -1.97 -2.82 115.15 119.65 3dqs h HIS 423 Ca -0.00 -0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.18 3dqs h HIS 423 Cb 0.36 0.01 -0.03 0.00 1.06 0.00 0.00 27.41 28.80 3dqs h HIS 423 CO 0.00 0.72 0.31 0.00 0.86 0.00 0.00 177.93 179.82 3dqs h ALA 424 N 0.14 0.86 -0.48 2.45 0.00 -1.92 -1.32 119.26 118.99 3dqs h ALA 424 Ca -0.00 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 3dqs h ALA 424 Cb 0.74 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3dqs h ALA 424 CO 0.00 0.42 0.29 0.00 0.00 0.00 0.00 179.25 179.97 3dqs h ALA 425 N 1.14 0.61 -0.08 0.00 0.00 -1.44 -0.39 119.26 119.11 3dqs h ALA 425 Ca 0.23 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 3dqs h ALA 425 Cb 0.13 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3dqs h ALA 425 CO -0.03 0.10 -0.62 1.79 0.00 0.00 0.00 179.25 180.49 3dqs h THR 426 N 0.64 1.38 -0.57 0.00 1.35 -1.32 -1.07 112.91 113.32 3dqs h THR 426 Ca 0.17 -2.00 -0.04 0.00 -0.55 0.00 0.00 66.41 64.00 3dqs h THR 426 Cb -0.01 2.00 -0.03 0.00 -1.73 0.00 0.00 68.15 68.38 3dqs h THR 426 CO -0.03 0.60 0.22 0.58 -0.25 0.00 0.00 175.52 176.63 3dqs h VAL 427 N 0.22 1.23 0.00 6.82 2.07 -0.94 -1.59 116.25 124.06 3dqs h VAL 427 Ca -0.01 -0.73 -0.09 0.00 0.82 0.00 0.00 66.70 66.70 3dqs h VAL 427 Cb 1.14 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 3dqs h VAL 427 CO 0.10 0.28 -0.42 0.77 0.02 0.00 0.00 177.57 178.32 3dqs h SER 428 N 0.79 0.00 0.19 0.57 4.64 -0.85 -2.55 113.55 116.35 3dqs h SER 428 Ca 0.19 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.38 3dqs h SER 428 Cb 0.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 3dqs h SER 428 CO -0.01 0.42 -0.46 0.15 -0.87 0.00 0.00 176.83 176.05 3dqs h PHE 429 N 0.00 0.39 -0.47 4.77 3.57 -0.73 -1.10 116.94 123.37 3dqs h PHE 429 Ca -0.00 -0.12 -0.06 0.00 3.53 0.00 0.00 57.97 61.32 3dqs h PHE 429 Cb 0.83 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.46 3dqs h PHE 429 CO 0.00 0.73 0.05 0.52 -2.23 0.00 0.00 178.31 177.39 3dqs h MET 430 N 0.26 0.75 -0.58 1.11 2.86 -0.90 -0.48 114.93 117.96 3dqs h MET 430 Ca 0.02 -0.17 -0.10 0.00 -2.06 0.00 0.00 59.70 57.39 3dqs h MET 430 Cb 0.92 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.46 3dqs h MET 430 CO 0.08 0.73 -0.02 -0.22 1.06 0.00 0.00 176.91 178.53 3dqs h LYS 431 N 0.71 1.03 -0.63 1.72 1.63 -1.19 -2.26 116.57 117.58 3dqs h LYS 431 Ca 0.15 -0.33 -0.01 0.00 -0.85 0.00 0.00 60.65 59.61 3dqs h LYS 431 Cb 0.36 -0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 31.87 3dqs h LYS 431 CO 0.01 1.02 0.35 1.25 -3.45 0.00 0.00 179.45 178.63 3dqs h HIS 432 N 0.93 0.87 -0.93 1.91 2.76 -0.41 -0.15 115.15 120.13 3dqs h HIS 432 Ca 0.16 -0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.32 3dqs h HIS 432 Cb 0.57 -0.28 -0.05 0.00 1.55 0.00 0.00 27.41 29.21 3dqs h HIS 432 CO 0.04 0.62 0.61 -0.07 -1.30 0.00 0.00 177.93 177.83 3dqs h LEU 433 N 0.86 1.08 -0.55 0.26 3.38 -0.82 0.12 115.31 119.65 3dqs h LEU 433 Ca 0.22 -0.03 -0.14 0.00 0.09 0.00 0.00 57.88 58.02 3dqs h LEU 433 Cb 0.03 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3dqs h LEU 433 CO -0.04 0.79 -0.31 -0.78 0.09 0.00 0.00 178.44 178.19 3dqs h ASP 434 N 1.27 0.88 -0.42 -0.43 1.82 -0.96 -0.21 116.42 118.36 3dqs h ASP 434 Ca 0.34 -0.36 -0.02 0.00 -0.39 0.00 0.00 57.03 56.60 3dqs h ASP 434 Cb -0.14 -0.24 -0.02 0.00 0.68 0.00 0.00 39.33 39.61 3dqs h ASP 434 CO -0.07 1.11 0.20 0.78 -1.61 0.00 0.00 179.24 179.65 3dqs h ASN 435 N 0.71 0.56 0.72 2.28 2.35 -0.45 -2.91 115.58 118.84 3dqs h ASN 435 Ca 0.08 -0.14 -0.11 0.00 -0.55 0.00 0.00 56.30 55.58 3dqs h ASN 435 Cb 0.86 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 39.07 3dqs h ASN 435 CO 0.08 0.54 -0.51 -0.33 -1.65 0.00 0.00 177.43 175.56 3dqs h GLU 436 N 0.54 0.00 -0.57 0.81 4.39 -0.63 -0.07 114.58 119.05 3dqs h GLU 436 Ca 0.14 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.84 3dqs h GLU 436 Cb 0.14 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.76 3dqs h GLU 436 CO -0.02 0.51 0.33 0.37 -1.16 0.00 0.00 179.01 179.04 3dqs h GLN 437 N 0.00 0.79 -0.15 2.33 5.75 -0.89 0.28 115.11 123.21 3dqs h GLN 437 Ca -0.01 -0.08 -0.11 0.00 -0.15 0.00 0.00 58.65 58.31 3dqs h GLN 437 Cb 1.01 -0.16 0.00 0.00 1.07 0.00 0.00 27.48 29.40 3dqs h GLN 437 CO 0.07 0.59 -0.31 0.87 -2.65 0.00 0.00 178.83 177.39 3dqs h LYS 438 N 0.78 0.48 -0.05 1.69 1.57 -1.31 -0.87 116.57 118.85 3dqs h LYS 438 Ca 0.20 -0.32 -0.25 0.00 -1.87 0.00 0.00 60.65 58.42 3dqs h LYS 438 Cb 0.02 0.04 0.02 0.00 0.08 0.00 0.00 32.23 32.39 3dqs h LYS 438 CO -0.04 0.92 -0.95 0.00 -0.57 0.00 0.00 179.45 178.82 3dqs h ALA 439 N 0.56 0.20 0.00 3.86 0.00 -0.87 -3.41 119.26 119.61 3dqs h ALA 439 Ca 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.25 3dqs h ALA 439 Cb 0.91 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3dqs h ALA 439 CO 0.07 0.69 0.00 0.54 0.00 0.00 0.00 179.25 180.55 3dqs n ARG 440 N -3.88 2.27 -0.83 0.00 1.74 0.90 -5.03 116.66 111.83 3dqs n ARG 440 Ca -0.10 -0.15 0.00 0.00 -0.77 0.00 0.00 57.85 56.84 3dqs n ARG 440 Cb 0.83 -0.55 0.00 0.00 -1.02 0.00 0.00 32.46 31.72 3dqs n ARG 440 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dqs n GLY 441 N 0.37 0.50 0.00 -0.13 0.00 -0.33 -3.99 105.19 101.60 3dqs n GLY 441 Ca 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.13 3dqs n GLY 441 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dqs n GLY 442 N -2.79 -1.60 3.38 -0.02 0.00 -1.15 -0.66 105.19 102.36 3dqs n GLY 442 Ca 0.00 -1.53 -0.02 0.00 0.00 0.00 0.00 46.02 44.47 3dqs n GLY 442 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dqs s PRO 444 N 2.80 4.21 -0.07 0.00 0.04 -1.26 -4.54 135.00 136.18 3dqs s PRO 444 Ca 0.03 2.27 -0.05 0.00 0.04 0.00 0.00 61.00 63.29 3dqs s PRO 444 Cb -0.13 -3.56 0.02 0.00 0.04 0.00 0.00 34.50 30.87 3dqs s PRO 444 CO -0.18 -0.69 0.17 0.00 0.04 0.00 0.00 177.00 176.33 3dqs s ALA 445 N 2.47 -0.39 -0.58 8.56 0.00 -0.13 -4.12 121.76 127.58 3dqs s ALA 445 Ca 0.72 0.56 -0.18 0.00 0.00 0.00 0.00 51.96 53.06 3dqs s ALA 445 Cb -0.39 -0.35 0.12 0.00 0.00 0.00 0.00 23.12 22.50 3dqs s ALA 445 CO 0.31 -0.11 0.63 0.34 0.00 0.00 0.00 175.76 176.93 3dqs s ASP 446 N 0.45 6.20 0.19 0.00 -1.08 0.11 -3.83 116.67 118.72 3dqs s ASP 446 Ca -0.03 -1.61 -0.16 0.00 -0.52 0.00 0.00 52.55 50.23 3dqs s ASP 446 Cb -0.04 -2.26 0.18 0.00 -1.46 0.00 0.00 42.92 39.33 3dqs s ASP 446 CO -0.02 -1.00 1.62 -0.25 0.52 0.00 0.00 175.17 176.04 3dqs h TRP 447 N 9.04 -0.46 -0.48 -5.34 7.01 -1.91 0.61 115.95 124.41 3dqs h TRP 447 Ca -0.29 0.05 0.11 0.00 2.11 0.00 0.00 58.89 60.88 3dqs h TRP 447 Cb 1.09 0.29 -0.02 0.00 -2.10 0.00 0.00 29.16 28.41 3dqs h TRP 447 CO 0.80 -0.29 0.34 0.00 -2.79 0.00 0.00 178.44 176.50 3dqs h ALA 448 N 1.40 2.26 0.00 2.65 0.00 -1.92 -1.13 119.26 122.51 3dqs h ALA 448 Ca 0.26 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.93 3dqs h ALA 448 Cb 0.46 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 3dqs h ALA 448 CO -0.60 -0.39 -1.72 0.91 0.00 0.00 0.00 179.25 177.46 3dqs n TRP 449 N -4.44 0.74 0.03 0.00 7.02 -0.46 -4.35 117.44 115.98 3dqs n TRP 449 Ca 0.08 0.25 -0.20 0.00 -1.02 0.00 0.00 57.50 56.62 3dqs n TRP 449 Cb 0.45 -1.06 -0.10 0.00 -2.42 0.00 0.00 31.31 28.18 3dqs n TRP 449 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 3dqs h ILE 450 N 0.00 1.29 -2.97 -0.99 1.08 -0.27 -3.44 117.51 112.21 3dqs h ILE 450 Ca -0.26 -2.21 -0.54 0.00 -0.39 0.00 0.00 64.86 61.46 3dqs h ILE 450 Cb 1.79 2.36 0.00 0.00 -3.07 0.00 0.00 36.82 37.91 3dqs h ILE 450 CO 0.05 0.68 0.77 -0.69 -0.69 0.00 0.00 178.15 178.27 3dqs s VAL 451 N -3.35 3.68 0.70 1.67 1.01 -0.49 -4.95 120.40 118.68 3dqs s VAL 451 Ca -0.10 1.12 -0.16 0.00 0.00 0.00 0.00 61.98 62.84 3dqs s VAL 451 Cb 0.07 -3.72 0.02 0.00 0.00 0.00 0.00 36.38 32.75 3dqs s VAL 451 CO 0.92 0.03 1.25 -2.84 0.00 0.00 0.00 175.10 174.45 3dqs s PRO 452 N 1.94 2.27 0.19 2.72 0.02 -1.26 -4.92 135.00 135.96 3dqs s PRO 452 Ca 0.63 1.91 0.20 0.00 0.02 0.00 0.00 61.00 63.76 3dqs s PRO 452 Cb -0.32 -1.83 0.87 0.00 0.02 0.00 0.00 34.50 33.24 3dqs s PRO 452 CO 0.27 -1.77 1.61 -0.35 -0.33 0.00 0.00 177.00 176.44 3dqs n PRO 453 N -2.40 0.13 -4.19 5.54 -0.04 -1.26 -4.14 135.00 128.64 3dqs n PRO 453 Ca 0.15 0.41 -0.16 0.00 -0.04 0.00 0.00 63.50 63.86 3dqs n PRO 453 Cb 0.49 -1.78 -0.11 0.00 -0.04 0.00 0.00 33.50 32.06 3dqs n PRO 453 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 3dqs s ILE 454 N -3.25 1.08 -1.26 0.52 -4.36 -1.26 -4.86 121.20 107.80 3dqs s ILE 454 Ca 0.04 -1.60 -0.03 0.00 -0.26 0.00 0.00 60.65 58.80 3dqs s ILE 454 Cb 0.08 -1.35 0.02 0.00 1.25 0.00 0.00 42.46 42.46 3dqs s ILE 454 CO 0.32 -0.46 0.22 -1.20 0.24 0.00 0.00 174.94 174.06 3dqs n SER 455 N 0.68 -4.39 -0.32 4.36 7.64 -1.26 -4.90 113.62 115.44 3dqs n SER 455 Ca -0.17 -0.05 -0.08 0.00 1.01 0.00 0.00 58.87 59.58 3dqs n SER 455 Cb 0.57 -3.66 -0.08 0.00 -1.01 0.00 0.00 64.21 60.03 3dqs n SER 455 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dqs n GLY 456 N -1.03 -2.51 0.00 0.23 0.00 -1.26 -0.93 105.19 99.69 3dqs n GLY 456 Ca -0.12 1.00 0.13 0.00 0.00 0.00 0.00 46.02 47.04 3dqs n GLY 456 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3dqs n SER 457 N -4.75 0.00 0.04 1.61 3.41 -1.26 -2.21 113.62 110.46 3dqs n SER 457 Ca 0.02 -0.75 0.12 0.00 -0.26 0.00 0.00 58.87 58.00 3dqs n SER 457 Cb 0.20 -0.03 0.31 0.00 -0.26 0.00 0.00 64.21 64.42 3dqs n SER 457 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3dqs n LEU 458 N -1.03 0.55 -4.91 1.04 4.77 -0.11 -4.82 117.00 112.48 3dqs n LEU 458 Ca 0.19 0.27 -0.30 0.00 -0.03 0.00 0.00 56.01 56.14 3dqs n LEU 458 Cb 0.11 -0.28 -0.04 0.00 -2.33 0.00 0.00 43.42 40.88 3dqs n LEU 458 CO 0.16 -0.02 -0.15 0.42 -1.33 0.00 0.00 177.39 176.47 3dqs s THR 459 N -3.08 5.32 0.46 -5.08 -4.23 -0.94 -5.02 115.64 103.07 3dqs s THR 459 Ca 0.10 -0.47 0.19 0.00 -1.18 0.00 0.00 61.69 60.33 3dqs s THR 459 Cb 0.15 -3.62 0.24 0.00 1.34 0.00 0.00 72.50 70.61 3dqs s THR 459 CO 0.66 0.10 2.06 1.55 -0.54 0.00 0.00 174.62 178.45 3dqs h PRO 460 N 2.93 0.00 0.00 3.99 0.13 -1.87 -3.07 132.00 134.11 3dqs h PRO 460 Ca -0.46 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.63 3dqs h PRO 460 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 3dqs h PRO 460 CO 0.74 0.13 -0.23 -0.39 -0.23 0.00 0.00 178.00 178.02 3dqs h VAL 461 N 0.00 1.12 -0.97 1.56 -1.51 -1.89 -2.69 116.25 111.86 3dqs h VAL 461 Ca -0.00 -0.79 0.15 0.00 -1.23 0.00 0.00 66.70 64.83 3dqs h VAL 461 Cb 0.26 1.43 -0.09 0.00 -2.13 0.00 0.00 31.29 30.76 3dqs h VAL 461 CO 0.02 0.22 0.61 0.15 -1.23 0.00 0.00 177.57 177.34 3dqs h PHE 462 N 0.00 1.01 -0.12 5.19 3.57 -1.73 -1.14 116.94 123.72 3dqs h PHE 462 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 3dqs h PHE 462 Cb 0.41 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.84 3dqs h PHE 462 CO 0.00 0.33 0.00 0.72 -2.23 0.00 0.00 178.31 177.13 3dqs n HIS 463 N -4.65 0.15 -3.66 0.41 8.25 -1.02 -4.81 115.22 109.89 3dqs n HIS 463 Ca 0.20 -0.08 -0.37 0.00 -0.26 0.00 0.00 57.72 57.21 3dqs n HIS 463 Cb 0.48 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.47 3dqs n HIS 463 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 3dqs s GLN 464 N -1.85 3.78 0.57 -0.41 2.00 -0.43 -0.47 119.66 122.85 3dqs s GLN 464 Ca 0.33 -0.42 -0.18 0.00 -2.00 0.00 0.00 55.36 53.09 3dqs s GLN 464 Cb 0.17 -3.51 -0.04 0.00 0.80 0.00 0.00 33.01 30.43 3dqs s GLN 464 CO 0.27 -0.20 1.12 -1.21 -0.50 0.00 0.00 175.29 174.76 3dqs s GLU 465 N 1.69 3.23 0.03 1.67 2.02 -0.27 -5.00 118.70 122.08 3dqs s GLU 465 Ca 0.07 1.53 0.01 0.00 0.02 0.00 0.00 54.97 56.60 3dqs s GLU 465 Cb -0.16 -2.00 -0.02 0.00 0.10 0.00 0.00 34.13 32.05 3dqs s GLU 465 CO 0.08 -0.93 -0.05 -1.64 0.02 0.00 0.00 175.26 172.74 3dqs s MET 466 N -3.51 0.44 -0.11 1.61 -1.94 -1.26 -4.69 119.30 109.84 3dqs s MET 466 Ca 0.71 -0.74 -0.00 0.00 -1.71 0.00 0.00 55.69 53.94 3dqs s MET 466 Cb -0.22 -0.05 -0.02 0.00 2.01 0.00 0.00 34.83 36.54 3dqs s MET 466 CO 0.31 -0.01 -0.10 0.08 -0.01 0.00 0.00 175.02 175.28 3dqs s VAL 467 N -1.70 3.36 -0.10 -6.03 1.01 -1.26 -4.93 120.40 110.75 3dqs s VAL 467 Ca -0.11 -0.57 0.03 0.00 0.00 0.00 0.00 61.98 61.33 3dqs s VAL 467 Cb -0.08 -2.40 -0.00 0.00 0.00 0.00 0.00 36.38 33.89 3dqs s VAL 467 CO -0.01 0.54 -0.22 0.21 0.00 0.00 0.00 175.10 175.62 3dqs s ASN 468 N -0.04 3.26 0.20 3.32 3.04 -1.25 -0.95 114.94 122.52 3dqs s ASN 468 Ca -0.02 -0.51 -0.23 0.00 0.04 0.00 0.00 52.86 52.15 3dqs s ASN 468 Cb -0.14 -1.42 0.05 0.00 -1.54 0.00 0.00 41.25 38.21 3dqs s ASN 468 CO 0.03 0.17 0.66 -0.72 -3.04 0.00 0.00 177.10 174.21 3dqs s TYR 469 N 0.31 -0.40 -0.26 0.43 -0.85 -1.26 -4.97 117.35 110.35 3dqs s TYR 469 Ca -0.17 0.10 -0.12 0.00 -0.52 0.00 0.00 57.07 56.36 3dqs s TYR 469 Cb -0.17 0.61 -0.05 0.00 0.38 0.00 0.00 41.96 42.74 3dqs s TYR 469 CO 0.08 -0.97 0.26 0.42 -1.52 0.00 0.00 175.55 173.81 3dqs s ILE 470 N -3.77 5.27 0.21 -3.49 1.01 -1.26 -4.85 121.20 114.32 3dqs s ILE 470 Ca 0.05 0.33 0.10 0.00 0.00 0.00 0.00 60.65 61.14 3dqs s ILE 470 Cb -0.03 -3.59 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 3dqs s ILE 470 CO -0.05 0.24 -0.15 -0.76 0.00 0.00 0.00 174.94 174.21 3dqs s LEU 471 N 1.71 2.75 0.05 2.97 1.43 -1.26 -3.98 118.68 122.34 3dqs s LEU 471 Ca 0.10 -0.75 0.07 0.00 -1.03 0.00 0.00 54.13 52.52 3dqs s LEU 471 Cb -0.15 -1.41 -0.02 0.00 0.03 0.00 0.00 46.19 44.63 3dqs s LEU 471 CO 0.09 0.09 -0.19 -0.55 0.23 0.00 0.00 176.35 176.03 3dqs s SER 472 N -2.96 2.24 0.68 2.29 0.15 -1.26 -4.20 113.70 110.64 3dqs s SER 472 Ca 0.25 -0.51 -0.17 0.00 0.70 0.00 0.00 55.95 56.22 3dqs s SER 472 Cb -0.08 -0.17 -0.05 0.00 -1.71 0.00 0.00 66.02 64.01 3dqs s SER 472 CO 0.14 0.12 0.55 -2.65 1.20 0.00 0.00 173.24 172.59 3dqs n PRO 473 N 1.82 0.39 -3.58 5.44 -0.02 -1.26 -5.01 135.00 132.78 3dqs n PRO 473 Ca -0.18 0.17 -0.11 0.00 -2.02 0.00 0.00 63.50 61.36 3dqs n PRO 473 Cb 0.54 -1.81 -0.04 0.00 -0.02 0.00 0.00 33.50 32.16 3dqs n PRO 473 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dqs s ALA 474 N -1.84 -1.13 -0.18 3.55 0.00 -0.71 -4.03 121.76 117.42 3dqs s ALA 474 Ca 0.67 0.16 -0.08 0.00 0.00 0.00 0.00 51.96 52.70 3dqs s ALA 474 Cb -0.38 0.70 -0.04 0.00 0.00 0.00 0.00 23.12 23.40 3dqs s ALA 474 CO 0.56 -0.65 0.10 -0.06 0.00 0.00 0.00 175.76 175.71 3dqs s PHE 475 N -3.61 3.35 0.12 0.00 0.40 -1.26 -0.55 117.98 116.44 3dqs s PHE 475 Ca 0.01 0.24 0.05 0.00 -0.60 0.00 0.00 56.93 56.63 3dqs s PHE 475 Cb 0.01 -2.09 -0.04 0.00 0.51 0.00 0.00 43.02 41.41 3dqs s PHE 475 CO -0.11 0.29 -0.12 1.03 0.70 0.00 0.00 175.22 177.00 3dqs s ARG 476 N 0.18 1.00 0.55 0.44 0.52 0.80 -4.95 118.95 117.48 3dqs s ARG 476 Ca 0.07 -1.27 -0.15 0.00 -0.52 0.00 0.00 55.73 53.86 3dqs s ARG 476 Cb -0.12 -0.77 -0.07 0.00 0.52 0.00 0.00 34.95 34.52 3dqs s ARG 476 CO -0.00 0.13 1.00 0.71 0.02 0.00 0.00 175.30 177.16 3dqs s TYR 477 N -2.47 3.49 0.02 -0.53 2.02 -1.26 -0.52 117.35 118.10 3dqs s TYR 477 Ca 0.10 1.42 -0.01 0.00 -0.37 0.00 0.00 57.07 58.20 3dqs s TYR 477 Cb -0.03 -2.78 -0.02 0.00 -0.40 0.00 0.00 41.96 38.73 3dqs s TYR 477 CO 0.02 -0.48 -0.00 1.14 -1.57 0.00 0.00 175.55 174.65 3dqs s GLN 478 N -4.39 0.39 0.54 -0.62 -2.07 -1.26 -4.76 119.66 107.49 3dqs s GLN 478 Ca 0.58 -0.69 -0.22 0.00 -1.82 0.00 0.00 55.36 53.21 3dqs s GLN 478 Cb -0.10 0.14 -0.05 0.00 -1.09 0.00 0.00 33.01 31.91 3dqs s GLN 478 CO 0.38 -0.07 1.37 -2.14 -1.32 0.00 0.00 175.29 173.51 3dqs s PRO 479 N -1.92 3.14 0.34 9.60 0.02 -1.26 -4.92 135.00 140.00 3dqs s PRO 479 Ca -0.12 2.27 -0.29 0.00 0.02 0.00 0.00 61.00 62.89 3dqs s PRO 479 Cb -0.06 -2.28 -0.11 0.00 0.02 0.00 0.00 34.50 32.07 3dqs s PRO 479 CO -0.02 -1.20 1.51 -0.51 -0.33 0.00 0.00 177.00 176.44 3dqs s ASP 480 N -0.90 6.39 0.59 2.53 1.01 -1.26 -4.88 116.67 120.15 3dqs s ASP 480 Ca 0.71 2.98 0.30 0.00 0.71 0.00 0.00 52.55 57.25 3dqs s ASP 480 Cb -0.41 -2.65 1.76 0.00 1.01 0.00 0.00 42.92 42.62 3dqs s ASP 480 CO 0.49 -0.86 2.18 1.55 0.21 0.00 0.00 175.17 178.75 3dqs h PRO 481 N 3.70 0.00 -0.01 8.23 0.13 -1.93 -3.55 132.00 138.57 3dqs h PRO 481 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 3dqs h PRO 481 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 3dqs h PRO 481 CO 0.70 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.80