#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hbg s ASP 95 N 0.00 6.09 0.40 1.69 3.68 -1.26 -4.95 116.67 122.31 3hbg s ASP 95 Ca 0.00 -0.44 0.28 0.00 2.13 0.00 0.00 52.55 54.52 3hbg s ASP 95 Cb 0.00 -2.15 1.38 0.00 -1.45 0.00 0.00 42.92 40.70 3hbg s ASP 95 CO 0.00 -0.28 1.85 -0.65 0.13 0.00 0.00 175.17 176.22 3hbg h PRO 96 N 8.50 0.00 -0.54 4.34 0.11 -2.06 -2.54 132.00 139.82 3hbg h PRO 96 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 3hbg h PRO 96 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3hbg h PRO 96 CO 0.66 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.64 3hbg n PHE 97 N -2.51 0.72 -0.28 0.65 3.01 -1.26 -4.60 117.46 113.20 3hbg n PHE 97 Ca -0.00 -0.47 0.10 0.00 1.01 0.00 0.00 57.45 58.08 3hbg n PHE 97 Cb 0.13 -0.01 0.34 0.00 -0.01 0.00 0.00 39.48 39.93 3hbg n PHE 97 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3hbg h ALA 98 N 3.34 1.74 -0.24 4.37 0.00 -1.88 -2.01 119.26 124.58 3hbg h ALA 98 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3hbg h ALA 98 Cb 0.87 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3hbg h ALA 98 CO 0.00 0.05 0.00 0.41 0.00 0.00 0.00 179.25 179.71 3hbg n GLY 99 N -1.42 0.27 3.76 0.00 0.00 -1.26 -4.94 105.19 101.60 3hbg n GLY 99 Ca 0.16 -0.33 -0.38 0.00 0.00 0.00 0.00 46.02 45.47 3hbg n GLY 99 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hbg s ASP 100 N -1.19 5.66 0.75 1.61 1.11 -0.76 -4.92 116.67 118.93 3hbg s ASP 100 Ca 0.24 2.56 -0.11 0.00 0.18 0.00 0.00 52.55 55.41 3hbg s ASP 100 Cb 0.12 -2.62 0.04 0.00 1.07 0.00 0.00 42.92 41.53 3hbg s ASP 100 CO 0.17 -1.28 1.09 -2.16 1.18 0.00 0.00 175.17 174.17 3hbg s PRO 101 N -2.82 2.45 0.58 8.23 0.04 -1.26 -5.03 135.00 137.19 3hbg s PRO 101 Ca 0.68 1.14 -0.17 0.00 0.04 0.00 0.00 61.00 62.69 3hbg s PRO 101 Cb -0.35 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 3hbg s PRO 101 CO 0.42 -1.49 1.07 -2.14 0.04 0.00 0.00 177.00 174.90 3hbg s PRO 102 N -4.87 3.33 0.27 0.56 0.02 -1.26 -5.07 135.00 127.98 3hbg s PRO 102 Ca 0.61 1.32 0.09 0.00 0.02 0.00 0.00 61.00 63.04 3hbg s PRO 102 Cb -0.17 -2.03 -0.05 0.00 0.02 0.00 0.00 34.50 32.27 3hbg s PRO 102 CO 0.55 -0.82 -0.14 1.03 -0.33 0.00 0.00 177.00 177.29 3hbg s ARG 103 N -3.81 1.59 0.23 5.54 3.00 -1.26 -5.06 118.95 119.18 3hbg s ARG 103 Ca 0.66 -1.75 -0.31 0.00 0.00 0.00 0.00 55.73 54.33 3hbg s ARG 103 Cb -0.18 -1.48 -0.11 0.00 0.00 0.00 0.00 34.95 33.19 3hbg s ARG 103 CO 0.33 0.21 1.58 -1.58 0.00 0.00 0.00 175.30 175.83 3hbg s HIS 104 N -2.74 2.94 0.66 -0.53 5.65 -1.26 -4.99 115.29 115.02 3hbg s HIS 104 Ca 0.28 0.70 -0.15 0.00 0.25 0.00 0.00 55.06 56.14 3hbg s HIS 104 Cb -0.01 -3.98 0.00 0.00 -1.18 0.00 0.00 32.58 27.41 3hbg s HIS 104 CO 0.13 -3.48 1.14 -2.14 -0.65 0.00 0.00 174.74 169.74 3hbg s PRO 105 N 0.37 2.69 0.00 2.88 0.02 -1.26 -3.78 135.00 135.92 3hbg s PRO 105 Ca 0.67 1.51 0.00 0.00 0.02 0.00 0.00 61.00 63.20 3hbg s PRO 105 Cb -0.46 -1.93 0.00 0.00 0.02 0.00 0.00 34.50 32.14 3hbg s PRO 105 CO 0.38 -1.36 0.00 0.41 -0.33 0.00 0.00 177.00 176.11 3hbg n GLY 106 N -0.21 0.66 3.79 0.52 0.00 -1.26 -5.05 105.19 103.64 3hbg n GLY 106 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 3hbg n GLY 106 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hbg s LEU 107 N 0.00 3.60 -0.64 0.99 1.02 -1.25 -4.45 118.68 117.95 3hbg s LEU 107 Ca 0.00 1.92 -0.23 0.00 0.02 0.00 0.00 54.13 55.84 3hbg s LEU 107 Cb 0.00 -4.55 0.06 0.00 0.02 0.00 0.00 46.19 41.72 3hbg s LEU 107 CO 0.00 -1.14 0.97 -0.60 0.02 0.00 0.00 176.35 175.60 3hbg s ARG 108 N -3.77 3.15 -0.34 1.70 3.52 0.65 -4.93 118.95 118.94 3hbg s ARG 108 Ca 0.66 -0.69 -0.22 0.00 -0.13 0.00 0.00 55.73 55.35 3hbg s ARG 108 Cb -0.18 -4.19 0.00 0.00 -1.56 0.00 0.00 34.95 29.03 3hbg s ARG 108 CO 0.32 -1.76 0.73 0.08 -0.81 0.00 0.00 175.30 173.86 3hbg s VAL 109 N 4.12 4.81 -0.07 7.11 1.01 -1.26 -1.13 120.40 134.98 3hbg s VAL 109 Ca 0.24 0.87 0.14 0.00 0.00 0.00 0.00 61.98 63.23 3hbg s VAL 109 Cb -0.16 -4.14 -0.16 0.00 0.00 0.00 0.00 36.38 31.92 3hbg s VAL 109 CO 0.12 -0.33 0.87 0.78 0.00 0.00 0.00 175.10 176.54 3hbg h ASN 110 N 8.37 0.00 -3.50 3.32 2.35 -1.01 -3.47 115.58 121.63 3hbg h ASN 110 Ca -0.25 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.40 3hbg h ASN 110 Cb 1.10 0.00 -0.25 0.00 0.05 0.00 0.00 38.32 39.22 3hbg h ASN 110 CO 0.87 0.77 -0.21 -0.55 -1.65 0.00 0.00 177.43 176.67 3hbg s SER 111 N -6.06 -0.54 -0.13 5.81 0.15 -0.73 -4.93 113.70 107.27 3hbg s SER 111 Ca -0.02 0.97 -0.17 0.00 0.70 0.00 0.00 55.95 57.43 3hbg s SER 111 Cb 0.08 0.91 -0.25 0.00 -1.71 0.00 0.00 66.02 65.05 3hbg s SER 111 CO 0.81 -0.18 0.49 -0.61 1.20 0.00 0.00 173.24 174.95 3hbg h GLN 112 N 6.35 0.18 -3.27 5.44 5.75 -1.90 0.19 115.11 127.85 3hbg h GLN 112 Ca -0.32 -0.31 -0.57 0.00 -0.15 0.00 0.00 58.65 57.31 3hbg h GLN 112 Cb 1.19 0.11 -0.40 0.00 1.07 0.00 0.00 27.48 29.45 3hbg h GLN 112 CO 0.25 1.15 -0.77 0.15 -2.65 0.00 0.00 178.83 176.96 3hbg s LYS 113 N -2.44 0.54 0.76 1.69 1.02 -1.26 -2.60 119.74 117.44 3hbg s LYS 113 Ca -0.22 -0.91 -0.11 0.00 0.02 0.00 0.00 55.97 54.75 3hbg s LYS 113 Cb 0.04 -1.70 0.04 0.00 -0.52 0.00 0.00 37.83 35.70 3hbg s LYS 113 CO 0.73 -1.01 1.08 -1.25 -0.92 0.00 0.00 175.35 173.98 3hbg s PRO 114 N 1.74 2.42 -0.22 -1.68 0.04 -1.26 -5.11 135.00 130.94 3hbg s PRO 114 Ca 0.10 0.84 -0.27 0.00 0.04 0.00 0.00 61.00 61.71 3hbg s PRO 114 Cb -0.17 -1.94 -0.00 0.00 0.04 0.00 0.00 34.50 32.43 3hbg s PRO 114 CO -0.28 -1.43 0.92 0.12 0.04 0.00 0.00 177.00 176.37 3hbg s PHE 115 N -3.07 3.35 -0.10 0.56 5.36 -1.07 -4.58 117.98 118.42 3hbg s PHE 115 Ca 0.60 1.31 -0.03 0.00 -0.96 0.00 0.00 56.93 57.84 3hbg s PHE 115 Cb -0.15 -3.14 0.04 0.00 -0.34 0.00 0.00 43.02 39.44 3hbg s PHE 115 CO 0.55 -0.40 0.09 -0.80 -1.46 0.00 0.00 175.22 173.19 3hbg s ASN 116 N 1.25 1.52 0.06 6.13 0.01 0.06 -1.94 114.94 122.03 3hbg s ASN 116 Ca 0.40 -0.14 -0.16 0.00 -0.71 0.00 0.00 52.86 52.24 3hbg s ASN 116 Cb -0.15 -0.11 0.03 0.00 0.41 0.00 0.00 41.25 41.43 3hbg s ASN 116 CO 0.08 -0.29 0.37 0.00 -1.51 0.00 0.00 177.10 175.76 3hbg s ALA 117 N 2.18 -0.88 0.10 0.60 0.00 -0.46 -0.27 121.76 123.04 3hbg s ALA 117 Ca 0.04 0.12 0.05 0.00 0.00 0.00 0.00 51.96 52.18 3hbg s ALA 117 Cb -0.14 0.41 -0.03 0.00 0.00 0.00 0.00 23.12 23.36 3hbg s ALA 117 CO -0.06 -0.48 -0.14 -1.83 0.00 0.00 0.00 175.76 173.25 3hbg s GLU 118 N -2.81 0.94 0.65 0.00 -1.05 -0.28 -0.75 118.70 115.39 3hbg s GLU 118 Ca -0.03 -1.14 -0.17 0.00 -0.15 0.00 0.00 54.97 53.48 3hbg s GLU 118 Cb -0.00 -0.84 -0.01 0.00 -0.44 0.00 0.00 34.13 32.84 3hbg s GLU 118 CO -0.05 0.17 1.17 -1.25 0.95 0.00 0.00 175.26 176.25 3hbg s PRO 119 N -2.39 2.72 0.50 -4.83 0.04 -1.24 -0.25 135.00 129.55 3hbg s PRO 119 Ca 0.05 1.66 -0.22 0.00 0.04 0.00 0.00 61.00 62.53 3hbg s PRO 119 Cb -0.06 -1.92 -0.06 0.00 0.04 0.00 0.00 34.50 32.50 3hbg s PRO 119 CO 0.02 -1.36 1.27 -1.25 0.04 0.00 0.00 177.00 175.72 3hbg s PRO 120 N -3.71 3.44 0.48 0.56 0.04 -1.26 -4.72 135.00 129.83 3hbg s PRO 120 Ca 0.73 2.02 0.14 0.00 0.04 0.00 0.00 61.00 63.93 3hbg s PRO 120 Cb -0.27 -2.34 1.13 0.00 0.04 0.00 0.00 34.50 33.07 3hbg s PRO 120 CO 0.38 -0.88 2.08 0.00 0.04 0.00 0.00 177.00 178.62 3hbg h ALA 121 N 1.75 1.98 0.00 8.56 0.00 -1.93 -1.94 119.26 127.69 3hbg h ALA 121 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3hbg h ALA 121 Cb 1.27 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3hbg h ALA 121 CO 0.59 -0.03 0.00 1.05 0.00 0.00 0.00 179.25 180.86 3hbg h GLU 122 N 0.23 0.00 0.00 0.00 9.09 -1.91 -2.75 114.58 119.24 3hbg h GLU 122 Ca 0.12 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.53 3hbg h GLU 122 Cb 0.20 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.30 3hbg h GLU 122 CO -0.02 0.00 -1.43 1.28 0.05 0.00 0.00 179.01 178.89 3hbg n LEU 123 N -2.69 0.17 -0.17 3.06 4.77 -0.75 -4.73 117.00 116.65 3hbg n LEU 123 Ca -0.00 -0.12 -0.03 0.00 -0.03 0.00 0.00 56.01 55.83 3hbg n LEU 123 Cb 0.19 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.35 3hbg n LEU 123 CO 0.20 0.04 1.00 0.25 -1.33 0.00 0.00 177.39 177.56 3hbg h LEU 124 N 0.00 0.29 -3.32 2.23 5.85 -1.21 -2.57 115.31 116.57 3hbg h LEU 124 Ca 0.00 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3hbg h LEU 124 Cb 0.59 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.63 3hbg h LEU 124 CO 0.00 0.19 0.00 0.00 -0.34 0.00 0.00 178.44 178.29 3hbg n ALA 125 N -2.39 3.40 0.14 1.25 0.00 -1.26 -4.40 120.51 117.24 3hbg n ALA 125 Ca 0.06 -1.78 0.04 0.00 0.00 0.00 0.00 53.44 51.76 3hbg n ALA 125 Cb 0.19 -1.03 0.03 0.00 0.00 0.00 0.00 19.45 18.64 3hbg n ALA 125 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3hbg h GLU 126 N 3.88 0.00 -4.37 0.00 4.39 -1.74 -3.45 114.58 113.28 3hbg h GLU 126 Ca 0.00 0.00 -0.34 0.00 0.34 0.00 0.00 59.36 59.36 3hbg h GLU 126 Cb 1.66 0.00 -0.29 0.00 -0.10 0.00 0.00 28.75 30.03 3hbg h GLU 126 CO 0.34 0.35 -0.76 1.03 -1.16 0.00 0.00 179.01 178.81 3hbg s ARG 127 N -3.02 0.49 0.20 2.33 0.52 -1.26 -5.05 118.95 113.15 3hbg s ARG 127 Ca 0.03 -0.21 -0.12 0.00 -0.52 0.00 0.00 55.73 54.92 3hbg s ARG 127 Cb 0.07 -0.47 0.12 0.00 0.52 0.00 0.00 34.95 35.19 3hbg s ARG 127 CO 0.74 0.12 1.86 0.35 0.02 0.00 0.00 175.30 178.40 3hbg h PHE 128 N 6.04 0.84 -3.69 -0.53 3.57 -1.91 -3.37 116.94 117.88 3hbg h PHE 128 Ca -0.29 0.02 -0.62 0.00 3.53 0.00 0.00 57.97 60.61 3hbg h PHE 128 Cb 1.19 -0.29 -0.15 0.00 2.79 0.00 0.00 35.95 39.50 3hbg h PHE 128 CO 0.41 0.54 -0.34 -0.51 -2.23 0.00 0.00 178.31 176.17 3hbg s LEU 129 N -10.13 4.07 -0.01 0.59 1.43 -1.26 -4.69 118.68 108.67 3hbg s LEU 129 Ca -0.13 0.23 -0.30 0.00 -1.03 0.00 0.00 54.13 52.90 3hbg s LEU 129 Cb 0.14 -2.32 -0.05 0.00 0.03 0.00 0.00 46.19 43.99 3hbg s LEU 129 CO 0.77 -0.09 1.30 -0.89 0.23 0.00 0.00 176.35 177.66 3hbg s THR 130 N 1.68 3.94 0.44 5.49 2.01 0.74 -4.98 115.64 124.96 3hbg s THR 130 Ca 0.13 1.32 -0.25 0.00 0.31 0.00 0.00 61.69 63.20 3hbg s THR 130 Cb -0.15 -3.85 -0.09 0.00 0.01 0.00 0.00 72.50 68.42 3hbg s THR 130 CO 0.09 0.02 1.20 -2.65 -0.69 0.00 0.00 174.62 172.59 3hbg n PRO 131 N 5.04 1.73 -0.30 4.92 -0.02 -1.26 -4.69 135.00 140.42 3hbg n PRO 131 Ca 0.12 0.62 0.14 0.00 -2.02 0.00 0.00 63.50 62.35 3hbg n PRO 131 Cb 0.45 -2.31 0.39 0.00 -0.02 0.00 0.00 33.50 32.01 3hbg n PRO 131 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 3hbg h ASN 132 N 1.83 0.65 0.98 2.55 4.21 -1.93 0.89 115.58 124.75 3hbg h ASN 132 Ca -0.47 0.06 -0.01 0.00 1.21 0.00 0.00 56.30 57.08 3hbg h ASN 132 Cb 1.31 -0.06 -0.00 0.00 -1.12 0.00 0.00 38.32 38.44 3hbg h ASN 132 CO 0.59 0.28 -0.06 1.05 -1.29 0.00 0.00 177.43 178.00 3hbg h GLU 133 N 0.66 0.00 0.00 0.81 9.09 -2.02 -3.13 114.58 119.99 3hbg h GLU 133 Ca 0.50 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.91 3hbg h GLU 133 Cb 0.89 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.99 3hbg h GLU 133 CO -0.26 0.06 -1.59 1.28 0.05 0.00 0.00 179.01 178.55 3hbg n LEU 134 N -3.18 0.33 -4.65 3.06 4.77 0.18 -4.53 117.00 112.99 3hbg n LEU 134 Ca 0.00 -0.17 -0.48 0.00 -0.03 0.00 0.00 56.01 55.33 3hbg n LEU 134 Cb 0.33 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.37 3hbg n LEU 134 CO 0.29 0.08 1.12 0.33 -1.33 0.00 0.00 177.39 177.88 3hbg n PHE 135 N -1.96 2.08 -1.72 -1.77 -0.00 -0.48 -3.66 117.46 109.95 3hbg n PHE 135 Ca -0.01 0.36 -0.39 0.00 -0.00 0.00 0.00 57.45 57.41 3hbg n PHE 135 Cb 0.46 -2.49 0.04 0.00 -0.00 0.00 0.00 39.48 37.49 3hbg n PHE 135 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 176.76 178.73 3hbg n PHE 136 N 3.23 2.10 -4.88 -5.13 -1.74 -1.26 -4.86 117.46 104.92 3hbg n PHE 136 Ca 0.17 0.44 -0.30 0.00 -0.56 0.00 0.00 57.45 57.20 3hbg n PHE 136 Cb 0.26 -2.34 -0.17 0.00 1.52 0.00 0.00 39.48 38.76 3hbg n PHE 136 CO 0.00 0.00 0.00 0.99 -0.56 0.00 0.00 176.76 177.19 3hbg s THR 137 N -1.30 1.78 -0.26 1.97 2.01 0.07 -5.00 115.64 114.91 3hbg s THR 137 Ca 0.71 -0.84 -0.00 0.00 0.31 0.00 0.00 61.69 61.87 3hbg s THR 137 Cb -0.43 -1.57 0.08 0.00 0.01 0.00 0.00 72.50 70.59 3hbg s THR 137 CO 0.50 0.50 0.02 -0.60 -0.69 0.00 0.00 174.62 174.34 3hbg s ARG 138 N 0.58 1.15 -0.12 4.92 3.00 -1.26 -1.35 118.95 125.88 3hbg s ARG 138 Ca -0.14 -1.01 0.01 0.00 -1.00 0.00 0.00 55.73 53.58 3hbg s ARG 138 Cb -0.17 -2.40 -0.02 0.00 0.00 0.00 0.00 34.95 32.37 3hbg s ARG 138 CO 0.05 -0.76 -0.13 -0.80 0.00 0.00 0.00 175.30 173.65 3hbg s ASN 139 N 1.49 4.01 0.19 -2.12 0.01 -0.82 -5.01 114.94 112.70 3hbg s ASN 139 Ca 0.02 -0.31 0.14 0.00 -0.71 0.00 0.00 52.86 52.00 3hbg s ASN 139 Cb -0.18 -1.48 -0.03 0.00 0.41 0.00 0.00 41.25 39.97 3hbg s ASN 139 CO -0.12 0.20 1.24 0.45 -1.51 0.00 0.00 177.10 177.35 3hbg h HIS 140 N 6.46 0.00 -4.62 2.20 3.86 -1.95 -3.39 115.15 117.72 3hbg h HIS 140 Ca -0.29 0.00 -0.36 0.00 -1.16 0.00 0.00 60.37 58.56 3hbg h HIS 140 Cb 1.20 0.00 -0.12 0.00 1.06 0.00 0.00 27.41 29.55 3hbg h HIS 140 CO 0.50 0.60 -0.44 -0.51 0.86 0.00 0.00 177.93 178.94 3hbg s LEU 141 N -6.30 1.40 0.59 2.43 1.43 -1.26 -4.74 118.68 112.22 3hbg s LEU 141 Ca 0.02 -1.58 -0.20 0.00 -1.03 0.00 0.00 54.13 51.34 3hbg s LEU 141 Cb 0.08 0.75 -0.04 0.00 0.03 0.00 0.00 46.19 47.01 3hbg s LEU 141 CO 0.77 -1.06 1.22 -2.65 0.23 0.00 0.00 176.35 174.86 3hbg n PRO 142 N -0.52 1.29 -2.42 1.29 -0.02 -1.26 -4.69 135.00 128.68 3hbg n PRO 142 Ca 0.04 0.49 -0.43 0.00 -2.02 0.00 0.00 63.50 61.59 3hbg n PRO 142 Cb 0.63 -2.43 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 3hbg n PRO 142 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3hbg s VAL 143 N -1.37 4.25 0.40 -1.45 1.01 -1.26 -4.86 120.40 117.12 3hbg s VAL 143 Ca 0.76 1.53 -0.27 0.00 0.00 0.00 0.00 61.98 64.00 3hbg s VAL 143 Cb -0.41 -3.99 -0.10 0.00 0.00 0.00 0.00 36.38 31.87 3hbg s VAL 143 CO 0.46 -0.09 1.38 -2.65 0.00 0.00 0.00 175.10 174.20 3hbg n PRO 144 N 6.11 2.27 -3.50 2.72 -0.02 -1.26 -4.73 135.00 136.58 3hbg n PRO 144 Ca 0.13 0.80 -0.41 0.00 -2.02 0.00 0.00 63.50 62.00 3hbg n PRO 144 Cb 0.45 -2.51 -0.10 0.00 -0.02 0.00 0.00 33.50 31.32 3hbg n PRO 144 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hbg s ALA 145 N -1.15 3.50 -0.19 3.55 0.00 -1.26 -5.01 121.76 121.20 3hbg s ALA 145 Ca 0.58 -1.41 0.00 0.00 0.00 0.00 0.00 51.96 51.12 3hbg s ALA 145 Cb -0.50 -2.73 0.01 0.00 0.00 0.00 0.00 23.12 19.91 3hbg s ALA 145 CO 0.61 -1.07 -0.17 0.08 0.00 0.00 0.00 175.76 175.21 3hbg s VAL 146 N 1.76 2.32 -0.24 0.00 1.01 -1.26 -5.08 120.40 118.92 3hbg s VAL 146 Ca 0.07 -0.85 -0.29 0.00 0.00 0.00 0.00 61.98 60.91 3hbg s VAL 146 Cb -0.18 -1.99 0.00 0.00 0.00 0.00 0.00 36.38 34.21 3hbg s VAL 146 CO 0.11 0.52 1.14 -0.70 0.00 0.00 0.00 175.10 176.17 3hbg s GLU 147 N 1.31 4.17 0.31 2.72 -6.30 -1.26 -4.95 118.70 114.70 3hbg s GLU 147 Ca 0.05 1.38 0.05 0.00 -2.50 0.00 0.00 54.97 53.94 3hbg s GLU 147 Cb -0.13 -3.72 0.51 0.00 0.00 0.00 0.00 34.13 30.79 3hbg s GLU 147 CO -0.11 -0.77 1.78 -1.00 0.02 0.00 0.00 175.26 175.18 3hbg h PRO 148 N 8.02 0.41 -0.03 4.30 0.13 -1.98 -2.80 132.00 140.06 3hbg h PRO 148 Ca -0.22 -0.14 -0.14 0.00 -0.87 0.00 0.00 66.00 64.63 3hbg h PRO 148 Cb 1.08 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 3hbg h PRO 148 CO 0.99 0.61 -0.62 0.66 -0.23 0.00 0.00 178.00 179.41 3hbg h SER 149 N 0.37 0.13 0.35 1.44 4.64 -2.05 -3.17 113.55 115.26 3hbg h SER 149 Ca 0.06 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3hbg h SER 149 Cb 0.58 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 3hbg h SER 149 CO 0.04 0.71 -0.68 -1.54 -0.87 0.00 0.00 176.83 174.49 3hbg n SER 150 N -3.83 0.66 -4.70 4.97 3.41 -1.20 -4.92 113.62 108.00 3hbg n SER 150 Ca -0.02 -0.48 -0.43 0.00 -0.26 0.00 0.00 58.87 57.68 3hbg n SER 150 Cb 0.62 0.51 -0.02 0.00 -0.26 0.00 0.00 64.21 65.06 3hbg n SER 150 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hbg n TYR 151 N -1.53 2.49 -4.23 7.33 4.19 -1.06 -5.01 117.16 119.34 3hbg n TYR 151 Ca 0.05 0.32 -0.19 0.00 3.31 0.00 0.00 57.90 61.39 3hbg n TYR 151 Cb 0.34 -2.54 -0.16 0.00 0.49 0.00 0.00 39.34 37.48 3hbg n TYR 151 CO 0.00 0.00 0.00 1.03 0.91 0.00 0.00 176.86 178.80 3hbg s ARG 152 N -0.23 0.75 -0.28 2.98 1.81 -1.26 -4.17 118.95 118.56 3hbg s ARG 152 Ca 0.68 -0.18 -0.16 0.00 -1.72 0.00 0.00 55.73 54.35 3hbg s ARG 152 Cb -0.58 -0.74 -0.03 0.00 -0.45 0.00 0.00 34.95 33.15 3hbg s ARG 152 CO 0.47 0.02 0.43 -1.17 -0.68 0.00 0.00 175.30 174.37 3hbg s LEU 153 N 0.44 4.11 -0.08 2.53 2.96 0.66 -4.85 118.68 124.44 3hbg s LEU 153 Ca -0.06 0.27 -0.23 0.00 -0.22 0.00 0.00 54.13 53.89 3hbg s LEU 153 Cb -0.10 -2.50 -0.04 0.00 0.50 0.00 0.00 46.19 44.06 3hbg s LEU 153 CO 0.00 -0.26 0.68 -0.60 -1.32 0.00 0.00 176.35 174.86 3hbg s ARG 154 N 2.17 4.41 -0.16 1.98 3.52 -0.54 -0.87 118.95 129.45 3hbg s ARG 154 Ca 0.17 0.83 0.01 0.00 -0.13 0.00 0.00 55.73 56.61 3hbg s ARG 154 Cb -0.16 -3.46 0.02 0.00 -1.56 0.00 0.00 34.95 29.79 3hbg s ARG 154 CO 0.10 0.04 -0.16 0.08 -0.81 0.00 0.00 175.30 174.55 3hbg s VAL 155 N 0.92 1.75 0.26 7.11 1.01 -0.50 -0.18 120.40 130.77 3hbg s VAL 155 Ca 0.36 -0.75 -0.03 0.00 0.00 0.00 0.00 61.98 61.56 3hbg s VAL 155 Cb -0.17 -1.62 -0.02 0.00 0.00 0.00 0.00 36.38 34.57 3hbg s VAL 155 CO 0.17 0.48 0.30 1.51 0.00 0.00 0.00 175.10 177.56 3hbg s ASP 156 N 1.42 0.49 0.00 3.32 1.47 -0.40 -0.69 116.67 122.27 3hbg s ASP 156 Ca 0.05 -1.36 0.00 0.00 1.18 0.00 0.00 52.55 52.42 3hbg s ASP 156 Cb -0.13 0.51 0.00 0.00 -0.34 0.00 0.00 42.92 42.96 3hbg s ASP 156 CO -0.11 -1.04 0.00 0.61 0.68 0.00 0.00 175.17 175.31 3hbg n GLY 157 N -0.41 3.39 0.33 2.12 0.00 -1.26 -1.89 105.19 107.46 3hbg n GLY 157 Ca 0.02 -0.86 0.02 0.00 0.00 0.00 0.00 46.02 45.21 3hbg n GLY 157 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hbg h PRO 158 N 0.00 -0.01 -0.84 1.61 0.11 -2.01 -1.57 132.00 129.29 3hbg h PRO 158 Ca 0.00 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.52 3hbg h PRO 158 Cb 0.00 0.00 -0.38 0.00 0.11 0.00 0.00 31.00 30.74 3hbg h PRO 158 CO 0.00 -0.01 -0.20 0.41 -0.21 0.00 0.00 178.00 177.99 3hbg n GLY 159 N -1.54 6.20 0.56 -0.55 0.00 -1.26 -4.80 105.19 103.81 3hbg n GLY 159 Ca 0.12 -2.52 0.00 0.00 0.00 0.00 0.00 46.02 43.61 3hbg n GLY 159 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hbg n GLY 160 N -0.79 -0.09 0.00 -0.02 0.00 -0.59 -4.39 105.19 99.30 3hbg n GLY 160 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.53 3hbg n GLY 160 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hbg n GLY 161 N 2.85 2.27 3.70 -0.02 0.00 -1.25 -4.49 105.19 108.23 3hbg n GLY 161 Ca 0.00 -1.36 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 3hbg n GLY 161 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hbg s THR 162 N 0.00 3.88 0.01 2.61 2.01 -1.26 -4.72 115.64 118.17 3hbg s THR 162 Ca 0.00 1.28 0.00 0.00 0.31 0.00 0.00 61.69 63.29 3hbg s THR 162 Cb 0.00 -3.82 -0.04 0.00 0.01 0.00 0.00 72.50 68.65 3hbg s THR 162 CO 0.00 0.03 0.08 -0.76 -0.69 0.00 0.00 174.62 173.27 3hbg s LEU 163 N 1.95 3.86 -0.35 4.42 1.43 0.14 -4.97 118.68 125.15 3hbg s LEU 163 Ca 0.61 0.11 0.01 0.00 -1.03 0.00 0.00 54.13 53.84 3hbg s LEU 163 Cb -0.30 -2.29 0.11 0.00 0.03 0.00 0.00 46.19 43.74 3hbg s LEU 163 CO 0.26 0.26 0.11 -0.55 0.23 0.00 0.00 176.35 176.66 3hbg s SER 164 N -1.82 4.23 -0.25 2.29 0.15 -1.26 -1.41 113.70 115.63 3hbg s SER 164 Ca 0.24 -2.04 -0.10 0.00 0.70 0.00 0.00 55.95 54.74 3hbg s SER 164 Cb -0.12 -1.18 -0.05 0.00 -1.71 0.00 0.00 66.02 62.96 3hbg s SER 164 CO 0.15 -0.37 0.16 -0.76 1.20 0.00 0.00 173.24 173.62 3hbg s LEU 165 N 1.07 4.06 0.79 3.45 1.43 -0.05 -4.84 118.68 124.59 3hbg s LEU 165 Ca 0.12 0.06 -0.11 0.00 -1.03 0.00 0.00 54.13 53.17 3hbg s LEU 165 Cb -0.19 -2.10 0.07 0.00 0.03 0.00 0.00 46.19 43.99 3hbg s LEU 165 CO -0.14 0.03 1.10 -0.94 0.23 0.00 0.00 176.35 176.63 3hbg s SER 166 N 1.27 4.58 0.20 2.29 1.04 -1.26 -0.25 113.70 121.56 3hbg s SER 166 Ca 0.07 1.27 -0.10 0.00 0.48 0.00 0.00 55.95 57.68 3hbg s SER 166 Cb -0.14 -2.01 0.13 0.00 0.10 0.00 0.00 66.02 64.11 3hbg s SER 166 CO 0.06 -1.91 1.79 0.25 0.98 0.00 0.00 173.24 174.41 3hbg h LEU 167 N -1.05 0.95 -0.79 2.42 5.85 -1.82 -0.65 115.31 120.22 3hbg h LEU 167 Ca -0.47 -0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.16 3hbg h LEU 167 Cb 1.27 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 42.01 3hbg h LEU 167 CO 0.60 0.81 0.50 0.00 -0.34 0.00 0.00 178.44 180.01 3hbg h ALA 168 N 1.18 1.05 -0.34 1.25 0.00 -1.93 -1.45 119.26 119.02 3hbg h ALA 168 Ca 0.25 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.99 3hbg h ALA 168 Cb 0.11 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3hbg h ALA 168 CO -0.03 0.30 -0.39 1.49 0.00 0.00 0.00 179.25 180.61 3hbg h GLU 169 N 0.96 0.82 -0.81 0.00 4.81 -1.83 -1.64 114.58 116.89 3hbg h GLU 169 Ca 0.32 -0.43 -0.01 0.00 -0.13 0.00 0.00 59.36 59.11 3hbg h GLU 169 Cb 0.05 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.40 3hbg h GLU 169 CO -0.13 1.06 0.45 -0.07 -0.73 0.00 0.00 179.01 179.60 3hbg h LEU 170 N 0.67 1.00 -0.38 1.64 3.38 -0.75 -0.33 115.31 120.54 3hbg h LEU 170 Ca 0.06 -0.08 -0.18 0.00 0.09 0.00 0.00 57.88 57.76 3hbg h LEU 170 Cb 0.96 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 3hbg h LEU 170 CO 0.09 0.80 -0.81 0.03 0.09 0.00 0.00 178.44 178.64 3hbg h ARG 171 N 1.13 0.15 0.00 1.13 3.08 -1.06 -3.37 114.38 115.45 3hbg h ARG 171 Ca 0.29 -0.15 -0.22 0.00 0.07 0.00 0.00 59.98 59.96 3hbg h ARG 171 Cb 0.02 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.06 3hbg h ARG 171 CO -0.05 0.88 -2.04 -1.13 -1.07 0.00 0.00 179.97 176.56 3hbg n SER 172 N -3.68 0.97 0.01 7.04 3.41 -0.64 -4.59 113.62 116.14 3hbg n SER 172 Ca -0.03 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.70 3hbg n SER 172 Cb 0.76 1.14 0.12 0.00 -0.26 0.00 0.00 64.21 65.97 3hbg n SER 172 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3hbg n ARG 173 N -2.48 0.07 -4.68 4.33 1.74 -0.15 -4.86 116.66 110.63 3hbg n ARG 173 Ca -0.21 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.64 3hbg n ARG 173 Cb 0.88 -1.53 -0.16 0.00 -1.02 0.00 0.00 32.46 30.64 3hbg n ARG 173 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3hbg s PHE 174 N -3.05 1.44 0.27 -1.55 0.08 -1.26 -5.09 117.98 108.83 3hbg s PHE 174 Ca 0.09 -0.39 -0.31 0.00 0.12 0.00 0.00 56.93 56.44 3hbg s PHE 174 Cb 0.16 -0.98 -0.12 0.00 -0.57 0.00 0.00 43.02 41.51 3hbg s PHE 174 CO 0.76 -0.13 1.53 -2.30 -0.10 0.00 0.00 175.22 174.97 3hbg n PRO 175 N 3.16 2.44 -2.56 0.24 -0.02 -1.26 -4.84 135.00 132.17 3hbg n PRO 175 Ca -0.18 0.87 -0.42 0.00 -2.02 0.00 0.00 63.50 61.75 3hbg n PRO 175 Cb 0.53 -2.60 -0.04 0.00 -0.02 0.00 0.00 33.50 31.37 3hbg n PRO 175 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3hbg s LYS 176 N -0.37 4.55 0.13 -0.52 2.20 -1.26 -4.39 119.74 120.08 3hbg s LYS 176 Ca 0.66 1.63 0.10 0.00 -0.36 0.00 0.00 55.97 58.01 3hbg s LYS 176 Cb -0.56 -3.35 -0.04 0.00 -1.51 0.00 0.00 37.83 32.37 3hbg s LYS 176 CO 0.48 -0.04 -0.24 -1.01 -0.36 0.00 0.00 175.35 174.18 3hbg s HIS 177 N 0.48 2.37 -0.13 4.03 3.76 0.40 -4.94 115.29 121.25 3hbg s HIS 177 Ca 0.53 -0.35 0.01 0.00 -0.15 0.00 0.00 55.06 55.10 3hbg s HIS 177 Cb -0.27 -1.27 -0.01 0.00 1.11 0.00 0.00 32.58 32.15 3hbg s HIS 177 CO 0.31 0.37 -0.16 -1.21 -0.85 0.00 0.00 174.74 173.20 3hbg s GLU 178 N -2.14 3.27 -0.08 1.40 0.41 -1.26 -1.58 118.70 118.72 3hbg s GLU 178 Ca 0.16 -0.74 -0.00 0.00 -0.41 0.00 0.00 54.97 53.97 3hbg s GLU 178 Cb -0.10 -2.57 0.02 0.00 -1.78 0.00 0.00 34.13 29.71 3hbg s GLU 178 CO 0.07 0.14 -0.05 0.08 -0.49 0.00 0.00 175.26 175.02 3hbg s VAL 179 N 0.50 0.73 -0.33 2.63 1.01 0.18 -4.95 120.40 120.16 3hbg s VAL 179 Ca -0.11 -0.14 -0.21 0.00 0.00 0.00 0.00 61.98 61.52 3hbg s VAL 179 Cb -0.16 -0.78 -0.00 0.00 0.00 0.00 0.00 36.38 35.44 3hbg s VAL 179 CO 0.05 0.30 0.68 -0.89 0.00 0.00 0.00 175.10 175.24 3hbg s THR 180 N 1.52 4.86 -0.01 3.92 2.01 -1.26 -0.18 115.64 126.50 3hbg s THR 180 Ca -0.00 0.82 -0.01 0.00 0.31 0.00 0.00 61.69 62.80 3hbg s THR 180 Cb -0.13 -4.09 0.01 0.00 0.01 0.00 0.00 72.50 68.30 3hbg s THR 180 CO -0.04 -0.27 0.03 0.00 -0.69 0.00 0.00 174.62 173.65 3hbg s ALA 181 N 2.79 -0.07 -0.11 7.40 0.00 -0.60 -3.85 121.76 127.32 3hbg s ALA 181 Ca 0.27 0.11 -0.19 0.00 0.00 0.00 0.00 51.96 52.15 3hbg s ALA 181 Cb -0.14 -0.07 -0.04 0.00 0.00 0.00 0.00 23.12 22.87 3hbg s ALA 181 CO 0.14 -0.02 0.50 0.99 0.00 0.00 0.00 175.76 177.37 3hbg s THR 182 N 0.10 5.17 -0.17 0.00 2.01 -0.63 -2.59 115.64 119.54 3hbg s THR 182 Ca -0.01 1.01 -0.08 0.00 0.31 0.00 0.00 61.69 62.93 3hbg s THR 182 Cb -0.01 -3.84 -0.04 0.00 0.01 0.00 0.00 72.50 68.61 3hbg s THR 182 CO -0.00 0.32 0.09 -0.76 -0.69 0.00 0.00 174.62 173.58 3hbg s LEU 183 N 0.64 4.01 -0.06 4.42 1.43 -0.22 -4.66 118.68 124.23 3hbg s LEU 183 Ca 0.27 0.20 0.02 0.00 -1.03 0.00 0.00 54.13 53.59 3hbg s LEU 183 Cb -0.15 -2.00 0.02 0.00 0.03 0.00 0.00 46.19 44.08 3hbg s LEU 183 CO 0.11 0.24 -0.10 -1.58 0.23 0.00 0.00 176.35 175.25 3hbg s GLN 184 N -0.01 1.46 0.40 1.70 0.74 -1.26 -1.93 119.66 120.77 3hbg s GLN 184 Ca 0.07 -0.33 -0.26 0.00 0.05 0.00 0.00 55.36 54.89 3hbg s GLN 184 Cb -0.12 -1.25 -0.09 0.00 1.10 0.00 0.00 33.01 32.66 3hbg s GLN 184 CO 0.00 -0.00 1.32 0.45 -0.55 0.00 0.00 175.29 176.51 3hbg s SER 185 N 0.72 6.30 0.54 6.67 0.15 -0.67 -1.13 113.70 126.28 3hbg s SER 185 Ca -0.14 2.69 0.27 0.00 0.70 0.00 0.00 55.95 59.47 3hbg s SER 185 Cb -0.15 -2.64 1.44 0.00 -1.71 0.00 0.00 66.02 62.95 3hbg s SER 185 CO 0.03 -0.86 1.98 0.00 1.20 0.00 0.00 173.24 175.58 3hbg h ALA 186 N 2.69 2.44 -0.65 5.45 0.00 -1.95 -1.91 119.26 125.33 3hbg h ALA 186 Ca -0.50 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3hbg h ALA 186 Cb 1.25 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3hbg h ALA 186 CO 0.63 -0.69 0.00 0.41 0.00 0.00 0.00 179.25 179.60 3hbg n GLY 187 N -1.61 2.25 3.60 0.00 0.00 -1.26 -1.62 105.19 106.54 3hbg n GLY 187 Ca 0.10 -0.74 -0.49 0.00 0.00 0.00 0.00 46.02 44.89 3hbg n GLY 187 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3hbg n ASN 188 N 1.34 1.74 -1.33 1.61 5.15 -0.72 -0.99 115.26 122.05 3hbg n ASN 188 Ca 0.23 1.13 -0.15 0.00 -0.60 0.00 0.00 54.58 55.19 3hbg n ASN 188 Cb 0.65 -1.25 -0.04 0.00 -0.53 0.00 0.00 39.78 38.60 3hbg n ASN 188 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3hbg n ARG 189 N 2.10 -1.08 -0.20 1.20 1.74 -0.05 -4.16 116.66 116.21 3hbg n ARG 189 Ca 0.15 0.90 0.04 0.00 -0.77 0.00 0.00 57.85 58.18 3hbg n ARG 189 Cb 0.24 -5.10 0.31 0.00 -1.02 0.00 0.00 32.46 26.89 3hbg n ARG 189 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 3hbg h ARG 190 N 0.00 0.83 -0.98 5.56 2.43 -0.82 -2.73 114.38 118.67 3hbg h ARG 190 Ca -0.32 -0.05 0.23 0.00 -0.81 0.00 0.00 59.98 59.03 3hbg h ARG 190 Cb 1.07 -0.19 -0.12 0.00 -0.42 0.00 0.00 29.97 30.31 3hbg h ARG 190 CO 0.43 0.55 0.56 0.77 -1.51 0.00 0.00 179.97 180.77 3hbg h SER 191 N 0.86 0.63 0.06 -3.80 0.02 -1.32 0.90 113.55 110.89 3hbg h SER 191 Ca 0.31 0.13 -0.10 0.00 -0.84 0.00 0.00 61.79 61.29 3hbg h SER 191 Cb 0.14 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 3hbg h SER 191 CO -0.10 0.12 -0.31 -0.33 -1.14 0.00 0.00 176.83 175.07 3hbg h GLU 192 N 0.58 0.38 -0.15 3.45 5.08 -1.74 -2.00 114.58 120.18 3hbg h GLU 192 Ca 0.61 -0.15 -0.20 0.00 -1.00 0.00 0.00 59.36 58.62 3hbg h GLU 192 Cb 1.12 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.36 3hbg h GLU 192 CO -0.47 0.65 -0.73 1.98 -1.00 0.00 0.00 179.01 179.45 3hbg h MET 193 N 0.33 0.67 -0.47 2.33 4.05 -0.98 -3.15 114.93 117.71 3hbg h MET 193 Ca 0.04 -0.53 0.07 0.00 -0.28 0.00 0.00 59.70 59.01 3hbg h MET 193 Cb 0.71 0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 31.59 3hbg h MET 193 CO 0.05 1.14 0.32 0.77 0.23 0.00 0.00 176.91 179.43 3hbg h SER 194 N 0.47 0.29 0.16 1.39 0.02 -0.74 -1.96 113.55 113.17 3hbg h SER 194 Ca -0.04 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.82 3hbg h SER 194 Cb 1.33 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.80 3hbg h SER 194 CO 0.14 0.18 -0.34 -0.09 -1.14 0.00 0.00 176.83 175.59 3hbg h ARG 195 N 0.33 0.26 0.02 3.45 9.65 -1.33 -3.11 114.38 123.65 3hbg h ARG 195 Ca 0.21 -0.11 -0.00 0.00 -1.10 0.00 0.00 59.98 58.98 3hbg h ARG 195 Cb 0.41 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.98 3hbg h ARG 195 CO -0.05 0.58 -0.01 0.28 2.80 0.00 0.00 179.97 183.56 3hbg h VAL 196 N 0.23 1.42 -2.18 0.20 2.07 -1.41 -3.47 116.25 113.11 3hbg h VAL 196 Ca 0.03 -1.51 -0.05 0.00 0.82 0.00 0.00 66.70 65.99 3hbg h VAL 196 Cb 0.71 2.42 -0.22 0.00 -1.52 0.00 0.00 31.29 32.68 3hbg h VAL 196 CO 0.05 0.38 0.02 -0.60 0.02 0.00 0.00 177.57 177.44 3hbg s ARG 197 N -3.49 0.73 0.29 1.57 3.52 -1.00 -5.15 118.95 115.42 3hbg s ARG 197 Ca -0.16 0.94 -0.29 0.00 -0.13 0.00 0.00 55.73 56.08 3hbg s ARG 197 Cb 0.00 0.31 -0.13 0.00 -1.56 0.00 0.00 34.95 33.57 3hbg s ARG 197 CO 0.64 -0.10 1.26 -2.30 -0.81 0.00 0.00 175.30 173.99 3hbg n PRO 198 N 3.05 1.88 -4.55 5.12 -0.02 -1.23 -4.03 135.00 135.22 3hbg n PRO 198 Ca -0.15 0.66 -0.25 0.00 -2.02 0.00 0.00 63.50 61.74 3hbg n PRO 198 Cb 0.56 -2.22 -0.10 0.00 -0.02 0.00 0.00 33.50 31.72 3hbg n PRO 198 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3hbg s VAL 199 N -0.72 1.49 -0.17 -1.45 -7.23 -1.26 -4.95 120.40 106.11 3hbg s VAL 199 Ca 0.61 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 58.68 3hbg s VAL 199 Cb -0.64 -2.81 -0.05 0.00 0.56 0.00 0.00 36.38 33.45 3hbg s VAL 199 CO 0.57 0.00 0.16 -0.54 -0.31 0.00 0.00 175.10 174.99 3hbg s LYS 200 N -3.80 4.03 0.00 4.82 1.02 -0.34 -5.02 119.74 120.44 3hbg s LYS 200 Ca 0.33 -0.14 0.00 0.00 0.02 0.00 0.00 55.97 56.18 3hbg s LYS 200 Cb 0.08 -3.36 0.00 0.00 -0.52 0.00 0.00 37.83 34.03 3hbg s LYS 200 CO 0.16 0.41 0.00 0.41 -0.92 0.00 0.00 175.35 175.40 3hbg n GLY 201 N 3.12 3.48 3.71 -3.33 0.00 -1.26 -4.40 105.19 106.51 3hbg n GLY 201 Ca -0.16 -1.84 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 3hbg n GLY 201 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hbg s LEU 202 N 0.00 4.38 -1.43 0.99 1.43 -1.26 -4.88 118.68 117.90 3hbg s LEU 202 Ca 0.00 2.78 -0.14 0.00 -1.03 0.00 0.00 54.13 55.74 3hbg s LEU 202 Cb 0.00 -3.59 -0.00 0.00 0.03 0.00 0.00 46.19 42.63 3hbg s LEU 202 CO 0.00 -0.95 2.36 -0.81 0.23 0.00 0.00 176.35 177.18 3hbg n PRO 203 N 4.39 2.92 -1.67 1.29 -0.04 -1.26 -4.83 135.00 135.80 3hbg n PRO 203 Ca 0.16 -2.44 -0.41 0.00 -0.04 0.00 0.00 63.50 60.77 3hbg n PRO 203 Cb 0.37 -3.14 0.01 0.00 -0.04 0.00 0.00 33.50 30.69 3hbg n PRO 203 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 3hbg n TRP 204 N 5.63 1.80 -0.04 0.54 7.02 -1.26 -4.43 117.44 126.69 3hbg n TRP 204 Ca 0.57 0.53 0.00 0.00 -1.02 0.00 0.00 57.50 57.59 3hbg n TRP 204 Cb 0.35 -2.33 0.00 0.00 -2.42 0.00 0.00 31.31 26.92 3hbg n TRP 204 CO 0.00 0.00 0.00 -3.47 -2.02 0.00 0.00 177.69 172.20 3hbg n ASP 205 N 0.38 0.00 -0.48 -0.99 2.03 -1.26 -1.09 116.55 115.14 3hbg n ASP 205 Ca 0.08 0.00 0.10 0.00 0.52 0.00 0.00 54.79 55.49 3hbg n ASP 205 Cb 0.39 0.00 0.40 0.00 -0.72 0.00 0.00 41.12 41.19 3hbg n ASP 205 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 3hbg n ILE 206 N 0.00 0.18 -0.50 5.18 -5.35 -1.26 -0.87 119.36 116.74 3hbg n ILE 206 Ca 0.00 -0.30 0.08 0.00 -0.27 0.00 0.00 62.75 62.26 3hbg n ILE 206 Cb 0.00 0.29 0.26 0.00 -1.74 0.00 0.00 39.64 38.45 3hbg n ILE 206 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3hbg n GLY 207 N 1.09 2.95 2.26 3.28 0.00 -1.26 -4.64 105.19 108.87 3hbg n GLY 207 Ca 0.16 -0.71 -0.29 0.00 0.00 0.00 0.00 46.02 45.17 3hbg n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hbg n ALA 208 N 0.70 6.96 -3.63 4.61 0.00 -1.26 -4.27 120.51 123.62 3hbg n ALA 208 Ca 0.20 -3.04 -0.12 0.00 0.00 0.00 0.00 53.44 50.48 3hbg n ALA 208 Cb 0.69 -2.81 -0.07 0.00 0.00 0.00 0.00 19.45 17.26 3hbg n ALA 208 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 3hbg s ILE 209 N 0.76 0.00 0.08 0.00 2.07 -1.26 -1.68 121.20 121.17 3hbg s ILE 209 Ca 0.65 0.00 -0.26 0.00 -1.41 0.00 0.00 60.65 59.64 3hbg s ILE 209 Cb 0.25 -1.00 0.08 0.00 0.13 0.00 0.00 42.46 41.92 3hbg s ILE 209 CO -0.07 0.00 0.72 -0.44 -1.91 0.00 0.00 174.94 173.25 3hbg s SER 210 N 0.52 -0.49 -0.04 4.50 0.01 -0.81 -4.67 113.70 112.73 3hbg s SER 210 Ca -0.01 0.04 0.03 0.00 1.31 0.00 0.00 55.95 57.32 3hbg s SER 210 Cb -0.05 0.51 0.00 0.00 0.21 0.00 0.00 66.02 66.69 3hbg s SER 210 CO -0.04 -0.81 -0.12 -0.89 0.41 0.00 0.00 173.24 171.79 3hbg s THR 211 N -3.35 1.06 0.06 1.44 2.01 -1.26 -1.06 115.64 114.54 3hbg s THR 211 Ca 0.02 -0.51 -0.04 0.00 0.31 0.00 0.00 61.69 61.47 3hbg s THR 211 Cb -0.01 -0.93 -0.02 0.00 0.01 0.00 0.00 72.50 71.54 3hbg s THR 211 CO -0.10 0.32 0.05 0.00 -0.69 0.00 0.00 174.62 174.20 3hbg s ALA 212 N 0.17 0.21 -0.39 7.40 0.00 -1.07 -0.19 121.76 127.91 3hbg s ALA 212 Ca -0.04 -0.94 -0.20 0.00 0.00 0.00 0.00 51.96 50.78 3hbg s ALA 212 Cb -0.10 0.33 0.01 0.00 0.00 0.00 0.00 23.12 23.35 3hbg s ALA 212 CO 0.01 -0.40 0.60 0.50 0.00 0.00 0.00 175.76 176.48 3hbg s ARG 213 N -3.66 3.50 -0.09 0.00 3.52 -1.26 -1.55 118.95 119.40 3hbg s ARG 213 Ca 0.04 -0.19 -0.13 0.00 -0.13 0.00 0.00 55.73 55.32 3hbg s ARG 213 Cb 0.05 -3.87 -0.05 0.00 -1.56 0.00 0.00 34.95 29.53 3hbg s ARG 213 CO -0.09 -0.82 0.31 -1.58 -0.81 0.00 0.00 175.30 172.31 3hbg s TRP 214 N 2.65 3.58 -0.08 5.12 0.52 0.75 -0.50 118.94 130.98 3hbg s TRP 214 Ca 0.22 0.74 0.04 0.00 0.02 0.00 0.00 56.10 57.11 3hbg s TRP 214 Cb -0.15 -2.26 -0.01 0.00 -1.15 0.00 0.00 33.47 29.91 3hbg s TRP 214 CO 0.16 0.47 -0.20 0.20 0.02 0.00 0.00 176.95 177.60 3hbg s GLY 215 N -0.35 1.40 0.00 0.98 0.00 -0.14 -0.64 107.32 108.57 3hbg s GLY 215 Ca 0.19 -0.98 0.00 0.00 0.00 0.00 0.00 44.72 43.93 3hbg s GLY 215 CO 0.07 -0.48 0.00 0.61 0.00 0.00 0.00 173.10 173.30 3hbg n GLY 216 N 3.13 -1.18 3.82 0.20 0.00 -0.62 -0.92 105.19 109.63 3hbg n GLY 216 Ca -0.18 -0.81 -0.35 0.00 0.00 0.00 0.00 46.02 44.68 3hbg n GLY 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hbg s ALA 217 N -1.00 3.33 0.07 4.61 0.00 -0.79 -0.45 121.76 127.52 3hbg s ALA 217 Ca 0.00 0.19 -0.31 0.00 0.00 0.00 0.00 51.96 51.84 3hbg s ALA 217 Cb 0.00 -2.87 -0.06 0.00 0.00 0.00 0.00 23.12 20.19 3hbg s ALA 217 CO 0.00 0.29 1.24 1.03 0.00 0.00 0.00 175.76 178.32 3hbg s ARG 218 N -2.38 4.41 0.27 0.00 0.52 -1.26 -0.10 118.95 120.40 3hbg s ARG 218 Ca 0.49 1.83 -0.01 0.00 -0.52 0.00 0.00 55.73 57.52 3hbg s ARG 218 Cb -0.14 -3.34 0.53 0.00 0.52 0.00 0.00 34.95 32.52 3hbg s ARG 218 CO 0.20 -0.30 1.79 1.25 0.02 0.00 0.00 175.30 178.25 3hbg h LEU 219 N 6.86 0.65 -0.56 2.53 5.85 -1.59 -1.48 115.31 127.56 3hbg h LEU 219 Ca -0.41 0.08 0.11 0.00 0.84 0.00 0.00 57.88 58.50 3hbg h LEU 219 Cb 1.21 -0.04 -0.10 0.00 0.37 0.00 0.00 40.66 42.10 3hbg h LEU 219 CO 0.82 0.31 -0.05 -0.09 -0.34 0.00 0.00 178.44 179.09 3hbg h ARG 220 N 0.73 0.07 -0.55 1.25 2.43 -1.74 -0.40 114.38 116.18 3hbg h ARG 220 Ca 0.47 -0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.56 3hbg h ARG 220 Cb 0.59 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.10 3hbg h ARG 220 CO -0.32 0.05 0.04 -0.44 -1.51 0.00 0.00 179.97 177.78 3hbg h ASP 221 N 0.07 0.88 -0.27 -3.80 3.32 -1.63 -0.93 116.42 114.07 3hbg h ASP 221 Ca 0.28 -0.22 -0.06 0.00 0.02 0.00 0.00 57.03 57.05 3hbg h ASP 221 Cb 0.45 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 3hbg h ASP 221 CO -0.51 0.92 -0.08 0.58 -1.72 0.00 0.00 179.24 178.43 3hbg h VAL 222 N 0.86 1.29 -0.57 -1.35 2.07 -0.90 -2.11 116.25 115.52 3hbg h VAL 222 Ca 0.17 -1.12 -0.11 0.00 0.82 0.00 0.00 66.70 66.46 3hbg h VAL 222 Cb 0.46 1.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 3hbg h VAL 222 CO 0.02 0.35 -0.07 -0.07 0.02 0.00 0.00 177.57 177.83 3hbg h LEU 223 N 0.29 1.04 -0.72 2.57 3.38 -0.96 -1.59 115.31 119.33 3hbg h LEU 223 Ca 0.07 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 3hbg h LEU 223 Cb 0.57 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 3hbg h LEU 223 CO 0.03 1.13 0.36 -0.07 0.09 0.00 0.00 178.44 179.98 3hbg h LEU 224 N 0.94 0.93 -1.39 1.67 3.38 -1.20 -1.99 115.31 117.66 3hbg h LEU 224 Ca 0.15 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 3hbg h LEU 224 Cb 0.63 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 3hbg h LEU 224 CO 0.04 0.79 0.31 -0.74 0.09 0.00 0.00 178.44 178.93 3hbg h HIS 225 N 1.00 0.70 0.00 1.13 2.76 -1.08 -1.29 115.15 118.37 3hbg h HIS 225 Ca 0.25 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.42 3hbg h HIS 225 Cb 0.10 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 28.83 3hbg h HIS 225 CO 0.00 0.48 0.00 0.00 -1.30 0.00 0.00 177.93 177.11 3hbg n ALA 226 N -2.46 1.84 0.00 5.26 0.00 -0.62 -4.88 120.51 119.66 3hbg n ALA 226 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.42 3hbg n ALA 226 Cb 0.08 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.24 3hbg n ALA 226 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hbg n GLY 227 N 0.37 0.83 3.76 0.00 0.00 -0.48 -4.18 105.19 105.49 3hbg n GLY 227 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 3hbg n GLY 227 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hbg s PHE 228 N -2.00 3.57 0.62 1.61 0.08 -0.79 -4.80 117.98 116.28 3hbg s PHE 228 Ca 0.00 1.73 -0.05 0.00 0.12 0.00 0.00 56.93 58.73 3hbg s PHE 228 Cb 0.00 -3.17 0.03 0.00 -0.57 0.00 0.00 43.02 39.32 3hbg s PHE 228 CO 0.00 -0.35 0.91 -1.25 -0.10 0.00 0.00 175.22 174.43 3hbg s PRO 229 N -1.73 2.57 0.20 0.24 0.04 -1.26 -4.24 135.00 130.83 3hbg s PRO 229 Ca 0.48 -0.26 -0.11 0.00 0.04 0.00 0.00 61.00 61.15 3hbg s PRO 229 Cb -0.27 -2.28 0.26 0.00 0.04 0.00 0.00 34.50 32.25 3hbg s PRO 229 CO 0.35 -0.90 1.71 0.93 0.04 0.00 0.00 177.00 179.13 3hbg h GLU 230 N -0.28 0.27 -5.62 4.56 4.39 -1.96 -3.43 114.58 112.51 3hbg h GLU 230 Ca -0.44 -0.02 -0.53 0.00 0.34 0.00 0.00 59.36 58.70 3hbg h GLU 230 Cb 1.29 -0.06 -0.29 0.00 -0.10 0.00 0.00 28.75 29.59 3hbg h GLU 230 CO 0.59 0.18 -0.83 -1.21 -1.16 0.00 0.00 179.01 176.58 3hbg s GLU 231 N -6.12 1.36 -0.05 2.33 2.02 -1.26 -4.93 118.70 112.05 3hbg s GLU 231 Ca -0.13 -0.63 0.06 0.00 0.02 0.00 0.00 54.97 54.29 3hbg s GLU 231 Cb 0.17 -1.32 -0.02 0.00 0.10 0.00 0.00 34.13 33.06 3hbg s GLU 231 CO 0.74 0.36 -0.22 -0.51 0.02 0.00 0.00 175.26 175.64 3hbg s LEU 232 N -0.46 2.24 0.06 1.80 1.43 -1.26 -5.10 118.68 117.39 3hbg s LEU 232 Ca 0.06 -0.43 -0.31 0.00 -1.03 0.00 0.00 54.13 52.43 3hbg s LEU 232 Cb -0.07 -1.42 -0.08 0.00 0.03 0.00 0.00 46.19 44.65 3hbg s LEU 232 CO -0.00 0.27 1.64 -1.58 0.23 0.00 0.00 176.35 176.91 3hbg s GLN 233 N -0.31 4.20 0.00 1.70 0.74 -1.26 -4.75 119.66 119.98 3hbg s GLN 233 Ca 0.01 2.31 0.00 0.00 0.05 0.00 0.00 55.36 57.73 3hbg s GLN 233 Cb -0.13 -3.61 0.00 0.00 1.10 0.00 0.00 33.01 30.38 3hbg s GLN 233 CO 0.02 -0.73 0.00 0.41 -0.55 0.00 0.00 175.29 174.45 3hbg n GLY 234 N 3.98 0.32 3.68 2.59 0.00 -1.26 -4.96 105.19 109.54 3hbg n GLY 234 Ca 0.16 -1.99 -0.38 0.00 0.00 0.00 0.00 46.02 43.81 3hbg n GLY 234 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hbg s GLU 235 N -1.30 4.19 0.13 1.61 0.41 -1.26 -5.06 118.70 117.42 3hbg s GLU 235 Ca 0.00 0.20 0.04 0.00 -0.41 0.00 0.00 54.97 54.80 3hbg s GLU 235 Cb 0.00 -3.52 -0.04 0.00 -1.78 0.00 0.00 34.13 28.78 3hbg s GLU 235 CO 0.00 -0.01 -0.10 -1.58 -0.49 0.00 0.00 175.26 173.08 3hbg s TRP 236 N 1.21 1.20 0.19 1.61 0.52 -1.26 -0.77 118.94 121.63 3hbg s TRP 236 Ca 0.19 -0.75 0.01 0.00 0.02 0.00 0.00 56.10 55.58 3hbg s TRP 236 Cb -0.15 -0.62 -0.05 0.00 -1.15 0.00 0.00 33.47 31.51 3hbg s TRP 236 CO 0.08 0.05 0.03 -3.38 0.02 0.00 0.00 176.95 173.74 3hbg s HIS 237 N -3.16 1.25 -0.16 -1.98 -3.43 0.49 -1.54 115.29 106.76 3hbg s HIS 237 Ca 0.14 -1.08 0.01 0.00 -0.80 0.00 0.00 55.06 53.32 3hbg s HIS 237 Cb 0.02 -0.71 0.01 0.00 -1.43 0.00 0.00 32.58 30.46 3hbg s HIS 237 CO -0.00 -0.28 -0.17 0.08 -2.00 0.00 0.00 174.74 172.37 3hbg s VAL 238 N -3.73 2.46 -0.07 -5.38 1.01 0.12 -1.37 120.40 113.43 3hbg s VAL 238 Ca 0.27 -0.83 -0.03 0.00 0.00 0.00 0.00 61.98 61.40 3hbg s VAL 238 Cb 0.07 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 3hbg s VAL 238 CO 0.06 0.52 0.05 0.00 0.00 0.00 0.00 175.10 175.73 3hbg s PHE 240 N -0.99 2.64 -0.07 0.00 0.08 0.45 -0.80 117.98 119.29 3hbg s PHE 240 Ca 0.16 -0.84 0.02 0.00 0.12 0.00 0.00 56.93 56.39 3hbg s PHE 240 Cb -0.12 -1.74 -0.02 0.00 -0.57 0.00 0.00 43.02 40.57 3hbg s PHE 240 CO 0.05 -0.30 -0.12 -1.21 -0.10 0.00 0.00 175.22 173.54 3hbg s GLU 241 N 0.25 2.74 0.52 0.44 2.02 -0.40 -1.91 118.70 122.36 3hbg s GLU 241 Ca -0.13 -0.66 -0.00 0.00 0.02 0.00 0.00 54.97 54.19 3hbg s GLU 241 Cb -0.17 -2.48 0.02 0.00 0.10 0.00 0.00 34.13 31.60 3hbg s GLU 241 CO 0.07 0.55 0.76 0.20 0.02 0.00 0.00 175.26 176.86 3hbg s GLY 242 N -0.52 1.68 0.41 -1.39 0.00 0.74 -0.24 107.32 108.00 3hbg s GLY 242 Ca 0.07 -1.11 0.26 0.00 0.00 0.00 0.00 44.72 43.94 3hbg s GLY 242 CO 0.02 -0.87 1.73 1.41 0.00 0.00 0.00 173.10 175.39 3hbg h LEU 243 N 0.15 0.00 -9.26 0.66 3.38 -0.73 -3.41 115.31 106.09 3hbg h LEU 243 Ca -0.44 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 56.97 3hbg h LEU 243 Cb 1.27 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.99 3hbg h LEU 243 CO 0.56 0.00 0.58 1.51 0.09 0.00 0.00 178.44 181.18 3hbg s ASP 244 N -5.65 7.23 0.02 -0.43 -4.77 -1.26 -4.96 116.67 106.84 3hbg s ASP 244 Ca 0.06 1.56 0.08 0.00 -3.30 0.00 0.00 52.55 50.95 3hbg s ASP 244 Cb 0.08 -2.56 -0.02 0.00 -1.09 0.00 0.00 42.92 39.33 3hbg s ASP 244 CO 0.61 -0.46 -0.24 0.00 0.70 0.00 0.00 175.17 175.78 3hbg s ALA 245 N 2.03 2.00 0.59 2.11 0.00 -1.26 -0.99 121.76 126.25 3hbg s ALA 245 Ca 0.49 -1.11 -0.19 0.00 0.00 0.00 0.00 51.96 51.15 3hbg s ALA 245 Cb -0.19 -0.45 -0.05 0.00 0.00 0.00 0.00 23.12 22.44 3hbg s ALA 245 CO 0.18 0.48 1.07 -3.47 0.00 0.00 0.00 175.76 174.02 3hbg n ASP 246 N 2.08 1.24 0.02 0.00 -0.08 0.76 -4.88 116.55 115.69 3hbg n ASP 246 Ca -0.16 0.84 0.22 0.00 -1.51 0.00 0.00 54.79 54.18 3hbg n ASP 246 Cb 0.52 -1.44 0.73 0.00 2.34 0.00 0.00 41.12 43.28 3hbg n ASP 246 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3hbg h PRO 247 N 0.67 0.00 0.00 -0.67 0.11 -2.00 0.63 132.00 130.74 3hbg h PRO 247 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3hbg h PRO 247 Cb 1.35 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.46 3hbg h PRO 247 CO 0.52 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.72 3hbg n GLY 248 N -1.57 -1.42 0.00 -0.55 0.00 -1.26 -4.92 105.19 95.47 3hbg n GLY 248 Ca 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3hbg n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hbg n GLY 249 N 0.82 0.61 3.68 -0.02 0.00 0.21 -5.09 105.19 105.40 3hbg n GLY 249 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3hbg n GLY 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hbg s ALA 250 N -1.13 3.66 0.65 4.61 0.00 -1.26 -4.59 121.76 123.70 3hbg s ALA 250 Ca 0.00 1.13 -0.16 0.00 0.00 0.00 0.00 51.96 52.93 3hbg s ALA 250 Cb 0.00 -3.71 -0.00 0.00 0.00 0.00 0.00 23.12 19.41 3hbg s ALA 250 CO 0.00 -1.19 1.13 -2.14 0.00 0.00 0.00 175.76 173.56 3hbg s PRO 251 N 3.07 2.79 0.29 0.00 0.02 -1.26 -0.17 135.00 139.74 3hbg s PRO 251 Ca 0.74 1.49 -0.30 0.00 0.02 0.00 0.00 61.00 62.95 3hbg s PRO 251 Cb -0.38 -1.94 -0.12 0.00 0.02 0.00 0.00 34.50 32.08 3hbg s PRO 251 CO 0.32 -1.27 1.56 0.98 -0.33 0.00 0.00 177.00 178.26 3hbg n TYR 252 N -2.27 2.78 -3.81 6.54 9.36 -0.16 -4.82 117.16 124.78 3hbg n TYR 252 Ca 0.11 0.29 -0.10 0.00 3.32 0.00 0.00 57.90 61.52 3hbg n TYR 252 Cb 0.51 -2.58 -0.07 0.00 -0.63 0.00 0.00 39.34 36.58 3hbg n TYR 252 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 3hbg s GLY 253 N 0.42 -0.01 0.16 2.98 0.00 -1.26 -0.18 107.32 109.44 3hbg s GLY 253 Ca 0.64 -0.37 -0.19 0.00 0.00 0.00 0.00 44.72 44.80 3hbg s GLY 253 CO 0.50 -0.57 0.51 0.00 0.00 0.00 0.00 173.10 173.54 3hbg s ALA 254 N -3.38 -1.19 0.18 3.20 0.00 -0.80 -1.82 121.76 117.95 3hbg s ALA 254 Ca 0.01 0.09 0.04 0.00 0.00 0.00 0.00 51.96 52.11 3hbg s ALA 254 Cb 0.02 0.81 -0.05 0.00 0.00 0.00 0.00 23.12 23.91 3hbg s ALA 254 CO -0.08 -0.74 -0.07 -1.54 0.00 0.00 0.00 175.76 173.32 3hbg s SER 255 N -2.81 1.86 0.08 0.00 1.04 -1.26 -0.41 113.70 112.20 3hbg s SER 255 Ca 0.04 -1.09 0.02 0.00 0.48 0.00 0.00 55.95 55.40 3hbg s SER 255 Cb -0.00 -0.01 -0.04 0.00 0.10 0.00 0.00 66.02 66.07 3hbg s SER 255 CO -0.09 -0.39 -0.07 0.27 0.98 0.00 0.00 173.24 173.94 3hbg s ILE 256 N -3.34 0.62 0.58 -1.02 -4.36 -0.47 -4.98 121.20 108.23 3hbg s ILE 256 Ca 0.21 -1.64 -0.20 0.00 -0.26 0.00 0.00 60.65 58.76 3hbg s ILE 256 Cb 0.04 -1.31 -0.04 0.00 1.25 0.00 0.00 42.46 42.40 3hbg s ILE 256 CO 0.04 -0.72 1.33 -2.65 0.24 0.00 0.00 174.94 173.19 3hbg n PRO 257 N 0.47 1.49 -0.26 0.37 -0.02 -1.26 -0.71 135.00 135.08 3hbg n PRO 257 Ca -0.16 0.56 0.02 0.00 -2.02 0.00 0.00 63.50 61.90 3hbg n PRO 257 Cb 0.59 -2.56 0.24 0.00 -0.02 0.00 0.00 33.50 31.75 3hbg n PRO 257 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 3hbg h TYR 258 N 1.11 1.00 -0.86 6.00 3.20 -1.57 -2.20 116.97 123.66 3hbg h TYR 258 Ca -0.51 0.02 0.07 0.00 3.14 0.00 0.00 58.73 61.46 3hbg h TYR 258 Cb 1.32 -0.33 -0.07 0.00 1.54 0.00 0.00 36.73 39.19 3hbg h TYR 258 CO 0.44 0.59 0.53 0.78 -1.64 0.00 0.00 178.16 178.85 3hbg h GLY 259 N 1.04 1.31 1.05 1.82 0.00 -1.91 -1.70 103.07 104.69 3hbg h GLY 259 Ca 0.32 -0.37 -0.12 0.00 0.00 0.00 0.00 47.33 47.16 3hbg h GLY 259 CO -0.09 0.23 -0.23 -0.09 0.00 0.00 0.00 176.54 176.36 3hbg h ARG 260 N 0.94 0.87 -0.37 4.80 2.43 -1.77 -1.30 114.38 119.98 3hbg h ARG 260 Ca 0.39 -0.40 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 3hbg h ARG 260 Cb 0.23 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 3hbg h ARG 260 CO -0.19 1.04 0.16 0.00 -1.51 0.00 0.00 179.97 179.47 3hbg h ALA 261 N 0.81 1.59 0.00 2.80 0.00 -1.13 -3.06 119.26 120.28 3hbg h ALA 261 Ca 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3hbg h ALA 261 Cb 0.80 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3hbg h ALA 261 CO 0.07 0.33 -1.28 1.28 0.00 0.00 0.00 179.25 179.64 3hbg n LEU 262 N -4.40 0.54 -4.70 0.00 7.99 -0.68 -2.84 117.00 112.91 3hbg n LEU 262 Ca 0.02 -0.09 -0.42 0.00 -0.01 0.00 0.00 56.01 55.51 3hbg n LEU 262 Cb 0.13 -0.05 -0.03 0.00 -0.11 0.00 0.00 43.42 43.36 3hbg n LEU 262 CO 0.36 0.06 1.27 -0.55 -1.51 0.00 0.00 177.39 177.02 3hbg s SER 263 N -3.98 6.65 0.29 -1.43 0.15 -0.50 -4.86 113.70 110.03 3hbg s SER 263 Ca 0.01 2.45 -0.02 0.00 0.70 0.00 0.00 55.95 59.09 3hbg s SER 263 Cb 0.14 -2.57 0.44 0.00 -1.71 0.00 0.00 66.02 62.32 3hbg s SER 263 CO 0.84 -0.84 1.92 -0.65 1.20 0.00 0.00 173.24 175.71 3hbg h PRO 264 N 7.92 0.97 0.00 5.44 0.11 -1.91 -2.88 132.00 141.65 3hbg h PRO 264 Ca -0.42 -0.11 -0.02 0.00 0.11 0.00 0.00 66.00 65.56 3hbg h PRO 264 Cb 1.20 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 3hbg h PRO 264 CO 0.92 0.72 -0.11 0.00 -0.21 0.00 0.00 178.00 179.32 3hbg h ALA 265 N 1.44 0.98 0.00 -0.75 0.00 -1.96 -3.24 119.26 115.73 3hbg h ALA 265 Ca 0.25 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3hbg h ALA 265 Cb 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3hbg h ALA 265 CO -0.04 0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.34 3hbg h ALA 266 N 1.89 1.00 -3.76 0.00 0.00 -1.79 -3.47 119.26 113.13 3hbg h ALA 266 Ca -0.00 0.00 -0.38 0.00 0.00 0.00 0.00 54.91 54.53 3hbg h ALA 266 Cb 0.79 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 3hbg h ALA 266 CO 0.01 0.00 -0.51 -0.25 0.00 0.00 0.00 179.25 178.50 3hbg n ASP 267 N -2.45 -5.38 -4.68 0.00 8.00 -1.22 -4.46 116.55 106.36 3hbg n ASP 267 Ca 0.03 -0.07 -0.42 0.00 0.71 0.00 0.00 54.79 55.04 3hbg n ASP 267 Cb 0.33 -4.45 -0.03 0.00 -0.02 0.00 0.00 41.12 36.95 3hbg n ASP 267 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3hbg s VAL 268 N -2.98 3.79 0.04 2.53 1.01 -1.26 -4.59 120.40 118.94 3hbg s VAL 268 Ca 0.11 1.13 0.07 0.00 0.00 0.00 0.00 61.98 63.29 3hbg s VAL 268 Cb -0.05 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.57 3hbg s VAL 268 CO 0.14 -0.02 -0.16 -0.76 0.00 0.00 0.00 175.10 174.29 3hbg s LEU 269 N 2.67 2.71 -0.76 3.92 1.43 -0.74 -1.61 118.68 126.30 3hbg s LEU 269 Ca 0.63 -0.39 -0.18 0.00 -1.03 0.00 0.00 54.13 53.17 3hbg s LEU 269 Cb -0.30 -1.57 0.14 0.00 0.03 0.00 0.00 46.19 44.49 3hbg s LEU 269 CO 0.25 0.26 0.85 -0.76 0.23 0.00 0.00 176.35 177.18 3hbg s LEU 270 N -1.47 5.65 -0.07 1.79 1.43 0.86 -0.78 118.68 126.08 3hbg s LEU 270 Ca 0.15 -1.95 -0.21 0.00 -1.03 0.00 0.00 54.13 51.09 3hbg s LEU 270 Cb -0.11 -2.31 -0.04 0.00 0.03 0.00 0.00 46.19 43.76 3hbg s LEU 270 CO 0.06 -0.96 0.60 0.00 0.23 0.00 0.00 176.35 176.28 3hbg s ALA 271 N 2.02 3.42 -0.17 4.21 0.00 0.92 -1.89 121.76 130.26 3hbg s ALA 271 Ca 0.20 -0.00 0.02 0.00 0.00 0.00 0.00 51.96 52.17 3hbg s ALA 271 Cb -0.14 -2.80 0.02 0.00 0.00 0.00 0.00 23.12 20.20 3hbg s ALA 271 CO -0.03 -0.00 0.74 2.48 0.00 0.00 0.00 175.76 178.95 3hbg n TYR 272 N 3.50 0.03 -4.17 0.00 0.18 -0.09 -1.70 117.16 114.91 3hbg n TYR 272 Ca -0.05 -0.20 -0.16 0.00 1.88 0.00 0.00 57.90 59.37 3hbg n TYR 272 Cb 0.51 -0.02 -0.15 0.00 -0.38 0.00 0.00 39.34 39.31 3hbg n TYR 272 CO 0.00 0.00 0.00 -2.00 -2.08 0.00 0.00 176.86 172.78 3hbg s GLU 273 N -0.48 0.46 -0.10 -3.48 2.12 -0.47 -2.63 118.70 114.13 3hbg s GLU 273 Ca 0.02 -0.18 -0.02 0.00 0.36 0.00 0.00 54.97 55.15 3hbg s GLU 273 Cb 0.01 -0.45 0.04 0.00 0.26 0.00 0.00 34.13 33.99 3hbg s GLU 273 CO 0.02 0.10 0.03 1.41 -0.54 0.00 0.00 175.26 176.28 3hbg s MET 274 N -0.03 0.44 -1.53 4.30 -2.45 0.41 -0.96 119.30 119.46 3hbg s MET 274 Ca 0.01 0.05 -0.10 0.00 -1.25 0.00 0.00 55.69 54.40 3hbg s MET 274 Cb -0.03 -1.17 0.08 0.00 1.25 0.00 0.00 34.83 34.96 3hbg s MET 274 CO -0.00 -0.40 0.74 0.09 1.05 0.00 0.00 175.02 176.49 3hbg n ASN 275 N 5.17 -2.70 0.00 1.11 3.02 0.35 -2.27 115.26 119.94 3hbg n ASN 275 Ca -0.07 -0.92 0.00 0.00 -0.03 0.00 0.00 54.58 53.56 3hbg n ASN 275 Cb 0.49 -3.31 0.00 0.00 -0.61 0.00 0.00 39.78 36.36 3hbg n ASN 275 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hbg n GLY 276 N -1.66 1.70 3.56 7.41 0.00 -1.26 -5.02 105.19 109.93 3hbg n GLY 276 Ca -0.08 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.68 3hbg n GLY 276 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hbg s THR 277 N -2.75 1.41 0.31 2.61 -4.23 -0.96 -5.11 115.64 106.93 3hbg s THR 277 Ca 0.00 -2.00 -0.28 0.00 -1.18 0.00 0.00 61.69 58.23 3hbg s THR 277 Cb 0.00 -2.73 -0.13 0.00 1.34 0.00 0.00 72.50 70.98 3hbg s THR 277 CO 0.00 0.00 1.18 1.21 -0.54 0.00 0.00 174.62 176.47 3hbg n GLU 278 N -0.90 1.78 -1.68 3.99 2.13 -1.26 -0.45 120.64 124.25 3hbg n GLU 278 Ca -0.06 0.62 -0.47 0.00 0.66 0.00 0.00 57.16 57.91 3hbg n GLU 278 Cb 0.67 -2.12 -0.04 0.00 0.27 0.00 0.00 31.44 30.21 3hbg n GLU 278 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 3hbg n LEU 279 N 1.08 3.46 -4.73 4.31 7.94 -1.08 -4.55 117.00 123.43 3hbg n LEU 279 Ca 0.07 0.99 -0.32 0.00 -1.11 0.00 0.00 56.01 55.64 3hbg n LEU 279 Cb 0.34 -1.39 0.11 0.00 0.53 0.00 0.00 43.42 43.01 3hbg n LEU 279 CO 0.61 -0.07 0.71 -2.84 -1.11 0.00 0.00 177.39 174.70 3hbg s PRO 280 N 3.58 1.83 0.17 1.96 0.02 -1.26 -4.18 135.00 137.12 3hbg s PRO 280 Ca 0.90 1.44 -0.15 0.00 0.02 0.00 0.00 61.00 63.21 3hbg s PRO 280 Cb -0.67 -1.83 0.12 0.00 0.02 0.00 0.00 34.50 32.14 3hbg s PRO 280 CO 0.49 -2.00 1.74 0.00 -0.33 0.00 0.00 177.00 176.89 3hbg h ARG 281 N -1.14 0.26 0.00 5.54 3.08 -1.92 -1.51 114.38 118.69 3hbg h ARG 281 Ca -0.44 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 59.59 3hbg h ARG 281 Cb 1.26 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 31.25 3hbg h ARG 281 CO 0.48 0.17 -0.01 -0.44 -1.07 0.00 0.00 179.97 179.10 3hbg h ASP 282 N 0.27 0.00 -0.33 7.04 3.32 -1.96 -2.55 116.42 122.21 3hbg h ASP 282 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 3hbg h ASP 282 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 3hbg h ASP 282 CO -0.23 0.01 0.00 1.41 -1.72 0.00 0.00 179.24 178.70 3hbg n HIS 283 N -3.22 0.85 0.00 4.55 8.25 -0.61 -4.84 115.22 120.19 3hbg n HIS 283 Ca -0.02 -0.72 0.00 0.00 -0.26 0.00 0.00 57.72 56.71 3hbg n HIS 283 Cb 0.12 -0.22 0.00 0.00 1.12 0.00 0.00 29.99 31.01 3hbg n HIS 283 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hbg n GLY 284 N -0.01 1.43 3.55 -1.41 0.00 -0.96 -4.79 105.19 103.01 3hbg n GLY 284 Ca 0.18 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.65 3hbg n GLY 284 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3hbg n PHE 285 N -0.73 1.15 0.75 1.61 7.35 -0.92 -1.87 117.46 124.81 3hbg n PHE 285 Ca 0.00 0.82 0.11 0.00 -0.76 0.00 0.00 57.45 57.62 3hbg n PHE 285 Cb 0.00 -2.23 0.02 0.00 0.35 0.00 0.00 39.48 37.62 3hbg n PHE 285 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 3hbg n PRO 286 N 2.11 0.16 -3.78 -7.13 -0.04 -1.26 -4.70 135.00 120.36 3hbg n PRO 286 Ca 0.19 -0.01 -0.13 0.00 -0.04 0.00 0.00 63.50 63.51 3hbg n PRO 286 Cb 0.14 -1.54 -0.14 0.00 -0.04 0.00 0.00 33.50 31.92 3hbg n PRO 286 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3hbg s VAL 287 N -3.11 -0.03 0.16 0.52 1.01 -0.78 -4.36 120.40 113.80 3hbg s VAL 287 Ca 0.06 0.11 0.06 0.00 0.00 0.00 0.00 61.98 62.21 3hbg s VAL 287 Cb 0.15 -0.22 -0.04 0.00 0.00 0.00 0.00 36.38 36.27 3hbg s VAL 287 CO 0.81 0.04 -0.12 0.00 0.00 0.00 0.00 175.10 175.83 3hbg s ARG 288 N 0.74 1.13 0.19 2.72 1.70 -0.69 -0.99 118.95 123.75 3hbg s ARG 288 Ca -0.06 -1.45 -0.26 0.00 -0.47 0.00 0.00 55.73 53.50 3hbg s ARG 288 Cb -0.07 -0.83 -0.08 0.00 -0.57 0.00 0.00 34.95 33.39 3hbg s ARG 288 CO -0.04 0.13 0.82 0.08 -1.08 0.00 0.00 175.30 175.21 3hbg s VAL 289 N -2.97 4.31 -0.17 4.99 1.01 0.09 -0.06 120.40 127.60 3hbg s VAL 289 Ca 0.17 1.77 0.01 0.00 0.00 0.00 0.00 61.98 63.93 3hbg s VAL 289 Cb -0.00 -4.16 0.01 0.00 0.00 0.00 0.00 36.38 32.23 3hbg s VAL 289 CO 0.03 0.49 -0.19 -0.69 0.00 0.00 0.00 175.10 174.74 3hbg s VAL 290 N -1.19 2.18 -0.55 2.92 1.01 0.04 -3.61 120.40 121.20 3hbg s VAL 290 Ca 0.38 -0.91 -0.04 0.00 0.00 0.00 0.00 61.98 61.41 3hbg s VAL 290 Cb -0.23 -1.91 0.14 0.00 0.00 0.00 0.00 36.38 34.38 3hbg s VAL 290 CO 0.27 0.53 0.37 -0.69 0.00 0.00 0.00 175.10 175.58 3hbg s VAL 291 N 1.14 3.69 0.49 2.92 1.01 -1.26 -1.79 120.40 126.59 3hbg s VAL 291 Ca 0.01 -2.55 -0.24 0.00 0.00 0.00 0.00 61.98 59.21 3hbg s VAL 291 Cb -0.14 -3.44 -0.07 0.00 0.00 0.00 0.00 36.38 32.73 3hbg s VAL 291 CO -0.09 -0.81 1.38 -2.84 0.00 0.00 0.00 175.10 172.74 3hbg s PRO 292 N 0.46 3.48 0.00 2.72 0.02 -1.26 -2.94 135.00 137.48 3hbg s PRO 292 Ca 0.13 2.29 0.00 0.00 0.02 0.00 0.00 61.00 63.44 3hbg s PRO 292 Cb -0.21 -2.49 0.00 0.00 0.02 0.00 0.00 34.50 31.82 3hbg s PRO 292 CO -0.04 -0.94 0.00 0.41 -0.33 0.00 0.00 177.00 176.11 3hbg n GLY 293 N 0.64 0.89 3.28 0.52 0.00 -1.26 -4.80 105.19 104.46 3hbg n GLY 293 Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 3hbg n GLY 293 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hbg s VAL 294 N -3.58 1.72 0.34 1.61 1.01 -1.15 -0.28 120.40 120.07 3hbg s VAL 294 Ca 0.00 -1.50 -0.26 0.00 0.00 0.00 0.00 61.98 60.22 3hbg s VAL 294 Cb 0.00 -1.55 -0.13 0.00 0.00 0.00 0.00 36.38 34.69 3hbg s VAL 294 CO 0.00 -0.02 0.79 0.55 0.00 0.00 0.00 175.10 176.42 3hbg n VAL 295 N 1.18 1.99 -0.21 2.92 3.14 0.57 -4.72 118.33 123.21 3hbg n VAL 295 Ca -0.19 -0.50 0.17 0.00 -2.96 0.00 0.00 64.34 60.86 3hbg n VAL 295 Cb 0.53 -0.74 0.50 0.00 -1.06 0.00 0.00 33.84 33.08 3hbg n VAL 295 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 3hbg h GLY 296 N 1.38 0.81 0.48 7.55 0.00 -1.48 -2.41 103.07 109.41 3hbg h GLY 296 Ca -0.39 -0.19 0.17 0.00 0.00 0.00 0.00 47.33 46.92 3hbg h GLY 296 CO 0.56 0.03 0.60 0.00 0.00 0.00 0.00 176.54 177.73 3hbg h ALA 297 N 1.62 2.34 0.00 3.60 0.00 -1.89 -0.80 119.26 124.14 3hbg h ALA 297 Ca 0.43 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3hbg h ALA 297 Cb 1.02 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3hbg h ALA 297 CO -0.15 -0.89 -0.53 0.00 0.00 0.00 0.00 179.25 177.67 3hbg h ARG 298 N 0.00 0.00 -5.09 0.00 2.47 -1.77 -3.41 114.38 106.58 3hbg h ARG 298 Ca 0.27 0.00 -0.71 0.00 -1.26 0.00 0.00 59.98 58.28 3hbg h ARG 298 Cb 1.47 0.00 -0.12 0.00 -1.65 0.00 0.00 29.97 29.67 3hbg h ARG 298 CO -0.00 0.00 1.98 0.43 0.56 0.00 0.00 179.97 182.94 3hbg n SER 299 N -2.20 4.95 -4.68 7.04 7.64 -0.31 -4.79 113.62 121.27 3hbg n SER 299 Ca 0.03 -2.95 -0.42 0.00 1.01 0.00 0.00 58.87 56.54 3hbg n SER 299 Cb 0.45 -1.65 -0.03 0.00 -1.01 0.00 0.00 64.21 61.96 3hbg n SER 299 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3hbg s VAL 300 N 2.85 3.27 0.46 0.44 1.01 -1.24 -4.63 120.40 122.57 3hbg s VAL 300 Ca 0.48 0.62 -0.04 0.00 0.00 0.00 0.00 61.98 63.03 3hbg s VAL 300 Cb 0.03 -3.40 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 3hbg s VAL 300 CO 0.03 -0.02 0.75 -0.54 0.00 0.00 0.00 175.10 175.33 3hbg s LYS 301 N 2.98 3.51 -1.28 2.72 1.02 -1.26 -0.73 119.74 126.70 3hbg s LYS 301 Ca 0.73 0.11 -0.06 0.00 0.02 0.00 0.00 55.97 56.77 3hbg s LYS 301 Cb -0.37 -2.42 -0.01 0.00 -0.52 0.00 0.00 37.83 34.52 3hbg s LYS 301 CO 0.31 -0.17 0.65 0.91 -0.92 0.00 0.00 175.35 176.13 3hbg n TRP 302 N -2.20 -1.85 -1.95 3.18 8.01 -0.97 -4.33 117.44 117.33 3hbg n TRP 302 Ca -0.00 0.71 -0.42 0.00 -1.31 0.00 0.00 57.50 56.48 3hbg n TRP 302 Cb 0.55 -3.94 -0.03 0.00 -2.01 0.00 0.00 31.31 25.89 3hbg n TRP 302 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.69 175.51 3hbg s LEU 303 N -6.65 4.37 -0.03 -0.99 2.96 -0.16 -0.14 118.68 118.04 3hbg s LEU 303 Ca 0.15 2.54 0.04 0.00 -0.22 0.00 0.00 54.13 56.64 3hbg s LEU 303 Cb -0.05 -3.58 -0.07 0.00 0.50 0.00 0.00 46.19 43.00 3hbg s LEU 303 CO 0.84 -0.83 0.06 -2.11 -1.32 0.00 0.00 176.35 172.99 3hbg n ARG 304 N 4.58 1.82 -3.73 1.98 1.85 0.67 -4.79 116.66 119.04 3hbg n ARG 304 Ca 0.14 -0.02 -0.12 0.00 -1.00 0.00 0.00 57.85 56.85 3hbg n ARG 304 Cb 0.40 -1.12 -0.12 0.00 -1.05 0.00 0.00 32.46 30.57 3hbg n ARG 304 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 3hbg s ARG 305 N -2.22 0.33 -0.16 2.89 3.52 -1.11 -1.47 118.95 120.74 3hbg s ARG 305 Ca -0.02 0.60 -0.02 0.00 -0.13 0.00 0.00 55.73 56.16 3hbg s ARG 305 Cb 0.02 0.01 -0.01 0.00 -1.56 0.00 0.00 34.95 33.41 3hbg s ARG 305 CO 0.20 -0.12 -0.09 0.08 -0.81 0.00 0.00 175.30 174.55 3hbg s VAL 306 N 0.97 3.25 -0.03 7.11 1.01 0.75 -1.28 120.40 132.18 3hbg s VAL 306 Ca -0.06 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.36 3hbg s VAL 306 Cb -0.07 -2.41 0.02 0.00 0.00 0.00 0.00 36.38 33.92 3hbg s VAL 306 CO -0.07 0.49 -0.04 0.00 0.00 0.00 0.00 175.10 175.48 3hbg s ALA 307 N 0.71 0.54 -0.12 5.51 0.00 0.02 -1.28 121.76 127.15 3hbg s ALA 307 Ca -0.04 -0.05 -0.13 0.00 0.00 0.00 0.00 51.96 51.74 3hbg s ALA 307 Cb -0.15 -0.32 -0.05 0.00 0.00 0.00 0.00 23.12 22.61 3hbg s ALA 307 CO 0.02 0.02 0.30 0.08 0.00 0.00 0.00 175.76 176.17 3hbg s VAL 308 N 0.65 5.28 -0.09 0.00 1.01 -0.79 0.41 120.40 126.86 3hbg s VAL 308 Ca -0.08 0.56 -0.14 0.00 0.00 0.00 0.00 61.98 62.32 3hbg s VAL 308 Cb -0.11 -3.61 0.03 0.00 0.00 0.00 0.00 36.38 32.69 3hbg s VAL 308 CO -0.00 0.47 0.36 -0.55 0.00 0.00 0.00 175.10 175.37 3hbg s SER 309 N -0.13 -0.33 0.62 3.32 0.15 -0.47 -4.02 113.70 112.84 3hbg s SER 309 Ca 0.18 0.52 -0.17 0.00 0.70 0.00 0.00 55.95 57.18 3hbg s SER 309 Cb -0.14 0.60 -0.02 0.00 -1.71 0.00 0.00 66.02 64.75 3hbg s SER 309 CO 0.06 -0.25 1.12 -2.16 1.20 0.00 0.00 173.24 173.21 3hbg s PRO 310 N -0.36 2.96 0.47 5.44 0.04 -1.26 -0.38 135.00 141.90 3hbg s PRO 310 Ca -0.05 1.49 -0.23 0.00 0.04 0.00 0.00 61.00 62.26 3hbg s PRO 310 Cb -0.03 -1.96 -0.07 0.00 0.04 0.00 0.00 34.50 32.47 3hbg s PRO 310 CO 0.02 -1.14 1.16 -0.51 0.04 0.00 0.00 177.00 176.56 3hbg s ASP 311 N -2.26 6.15 0.00 6.66 1.11 0.05 -4.74 116.67 123.63 3hbg s ASP 311 Ca 0.69 2.28 0.00 0.00 0.18 0.00 0.00 52.55 55.70 3hbg s ASP 311 Cb -0.22 -2.60 0.00 0.00 1.07 0.00 0.00 42.92 41.17 3hbg s ASP 311 CO 0.37 -0.93 0.00 -1.84 1.18 0.00 0.00 175.17 173.94 3hbg n GLU 312 N -0.56 0.00 0.00 8.23 0.28 -1.26 -4.98 120.64 122.34 3hbg n GLU 312 Ca 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.08 3hbg n GLU 312 Cb 0.48 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.35 3hbg n GLU 312 CO 0.00 0.00 0.00 -2.30 -0.16 0.00 0.00 177.13 174.67 3hbg n PRO 327 N -0.46 0.00 -4.62 3.44 -0.02 -1.26 -5.30 135.00 126.79 3hbg n PRO 327 Ca 0.00 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.15 3hbg n PRO 327 Cb 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 33.50 33.34 3hbg n PRO 327 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hbg s VAL 329 N 0.52 3.15 -0.05 0.00 -7.23 -1.26 -5.00 120.40 110.53 3hbg s VAL 329 Ca -0.08 -0.60 -0.30 0.00 -1.81 0.00 0.00 61.98 59.19 3hbg s VAL 329 Cb -0.15 -2.36 -0.04 0.00 0.56 0.00 0.00 36.38 34.38 3hbg s VAL 329 CO 0.04 0.49 1.26 -0.62 -0.31 0.00 0.00 175.10 175.96 3hbg s ASP 330 N 0.76 6.99 0.23 4.85 -1.08 -1.26 -4.06 116.67 123.10 3hbg s ASP 330 Ca -0.04 1.89 0.14 0.00 -0.52 0.00 0.00 52.55 54.02 3hbg s ASP 330 Cb -0.15 -2.56 0.78 0.00 -1.46 0.00 0.00 42.92 39.53 3hbg s ASP 330 CO 0.01 -0.63 1.41 0.79 0.52 0.00 0.00 175.17 177.28 3hbg n TRP 331 N 5.32 0.49 0.34 -5.34 7.02 -0.76 -2.15 117.44 122.36 3hbg n TRP 331 Ca 0.12 0.25 0.13 0.00 -1.02 0.00 0.00 57.50 56.98 3hbg n TRP 331 Cb 0.45 -0.87 0.57 0.00 -2.42 0.00 0.00 31.31 29.04 3hbg n TRP 331 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 3hbg h ASP 332 N 0.00 0.00 -0.92 -0.99 5.19 -1.92 -3.51 116.42 114.28 3hbg h ASP 332 Ca 0.00 0.00 -0.48 0.00 -0.62 0.00 0.00 57.03 55.93 3hbg h ASP 332 Cb 0.10 0.00 -0.08 0.00 0.18 0.00 0.00 39.33 39.53 3hbg h ASP 332 CO 0.00 0.00 1.27 -0.89 -3.12 0.00 0.00 179.24 176.50 3hbg s THR 333 N -3.44 3.75 0.00 0.35 2.01 -0.92 -5.11 115.64 112.28 3hbg s THR 333 Ca 0.02 -0.73 0.00 0.00 0.31 0.00 0.00 61.69 61.29 3hbg s THR 333 Cb 0.09 -4.68 0.00 0.00 0.01 0.00 0.00 72.50 67.92 3hbg s THR 333 CO 0.40 -1.55 0.00 -2.65 -0.69 0.00 0.00 174.62 170.13 3hbg n PRO 340 N 8.80 1.73 -2.25 4.92 -0.02 -1.26 -5.19 135.00 141.74 3hbg n PRO 340 Ca 0.38 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.44 3hbg n PRO 340 Cb 0.49 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.94 3hbg n PRO 340 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hbg s ALA 341 N -2.43 3.50 0.02 3.55 0.00 -1.26 -4.93 121.76 120.20 3hbg s ALA 341 Ca 0.00 1.08 -0.37 0.00 0.00 0.00 0.00 51.96 52.67 3hbg s ALA 341 Cb 0.00 -3.46 -0.16 0.00 0.00 0.00 0.00 23.12 19.50 3hbg s ALA 341 CO 0.00 -0.50 1.46 -0.89 0.00 0.00 0.00 175.76 175.83 3hbg n ILE 342 N 2.37 0.08 0.00 0.00 5.41 -1.26 -4.91 119.36 121.05 3hbg n ILE 342 Ca 0.05 -0.01 0.00 0.00 1.00 0.00 0.00 62.75 63.78 3hbg n ILE 342 Cb 0.43 -1.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.36 3hbg n ILE 342 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3hbg n GLN 343 N 3.30 0.00 -2.00 0.38 1.13 -1.26 -4.81 117.38 114.12 3hbg n GLN 343 Ca 0.20 0.00 -0.37 0.00 -1.94 0.00 0.00 57.00 54.89 3hbg n GLN 343 Cb 0.19 0.00 0.03 0.00 0.11 0.00 0.00 30.24 30.57 3hbg n GLN 343 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 3hbg s GLU 344 N 0.03 3.15 0.24 -1.09 2.02 -1.26 -0.31 118.70 121.47 3hbg s GLU 344 Ca 0.00 1.92 0.07 0.00 0.02 0.00 0.00 54.97 56.98 3hbg s GLU 344 Cb 0.00 -2.09 -0.04 0.00 0.10 0.00 0.00 34.13 32.10 3hbg s GLU 344 CO 0.00 -1.09 0.15 -0.51 0.02 0.00 0.00 175.26 173.83 3hbg s LEU 345 N -3.75 3.69 0.00 1.80 1.43 -1.25 -4.80 118.68 115.80 3hbg s LEU 345 Ca 0.74 -0.31 -0.01 0.00 -1.03 0.00 0.00 54.13 53.52 3hbg s LEU 345 Cb -0.33 -2.23 0.01 0.00 0.03 0.00 0.00 46.19 43.67 3hbg s LEU 345 CO 0.37 -0.02 0.07 -0.81 0.23 0.00 0.00 176.35 176.20 3hbg n PRO 346 N -1.02 0.24 -1.99 1.29 -0.04 -1.26 -1.80 135.00 130.43 3hbg n PRO 346 Ca -0.08 -0.15 -0.41 0.00 -0.04 0.00 0.00 63.50 62.82 3hbg n PRO 346 Cb 0.58 -0.07 -0.02 0.00 -0.04 0.00 0.00 33.50 33.96 3hbg n PRO 346 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3hbg s VAL 347 N -0.59 2.48 0.02 0.52 1.01 -1.26 -3.68 120.40 118.89 3hbg s VAL 347 Ca 0.05 0.46 0.02 0.00 0.00 0.00 0.00 61.98 62.50 3hbg s VAL 347 Cb -0.00 -3.29 -0.01 0.00 0.00 0.00 0.00 36.38 33.07 3hbg s VAL 347 CO 0.03 0.10 -0.05 -1.58 0.00 0.00 0.00 175.10 173.60 3hbg s GLN 348 N -1.55 0.41 0.05 2.72 2.00 0.45 -4.82 119.66 118.91 3hbg s GLN 348 Ca 0.53 -0.42 -0.23 0.00 -2.00 0.00 0.00 55.36 53.24 3hbg s GLN 348 Cb -0.42 -0.28 0.06 0.00 0.80 0.00 0.00 33.01 33.16 3hbg s GLN 348 CO 0.54 0.06 0.54 -1.54 -0.50 0.00 0.00 175.29 174.39 3hbg s SER 349 N -0.77 -0.47 -0.00 6.67 1.04 -1.26 -1.18 113.70 117.72 3hbg s SER 349 Ca -0.04 0.22 -0.19 0.00 0.48 0.00 0.00 55.95 56.41 3hbg s SER 349 Cb -0.05 0.51 0.04 0.00 0.10 0.00 0.00 66.02 66.61 3hbg s SER 349 CO -0.00 -0.73 0.42 0.00 0.98 0.00 0.00 173.24 173.91 3hbg s ALA 350 N -2.42 -1.06 -0.21 5.32 0.00 -0.86 -4.48 121.76 118.05 3hbg s ALA 350 Ca -0.05 0.53 -0.19 0.00 0.00 0.00 0.00 51.96 52.25 3hbg s ALA 350 Cb -0.01 0.14 -0.03 0.00 0.00 0.00 0.00 23.12 23.22 3hbg s ALA 350 CO -0.01 -0.34 0.55 0.08 0.00 0.00 0.00 175.76 176.03 3hbg s VAL 351 N -1.64 5.07 -0.40 0.00 1.01 -1.26 -1.94 120.40 121.24 3hbg s VAL 351 Ca -0.11 1.00 0.16 0.00 0.00 0.00 0.00 61.98 63.04 3hbg s VAL 351 Cb -0.03 -3.87 -0.21 0.00 0.00 0.00 0.00 36.38 32.28 3hbg s VAL 351 CO 0.04 0.14 0.51 0.35 0.00 0.00 0.00 175.10 176.14 3hbg n THR 352 N 4.71 0.00 -3.70 3.92 -2.24 0.32 -4.95 114.28 112.33 3hbg n THR 352 Ca -0.04 -0.24 -0.11 0.00 -2.27 0.00 0.00 64.05 61.39 3hbg n THR 352 Cb 0.50 0.60 -0.12 0.00 -2.10 0.00 0.00 70.33 69.21 3hbg n THR 352 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 3hbg s GLN 353 N -2.76 0.28 0.82 -0.78 0.74 -0.93 -4.34 119.66 112.68 3hbg s GLN 353 Ca 0.00 0.70 -0.14 0.00 0.05 0.00 0.00 55.36 55.97 3hbg s GLN 353 Cb 0.11 -0.04 0.20 0.00 1.10 0.00 0.00 33.01 34.38 3hbg s GLN 353 CO 0.65 -0.18 0.96 -0.35 -0.55 0.00 0.00 175.29 175.81 3hbg n PRO 354 N 4.45 -1.60 -4.00 1.67 -0.04 -1.26 -1.11 135.00 133.11 3hbg n PRO 354 Ca -0.21 -1.49 -0.26 0.00 -0.04 0.00 0.00 63.50 61.49 3hbg n PRO 354 Cb 0.53 -1.13 -0.04 0.00 -0.04 0.00 0.00 33.50 32.82 3hbg n PRO 354 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3hbg s ARG 355 N -5.11 3.23 0.19 0.54 1.81 -1.26 -5.01 118.95 113.33 3hbg s ARG 355 Ca 0.57 -0.69 -0.33 0.00 -1.72 0.00 0.00 55.73 53.56 3hbg s ARG 355 Cb -0.03 -2.85 -0.15 0.00 -0.45 0.00 0.00 34.95 31.48 3hbg s ARG 355 CO 0.41 0.51 1.37 -2.30 -0.68 0.00 0.00 175.30 174.61 3hbg n PRO 356 N -0.42 1.71 -0.46 3.54 -0.02 -1.26 -1.82 135.00 136.26 3hbg n PRO 356 Ca -0.07 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 3hbg n PRO 356 Cb 0.54 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 3hbg n PRO 356 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hbg n GLY 357 N 2.40 1.45 3.74 -1.23 0.00 -0.01 -5.01 105.19 106.53 3hbg n GLY 357 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 3hbg n GLY 357 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hbg s ALA 358 N -3.23 2.50 -0.31 4.61 0.00 -0.76 -4.78 121.76 119.80 3hbg s ALA 358 Ca 0.00 1.25 -0.06 0.00 0.00 0.00 0.00 51.96 53.15 3hbg s ALA 358 Cb 0.00 -3.56 0.02 0.00 0.00 0.00 0.00 23.12 19.58 3hbg s ALA 358 CO 0.00 -1.53 0.08 0.00 0.00 0.00 0.00 175.76 174.30 3hbg s ALA 359 N -1.37 3.03 -0.04 0.00 0.00 -1.26 -1.61 121.76 120.50 3hbg s ALA 359 Ca 0.80 -1.56 -0.03 0.00 0.00 0.00 0.00 51.96 51.17 3hbg s ALA 359 Cb -0.38 -2.15 -0.04 0.00 0.00 0.00 0.00 23.12 20.55 3hbg s ALA 359 CO 0.42 -1.06 0.13 0.14 0.00 0.00 0.00 175.76 175.38 3hbg s VAL 360 N 1.45 5.16 0.60 0.00 -7.23 0.33 -4.83 120.40 115.88 3hbg s VAL 360 Ca 0.01 -0.14 -0.17 0.00 -1.81 0.00 0.00 61.98 59.86 3hbg s VAL 360 Cb -0.18 -3.33 -0.03 0.00 0.56 0.00 0.00 36.38 33.40 3hbg s VAL 360 CO 0.02 0.43 1.13 -2.16 -0.31 0.00 0.00 175.10 174.22 3hbg s PRO 361 N -1.55 3.03 0.83 4.82 0.04 -1.26 -0.36 135.00 140.54 3hbg s PRO 361 Ca 0.22 1.56 -0.11 0.00 0.04 0.00 0.00 61.00 62.71 3hbg s PRO 361 Cb -0.12 -1.97 0.09 0.00 0.04 0.00 0.00 34.50 32.54 3hbg s PRO 361 CO 0.12 -1.10 1.12 -1.25 0.04 0.00 0.00 177.00 175.93 3hbg s PRO 362 N -3.64 1.74 0.00 0.56 0.04 -1.26 -4.74 135.00 127.70 3hbg s PRO 362 Ca 0.71 1.37 0.00 0.00 0.04 0.00 0.00 61.00 63.12 3hbg s PRO 362 Cb -0.24 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.48 3hbg s PRO 362 CO 0.34 -2.06 0.00 0.41 0.04 0.00 0.00 177.00 175.73 3hbg n GLY 363 N -0.51 0.15 3.88 0.56 0.00 -0.74 -4.99 105.19 103.54 3hbg n GLY 363 Ca 0.11 -1.32 -0.36 0.00 0.00 0.00 0.00 46.02 44.45 3hbg n GLY 363 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hbg s GLU 364 N 0.00 3.56 -0.09 1.61 0.41 -1.26 0.65 118.70 123.58 3hbg s GLU 364 Ca 0.00 -0.04 0.02 0.00 -0.41 0.00 0.00 54.97 54.55 3hbg s GLU 364 Cb 0.00 -3.16 0.01 0.00 -1.78 0.00 0.00 34.13 29.20 3hbg s GLU 364 CO 0.00 0.72 -0.15 -1.17 -0.49 0.00 0.00 175.26 174.17 3hbg s LEU 365 N -1.30 1.74 -0.32 1.80 2.96 0.84 -4.88 118.68 119.53 3hbg s LEU 365 Ca 0.21 -0.40 -0.18 0.00 -0.22 0.00 0.00 54.13 53.54 3hbg s LEU 365 Cb -0.13 -1.05 -0.01 0.00 0.50 0.00 0.00 46.19 45.50 3hbg s LEU 365 CO 0.10 0.04 0.51 -0.89 -1.32 0.00 0.00 176.35 174.79 3hbg s THR 366 N 0.81 5.04 -0.17 3.68 2.01 -1.26 -1.04 115.64 124.70 3hbg s THR 366 Ca -0.11 0.54 -0.08 0.00 0.31 0.00 0.00 61.69 62.35 3hbg s THR 366 Cb -0.16 -3.91 -0.04 0.00 0.01 0.00 0.00 72.50 68.40 3hbg s THR 366 CO 0.01 -0.10 0.11 -0.69 -0.69 0.00 0.00 174.62 173.27 3hbg s VAL 367 N 2.36 5.23 0.09 3.82 1.01 0.85 -4.37 120.40 129.40 3hbg s VAL 367 Ca 0.20 0.12 0.03 0.00 0.00 0.00 0.00 61.98 62.33 3hbg s VAL 367 Cb -0.15 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 3hbg s VAL 367 CO 0.12 0.49 -0.09 -0.54 0.00 0.00 0.00 175.10 175.08 3hbg s LYS 368 N -0.01 0.81 0.00 2.72 1.02 -0.27 -0.54 119.74 123.46 3hbg s LYS 368 Ca 0.09 -1.16 0.00 0.00 0.02 0.00 0.00 55.97 54.92 3hbg s LYS 368 Cb -0.12 -0.42 0.00 0.00 -0.52 0.00 0.00 37.83 36.78 3hbg s LYS 368 CO 0.00 0.05 0.00 0.41 -0.92 0.00 0.00 175.35 174.89 3hbg n GLY 369 N 0.50 1.10 3.46 -3.33 0.00 -0.72 -0.52 105.19 105.69 3hbg n GLY 369 Ca -0.16 -0.78 -0.23 0.00 0.00 0.00 0.00 46.02 44.85 3hbg n GLY 369 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hbg s TYR 370 N -3.51 2.16 0.02 1.61 -0.85 -0.82 -1.08 117.35 114.88 3hbg s TYR 370 Ca 0.00 -0.48 -0.12 0.00 -0.52 0.00 0.00 57.07 55.95 3hbg s TYR 370 Cb 0.00 -1.08 0.01 0.00 0.38 0.00 0.00 41.96 41.27 3hbg s TYR 370 CO 0.00 0.55 0.26 0.00 -1.52 0.00 0.00 175.55 174.84 3hbg s ALA 371 N -2.70 -0.60 -0.03 9.51 0.00 0.17 -2.03 121.76 126.08 3hbg s ALA 371 Ca 0.29 0.02 -0.29 0.00 0.00 0.00 0.00 51.96 51.98 3hbg s ALA 371 Cb -0.01 0.22 0.10 0.00 0.00 0.00 0.00 23.12 23.43 3hbg s ALA 371 CO 0.13 -0.33 0.83 -0.46 0.00 0.00 0.00 175.76 175.93 3hbg s TRP 372 N -2.07 -0.44 0.03 0.00 -0.00 -0.33 -0.25 118.94 115.87 3hbg s TRP 372 Ca -0.09 0.52 0.00 0.00 -0.00 0.00 0.00 56.10 56.53 3hbg s TRP 372 Cb -0.03 0.49 -0.02 0.00 -0.00 0.00 0.00 33.47 33.91 3hbg s TRP 372 CO -0.01 -0.55 -0.04 0.45 -0.00 0.00 0.00 176.95 176.81 3hbg s SER 373 N -1.91 0.36 1.05 5.86 0.15 -1.26 -0.41 113.70 117.54 3hbg s SER 373 Ca -0.01 -0.57 -0.15 0.00 0.70 0.00 0.00 55.95 55.92 3hbg s SER 373 Cb -0.01 0.10 0.22 0.00 -1.71 0.00 0.00 66.02 64.62 3hbg s SER 373 CO -0.03 -0.33 1.13 -0.83 1.20 0.00 0.00 173.24 174.38 3hbg s GLY 374 N -1.67 1.59 -1.01 9.45 0.00 -0.74 -4.25 107.32 110.68 3hbg s GLY 374 Ca -0.12 -0.67 0.00 0.00 0.00 0.00 0.00 44.72 43.92 3hbg s GLY 374 CO -0.02 0.04 0.00 0.61 0.00 0.00 0.00 173.10 173.73 3hbg n GLY 375 N -1.47 1.00 1.81 0.20 0.00 0.61 -2.05 105.19 105.30 3hbg n GLY 375 Ca 0.09 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.97 3hbg n GLY 375 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hbg n GLY 376 N -0.49 0.51 3.71 -0.02 0.00 -1.26 -4.83 105.19 102.81 3hbg n GLY 376 Ca -0.10 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.21 3hbg n GLY 376 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hbg s ARG 377 N -0.60 4.54 0.30 1.61 0.52 -0.87 -1.27 118.95 123.18 3hbg s ARG 377 Ca 0.00 1.44 -0.27 0.00 -0.52 0.00 0.00 55.73 56.39 3hbg s ARG 377 Cb 0.00 -3.46 -0.10 0.00 0.52 0.00 0.00 34.95 31.92 3hbg s ARG 377 CO 0.00 -0.08 0.94 -2.00 0.02 0.00 0.00 175.30 174.17 3hbg s GLU 378 N 1.08 4.64 -0.11 3.54 2.12 -1.26 -4.13 118.70 124.58 3hbg s GLU 378 Ca 0.52 1.35 -0.30 0.00 0.36 0.00 0.00 54.97 56.91 3hbg s GLU 378 Cb -0.21 -2.91 -0.02 0.00 0.26 0.00 0.00 34.13 31.24 3hbg s GLU 378 CO 0.27 0.34 1.25 0.08 -0.54 0.00 0.00 175.26 176.66 3hbg s VAL 379 N -1.51 4.23 -0.47 3.70 1.01 -1.26 0.06 120.40 126.16 3hbg s VAL 379 Ca 0.48 1.52 0.16 0.00 0.00 0.00 0.00 61.98 64.15 3hbg s VAL 379 Cb -0.20 -3.98 -0.21 0.00 0.00 0.00 0.00 36.38 31.98 3hbg s VAL 379 CO 0.25 -0.07 0.56 1.33 0.00 0.00 0.00 175.10 177.17 3hbg n VAL 380 N 5.03 0.00 -3.61 2.92 0.24 -0.05 -4.92 118.33 117.94 3hbg n VAL 380 Ca 0.13 -0.22 -0.14 0.00 -2.04 0.00 0.00 64.34 62.06 3hbg n VAL 380 Cb 0.45 0.64 -0.07 0.00 -1.47 0.00 0.00 33.84 33.40 3hbg n VAL 380 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3hbg s ARG 381 N -2.79 0.83 -0.11 7.34 3.52 -1.17 -5.01 118.95 121.56 3hbg s ARG 381 Ca 0.01 0.78 0.00 0.00 -0.13 0.00 0.00 55.73 56.40 3hbg s ARG 381 Cb 0.12 0.40 0.02 0.00 -1.56 0.00 0.00 34.95 33.93 3hbg s ARG 381 CO 0.68 -0.14 -0.11 0.08 -0.81 0.00 0.00 175.30 175.00 3hbg s VAL 382 N 0.02 1.21 -0.13 7.11 1.01 -1.26 -1.41 120.40 126.94 3hbg s VAL 382 Ca -0.02 -0.43 -0.07 0.00 0.00 0.00 0.00 61.98 61.46 3hbg s VAL 382 Cb -0.04 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 3hbg s VAL 382 CO 0.02 0.39 0.14 -1.81 0.00 0.00 0.00 175.10 173.84 3hbg s ASP 383 N 1.39 6.36 -0.06 3.32 1.01 0.34 -0.92 116.67 128.13 3hbg s ASP 383 Ca 0.00 0.44 0.03 0.00 0.71 0.00 0.00 52.55 53.73 3hbg s ASP 383 Cb -0.13 -2.07 0.00 0.00 1.01 0.00 0.00 42.92 41.73 3hbg s ASP 383 CO -0.06 0.37 -0.16 -0.69 0.21 0.00 0.00 175.17 174.85 3hbg s VAL 384 N -0.82 1.36 0.12 -1.27 1.01 0.60 -1.66 120.40 119.74 3hbg s VAL 384 Ca 0.14 -0.64 0.09 0.00 0.00 0.00 0.00 61.98 61.57 3hbg s VAL 384 Cb -0.12 -1.20 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 3hbg s VAL 384 CO 0.03 0.40 -0.19 -0.55 0.00 0.00 0.00 175.10 174.79 3hbg s SER 385 N 0.35 3.82 0.00 3.32 0.15 0.35 -0.36 113.70 121.34 3hbg s SER 385 Ca -0.10 -0.57 0.09 0.00 0.70 0.00 0.00 55.95 56.06 3hbg s SER 385 Cb -0.14 -0.51 0.01 0.00 -1.71 0.00 0.00 66.02 63.66 3hbg s SER 385 CO 0.04 0.18 0.62 0.18 1.20 0.00 0.00 173.24 175.45 3hbg n LEU 386 N 0.84 1.21 -2.03 3.45 4.77 -1.26 -1.14 117.00 122.83 3hbg n LEU 386 Ca -0.16 -0.79 -0.19 0.00 -0.03 0.00 0.00 56.01 54.84 3hbg n LEU 386 Cb 0.53 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.65 3hbg n LEU 386 CO 0.28 0.24 0.17 -0.90 -1.33 0.00 0.00 177.39 175.85 3hbg n ASP 387 N -0.18 4.32 -0.54 -1.43 5.68 -1.17 -1.57 116.55 121.64 3hbg n ASP 387 Ca 0.04 -3.54 -0.07 0.00 -0.50 0.00 0.00 54.79 50.72 3hbg n ASP 387 Cb 0.19 -0.37 -0.03 0.00 -1.14 0.00 0.00 41.12 39.78 3hbg n ASP 387 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3hbg n GLY 388 N -0.71 0.92 0.29 6.12 0.00 -0.28 -3.30 105.19 108.23 3hbg n GLY 388 Ca 0.38 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.79 3hbg n GLY 388 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hbg n GLY 389 N -1.95 0.92 0.13 -0.02 0.00 -1.26 -5.00 105.19 98.00 3hbg n GLY 389 Ca -0.07 -0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.70 3hbg n GLY 389 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3hbg h ARG 390 N 2.01 0.36 -5.34 1.61 3.08 -1.96 -3.47 114.38 110.67 3hbg h ARG 390 Ca 0.00 -0.46 -0.41 0.00 0.07 0.00 0.00 59.98 59.18 3hbg h ARG 390 Cb 0.00 0.15 -0.22 0.00 0.08 0.00 0.00 29.97 29.98 3hbg h ARG 390 CO 0.00 1.15 -0.78 0.95 -1.07 0.00 0.00 179.97 180.23 3hbg s THR 391 N -2.89 1.11 0.07 2.04 -4.23 -1.26 -5.12 115.64 105.36 3hbg s THR 391 Ca -0.13 -1.29 0.05 0.00 -1.18 0.00 0.00 61.69 59.14 3hbg s THR 391 Cb 0.02 -1.06 -0.03 0.00 1.34 0.00 0.00 72.50 72.77 3hbg s THR 391 CO 0.82 -0.22 -0.14 0.26 -0.54 0.00 0.00 174.62 174.80 3hbg s TRP 392 N -1.26 1.24 0.09 3.99 0.52 -1.26 -4.27 118.94 117.99 3hbg s TRP 392 Ca -0.02 -0.44 0.06 0.00 0.02 0.00 0.00 56.10 55.72 3hbg s TRP 392 Cb -0.10 -0.71 -0.03 0.00 -1.15 0.00 0.00 33.47 31.48 3hbg s TRP 392 CO 0.02 0.06 -0.16 0.15 0.02 0.00 0.00 176.95 177.04 3hbg s LYS 393 N -1.65 0.95 -0.04 4.98 1.02 0.52 -4.93 119.74 120.58 3hbg s LYS 393 Ca -0.01 -1.06 -0.26 0.00 0.02 0.00 0.00 55.97 54.66 3hbg s LYS 393 Cb -0.10 -1.03 -0.03 0.00 -0.52 0.00 0.00 37.83 36.15 3hbg s LYS 393 CO 0.02 0.23 0.81 0.08 -0.92 0.00 0.00 175.35 175.57 3hbg s VAL 394 N -1.33 4.98 0.60 3.17 1.01 -1.26 -0.29 120.40 127.28 3hbg s VAL 394 Ca 0.02 1.68 -0.10 0.00 0.00 0.00 0.00 61.98 63.58 3hbg s VAL 394 Cb -0.09 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.10 3hbg s VAL 394 CO 0.03 0.22 1.00 0.00 0.00 0.00 0.00 175.10 176.35 3hbg s ALA 395 N 0.89 3.13 0.01 5.51 0.00 -0.09 -4.94 121.76 126.27 3hbg s ALA 395 Ca 0.43 -0.13 -0.24 0.00 0.00 0.00 0.00 51.96 52.02 3hbg s ALA 395 Cb -0.19 -3.03 -0.05 0.00 0.00 0.00 0.00 23.12 19.85 3hbg s ALA 395 CO 0.22 -0.65 0.72 0.50 0.00 0.00 0.00 175.76 176.55 3hbg s ARG 396 N -5.13 4.45 -0.05 0.00 3.52 -0.36 -4.70 118.95 116.68 3hbg s ARG 396 Ca 0.54 0.96 -0.04 0.00 -0.13 0.00 0.00 55.73 57.07 3hbg s ARG 396 Cb -0.11 -3.38 -0.04 0.00 -1.56 0.00 0.00 34.95 29.86 3hbg s ARG 396 CO 0.53 0.25 0.16 -0.51 -0.81 0.00 0.00 175.30 174.92 3hbg s LEU 397 N 0.10 4.32 -0.06 -0.88 1.43 -1.26 -1.58 118.68 120.75 3hbg s LEU 397 Ca 0.37 0.37 0.02 0.00 -1.03 0.00 0.00 54.13 53.86 3hbg s LEU 397 Cb -0.19 -2.39 0.02 0.00 0.03 0.00 0.00 46.19 43.66 3hbg s LEU 397 CO 0.21 0.32 -0.11 -0.04 0.23 0.00 0.00 176.35 176.96 3hbg s MET 398 N -1.59 1.54 0.08 1.70 -1.94 0.11 -5.00 119.30 114.20 3hbg s MET 398 Ca 0.22 -0.35 -0.10 0.00 -1.71 0.00 0.00 55.69 53.75 3hbg s MET 398 Cb -0.12 -1.32 0.04 0.00 2.01 0.00 0.00 34.83 35.44 3hbg s MET 398 CO 0.13 -0.01 0.48 0.41 -0.01 0.00 0.00 175.02 176.03 3hbg n GLY 399 N 3.92 0.94 0.76 -0.03 0.00 -1.26 -0.81 105.19 108.71 3hbg n GLY 399 Ca -0.23 -1.02 0.09 0.00 0.00 0.00 0.00 46.02 44.87 3hbg n GLY 399 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hbg n ASP 400 N -0.89 2.26 -3.98 1.61 3.85 -1.26 -4.97 116.55 113.18 3hbg n ASP 400 Ca -0.01 -1.87 -0.27 0.00 -0.71 0.00 0.00 54.79 51.93 3hbg n ASP 400 Cb 0.27 -0.20 -0.02 0.00 -1.35 0.00 0.00 41.12 39.81 3hbg n ASP 400 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 3hbg n LYS 401 N 0.71 -2.78 -1.10 0.11 5.02 -1.26 -4.90 118.16 113.97 3hbg n LYS 401 Ca 0.16 0.36 -0.32 0.00 -2.02 0.00 0.00 58.31 56.49 3hbg n LYS 401 Cb 0.40 -4.33 0.12 0.00 -0.02 0.00 0.00 35.03 31.20 3hbg n LYS 401 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hbg s ALA 402 N -3.96 1.89 0.70 7.82 0.00 -1.26 -4.98 121.76 121.96 3hbg s ALA 402 Ca 0.05 0.63 -0.16 0.00 0.00 0.00 0.00 51.96 52.48 3hbg s ALA 402 Cb -0.02 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.67 3hbg s ALA 402 CO 0.90 -2.21 0.86 -2.30 0.00 0.00 0.00 175.76 173.02 3hbg n PRO 403 N -3.51 0.51 -1.58 0.00 -0.02 -1.26 -4.80 135.00 124.33 3hbg n PRO 403 Ca 0.12 0.22 -0.54 0.00 -2.02 0.00 0.00 63.50 61.28 3hbg n PRO 403 Cb 0.52 -2.12 -0.06 0.00 -0.02 0.00 0.00 33.50 31.81 3hbg n PRO 403 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3hbg n PRO 404 N -1.47 0.93 -1.06 0.52 -0.01 -1.26 -1.32 135.00 131.33 3hbg n PRO 404 Ca 0.12 0.34 -0.02 0.00 -0.01 0.00 0.00 63.50 63.93 3hbg n PRO 404 Cb 0.49 -1.96 -0.01 0.00 -0.01 0.00 0.00 33.50 32.02 3hbg n PRO 404 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 3hbg n GLY 405 N 2.47 0.38 1.03 -1.23 0.00 -1.25 -4.85 105.19 101.74 3hbg n GLY 405 Ca 0.19 -0.07 0.05 0.00 0.00 0.00 0.00 46.02 46.19 3hbg n GLY 405 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hbg n ARG 406 N -0.93 0.83 -2.63 1.61 1.74 -0.43 -4.50 116.66 112.35 3hbg n ARG 406 Ca -0.02 -2.69 -0.43 0.00 -0.77 0.00 0.00 57.85 53.94 3hbg n ARG 406 Cb 0.32 -0.85 0.00 0.00 -1.02 0.00 0.00 32.46 30.91 3hbg n ARG 406 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hbg n ALA 407 N -0.35 4.03 0.21 7.54 0.00 -0.39 -4.58 120.51 126.96 3hbg n ALA 407 Ca 0.13 -4.05 0.11 0.00 0.00 0.00 0.00 53.44 49.63 3hbg n ALA 407 Cb 0.91 -3.33 0.16 0.00 0.00 0.00 0.00 19.45 17.19 3hbg n ALA 407 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 3hbg h TRP 408 N 7.09 0.00 -2.86 0.00 -0.00 -1.83 -3.37 115.95 114.97 3hbg h TRP 408 Ca 0.40 0.00 -0.60 0.00 -0.00 0.00 0.00 58.89 58.70 3hbg h TRP 408 Cb 0.83 0.00 -0.06 0.00 -0.00 0.00 0.00 29.16 29.93 3hbg h TRP 408 CO 1.29 0.04 -0.54 0.00 -0.00 0.00 0.00 178.44 179.23 3hbg s ALA 409 N -3.19 3.76 1.01 1.49 0.00 -1.25 -1.60 121.76 121.99 3hbg s ALA 409 Ca 0.07 -1.02 -0.12 0.00 0.00 0.00 0.00 51.96 50.88 3hbg s ALA 409 Cb 0.05 -1.59 0.20 0.00 0.00 0.00 0.00 23.12 21.78 3hbg s ALA 409 CO 0.68 0.66 1.08 1.67 0.00 0.00 0.00 175.76 179.85 3hbg s TRP 410 N -1.58 1.84 -0.14 0.00 -2.14 -1.26 -4.91 118.94 110.75 3hbg s TRP 410 Ca 0.32 1.25 -0.04 0.00 2.66 0.00 0.00 56.10 60.30 3hbg s TRP 410 Cb -0.12 -3.18 -0.03 0.00 -3.10 0.00 0.00 33.47 27.04 3hbg s TRP 410 CO 0.25 -3.07 0.00 0.00 -2.66 0.00 0.00 176.95 171.47 3hbg s ALA 411 N -2.73 3.21 0.08 2.67 0.00 0.65 -4.70 121.76 120.93 3hbg s ALA 411 Ca 0.66 -0.79 -0.12 0.00 0.00 0.00 0.00 51.96 51.70 3hbg s ALA 411 Cb -0.21 -1.62 -0.06 0.00 0.00 0.00 0.00 23.12 21.23 3hbg s ALA 411 CO 0.60 0.34 0.44 -0.51 0.00 0.00 0.00 175.76 176.63 3hbg s LEU 412 N -0.08 4.38 0.11 0.00 1.43 0.01 -0.66 118.68 123.87 3hbg s LEU 412 Ca 0.04 0.91 0.04 0.00 -1.03 0.00 0.00 54.13 54.09 3hbg s LEU 412 Cb -0.13 -2.97 -0.04 0.00 0.03 0.00 0.00 46.19 43.09 3hbg s LEU 412 CO 0.02 0.19 -0.11 -1.66 0.23 0.00 0.00 176.35 175.02 3hbg s TRP 413 N -1.34 1.16 -0.01 0.29 1.48 -0.24 0.07 118.94 120.35 3hbg s TRP 413 Ca 0.32 -0.65 -0.16 0.00 -1.06 0.00 0.00 56.10 54.56 3hbg s TRP 413 Cb -0.15 -0.62 0.03 0.00 -1.16 0.00 0.00 33.47 31.57 3hbg s TRP 413 CO 0.17 0.04 0.33 -1.83 -4.06 0.00 0.00 176.95 171.60 3hbg s GLU 414 N -2.88 0.70 -0.06 3.25 -1.05 -0.61 -1.75 118.70 116.29 3hbg s GLU 414 Ca 0.08 -0.19 -0.03 0.00 -0.15 0.00 0.00 54.97 54.68 3hbg s GLU 414 Cb -0.03 0.31 0.04 0.00 -0.44 0.00 0.00 34.13 34.02 3hbg s GLU 414 CO 0.01 -0.20 0.14 -1.17 0.95 0.00 0.00 175.26 174.98 3hbg s LEU 415 N -1.38 0.69 -0.20 1.83 2.96 0.29 -1.23 118.68 121.64 3hbg s LEU 415 Ca -0.13 0.28 -0.06 0.00 -0.22 0.00 0.00 54.13 54.00 3hbg s LEU 415 Cb -0.05 0.31 -0.03 0.00 0.50 0.00 0.00 46.19 46.93 3hbg s LEU 415 CO 0.04 -0.15 0.03 -0.89 -1.32 0.00 0.00 176.35 174.05 3hbg s THR 416 N 1.26 4.20 0.01 3.68 2.01 -1.26 -0.10 115.64 125.43 3hbg s THR 416 Ca -0.08 -0.23 0.01 0.00 0.31 0.00 0.00 61.69 61.70 3hbg s THR 416 Cb -0.12 -2.91 -0.01 0.00 0.01 0.00 0.00 72.50 69.47 3hbg s THR 416 CO -0.06 0.42 -0.04 0.54 -0.69 0.00 0.00 174.62 174.79 3hbg s VAL 417 N 0.98 0.26 0.25 3.82 0.11 -0.20 -4.94 120.40 120.68 3hbg s VAL 417 Ca 0.02 -0.55 -0.30 0.00 -2.93 0.00 0.00 61.98 58.23 3hbg s VAL 417 Cb -0.14 -0.30 -0.09 0.00 -1.53 0.00 0.00 36.38 34.31 3hbg s VAL 417 CO 0.02 -0.19 1.15 -2.16 -3.33 0.00 0.00 175.10 170.59 3hbg s PRO 418 N -0.78 4.56 0.03 1.54 0.04 -1.26 -0.11 135.00 139.02 3hbg s PRO 418 Ca -0.06 1.87 0.07 0.00 0.04 0.00 0.00 61.00 62.91 3hbg s PRO 418 Cb -0.05 -3.19 -0.02 0.00 0.04 0.00 0.00 34.50 31.27 3hbg s PRO 418 CO -0.00 0.08 -0.19 0.14 0.04 0.00 0.00 177.00 177.06 3hbg s VAL 419 N -0.81 1.55 -0.09 -0.36 -7.23 0.21 -4.89 120.40 108.79 3hbg s VAL 419 Ca 0.47 -1.07 -0.12 0.00 -1.81 0.00 0.00 61.98 59.45 3hbg s VAL 419 Cb -0.33 -1.34 -0.05 0.00 0.56 0.00 0.00 36.38 35.22 3hbg s VAL 419 CO 0.41 0.24 0.29 -0.70 -0.31 0.00 0.00 175.10 175.03 3hbg s GLU 420 N -0.98 3.90 0.20 4.82 2.12 -1.26 -1.80 118.70 125.70 3hbg s GLU 420 Ca 0.07 0.15 -0.32 0.00 0.36 0.00 0.00 54.97 55.23 3hbg s GLU 420 Cb -0.08 -3.28 -0.15 0.00 0.26 0.00 0.00 34.13 30.88 3hbg s GLU 420 CO 0.01 0.56 1.29 0.00 -0.54 0.00 0.00 175.26 176.59 3hbg n ALA 421 N 2.46 0.15 -0.76 6.30 0.00 -1.26 -2.84 120.51 124.56 3hbg n ALA 421 Ca -0.15 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.73 3hbg n ALA 421 Cb 0.53 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.83 3hbg n ALA 421 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hbg n GLY 422 N 2.14 0.78 3.97 0.00 0.00 -0.98 -4.93 105.19 106.18 3hbg n GLY 422 Ca 0.14 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 3hbg n GLY 422 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hbg s THR 423 N -2.94 3.69 -0.11 2.61 -4.23 -1.13 -4.89 115.64 108.64 3hbg s THR 423 Ca 0.00 -0.73 0.01 0.00 -1.18 0.00 0.00 61.69 59.80 3hbg s THR 423 Cb 0.00 -3.33 -0.01 0.00 1.34 0.00 0.00 72.50 70.50 3hbg s THR 423 CO 0.00 -0.19 -0.15 -1.61 -0.54 0.00 0.00 174.62 172.13 3hbg s GLU 424 N -4.46 3.15 -0.01 3.99 0.41 -1.26 -0.83 118.70 119.69 3hbg s GLU 424 Ca 0.50 -0.73 0.03 0.00 -0.41 0.00 0.00 54.97 54.36 3hbg s GLU 424 Cb -0.10 -2.52 -0.03 0.00 -1.78 0.00 0.00 34.13 29.70 3hbg s GLU 424 CO 0.35 0.28 -0.08 -0.51 -0.49 0.00 0.00 175.26 174.82 3hbg s LEU 425 N 0.15 3.12 -0.33 1.80 1.43 0.05 -4.97 118.68 119.93 3hbg s LEU 425 Ca -0.08 -0.13 0.03 0.00 -1.03 0.00 0.00 54.13 52.92 3hbg s LEU 425 Cb -0.15 -1.76 0.10 0.00 0.03 0.00 0.00 46.19 44.40 3hbg s LEU 425 CO 0.05 0.30 0.05 -0.70 0.23 0.00 0.00 176.35 176.29 3hbg s GLU 426 N -1.25 1.35 -0.10 1.70 2.12 -0.61 -1.89 118.70 120.02 3hbg s GLU 426 Ca 0.16 -1.69 -0.25 0.00 0.36 0.00 0.00 54.97 53.55 3hbg s GLU 426 Cb -0.11 -2.95 -0.03 0.00 0.26 0.00 0.00 34.13 31.31 3hbg s GLU 426 CO 0.06 -0.93 0.80 0.42 -0.54 0.00 0.00 175.26 175.06 3hbg s ILE 427 N 1.06 4.95 -0.01 -3.70 1.01 0.75 -1.12 121.20 124.13 3hbg s ILE 427 Ca 0.10 1.62 0.04 0.00 0.00 0.00 0.00 60.65 62.41 3hbg s ILE 427 Cb -0.19 -4.12 -0.01 0.00 0.01 0.00 0.00 42.46 38.15 3hbg s ILE 427 CO -0.11 0.14 -0.13 -0.69 0.00 0.00 0.00 174.94 174.14 3hbg s VAL 428 N 1.41 1.06 0.10 2.92 1.01 -0.29 0.05 120.40 126.66 3hbg s VAL 428 Ca 0.40 -0.59 0.07 0.00 0.00 0.00 0.00 61.98 61.86 3hbg s VAL 428 Cb -0.18 -0.89 -0.03 0.00 0.00 0.00 0.00 36.38 35.28 3hbg s VAL 428 CO 0.17 0.29 -0.18 0.00 0.00 0.00 0.00 175.10 175.38 3hbg s LYS 430 N -2.05 0.68 0.23 0.00 -2.85 -0.66 -3.52 119.74 111.57 3hbg s LYS 430 Ca 0.05 -0.30 0.10 0.00 -1.00 0.00 0.00 55.97 54.82 3hbg s LYS 430 Cb -0.09 0.30 -0.05 0.00 -2.06 0.00 0.00 37.83 35.93 3hbg s LYS 430 CO 0.04 -0.19 -0.18 0.00 0.10 0.00 0.00 175.35 175.11 3hbg s ALA 431 N -1.67 2.34 -0.03 0.59 0.00 -1.26 -0.50 121.76 121.23 3hbg s ALA 431 Ca -0.11 -1.71 0.04 0.00 0.00 0.00 0.00 51.96 50.18 3hbg s ALA 431 Cb -0.04 -0.19 -0.00 0.00 0.00 0.00 0.00 23.12 22.88 3hbg s ALA 431 CO 0.02 0.21 -0.16 0.08 0.00 0.00 0.00 175.76 175.91 3hbg s VAL 432 N -2.52 1.32 0.60 0.00 1.01 -0.50 -3.93 120.40 116.38 3hbg s VAL 432 Ca 0.24 -0.67 0.09 0.00 0.00 0.00 0.00 61.98 61.63 3hbg s VAL 432 Cb -0.04 -1.13 0.10 0.00 0.00 0.00 0.00 36.38 35.31 3hbg s VAL 432 CO 0.10 0.38 0.83 1.51 0.00 0.00 0.00 175.10 177.93 3hbg s ASP 433 N -0.05 4.96 0.00 3.32 1.47 -0.86 -0.87 116.67 124.64 3hbg s ASP 433 Ca -0.01 -0.82 0.19 0.00 1.18 0.00 0.00 52.55 53.09 3hbg s ASP 433 Cb -0.10 0.34 0.85 0.00 -0.34 0.00 0.00 42.92 43.67 3hbg s ASP 433 CO 0.01 -1.45 1.61 -1.54 0.68 0.00 0.00 175.17 174.48 3hbg n SER 434 N -2.35 0.00 -1.26 2.11 3.41 0.11 -0.50 113.62 115.14 3hbg n SER 434 Ca 0.16 0.41 0.12 0.00 -0.26 0.00 0.00 58.87 59.30 3hbg n SER 434 Cb 0.62 -0.46 0.28 0.00 -0.26 0.00 0.00 64.21 64.38 3hbg n SER 434 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3hbg n SER 435 N -1.46 3.76 -1.26 4.04 7.64 -1.26 -4.97 113.62 120.11 3hbg n SER 435 Ca 0.05 -1.99 -0.13 0.00 1.01 0.00 0.00 58.87 57.81 3hbg n SER 435 Cb 0.21 -0.39 -0.03 0.00 -1.01 0.00 0.00 64.21 62.98 3hbg n SER 435 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 3hbg n TYR 436 N 1.57 -0.29 -2.35 1.43 4.01 0.35 -5.02 117.16 116.86 3hbg n TYR 436 Ca 0.22 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.61 3hbg n TYR 436 Cb 0.61 -2.65 -0.01 0.00 -0.31 0.00 0.00 39.34 36.98 3hbg n TYR 436 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 3hbg s ASN 437 N -2.65 6.08 0.43 7.72 0.01 -1.26 -4.82 114.94 120.44 3hbg s ASN 437 Ca 0.00 2.14 0.04 0.00 -0.71 0.00 0.00 52.86 54.33 3hbg s ASN 437 Cb 0.00 -2.58 -0.04 0.00 0.41 0.00 0.00 41.25 39.03 3hbg s ASN 437 CO 0.00 -0.97 0.04 0.68 -1.51 0.00 0.00 177.10 175.34 3hbg s VAL 438 N -1.74 1.27 0.00 1.60 -7.23 -1.26 -2.03 120.40 111.01 3hbg s VAL 438 Ca 0.68 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.81 3hbg s VAL 438 Cb -0.23 -2.54 -0.04 0.00 0.56 0.00 0.00 36.38 34.12 3hbg s VAL 438 CO 0.28 0.00 0.21 -1.10 -0.31 0.00 0.00 175.10 174.18 3hbg s GLN 439 N -3.80 3.48 0.61 4.82 -0.21 -1.25 -4.68 119.66 118.63 3hbg s GLN 439 Ca 0.23 -0.25 -0.18 0.00 0.02 0.00 0.00 55.36 55.18 3hbg s GLN 439 Cb 0.05 -3.08 -0.02 0.00 1.00 0.00 0.00 33.01 30.96 3hbg s GLN 439 CO 0.12 0.66 1.17 -1.25 -2.12 0.00 0.00 175.29 173.87 3hbg s PRO 440 N -1.92 2.92 0.35 2.91 0.04 -1.26 -4.87 135.00 133.17 3hbg s PRO 440 Ca 0.28 1.68 0.22 0.00 0.04 0.00 0.00 61.00 63.23 3hbg s PRO 440 Cb -0.13 -1.94 0.21 0.00 0.04 0.00 0.00 34.50 32.69 3hbg s PRO 440 CO 0.18 -1.21 1.41 0.38 0.04 0.00 0.00 177.00 177.80 3hbg h ASP 441 N 0.64 0.00 -4.99 6.66 3.04 -1.95 -2.31 116.42 117.52 3hbg h ASP 441 Ca -0.49 0.00 -0.14 0.00 -3.24 0.00 0.00 57.03 53.15 3hbg h ASP 441 Cb 1.28 0.00 -0.20 0.00 -1.04 0.00 0.00 39.33 39.37 3hbg h ASP 441 CO 0.55 0.03 -0.49 -0.94 -2.04 0.00 0.00 179.24 176.35 3hbg s SER 442 N -5.94 0.03 0.09 4.15 1.04 -1.26 -3.85 113.70 107.95 3hbg s SER 442 Ca 0.04 -0.22 -0.14 0.00 0.48 0.00 0.00 55.95 56.12 3hbg s SER 442 Cb 0.07 0.21 -0.14 0.00 0.10 0.00 0.00 66.02 66.26 3hbg s SER 442 CO 0.71 -0.38 1.33 0.58 0.98 0.00 0.00 173.24 176.46 3hbg h VAL 443 N 4.23 1.30 -0.61 5.02 2.07 -1.92 -3.36 116.25 122.98 3hbg h VAL 443 Ca -0.31 -1.81 0.12 0.00 0.82 0.00 0.00 66.70 65.52 3hbg h VAL 443 Cb 1.19 1.88 -0.09 0.00 -1.52 0.00 0.00 31.29 32.75 3hbg h VAL 443 CO 0.41 0.57 0.09 0.00 0.02 0.00 0.00 177.57 178.66 3hbg h ALA 444 N 0.59 0.69 0.00 1.67 0.00 -1.97 -0.26 119.26 119.98 3hbg h ALA 444 Ca -0.02 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3hbg h ALA 444 Cb 1.21 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.23 3hbg h ALA 444 CO 0.13 -0.34 0.00 -1.35 0.00 0.00 0.00 179.25 177.69 3hbg h PRO 445 N 0.21 0.00 -0.32 0.00 0.11 -2.03 -2.85 132.00 127.12 3hbg h PRO 445 Ca 0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.43 3hbg h PRO 445 Cb 0.50 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.61 3hbg h PRO 445 CO -0.45 0.00 0.00 0.44 -0.21 0.00 0.00 178.00 177.78 3hbg n ILE 446 N -3.04 0.50 -1.74 4.15 -5.35 -0.20 -5.01 119.36 108.67 3hbg n ILE 446 Ca -0.00 -0.75 -0.41 0.00 -0.27 0.00 0.00 62.75 61.31 3hbg n ILE 446 Cb 0.25 0.96 0.00 0.00 -1.74 0.00 0.00 39.64 39.11 3hbg n ILE 446 CO 0.00 0.00 0.00 1.87 -1.76 0.00 0.00 176.55 176.66 3hbg n TRP 447 N 1.22 2.65 -3.79 4.28 -0.00 -0.66 -4.97 117.44 116.16 3hbg n TRP 447 Ca 0.16 0.48 -0.12 0.00 -0.00 0.00 0.00 57.50 58.03 3hbg n TRP 447 Cb 0.53 -2.47 -0.08 0.00 -0.00 0.00 0.00 31.31 29.29 3hbg n TRP 447 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 3hbg s ASN 448 N -0.27 -0.10 0.41 5.87 2.20 -1.26 -5.06 114.94 116.73 3hbg s ASN 448 Ca 0.56 -0.11 0.11 0.00 -0.94 0.00 0.00 52.86 52.47 3hbg s ASN 448 Cb -0.50 0.30 0.93 0.00 -2.00 0.00 0.00 41.25 39.98 3hbg s ASN 448 CO 0.62 -0.49 2.00 0.25 -2.94 0.00 0.00 177.10 176.53 3hbg h LEU 449 N 3.71 0.45 -0.05 3.54 5.85 -1.95 -0.16 115.31 126.69 3hbg h LEU 449 Ca -0.31 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.42 3hbg h LEU 449 Cb 1.19 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.12 3hbg h LEU 449 CO 0.43 0.29 0.00 0.54 -0.34 0.00 0.00 178.44 179.36 3hbg n ARG 450 N -4.47 0.05 -2.81 1.25 1.74 -1.26 -1.20 116.66 109.96 3hbg n ARG 450 Ca 0.08 0.12 -0.21 0.00 -0.77 0.00 0.00 57.85 57.07 3hbg n ARG 450 Cb 0.27 -1.57 0.02 0.00 -1.02 0.00 0.00 32.46 30.16 3hbg n ARG 450 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hbg n GLY 451 N 1.01 -0.48 4.00 -0.13 0.00 -0.07 -4.68 105.19 104.85 3hbg n GLY 451 Ca 0.06 0.06 -0.18 0.00 0.00 0.00 0.00 46.02 45.96 3hbg n GLY 451 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hbg s VAL 452 N -3.12 3.26 -1.33 1.61 -7.23 -1.26 -4.42 120.40 107.91 3hbg s VAL 452 Ca 0.21 -0.98 -0.03 0.00 -1.81 0.00 0.00 61.98 59.36 3hbg s VAL 452 Cb -0.09 -3.10 0.02 0.00 0.56 0.00 0.00 36.38 33.76 3hbg s VAL 452 CO 0.26 -0.04 0.84 0.18 -0.31 0.00 0.00 175.10 176.03 3hbg n LEU 453 N -1.82 -3.21 -4.46 1.32 4.77 -0.64 -4.81 117.00 108.15 3hbg n LEU 453 Ca 0.06 -0.75 -0.43 0.00 -0.03 0.00 0.00 56.01 54.85 3hbg n LEU 453 Cb 0.59 -2.76 -0.03 0.00 -2.33 0.00 0.00 43.42 38.89 3hbg n LEU 453 CO 0.40 0.43 0.94 -0.55 -1.33 0.00 0.00 177.39 177.29 3hbg s SER 454 N -4.10 6.42 -0.04 -1.43 0.15 -1.26 -4.76 113.70 108.68 3hbg s SER 454 Ca 0.16 -1.53 0.06 0.00 0.70 0.00 0.00 55.95 55.34 3hbg s SER 454 Cb -0.08 -2.43 0.10 0.00 -1.71 0.00 0.00 66.02 61.90 3hbg s SER 454 CO 0.79 -1.28 1.00 0.35 1.20 0.00 0.00 173.24 175.31 3hbg n THR 455 N 5.83 0.69 -0.98 6.45 -2.24 -1.26 -4.72 114.28 118.05 3hbg n THR 455 Ca 0.13 -0.82 -0.31 0.00 -2.27 0.00 0.00 64.05 60.79 3hbg n THR 455 Cb 0.48 0.30 0.14 0.00 -2.10 0.00 0.00 70.33 69.14 3hbg n THR 455 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hbg s ALA 456 N -1.02 1.69 0.04 6.98 0.00 -1.26 -4.26 121.76 123.92 3hbg s ALA 456 Ca 0.11 0.35 -0.34 0.00 0.00 0.00 0.00 51.96 52.07 3hbg s ALA 456 Cb 0.09 -3.34 -0.13 0.00 0.00 0.00 0.00 23.12 19.75 3hbg s ALA 456 CO 0.01 -2.37 1.72 0.91 0.00 0.00 0.00 175.76 176.03 3hbg n TRP 457 N -3.94 2.28 -2.41 0.00 8.01 -0.87 -4.91 117.44 115.60 3hbg n TRP 457 Ca 0.10 0.15 -0.42 0.00 -1.31 0.00 0.00 57.50 56.01 3hbg n TRP 457 Cb 0.53 -2.60 -0.03 0.00 -2.01 0.00 0.00 31.31 27.20 3hbg n TRP 457 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.69 175.10 3hbg s HIS 458 N 2.41 3.43 -0.10 -5.99 2.46 -1.23 -4.90 115.29 111.36 3hbg s HIS 458 Ca 0.86 1.29 0.03 0.00 0.47 0.00 0.00 55.06 57.70 3hbg s HIS 458 Cb -0.69 -3.43 0.01 0.00 -0.13 0.00 0.00 32.58 28.33 3hbg s HIS 458 CO 0.45 -1.33 -0.18 1.03 -2.47 0.00 0.00 174.74 172.24 3hbg s ARG 459 N 1.05 2.52 -0.15 2.88 0.52 -1.26 -2.54 118.95 121.98 3hbg s ARG 459 Ca 0.59 -0.68 0.00 0.00 -0.52 0.00 0.00 55.73 55.12 3hbg s ARG 459 Cb -0.30 -2.03 0.03 0.00 0.52 0.00 0.00 34.95 33.17 3hbg s ARG 459 CO 0.29 0.03 -0.12 0.08 0.02 0.00 0.00 175.30 175.60 3hbg s VAL 460 N 0.72 1.46 -0.17 3.52 1.01 0.11 -4.95 120.40 122.09 3hbg s VAL 460 Ca -0.12 -0.60 -0.16 0.00 0.00 0.00 0.00 61.98 61.10 3hbg s VAL 460 Cb -0.16 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 3hbg s VAL 460 CO 0.02 0.41 0.40 -0.13 0.00 0.00 0.00 175.10 175.80 3hbg s ARG 461 N 1.53 4.24 0.08 2.72 0.52 -1.26 -0.18 118.95 126.59 3hbg s ARG 461 Ca 0.04 0.25 0.01 0.00 -0.52 0.00 0.00 55.73 55.52 3hbg s ARG 461 Cb -0.13 -3.48 -0.04 0.00 0.52 0.00 0.00 34.95 31.82 3hbg s ARG 461 CO -0.10 0.08 -0.06 0.14 0.02 0.00 0.00 175.30 175.38 3hbg s VAL 462 N 0.93 0.54 -0.04 3.52 -7.23 -0.79 -0.83 120.40 116.49 3hbg s VAL 462 Ca 0.21 -1.78 0.01 0.00 -1.81 0.00 0.00 61.98 58.61 3hbg s VAL 462 Cb -0.14 -1.49 -0.03 0.00 0.56 0.00 0.00 36.38 35.28 3hbg s VAL 462 CO 0.08 -0.84 -0.06 -0.44 -0.31 0.00 0.00 175.10 173.52 3hbg s SER 463 N -2.81 4.72 -0.20 4.85 0.01 -0.63 -0.77 113.70 118.86 3hbg s SER 463 Ca 0.07 -0.05 -0.16 0.00 1.31 0.00 0.00 55.95 57.13 3hbg s SER 463 Cb 0.04 -1.18 -0.04 0.00 0.21 0.00 0.00 66.02 65.05 3hbg s SER 463 CO -0.05 0.33 0.41 -0.69 0.41 0.00 0.00 173.24 173.65 3hbg s VAL 464 N -0.90 5.19 0.87 3.43 1.01 -0.01 -0.52 120.40 129.48 3hbg s VAL 464 Ca 0.14 0.73 -0.12 0.00 0.00 0.00 0.00 61.98 62.73 3hbg s VAL 464 Cb -0.11 -3.74 0.08 0.00 0.00 0.00 0.00 36.38 32.61 3hbg s VAL 464 CO 0.04 0.25 0.95 0.00 0.00 0.00 0.00 175.10 176.34 3hbg n GLN 465 N 4.47 -0.12 0.00 2.72 6.02 0.51 -2.31 117.38 128.68 3hbg n GLN 465 Ca -0.08 0.03 0.15 0.00 -0.01 0.00 0.00 57.00 57.09 3hbg n GLN 465 Cb 0.51 -2.24 0.88 0.00 1.02 0.00 0.00 30.24 30.42 3hbg n GLN 465 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80