#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hbp n ASP 95 N 0.00 3.08 0.10 1.69 -0.08 -1.26 -4.85 116.55 115.23 3hbp n ASP 95 Ca 0.00 1.11 0.12 0.00 -1.51 0.00 0.00 54.79 54.51 3hbp n ASP 95 Cb 0.00 -1.45 0.15 0.00 2.34 0.00 0.00 41.12 42.15 3hbp n ASP 95 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3hbp h PRO 96 N 5.12 0.00 -0.08 -0.67 0.11 -2.05 -3.34 132.00 131.08 3hbp h PRO 96 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3hbp h PRO 96 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3hbp h PRO 96 CO 0.83 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.81 3hbp n PHE 97 N -2.42 0.07 -0.04 0.65 3.72 -1.26 -4.58 117.46 113.60 3hbp n PHE 97 Ca 0.03 -0.04 0.20 0.00 -0.05 0.00 0.00 57.45 57.60 3hbp n PHE 97 Cb 0.48 0.00 0.67 0.00 -0.94 0.00 0.00 39.48 39.69 3hbp n PHE 97 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3hbp h ALA 98 N 4.65 2.49 -0.22 4.37 0.00 -1.96 -1.03 119.26 127.55 3hbp h ALA 98 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3hbp h ALA 98 Cb 0.96 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3hbp h ALA 98 CO 0.00 -0.65 0.00 0.41 0.00 0.00 0.00 179.25 179.01 3hbp n GLY 99 N -1.63 0.31 3.75 0.00 0.00 -1.26 -4.93 105.19 101.42 3hbp n GLY 99 Ca 0.11 -0.37 -0.37 0.00 0.00 0.00 0.00 46.02 45.38 3hbp n GLY 99 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hbp s ASP 100 N -1.33 5.45 0.76 1.61 1.11 -0.39 -4.93 116.67 118.94 3hbp s ASP 100 Ca 0.27 2.56 -0.11 0.00 0.18 0.00 0.00 52.55 55.46 3hbp s ASP 100 Cb 0.15 -2.62 0.05 0.00 1.07 0.00 0.00 42.92 41.57 3hbp s ASP 100 CO 0.21 -1.43 1.09 -2.16 1.18 0.00 0.00 175.17 174.06 3hbp s PRO 101 N -2.96 2.34 0.55 8.23 0.04 -1.26 -5.02 135.00 136.91 3hbp s PRO 101 Ca 0.71 1.19 -0.14 0.00 0.04 0.00 0.00 61.00 62.80 3hbp s PRO 101 Cb -0.35 -1.91 -0.06 0.00 0.04 0.00 0.00 34.50 32.22 3hbp s PRO 101 CO 0.41 -1.58 0.99 -2.14 0.04 0.00 0.00 177.00 174.72 3hbp s PRO 102 N -4.81 3.81 0.33 0.56 0.02 -1.26 -5.08 135.00 128.58 3hbp s PRO 102 Ca 0.62 0.86 0.09 0.00 0.02 0.00 0.00 61.00 62.59 3hbp s PRO 102 Cb -0.17 -2.13 -0.06 0.00 0.02 0.00 0.00 34.50 32.16 3hbp s PRO 102 CO 0.54 -0.37 -0.10 1.03 -0.33 0.00 0.00 177.00 177.77 3hbp s ARG 103 N -4.47 1.78 0.21 5.54 3.00 -1.26 -5.08 118.95 118.66 3hbp s ARG 103 Ca 0.57 -1.91 -0.32 0.00 0.00 0.00 0.00 55.73 54.08 3hbp s ARG 103 Cb -0.10 -1.66 -0.11 0.00 0.00 0.00 0.00 34.95 33.08 3hbp s ARG 103 CO 0.40 0.15 1.65 -1.58 0.00 0.00 0.00 175.30 175.92 3hbp s HIS 104 N -2.64 2.94 0.58 -0.53 5.65 -1.26 -4.93 115.29 115.09 3hbp s HIS 104 Ca 0.32 0.50 0.27 0.00 0.25 0.00 0.00 55.06 56.40 3hbp s HIS 104 Cb 0.02 -4.06 1.70 0.00 -1.18 0.00 0.00 32.58 29.06 3hbp s HIS 104 CO 0.16 -3.92 2.22 -1.00 -0.65 0.00 0.00 174.74 171.55 3hbp h PRO 105 N 6.52 0.00 -0.24 2.88 0.13 -1.99 -3.29 132.00 136.01 3hbp h PRO 105 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3hbp h PRO 105 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3hbp h PRO 105 CO 0.92 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 179.10 3hbp n GLY 106 N -1.37 0.23 3.82 1.56 0.00 -1.26 -4.97 105.19 103.20 3hbp n GLY 106 Ca -0.02 -0.32 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 3hbp n GLY 106 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hbp s LEU 107 N -1.14 3.47 -0.84 0.99 1.43 -1.24 -4.55 118.68 116.80 3hbp s LEU 107 Ca 0.22 1.68 -0.20 0.00 -1.03 0.00 0.00 54.13 54.79 3hbp s LEU 107 Cb 0.11 -4.52 0.10 0.00 0.03 0.00 0.00 46.19 41.92 3hbp s LEU 107 CO 0.16 -1.00 1.09 -0.13 0.23 0.00 0.00 176.35 176.70 3hbp s ARG 108 N -4.30 3.42 -0.23 1.70 1.81 0.45 -4.95 118.95 116.85 3hbp s ARG 108 Ca 0.61 -1.37 -0.22 0.00 -1.72 0.00 0.00 55.73 53.03 3hbp s ARG 108 Cb -0.13 -4.70 -0.02 0.00 -0.45 0.00 0.00 34.95 29.65 3hbp s ARG 108 CO 0.39 -1.82 0.71 0.08 -0.68 0.00 0.00 175.30 173.98 3hbp s VAL 109 N 3.37 4.94 -0.55 3.52 1.01 -1.26 -1.34 120.40 130.08 3hbp s VAL 109 Ca 0.30 1.32 0.22 0.00 0.00 0.00 0.00 61.98 63.81 3hbp s VAL 109 Cb -0.09 -4.01 -0.27 0.00 0.00 0.00 0.00 36.38 32.01 3hbp s VAL 109 CO -0.02 0.01 0.72 -0.46 0.00 0.00 0.00 175.10 175.35 3hbp n ASN 110 N 5.62 0.53 -3.66 3.32 0.23 -0.39 -4.92 115.26 115.99 3hbp n ASN 110 Ca 0.02 -0.51 -0.08 0.00 -0.53 0.00 0.00 54.58 53.48 3hbp n ASN 110 Cb 0.49 1.43 -0.09 0.00 -2.08 0.00 0.00 39.78 39.53 3hbp n ASN 110 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 3hbp s SER 111 N -3.73 -0.74 -0.06 0.53 0.15 -1.13 -4.89 113.70 103.83 3hbp s SER 111 Ca 0.01 1.23 -0.11 0.00 0.70 0.00 0.00 55.95 57.77 3hbp s SER 111 Cb 0.15 1.18 -0.30 0.00 -1.71 0.00 0.00 66.02 65.34 3hbp s SER 111 CO 0.88 -0.22 0.63 -0.61 1.20 0.00 0.00 173.24 175.13 3hbp h GLN 112 N 7.19 0.37 -3.26 5.44 5.75 -1.91 -0.60 115.11 128.09 3hbp h GLN 112 Ca -0.31 -0.63 -0.56 0.00 -0.15 0.00 0.00 58.65 57.00 3hbp h GLN 112 Cb 1.19 0.24 -0.40 0.00 1.07 0.00 0.00 27.48 29.58 3hbp h GLN 112 CO 0.21 1.30 -0.77 0.15 -2.65 0.00 0.00 178.83 177.08 3hbp s LYS 113 N -2.56 0.50 0.75 1.69 1.02 -1.26 -2.43 119.74 117.45 3hbp s LYS 113 Ca -0.17 -0.80 -0.11 0.00 0.02 0.00 0.00 55.97 54.92 3hbp s LYS 113 Cb 0.05 -1.68 0.04 0.00 -0.52 0.00 0.00 37.83 35.73 3hbp s LYS 113 CO 0.84 -0.97 1.08 -1.25 -0.92 0.00 0.00 175.35 174.13 3hbp s PRO 114 N 1.83 2.44 -0.12 -1.68 0.04 -1.26 -5.10 135.00 131.14 3hbp s PRO 114 Ca 0.08 1.06 -0.29 0.00 0.04 0.00 0.00 61.00 61.90 3hbp s PRO 114 Cb -0.17 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.44 3hbp s PRO 114 CO -0.28 -1.49 0.98 0.12 0.04 0.00 0.00 177.00 176.38 3hbp s PHE 115 N -2.96 3.49 -0.15 0.56 5.36 -1.02 -4.64 117.98 118.62 3hbp s PHE 115 Ca 0.60 1.54 -0.04 0.00 -0.96 0.00 0.00 56.93 58.07 3hbp s PHE 115 Cb -0.16 -3.17 0.07 0.00 -0.34 0.00 0.00 43.02 39.42 3hbp s PHE 115 CO 0.56 -0.24 0.19 -0.80 -1.46 0.00 0.00 175.22 173.47 3hbp s ASN 116 N 1.11 1.08 0.05 6.13 0.01 -0.23 -1.91 114.94 121.17 3hbp s ASN 116 Ca 0.47 0.07 -0.09 0.00 -0.71 0.00 0.00 52.86 52.59 3hbp s ASN 116 Cb -0.18 0.34 0.00 0.00 0.41 0.00 0.00 41.25 41.82 3hbp s ASN 116 CO 0.16 -0.29 0.19 0.00 -1.51 0.00 0.00 177.10 175.66 3hbp s ALA 117 N 2.31 -0.33 0.14 0.60 0.00 -0.47 -1.26 121.76 122.74 3hbp s ALA 117 Ca 0.04 -0.34 0.08 0.00 0.00 0.00 0.00 51.96 51.73 3hbp s ALA 117 Cb -0.14 0.31 -0.04 0.00 0.00 0.00 0.00 23.12 23.26 3hbp s ALA 117 CO -0.09 -0.39 -0.17 -1.83 0.00 0.00 0.00 175.76 173.28 3hbp s GLU 118 N -2.79 1.16 0.58 0.00 -1.05 -0.45 -0.99 118.70 115.16 3hbp s GLU 118 Ca -0.03 -1.31 -0.18 0.00 -0.15 0.00 0.00 54.97 53.30 3hbp s GLU 118 Cb -0.00 -1.20 -0.04 0.00 -0.44 0.00 0.00 34.13 32.45 3hbp s GLU 118 CO -0.05 0.25 1.12 -1.25 0.95 0.00 0.00 175.26 176.28 3hbp s PRO 119 N -2.59 3.17 0.32 -4.83 0.04 -1.25 -0.41 135.00 129.44 3hbp s PRO 119 Ca 0.12 1.53 -0.29 0.00 0.04 0.00 0.00 61.00 62.40 3hbp s PRO 119 Cb -0.06 -1.99 -0.12 0.00 0.04 0.00 0.00 34.50 32.37 3hbp s PRO 119 CO 0.05 -0.98 1.40 -2.30 0.04 0.00 0.00 177.00 175.20 3hbp n PRO 120 N -1.68 2.30 0.27 0.56 -0.02 -1.26 -4.75 135.00 130.42 3hbp n PRO 120 Ca 0.11 0.81 0.17 0.00 -2.02 0.00 0.00 63.50 62.57 3hbp n PRO 120 Cb 0.51 -2.47 0.93 0.00 -0.02 0.00 0.00 33.50 32.45 3hbp n PRO 120 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hbp h ALA 121 N 3.29 1.54 0.00 3.55 0.00 -1.93 -0.92 119.26 124.79 3hbp h ALA 121 Ca -0.47 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.40 3hbp h ALA 121 Cb 1.26 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 3hbp h ALA 121 CO 0.68 -0.13 -0.21 0.93 0.00 0.00 0.00 179.25 180.52 3hbp h GLU 122 N 0.00 0.00 0.00 0.00 3.07 -1.89 -3.12 114.58 112.64 3hbp h GLU 122 Ca 0.03 0.00 -0.26 0.00 -0.50 0.00 0.00 59.36 58.63 3hbp h GLU 122 Cb 0.22 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.08 3hbp h GLU 122 CO -0.00 0.21 -2.23 1.28 -1.40 0.00 0.00 179.01 176.86 3hbp n LEU 123 N -3.85 0.06 -0.27 1.33 4.77 -0.39 -4.58 117.00 114.07 3hbp n LEU 123 Ca -0.02 0.03 0.07 0.00 -0.03 0.00 0.00 56.01 56.06 3hbp n LEU 123 Cb 0.30 0.34 0.20 0.00 -2.33 0.00 0.00 43.42 41.93 3hbp n LEU 123 CO 0.34 0.35 0.87 0.25 -1.33 0.00 0.00 177.39 177.87 3hbp h LEU 124 N 0.00 -0.21 -3.42 2.23 5.85 -1.37 0.01 115.31 118.40 3hbp h LEU 124 Ca -0.38 0.19 -0.04 0.00 0.84 0.00 0.00 57.88 58.48 3hbp h LEU 124 Cb 1.89 0.30 -0.02 0.00 0.37 0.00 0.00 40.66 43.20 3hbp h LEU 124 CO 0.02 -0.15 0.03 0.00 -0.34 0.00 0.00 178.44 178.00 3hbp n ALA 125 N -2.84 3.54 -0.16 1.25 0.00 -1.26 -4.40 120.51 116.64 3hbp n ALA 125 Ca 0.16 -2.27 -0.04 0.00 0.00 0.00 0.00 53.44 51.29 3hbp n ALA 125 Cb 0.53 -0.90 0.17 0.00 0.00 0.00 0.00 19.45 19.24 3hbp n ALA 125 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3hbp h GLU 126 N 2.47 0.89 -4.43 0.00 4.81 -1.23 -3.45 114.58 113.64 3hbp h GLU 126 Ca 0.05 -0.18 -0.31 0.00 -0.13 0.00 0.00 59.36 58.78 3hbp h GLU 126 Cb 1.73 -0.13 -0.26 0.00 0.63 0.00 0.00 28.75 30.72 3hbp h GLU 126 CO 0.38 0.79 -0.75 1.03 -0.73 0.00 0.00 179.01 179.73 3hbp s ARG 127 N -5.25 0.48 0.09 1.92 0.52 -1.26 -5.05 118.95 110.40 3hbp s ARG 127 Ca -0.10 -0.39 -0.21 0.00 -0.52 0.00 0.00 55.73 54.51 3hbp s ARG 127 Cb 0.15 -0.40 -0.10 0.00 0.52 0.00 0.00 34.95 35.13 3hbp s ARG 127 CO 0.81 0.10 1.65 0.35 0.02 0.00 0.00 175.30 178.23 3hbp h PHE 128 N 5.50 0.25 -3.55 -0.53 3.57 -1.91 -3.38 116.94 116.89 3hbp h PHE 128 Ca -0.31 -0.01 -0.62 0.00 3.53 0.00 0.00 57.97 60.56 3hbp h PHE 128 Cb 1.19 -0.08 -0.13 0.00 2.79 0.00 0.00 35.95 39.73 3hbp h PHE 128 CO 0.49 0.29 0.07 -0.51 -2.23 0.00 0.00 178.31 176.41 3hbp s LEU 129 N -9.89 4.10 -0.01 0.59 1.43 -1.26 -4.69 118.68 108.95 3hbp s LEU 129 Ca -0.14 0.49 -0.30 0.00 -1.03 0.00 0.00 54.13 53.16 3hbp s LEU 129 Cb 0.07 -2.74 -0.06 0.00 0.03 0.00 0.00 46.19 43.49 3hbp s LEU 129 CO 0.70 -0.38 1.54 -0.89 0.23 0.00 0.00 176.35 177.55 3hbp s THR 130 N 2.44 3.53 0.52 5.49 2.01 0.12 -4.96 115.64 124.80 3hbp s THR 130 Ca 0.23 0.84 -0.21 0.00 0.31 0.00 0.00 61.69 62.86 3hbp s THR 130 Cb -0.15 -3.54 -0.07 0.00 0.01 0.00 0.00 72.50 68.74 3hbp s THR 130 CO 0.10 -0.03 1.01 -2.65 -0.69 0.00 0.00 174.62 172.36 3hbp n PRO 131 N 6.09 1.18 -0.20 4.92 -0.02 -1.26 -4.70 135.00 141.02 3hbp n PRO 131 Ca 0.15 0.44 0.20 0.00 -2.02 0.00 0.00 63.50 62.27 3hbp n PRO 131 Cb 0.43 -2.15 0.56 0.00 -0.02 0.00 0.00 33.50 32.32 3hbp n PRO 131 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 3hbp h ASN 132 N 1.05 0.30 1.54 2.55 4.21 -1.92 -0.72 115.58 122.58 3hbp h ASN 132 Ca -0.47 0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.07 3hbp h ASN 132 Cb 1.35 -0.03 0.00 0.00 -1.12 0.00 0.00 38.32 38.52 3hbp h ASN 132 CO 0.54 0.13 0.00 -0.33 -1.29 0.00 0.00 177.43 176.48 3hbp h GLU 133 N 0.31 0.00 0.00 0.81 3.07 -2.02 -3.25 114.58 113.50 3hbp h GLU 133 Ca 0.43 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.29 3hbp h GLU 133 Cb 1.19 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.10 3hbp h GLU 133 CO -0.12 0.00 -0.92 1.28 -1.40 0.00 0.00 179.01 177.85 3hbp n LEU 134 N -3.05 0.54 -4.68 1.33 4.77 -0.36 -4.61 117.00 110.94 3hbp n LEU 134 Ca 0.03 -0.39 -0.45 0.00 -0.03 0.00 0.00 56.01 55.17 3hbp n LEU 134 Cb 0.42 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.48 3hbp n LEU 134 CO 0.31 0.13 1.33 0.33 -1.33 0.00 0.00 177.39 178.16 3hbp n PHE 135 N -1.50 2.42 -1.66 -1.77 -0.00 -0.70 -3.85 117.46 110.40 3hbp n PHE 135 Ca 0.02 0.10 -0.39 0.00 -0.00 0.00 0.00 57.45 57.18 3hbp n PHE 135 Cb 0.27 -2.62 0.04 0.00 -0.00 0.00 0.00 39.48 37.17 3hbp n PHE 135 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 176.76 178.73 3hbp n PHE 136 N 4.52 1.43 -4.85 -5.13 -1.74 -1.26 -4.88 117.46 105.55 3hbp n PHE 136 Ca 0.18 0.45 -0.30 0.00 -0.56 0.00 0.00 57.45 57.23 3hbp n PHE 136 Cb 0.31 -2.24 -0.17 0.00 1.52 0.00 0.00 39.48 38.91 3hbp n PHE 136 CO 0.00 0.00 0.00 0.99 -0.56 0.00 0.00 176.76 177.19 3hbp s THR 137 N -1.39 1.73 -0.28 1.97 2.01 -0.17 -4.98 115.64 114.54 3hbp s THR 137 Ca 0.72 -0.81 0.00 0.00 0.31 0.00 0.00 61.69 61.91 3hbp s THR 137 Cb -0.44 -1.53 0.08 0.00 0.01 0.00 0.00 72.50 70.62 3hbp s THR 137 CO 0.49 0.49 0.04 -0.60 -0.69 0.00 0.00 174.62 174.35 3hbp s ARG 138 N 0.60 1.08 -0.14 4.92 6.06 -1.26 -1.37 118.95 128.84 3hbp s ARG 138 Ca -0.14 -1.09 -0.01 0.00 -2.50 0.00 0.00 55.73 52.00 3hbp s ARG 138 Cb -0.17 -2.37 -0.02 0.00 0.06 0.00 0.00 34.95 32.46 3hbp s ARG 138 CO 0.04 -0.82 -0.11 -0.80 -2.50 0.00 0.00 175.30 171.11 3hbp s ASN 139 N 1.48 4.15 0.36 -2.12 0.01 -0.80 -4.99 114.94 113.03 3hbp s ASN 139 Ca 0.04 -0.30 0.21 0.00 -0.71 0.00 0.00 52.86 52.10 3hbp s ASN 139 Cb -0.18 -1.65 0.22 0.00 0.41 0.00 0.00 41.25 40.06 3hbp s ASN 139 CO -0.15 0.15 1.47 0.45 -1.51 0.00 0.00 177.10 177.51 3hbp h HIS 140 N 6.79 0.00 -4.33 2.20 3.86 -1.94 -3.39 115.15 118.34 3hbp h HIS 140 Ca -0.28 0.00 -0.24 0.00 -1.16 0.00 0.00 60.37 58.69 3hbp h HIS 140 Cb 1.21 0.00 -0.12 0.00 1.06 0.00 0.00 27.41 29.56 3hbp h HIS 140 CO 0.51 0.12 -0.40 -0.51 0.86 0.00 0.00 177.93 178.51 3hbp s LEU 141 N -6.12 1.03 0.50 2.43 1.43 -1.26 -4.72 118.68 111.98 3hbp s LEU 141 Ca 0.05 -1.37 -0.22 0.00 -1.03 0.00 0.00 54.13 51.56 3hbp s LEU 141 Cb 0.06 0.95 -0.07 0.00 0.03 0.00 0.00 46.19 47.16 3hbp s LEU 141 CO 0.71 -1.04 1.12 -2.65 0.23 0.00 0.00 176.35 174.72 3hbp n PRO 142 N -0.41 1.40 -2.58 1.29 -0.02 -1.26 -4.69 135.00 128.73 3hbp n PRO 142 Ca 0.02 0.51 -0.43 0.00 -2.02 0.00 0.00 63.50 61.58 3hbp n PRO 142 Cb 0.64 -2.26 -0.02 0.00 -0.02 0.00 0.00 33.50 31.83 3hbp n PRO 142 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3hbp s VAL 143 N -1.34 4.54 0.49 -1.45 1.01 -1.26 -4.80 120.40 117.59 3hbp s VAL 143 Ca 0.68 1.84 -0.24 0.00 0.00 0.00 0.00 61.98 64.27 3hbp s VAL 143 Cb -0.47 -4.19 -0.07 0.00 0.00 0.00 0.00 36.38 31.65 3hbp s VAL 143 CO 0.53 -0.09 1.38 -2.65 0.00 0.00 0.00 175.10 174.26 3hbp n PRO 144 N 5.84 1.95 -3.60 2.72 -0.02 -1.26 -4.71 135.00 135.91 3hbp n PRO 144 Ca 0.11 0.70 -0.40 0.00 -2.02 0.00 0.00 63.50 61.90 3hbp n PRO 144 Cb 0.46 -2.57 -0.11 0.00 -0.02 0.00 0.00 33.50 31.26 3hbp n PRO 144 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hbp s ALA 145 N -1.24 3.32 -0.15 3.55 0.00 -1.26 -5.01 121.76 120.97 3hbp s ALA 145 Ca 0.66 -1.53 0.00 0.00 0.00 0.00 0.00 51.96 51.09 3hbp s ALA 145 Cb -0.44 -2.54 -0.00 0.00 0.00 0.00 0.00 23.12 20.14 3hbp s ALA 145 CO 0.54 -1.12 -0.15 0.08 0.00 0.00 0.00 175.76 175.11 3hbp s VAL 146 N 1.61 2.73 -0.27 0.00 1.01 -1.26 -5.08 120.40 119.14 3hbp s VAL 146 Ca 0.04 -0.75 -0.27 0.00 0.00 0.00 0.00 61.98 61.00 3hbp s VAL 146 Cb -0.18 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.05 3hbp s VAL 146 CO 0.07 0.51 0.98 -0.70 0.00 0.00 0.00 175.10 175.96 3hbp s GLU 147 N 0.79 4.14 0.24 2.72 -6.30 -1.26 -4.97 118.70 114.05 3hbp s GLU 147 Ca -0.05 1.08 -0.05 0.00 -2.50 0.00 0.00 54.97 53.45 3hbp s GLU 147 Cb -0.15 -3.69 0.37 0.00 0.00 0.00 0.00 34.13 30.67 3hbp s GLU 147 CO 0.00 -0.71 1.81 -1.00 0.02 0.00 0.00 175.26 175.39 3hbp h PRO 148 N 7.80 0.75 -0.50 4.30 0.13 -1.98 -2.82 132.00 139.68 3hbp h PRO 148 Ca -0.21 -0.04 -0.11 0.00 -0.87 0.00 0.00 66.00 64.76 3hbp h PRO 148 Cb 1.07 -0.17 -0.02 0.00 0.13 0.00 0.00 31.00 32.02 3hbp h PRO 148 CO 0.96 0.49 -0.13 0.66 -0.23 0.00 0.00 178.00 179.76 3hbp h SER 149 N 0.77 0.98 0.42 1.44 4.64 -2.04 -3.21 113.55 116.55 3hbp h SER 149 Ca 0.38 -0.36 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3hbp h SER 149 Cb 0.34 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 3hbp h SER 149 CO -0.24 1.12 -0.32 -1.54 -0.87 0.00 0.00 176.83 174.98 3hbp n SER 150 N -4.18 0.65 -4.70 4.97 3.41 -1.18 -4.87 113.62 107.72 3hbp n SER 150 Ca 0.01 -0.47 -0.44 0.00 -0.26 0.00 0.00 58.87 57.70 3hbp n SER 150 Cb 0.41 0.10 -0.03 0.00 -0.26 0.00 0.00 64.21 64.43 3hbp n SER 150 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hbp n TYR 151 N -1.11 2.48 -4.03 7.33 4.19 -1.07 -5.02 117.16 119.93 3hbp n TYR 151 Ca 0.09 0.28 -0.21 0.00 3.31 0.00 0.00 57.90 61.38 3hbp n TYR 151 Cb 0.33 -2.55 -0.17 0.00 0.49 0.00 0.00 39.34 37.44 3hbp n TYR 151 CO 0.00 0.00 0.00 1.03 0.91 0.00 0.00 176.86 178.80 3hbp s ARG 152 N 0.10 0.75 -0.11 2.98 1.81 -1.26 -4.04 118.95 119.18 3hbp s ARG 152 Ca 0.70 -0.04 -0.23 0.00 -1.72 0.00 0.00 55.73 54.44 3hbp s ARG 152 Cb -0.59 -0.87 -0.03 0.00 -0.45 0.00 0.00 34.95 33.01 3hbp s ARG 152 CO 0.44 -0.15 0.71 -1.17 -0.68 0.00 0.00 175.30 174.45 3hbp s LEU 153 N 1.24 4.26 -0.27 2.53 2.96 0.83 -4.86 118.68 125.36 3hbp s LEU 153 Ca -0.06 1.12 -0.13 0.00 -0.22 0.00 0.00 54.13 54.84 3hbp s LEU 153 Cb -0.14 -3.07 -0.04 0.00 0.50 0.00 0.00 46.19 43.44 3hbp s LEU 153 CO -0.02 -0.20 0.28 -0.60 -1.32 0.00 0.00 176.35 174.49 3hbp s ARG 154 N 1.27 3.99 -0.21 1.98 3.52 -1.11 -0.55 118.95 127.84 3hbp s ARG 154 Ca 0.36 -0.14 -0.00 0.00 -0.13 0.00 0.00 55.73 55.82 3hbp s ARG 154 Cb -0.17 -3.65 0.02 0.00 -1.56 0.00 0.00 34.95 29.59 3hbp s ARG 154 CO 0.15 -0.22 -0.12 0.08 -0.81 0.00 0.00 175.30 174.38 3hbp s VAL 155 N 1.88 2.54 -0.12 7.11 1.01 0.11 -1.21 120.40 131.72 3hbp s VAL 155 Ca 0.11 -0.94 -0.29 0.00 0.00 0.00 0.00 61.98 60.86 3hbp s VAL 155 Cb -0.16 -2.19 -0.01 0.00 0.00 0.00 0.00 36.38 34.03 3hbp s VAL 155 CO 0.10 0.38 1.01 -1.81 0.00 0.00 0.00 175.10 174.78 3hbp s ASP 156 N 1.32 7.23 0.83 3.32 1.01 -0.92 0.37 116.67 129.83 3hbp s ASP 156 Ca 0.03 1.52 -0.12 0.00 0.71 0.00 0.00 52.55 54.68 3hbp s ASP 156 Cb -0.15 -2.55 0.09 0.00 1.01 0.00 0.00 42.92 41.32 3hbp s ASP 156 CO -0.08 -0.47 1.18 -0.83 0.21 0.00 0.00 175.17 175.18 3hbp s GLY 157 N 1.11 1.60 0.42 0.21 0.00 -0.40 -4.55 107.32 105.70 3hbp s GLY 157 Ca 0.48 -0.66 0.12 0.00 0.00 0.00 0.00 44.72 44.66 3hbp s GLY 157 CO 0.17 -0.14 1.97 -2.55 0.00 0.00 0.00 173.10 172.55 3hbp h PRO 158 N -1.16 0.48 -0.11 2.90 0.11 -1.88 -2.43 132.00 129.90 3hbp h PRO 158 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3hbp h PRO 158 Cb 1.33 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3hbp h PRO 158 CO 0.64 0.32 0.00 0.41 -0.21 0.00 0.00 178.00 179.16 3hbp n GLY 159 N -1.50 0.21 0.49 -0.55 0.00 -1.26 -4.93 105.19 97.65 3hbp n GLY 159 Ca 0.10 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.69 3hbp n GLY 159 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hbp n GLY 160 N 1.16 0.74 3.54 -0.02 0.00 -0.92 -5.09 105.19 104.60 3hbp n GLY 160 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 3hbp n GLY 160 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hbp s GLY 161 N -2.06 1.55 -0.07 -0.02 0.00 -1.26 -4.82 107.32 100.63 3hbp s GLY 161 Ca 0.00 -0.87 0.02 0.00 0.00 0.00 0.00 44.72 43.87 3hbp s GLY 161 CO 0.00 0.01 -0.12 -1.59 0.00 0.00 0.00 173.10 171.40 3hbp s THR 162 N -2.86 1.18 0.04 0.90 2.01 -1.26 -1.27 115.64 114.38 3hbp s THR 162 Ca 0.70 -0.49 -0.14 0.00 0.31 0.00 0.00 61.69 62.07 3hbp s THR 162 Cb -0.11 -1.09 -0.06 0.00 0.01 0.00 0.00 72.50 71.25 3hbp s THR 162 CO 0.57 0.37 0.43 -0.22 -0.69 0.00 0.00 174.62 175.08 3hbp s LEU 163 N 0.77 4.44 -0.11 4.42 2.96 0.16 -4.93 118.68 126.39 3hbp s LEU 163 Ca -0.12 0.96 0.00 0.00 -0.22 0.00 0.00 54.13 54.75 3hbp s LEU 163 Cb -0.16 -2.77 0.02 0.00 0.50 0.00 0.00 46.19 43.79 3hbp s LEU 163 CO 0.02 0.27 -0.10 -0.55 -1.32 0.00 0.00 176.35 174.67 3hbp s SER 164 N -1.30 2.20 -0.13 3.68 0.15 -1.26 0.07 113.70 117.12 3hbp s SER 164 Ca 0.28 -0.34 0.01 0.00 0.70 0.00 0.00 55.95 56.60 3hbp s SER 164 Cb -0.16 -0.91 0.02 0.00 -1.71 0.00 0.00 66.02 63.26 3hbp s SER 164 CO 0.15 -0.07 -0.15 -0.76 1.20 0.00 0.00 173.24 173.61 3hbp s LEU 165 N 1.43 1.72 0.77 3.45 1.43 0.28 -4.93 118.68 122.83 3hbp s LEU 165 Ca 0.01 -0.47 -0.11 0.00 -1.03 0.00 0.00 54.13 52.53 3hbp s LEU 165 Cb -0.13 -1.16 0.05 0.00 0.03 0.00 0.00 46.19 44.98 3hbp s LEU 165 CO -0.06 -0.02 1.08 -0.94 0.23 0.00 0.00 176.35 176.65 3hbp s SER 166 N 1.24 4.72 0.24 2.29 1.04 -1.26 -0.12 113.70 121.85 3hbp s SER 166 Ca -0.01 1.44 -0.05 0.00 0.48 0.00 0.00 55.95 57.81 3hbp s SER 166 Cb -0.14 -2.21 0.41 0.00 0.10 0.00 0.00 66.02 64.18 3hbp s SER 166 CO -0.06 -1.84 1.76 0.25 0.98 0.00 0.00 173.24 174.33 3hbp h LEU 167 N -1.00 0.44 -0.56 2.42 5.85 -1.82 -1.90 115.31 118.75 3hbp h LEU 167 Ca -0.46 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.33 3hbp h LEU 167 Cb 1.25 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 42.26 3hbp h LEU 167 CO 0.58 0.22 0.31 0.00 -0.34 0.00 0.00 178.44 179.21 3hbp h ALA 168 N 1.49 0.71 -0.55 1.25 0.00 -1.93 -1.69 119.26 118.54 3hbp h ALA 168 Ca 0.39 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.22 3hbp h ALA 168 Cb 0.49 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 3hbp h ALA 168 CO -0.32 0.23 0.36 0.93 0.00 0.00 0.00 179.25 180.44 3hbp h GLU 169 N 0.75 0.70 -0.68 0.00 5.08 -1.86 -0.44 114.58 118.13 3hbp h GLU 169 Ca 0.20 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 3hbp h GLU 169 Cb 0.04 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 3hbp h GLU 169 CO -0.03 0.47 0.38 1.25 -1.00 0.00 0.00 179.01 180.07 3hbp h LEU 170 N 0.73 0.82 -0.46 1.33 5.85 -1.02 0.25 115.31 122.80 3hbp h LEU 170 Ca 0.21 -0.06 -0.16 0.00 0.84 0.00 0.00 57.88 58.70 3hbp h LEU 170 Cb -0.06 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 40.76 3hbp h LEU 170 CO -0.06 0.66 -0.52 0.03 -0.34 0.00 0.00 178.44 178.21 3hbp h ARG 171 N 0.94 0.68 0.01 1.25 3.08 -1.09 -3.35 114.38 115.89 3hbp h ARG 171 Ca 0.24 -0.42 -0.35 0.00 0.07 0.00 0.00 59.98 59.52 3hbp h ARG 171 Cb 0.01 0.04 -0.06 0.00 0.08 0.00 0.00 29.97 30.04 3hbp h ARG 171 CO -0.04 1.03 -2.19 -1.13 -1.07 0.00 0.00 179.97 176.57 3hbp n SER 172 N -3.99 0.65 0.18 7.04 3.41 -0.19 -4.45 113.62 116.27 3hbp n SER 172 Ca -0.03 0.11 0.09 0.00 -0.26 0.00 0.00 58.87 58.78 3hbp n SER 172 Cb 0.60 0.39 0.10 0.00 -0.26 0.00 0.00 64.21 65.04 3hbp n SER 172 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3hbp h ARG 173 N 0.01 0.00 -5.32 4.33 2.43 -0.73 -3.45 114.38 111.65 3hbp h ARG 173 Ca -0.47 0.00 -0.66 0.00 -0.81 0.00 0.00 59.98 58.04 3hbp h ARG 173 Cb 2.12 0.00 -0.33 0.00 -0.42 0.00 0.00 29.97 31.35 3hbp h ARG 173 CO 0.03 0.12 -0.87 -0.06 -1.51 0.00 0.00 179.97 177.68 3hbp s PHE 174 N -3.17 2.39 0.04 2.20 0.08 -1.26 -5.08 117.98 113.19 3hbp s PHE 174 Ca 0.05 -0.94 -0.34 0.00 0.12 0.00 0.00 56.93 55.82 3hbp s PHE 174 Cb 0.06 -1.61 -0.13 0.00 -0.57 0.00 0.00 43.02 40.77 3hbp s PHE 174 CO 0.71 -0.37 1.69 -2.30 -0.10 0.00 0.00 175.22 174.84 3hbp n PRO 175 N 3.48 2.05 -2.16 0.24 -0.02 -1.26 -4.85 135.00 132.48 3hbp n PRO 175 Ca -0.19 0.75 -0.41 0.00 -2.02 0.00 0.00 63.50 61.62 3hbp n PRO 175 Cb 0.53 -2.53 -0.03 0.00 -0.02 0.00 0.00 33.50 31.45 3hbp n PRO 175 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3hbp s LYS 176 N 2.21 4.38 -0.01 -0.52 2.20 -1.26 -4.39 119.74 122.33 3hbp s LYS 176 Ca 0.85 2.14 0.04 0.00 -0.36 0.00 0.00 55.97 58.65 3hbp s LYS 176 Cb -0.72 -3.13 -0.01 0.00 -1.51 0.00 0.00 37.83 32.47 3hbp s LYS 176 CO 0.45 -0.21 -0.14 -1.58 -0.36 0.00 0.00 175.35 173.51 3hbp s HIS 177 N -0.56 1.23 -0.15 4.03 5.65 -0.52 -4.94 115.29 120.04 3hbp s HIS 177 Ca 0.53 -0.24 -0.04 0.00 0.25 0.00 0.00 55.06 55.55 3hbp s HIS 177 Cb -0.38 -0.80 -0.03 0.00 -1.18 0.00 0.00 32.58 30.18 3hbp s HIS 177 CO 0.46 -0.03 0.01 -1.21 -0.65 0.00 0.00 174.74 173.31 3hbp s GLU 178 N -0.27 3.59 -0.05 2.88 0.41 -1.26 -1.80 118.70 122.20 3hbp s GLU 178 Ca 0.04 -0.42 -0.00 0.00 -0.41 0.00 0.00 54.97 54.18 3hbp s GLU 178 Cb -0.06 -2.99 0.03 0.00 -1.78 0.00 0.00 34.13 29.33 3hbp s GLU 178 CO -0.00 0.38 -0.01 0.08 -0.49 0.00 0.00 175.26 175.22 3hbp s VAL 179 N 0.01 0.38 -0.35 2.63 1.01 0.97 -4.95 120.40 120.10 3hbp s VAL 179 Ca 0.03 0.03 -0.20 0.00 0.00 0.00 0.00 61.98 61.84 3hbp s VAL 179 Cb -0.13 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.77 3hbp s VAL 179 CO 0.02 0.22 0.64 -0.89 0.00 0.00 0.00 175.10 175.09 3hbp s THR 180 N 1.39 4.89 -0.00 3.92 2.01 -1.26 0.32 115.64 126.90 3hbp s THR 180 Ca -0.04 0.63 0.01 0.00 0.31 0.00 0.00 61.69 62.60 3hbp s THR 180 Cb -0.13 -4.07 0.00 0.00 0.01 0.00 0.00 72.50 68.31 3hbp s THR 180 CO -0.02 -0.29 -0.02 0.00 -0.69 0.00 0.00 174.62 173.59 3hbp s ALA 181 N 2.70 0.18 -0.17 7.40 0.00 -0.57 -3.74 121.76 127.57 3hbp s ALA 181 Ca 0.25 -0.07 -0.23 0.00 0.00 0.00 0.00 51.96 51.91 3hbp s ALA 181 Cb -0.14 -0.06 -0.02 0.00 0.00 0.00 0.00 23.12 22.89 3hbp s ALA 181 CO 0.14 0.04 0.71 0.99 0.00 0.00 0.00 175.76 177.64 3hbp s THR 182 N 0.02 4.97 -0.18 0.00 2.01 -0.53 -2.75 115.64 119.18 3hbp s THR 182 Ca 0.00 1.38 -0.13 0.00 0.31 0.00 0.00 61.69 63.26 3hbp s THR 182 Cb -0.02 -4.03 -0.05 0.00 0.01 0.00 0.00 72.50 68.42 3hbp s THR 182 CO -0.00 0.10 0.24 -0.76 -0.69 0.00 0.00 174.62 173.51 3hbp s LEU 183 N 1.86 4.22 -0.04 4.42 1.43 -0.16 -4.59 118.68 125.81 3hbp s LEU 183 Ca 0.33 0.39 0.03 0.00 -1.03 0.00 0.00 54.13 53.85 3hbp s LEU 183 Cb -0.16 -2.28 0.01 0.00 0.03 0.00 0.00 46.19 43.78 3hbp s LEU 183 CO 0.12 0.11 -0.10 -1.58 0.23 0.00 0.00 176.35 175.12 3hbp s GLN 184 N 0.55 1.23 0.42 1.70 0.74 -1.26 -1.01 119.66 122.02 3hbp s GLN 184 Ca 0.13 -0.35 -0.23 0.00 0.05 0.00 0.00 55.36 54.96 3hbp s GLN 184 Cb -0.13 -1.10 -0.09 0.00 1.10 0.00 0.00 33.01 32.80 3hbp s GLN 184 CO 0.02 0.09 1.05 0.45 -0.55 0.00 0.00 175.29 176.35 3hbp s SER 185 N 0.35 6.67 0.47 6.67 0.15 -0.08 -1.25 113.70 126.67 3hbp s SER 185 Ca -0.07 2.01 0.19 0.00 0.70 0.00 0.00 55.95 58.79 3hbp s SER 185 Cb -0.11 -2.58 1.18 0.00 -1.71 0.00 0.00 66.02 62.80 3hbp s SER 185 CO 0.01 -0.55 1.95 0.00 1.20 0.00 0.00 173.24 175.85 3hbp h ALA 186 N 2.29 2.25 -0.55 5.45 0.00 -1.95 -2.26 119.26 124.49 3hbp h ALA 186 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3hbp h ALA 186 Cb 1.22 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3hbp h ALA 186 CO 0.62 -0.43 0.00 0.41 0.00 0.00 0.00 179.25 179.85 3hbp n GLY 187 N -1.57 2.15 3.66 0.00 0.00 -1.26 -1.44 105.19 106.74 3hbp n GLY 187 Ca 0.12 -0.69 -0.46 0.00 0.00 0.00 0.00 46.02 45.00 3hbp n GLY 187 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3hbp n ASN 188 N 0.97 2.78 -0.92 1.61 5.15 -0.85 -0.91 115.26 123.08 3hbp n ASN 188 Ca 0.21 1.12 -0.12 0.00 -0.60 0.00 0.00 54.58 55.19 3hbp n ASN 188 Cb 0.70 -1.41 -0.05 0.00 -0.53 0.00 0.00 39.78 38.50 3hbp n ASN 188 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3hbp n ARG 189 N 2.61 -0.81 -0.31 1.20 1.74 -1.15 -4.25 116.66 115.69 3hbp n ARG 189 Ca 0.14 0.88 0.08 0.00 -0.77 0.00 0.00 57.85 58.17 3hbp n ARG 189 Cb 0.29 -4.88 0.28 0.00 -1.02 0.00 0.00 32.46 27.14 3hbp n ARG 189 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 3hbp h ARG 190 N 0.00 0.88 -0.17 5.56 2.43 -0.96 -2.91 114.38 119.22 3hbp h ARG 190 Ca -0.24 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 58.87 3hbp h ARG 190 Cb 0.79 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 3hbp h ARG 190 CO 0.34 0.58 0.05 0.66 -1.51 0.00 0.00 179.97 180.10 3hbp h SER 191 N 0.91 0.21 -0.35 -3.80 4.64 -1.50 -0.75 113.55 112.91 3hbp h SER 191 Ca 0.45 -0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.68 3hbp h SER 191 Cb 0.47 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.48 3hbp h SER 191 CO -0.21 0.21 0.00 -0.33 -0.87 0.00 0.00 176.83 175.63 3hbp h GLU 192 N 0.24 0.72 -0.21 4.77 5.08 -1.78 -2.58 114.58 120.81 3hbp h GLU 192 Ca 0.06 -0.18 -0.07 0.00 -1.00 0.00 0.00 59.36 58.17 3hbp h GLU 192 Cb 0.08 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 3hbp h GLU 192 CO -0.00 0.73 -0.19 1.98 -1.00 0.00 0.00 179.01 180.53 3hbp h MET 193 N 0.68 0.37 0.00 2.33 4.05 -1.23 -2.93 114.93 118.20 3hbp h MET 193 Ca 0.14 -0.11 -0.05 0.00 -0.28 0.00 0.00 59.70 59.40 3hbp h MET 193 Cb 0.42 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.17 3hbp h MET 193 CO 0.02 0.55 -0.21 0.77 0.23 0.00 0.00 176.91 178.26 3hbp h SER 194 N 0.34 0.00 0.28 1.39 0.02 -1.02 -2.71 113.55 111.85 3hbp h SER 194 Ca 0.06 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.97 3hbp h SER 194 Cb 0.53 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 3hbp h SER 194 CO 0.03 0.21 -0.17 0.03 -1.14 0.00 0.00 176.83 175.80 3hbp h ARG 195 N 0.00 0.00 0.04 3.45 3.08 -1.30 -3.07 114.38 116.58 3hbp h ARG 195 Ca -0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 3hbp h ARG 195 Cb 0.68 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.74 3hbp h ARG 195 CO 0.03 0.17 -0.37 0.28 -1.07 0.00 0.00 179.97 179.01 3hbp h VAL 196 N 0.00 1.59 -1.68 2.04 2.07 -1.61 -3.47 116.25 115.19 3hbp h VAL 196 Ca -0.00 -2.21 0.09 0.00 0.82 0.00 0.00 66.70 65.40 3hbp h VAL 196 Cb 0.35 3.02 -0.23 0.00 -1.52 0.00 0.00 31.29 32.91 3hbp h VAL 196 CO 0.02 0.61 0.15 -0.60 0.02 0.00 0.00 177.57 177.77 3hbp s ARG 197 N -2.73 0.51 0.40 1.57 3.52 -1.16 -5.14 118.95 115.91 3hbp s ARG 197 Ca -0.16 1.00 -0.26 0.00 -0.13 0.00 0.00 55.73 56.18 3hbp s ARG 197 Cb 0.00 0.30 -0.11 0.00 -1.56 0.00 0.00 34.95 33.58 3hbp s ARG 197 CO 0.76 -0.13 1.18 -2.30 -0.81 0.00 0.00 175.30 174.00 3hbp n PRO 198 N 4.41 1.74 -4.47 5.12 -0.02 -1.22 -4.16 135.00 136.41 3hbp n PRO 198 Ca -0.16 0.62 -0.23 0.00 -2.02 0.00 0.00 63.50 61.70 3hbp n PRO 198 Cb 0.56 -2.24 -0.10 0.00 -0.02 0.00 0.00 33.50 31.70 3hbp n PRO 198 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3hbp s VAL 199 N -1.20 2.17 -0.04 -1.45 -7.23 -1.26 -4.99 120.40 106.41 3hbp s VAL 199 Ca 0.61 -2.28 -0.21 0.00 -1.81 0.00 0.00 61.98 58.29 3hbp s VAL 199 Cb -0.54 -2.38 -0.05 0.00 0.56 0.00 0.00 36.38 33.97 3hbp s VAL 199 CO 0.58 -0.36 0.59 -0.54 -0.31 0.00 0.00 175.10 175.07 3hbp s LYS 200 N -3.59 4.34 0.00 4.82 -0.14 -1.08 -5.00 119.74 119.08 3hbp s LYS 200 Ca 0.29 0.71 0.00 0.00 -1.36 0.00 0.00 55.97 55.61 3hbp s LYS 200 Cb -0.01 -3.38 0.00 0.00 -1.68 0.00 0.00 37.83 32.76 3hbp s LYS 200 CO 0.14 0.27 0.00 0.41 -0.76 0.00 0.00 175.35 175.40 3hbp n GLY 201 N 2.74 2.18 3.73 -3.33 0.00 -1.26 -4.45 105.19 104.81 3hbp n GLY 201 Ca -0.06 -1.79 -0.42 0.00 0.00 0.00 0.00 46.02 43.76 3hbp n GLY 201 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hbp s LEU 202 N 0.00 4.39 -1.50 0.99 1.43 -1.26 -4.89 118.68 117.83 3hbp s LEU 202 Ca 0.00 2.52 -0.11 0.00 -1.03 0.00 0.00 54.13 55.51 3hbp s LEU 202 Cb 0.00 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.61 3hbp s LEU 202 CO 0.00 -0.66 2.55 -0.81 0.23 0.00 0.00 176.35 177.66 3hbp n PRO 203 N 2.96 3.53 -1.68 1.29 -0.04 -1.26 -4.84 135.00 134.96 3hbp n PRO 203 Ca 0.08 -2.61 -0.44 0.00 -0.04 0.00 0.00 63.50 60.49 3hbp n PRO 203 Cb 0.41 -2.95 -0.02 0.00 -0.04 0.00 0.00 33.50 30.90 3hbp n PRO 203 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 3hbp n TRP 204 N 4.21 2.17 -2.20 0.54 7.02 -1.26 -4.65 117.44 123.26 3hbp n TRP 204 Ca 0.64 0.47 0.00 0.00 -1.02 0.00 0.00 57.50 57.59 3hbp n TRP 204 Cb 0.30 -2.44 0.00 0.00 -2.42 0.00 0.00 31.31 26.74 3hbp n TRP 204 CO 0.00 0.00 0.00 -3.47 -2.02 0.00 0.00 177.69 172.20 3hbp n ASP 205 N 1.79 0.00 -0.03 -0.99 2.03 -1.26 -1.41 116.55 116.68 3hbp n ASP 205 Ca 0.10 -0.40 0.00 0.00 0.52 0.00 0.00 54.79 55.01 3hbp n ASP 205 Cb 0.33 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.73 3hbp n ASP 205 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 3hbp n ILE 206 N -0.44 0.00 -0.83 5.18 -5.35 -1.26 -2.94 119.36 113.72 3hbp n ILE 206 Ca 0.00 0.00 0.08 0.00 -0.27 0.00 0.00 62.75 62.56 3hbp n ILE 206 Cb 0.00 -0.32 0.17 0.00 -1.74 0.00 0.00 39.64 37.75 3hbp n ILE 206 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3hbp n GLY 207 N -0.12 4.14 2.22 3.28 0.00 -1.26 -4.70 105.19 108.75 3hbp n GLY 207 Ca 0.00 -0.89 -0.26 0.00 0.00 0.00 0.00 46.02 44.87 3hbp n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hbp n ALA 208 N -0.79 6.84 -3.64 4.61 0.00 -1.24 -4.36 120.51 121.93 3hbp n ALA 208 Ca 0.16 -2.80 -0.09 0.00 0.00 0.00 0.00 53.44 50.71 3hbp n ALA 208 Cb 0.67 -2.70 -0.07 0.00 0.00 0.00 0.00 19.45 17.35 3hbp n ALA 208 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 3hbp s ILE 209 N 0.72 -0.00 0.17 0.00 2.07 -1.26 -0.91 121.20 121.99 3hbp s ILE 209 Ca 0.66 0.00 -0.16 0.00 -1.41 0.00 0.00 60.65 59.73 3hbp s ILE 209 Cb 0.27 -0.99 0.03 0.00 0.13 0.00 0.00 42.46 41.89 3hbp s ILE 209 CO -0.06 0.00 0.46 -0.44 -1.91 0.00 0.00 174.94 172.99 3hbp s SER 210 N 1.31 -0.23 -0.05 4.50 0.01 -0.18 -4.68 113.70 114.38 3hbp s SER 210 Ca -0.07 -0.47 0.03 0.00 1.31 0.00 0.00 55.95 56.75 3hbp s SER 210 Cb -0.05 0.53 0.00 0.00 0.21 0.00 0.00 66.02 66.72 3hbp s SER 210 CO -0.14 -0.98 -0.14 -0.89 0.41 0.00 0.00 173.24 171.50 3hbp s THR 211 N -3.86 1.22 0.04 1.44 2.01 -1.26 -0.99 115.64 114.23 3hbp s THR 211 Ca 0.08 -0.58 -0.03 0.00 0.31 0.00 0.00 61.69 61.47 3hbp s THR 211 Cb 0.00 -1.07 -0.02 0.00 0.01 0.00 0.00 72.50 71.42 3hbp s THR 211 CO -0.05 0.36 0.04 0.00 -0.69 0.00 0.00 174.62 174.28 3hbp s ALA 212 N 0.25 0.14 -0.27 7.40 0.00 -1.11 0.15 121.76 128.32 3hbp s ALA 212 Ca -0.07 -0.77 -0.27 0.00 0.00 0.00 0.00 51.96 50.85 3hbp s ALA 212 Cb -0.12 0.25 0.01 0.00 0.00 0.00 0.00 23.12 23.26 3hbp s ALA 212 CO 0.02 -0.32 0.95 0.50 0.00 0.00 0.00 175.76 176.92 3hbp s ARG 213 N -2.90 4.13 -0.14 0.00 3.52 -1.26 -1.50 118.95 120.79 3hbp s ARG 213 Ca -0.03 1.03 -0.07 0.00 -0.13 0.00 0.00 55.73 56.54 3hbp s ARG 213 Cb 0.01 -3.69 -0.04 0.00 -1.56 0.00 0.00 34.95 29.67 3hbp s ARG 213 CO -0.06 -0.69 0.08 -1.58 -0.81 0.00 0.00 175.30 172.24 3hbp s TRP 214 N 3.20 3.37 -0.05 5.12 0.52 0.15 -0.39 118.94 130.86 3hbp s TRP 214 Ca 0.40 0.28 0.07 0.00 0.02 0.00 0.00 56.10 56.87 3hbp s TRP 214 Cb -0.14 -1.98 -0.01 0.00 -1.15 0.00 0.00 33.47 30.18 3hbp s TRP 214 CO 0.10 0.43 -0.25 0.20 0.02 0.00 0.00 176.95 177.45 3hbp s GLY 215 N -0.35 1.28 0.00 0.98 0.00 -0.15 -0.02 107.32 109.06 3hbp s GLY 215 Ca 0.10 -1.06 0.00 0.00 0.00 0.00 0.00 44.72 43.76 3hbp s GLY 215 CO 0.02 -0.73 0.00 0.61 0.00 0.00 0.00 173.10 173.00 3hbp n GLY 216 N 2.79 -1.34 3.78 0.20 0.00 -0.75 -1.79 105.19 108.08 3hbp n GLY 216 Ca -0.17 -0.95 -0.37 0.00 0.00 0.00 0.00 46.02 44.53 3hbp n GLY 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hbp s ALA 217 N -1.18 3.20 0.17 4.61 0.00 -0.60 -1.44 121.76 126.52 3hbp s ALA 217 Ca 0.00 0.62 -0.30 0.00 0.00 0.00 0.00 51.96 52.27 3hbp s ALA 217 Cb 0.00 -3.23 -0.08 0.00 0.00 0.00 0.00 23.12 19.81 3hbp s ALA 217 CO 0.00 0.03 1.35 1.03 0.00 0.00 0.00 175.76 178.17 3hbp s ARG 218 N -2.08 4.36 0.26 0.00 0.52 -1.26 -0.24 118.95 120.50 3hbp s ARG 218 Ca 0.51 2.07 -0.04 0.00 -0.52 0.00 0.00 55.73 57.76 3hbp s ARG 218 Cb -0.21 -3.21 0.35 0.00 0.52 0.00 0.00 34.95 32.40 3hbp s ARG 218 CO 0.27 -0.33 1.89 1.25 0.02 0.00 0.00 175.30 178.40 3hbp h LEU 219 N 5.90 1.05 -0.66 2.53 5.85 -1.29 -2.17 115.31 126.52 3hbp h LEU 219 Ca -0.44 -0.00 0.13 0.00 0.84 0.00 0.00 57.88 58.41 3hbp h LEU 219 Cb 1.21 -0.23 -0.09 0.00 0.37 0.00 0.00 40.66 41.92 3hbp h LEU 219 CO 0.81 0.70 0.19 -0.09 -0.34 0.00 0.00 178.44 179.70 3hbp h ARG 220 N 1.20 0.31 -0.52 1.25 2.43 -1.73 -1.21 114.38 116.10 3hbp h ARG 220 Ca 0.40 -0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 59.44 3hbp h ARG 220 Cb 0.07 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 3hbp h ARG 220 CO -0.14 0.21 -0.14 -0.44 -1.51 0.00 0.00 179.97 177.94 3hbp h ASP 221 N 0.32 1.03 -0.73 -3.80 3.32 -1.74 -0.64 116.42 114.18 3hbp h ASP 221 Ca 0.36 -0.36 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 3hbp h ASP 221 Cb 0.54 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.78 3hbp h ASP 221 CO -0.41 1.16 0.31 0.58 -1.72 0.00 0.00 179.24 179.15 3hbp h VAL 222 N 0.89 1.25 -0.30 -1.35 2.07 -1.05 0.26 116.25 118.01 3hbp h VAL 222 Ca 0.13 -0.75 -0.18 0.00 0.82 0.00 0.00 66.70 66.72 3hbp h VAL 222 Cb 0.71 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 30.87 3hbp h VAL 222 CO 0.05 0.31 -0.52 -0.07 0.02 0.00 0.00 177.57 177.36 3hbp h LEU 223 N 1.03 0.97 -1.08 2.57 3.38 -0.98 -1.76 115.31 119.45 3hbp h LEU 223 Ca 0.24 -0.53 -0.03 0.00 0.09 0.00 0.00 57.88 57.66 3hbp h LEU 223 Cb 0.19 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 3hbp h LEU 223 CO -0.02 1.31 0.27 -0.07 0.09 0.00 0.00 178.44 180.02 3hbp h LEU 224 N 0.66 0.84 -0.99 1.67 3.38 -0.89 -2.20 115.31 117.79 3hbp h LEU 224 Ca 0.02 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 3hbp h LEU 224 Cb 1.13 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.63 3hbp h LEU 224 CO 0.12 0.74 0.18 -0.74 0.09 0.00 0.00 178.44 178.83 3hbp h HIS 225 N 0.92 0.93 0.00 1.13 2.76 -0.30 -1.28 115.15 119.30 3hbp h HIS 225 Ca 0.22 -0.08 0.00 0.00 -2.20 0.00 0.00 60.37 58.31 3hbp h HIS 225 Cb 0.15 -0.27 0.00 0.00 1.55 0.00 0.00 27.41 28.84 3hbp h HIS 225 CO 0.01 0.75 0.00 0.00 -1.30 0.00 0.00 177.93 177.39 3hbp h ALA 226 N 1.32 1.00 0.00 5.26 0.00 -0.73 -3.46 119.26 122.64 3hbp h ALA 226 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3hbp h ALA 226 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3hbp h ALA 226 CO -0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.65 3hbp n GLY 227 N -0.23 0.98 3.77 0.00 0.00 -0.48 -4.39 105.19 104.84 3hbp n GLY 227 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 3hbp n GLY 227 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hbp s PHE 228 N -2.00 2.69 0.89 1.61 0.08 -0.92 -4.87 117.98 115.46 3hbp s PHE 228 Ca 0.00 1.50 -0.14 0.00 0.12 0.00 0.00 56.93 58.41 3hbp s PHE 228 Cb 0.00 -3.47 0.15 0.00 -0.57 0.00 0.00 43.02 39.13 3hbp s PHE 228 CO 0.00 -1.86 1.26 -1.25 -0.10 0.00 0.00 175.22 173.27 3hbp s PRO 229 N -2.85 1.22 0.35 0.24 0.04 -1.26 -4.46 135.00 128.27 3hbp s PRO 229 Ca 0.67 -0.20 0.05 0.00 0.04 0.00 0.00 61.00 61.57 3hbp s PRO 229 Cb -0.31 -1.90 0.64 0.00 0.04 0.00 0.00 34.50 32.97 3hbp s PRO 229 CO 0.36 -2.05 1.89 0.93 0.04 0.00 0.00 177.00 178.17 3hbp h GLU 230 N -1.38 0.50 -3.47 4.56 4.39 -1.98 -3.43 114.58 113.76 3hbp h GLU 230 Ca -0.45 -0.10 -0.34 0.00 0.34 0.00 0.00 59.36 58.81 3hbp h GLU 230 Cb 1.28 -0.08 -0.36 0.00 -0.10 0.00 0.00 28.75 29.49 3hbp h GLU 230 CO 0.50 0.52 -0.74 -2.00 -1.16 0.00 0.00 179.01 176.14 3hbp s GLU 231 N -4.98 0.02 -0.02 2.33 2.12 -1.26 -4.92 118.70 111.98 3hbp s GLU 231 Ca -0.07 0.24 0.00 0.00 0.36 0.00 0.00 54.97 55.50 3hbp s GLU 231 Cb 0.16 -0.41 -0.04 0.00 0.26 0.00 0.00 34.13 34.10 3hbp s GLU 231 CO 0.76 -0.23 0.02 -0.51 -0.54 0.00 0.00 175.26 174.76 3hbp s LEU 232 N 1.52 3.63 0.25 2.70 1.43 -1.26 -5.11 118.68 121.84 3hbp s LEU 232 Ca -0.03 0.06 -0.30 0.00 -1.03 0.00 0.00 54.13 52.83 3hbp s LEU 232 Cb -0.13 -2.05 -0.09 0.00 0.03 0.00 0.00 46.19 43.95 3hbp s LEU 232 CO -0.03 0.29 0.95 -1.10 0.23 0.00 0.00 176.35 176.70 3hbp s GLN 233 N -1.50 4.83 0.97 1.70 -1.52 -1.26 -4.85 119.66 118.03 3hbp s GLN 233 Ca 0.19 1.51 0.00 0.00 -1.95 0.00 0.00 55.36 55.12 3hbp s GLN 233 Cb -0.12 -3.25 0.00 0.00 -0.22 0.00 0.00 33.01 29.42 3hbp s GLN 233 CO 0.10 0.48 0.00 0.41 -0.25 0.00 0.00 175.29 176.03 3hbp n GLY 234 N 1.42 -1.72 3.36 3.09 0.00 -1.26 -4.87 105.19 105.22 3hbp n GLY 234 Ca -0.02 -1.66 -0.38 0.00 0.00 0.00 0.00 46.02 43.96 3hbp n GLY 234 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hbp s GLU 235 N 0.00 3.12 0.17 1.61 0.41 -1.26 -5.07 118.70 117.67 3hbp s GLU 235 Ca 0.00 -0.85 0.08 0.00 -0.41 0.00 0.00 54.97 53.79 3hbp s GLU 235 Cb 0.00 -3.43 -0.04 0.00 -1.78 0.00 0.00 34.13 28.88 3hbp s GLU 235 CO 0.00 -0.45 -0.17 -1.58 -0.49 0.00 0.00 175.26 172.57 3hbp s TRP 236 N 1.52 1.72 0.05 1.61 0.52 -1.26 -4.60 118.94 118.51 3hbp s TRP 236 Ca 0.03 -0.51 0.00 0.00 0.02 0.00 0.00 56.10 55.64 3hbp s TRP 236 Cb -0.17 -0.85 -0.03 0.00 -1.15 0.00 0.00 33.47 31.26 3hbp s TRP 236 CO 0.03 0.31 -0.04 -1.01 0.02 0.00 0.00 176.95 176.26 3hbp s HIS 237 N -2.27 0.52 -0.27 -1.98 3.76 0.54 -0.67 115.29 114.91 3hbp s HIS 237 Ca 0.16 -0.78 -0.03 0.00 -0.15 0.00 0.00 55.06 54.26 3hbp s HIS 237 Cb -0.04 -0.35 0.02 0.00 1.11 0.00 0.00 32.58 33.32 3hbp s HIS 237 CO 0.06 -0.23 -0.00 0.08 -0.85 0.00 0.00 174.74 173.79 3hbp s VAL 238 N -2.68 3.27 0.10 -0.90 1.01 0.31 -0.95 120.40 120.56 3hbp s VAL 238 Ca -0.02 -0.96 -0.17 0.00 0.00 0.00 0.00 61.98 60.83 3hbp s VAL 238 Cb -0.01 -2.70 -0.07 0.00 0.00 0.00 0.00 36.38 33.60 3hbp s VAL 238 CO -0.05 0.12 0.55 0.00 0.00 0.00 0.00 175.10 175.72 3hbp s PHE 240 N -1.27 1.98 -0.02 0.00 0.08 0.14 -1.11 117.98 117.77 3hbp s PHE 240 Ca 0.33 -0.48 0.07 0.00 0.12 0.00 0.00 56.93 56.98 3hbp s PHE 240 Cb -0.17 -1.29 -0.02 0.00 -0.57 0.00 0.00 43.02 40.97 3hbp s PHE 240 CO 0.19 -0.11 -0.24 -1.21 -0.10 0.00 0.00 175.22 173.75 3hbp s GLU 241 N -0.28 1.98 0.47 0.44 2.02 -0.61 -1.96 118.70 120.77 3hbp s GLU 241 Ca 0.02 -0.87 -0.02 0.00 0.02 0.00 0.00 54.97 54.13 3hbp s GLU 241 Cb -0.10 -1.91 -0.01 0.00 0.10 0.00 0.00 34.13 32.21 3hbp s GLU 241 CO 0.01 0.52 0.72 0.20 0.02 0.00 0.00 175.26 176.73 3hbp s GLY 242 N -0.56 1.54 0.42 -1.39 0.00 0.40 -0.65 107.32 107.09 3hbp s GLY 242 Ca 0.09 -0.89 0.22 0.00 0.00 0.00 0.00 44.72 44.14 3hbp s GLY 242 CO -0.01 -0.71 1.80 1.41 0.00 0.00 0.00 173.10 175.59 3hbp h LEU 243 N 0.29 0.00 -9.69 0.66 3.38 -0.56 -3.41 115.31 105.97 3hbp h LEU 243 Ca -0.46 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 56.98 3hbp h LEU 243 Cb 1.24 0.00 0.03 0.00 0.09 0.00 0.00 40.66 42.02 3hbp h LEU 243 CO 0.59 0.27 0.60 1.51 0.09 0.00 0.00 178.44 181.49 3hbp s ASP 244 N -6.27 7.00 0.03 -0.43 -4.77 -1.26 -4.95 116.67 106.01 3hbp s ASP 244 Ca 0.00 2.33 -0.02 0.00 -3.30 0.00 0.00 52.55 51.57 3hbp s ASP 244 Cb 0.10 -2.61 -0.02 0.00 -1.09 0.00 0.00 42.92 39.30 3hbp s ASP 244 CO 0.65 -0.43 0.00 0.00 0.70 0.00 0.00 175.17 176.09 3hbp s ALA 245 N -0.12 0.12 0.94 2.11 0.00 -1.26 -2.28 121.76 121.27 3hbp s ALA 245 Ca 0.54 -0.66 -0.12 0.00 0.00 0.00 0.00 51.96 51.71 3hbp s ALA 245 Cb -0.35 0.18 0.15 0.00 0.00 0.00 0.00 23.12 23.11 3hbp s ALA 245 CO 0.39 -0.23 1.12 0.16 0.00 0.00 0.00 175.76 177.20 3hbp s ASP 246 N -1.83 3.23 0.41 0.00 1.47 -0.97 -4.84 116.67 114.14 3hbp s ASP 246 Ca -0.10 1.06 0.14 0.00 1.18 0.00 0.00 52.55 54.83 3hbp s ASP 246 Cb -0.05 -1.67 1.00 0.00 -0.34 0.00 0.00 42.92 41.86 3hbp s ASP 246 CO -0.03 -2.74 1.91 1.55 0.68 0.00 0.00 175.17 176.55 3hbp h PRO 247 N -1.62 0.46 -0.04 2.11 0.13 -2.02 0.96 132.00 131.98 3hbp h PRO 247 Ca -0.52 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 3hbp h PRO 247 Cb 1.33 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.36 3hbp h PRO 247 CO 0.60 0.30 0.00 0.41 -0.23 0.00 0.00 178.00 179.09 3hbp n GLY 248 N -1.50 -0.68 0.71 1.56 0.00 -1.26 -4.95 105.19 99.07 3hbp n GLY 248 Ca 0.15 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3hbp n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hbp n GLY 249 N 0.86 0.63 3.67 -0.02 0.00 0.33 -5.05 105.19 105.61 3hbp n GLY 249 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 3hbp n GLY 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hbp s ALA 250 N -2.44 3.60 0.55 4.61 0.00 -1.26 -4.75 121.76 122.06 3hbp s ALA 250 Ca 0.00 0.34 -0.15 0.00 0.00 0.00 0.00 51.96 52.14 3hbp s ALA 250 Cb 0.00 -3.54 -0.06 0.00 0.00 0.00 0.00 23.12 19.51 3hbp s ALA 250 CO 0.00 -0.96 1.00 -1.25 0.00 0.00 0.00 175.76 174.55 3hbp s PRO 251 N 2.92 3.79 0.27 0.00 0.04 -1.26 -2.30 135.00 138.47 3hbp s PRO 251 Ca 0.49 0.94 -0.31 0.00 0.04 0.00 0.00 61.00 62.16 3hbp s PRO 251 Cb -0.18 -2.11 -0.12 0.00 0.04 0.00 0.00 34.50 32.12 3hbp s PRO 251 CO 0.12 -0.40 1.57 0.98 0.04 0.00 0.00 177.00 179.31 3hbp n TYR 252 N -1.89 2.70 -3.91 0.56 9.36 -0.96 -4.86 117.16 118.15 3hbp n TYR 252 Ca 0.07 0.27 -0.08 0.00 3.32 0.00 0.00 57.90 61.47 3hbp n TYR 252 Cb 0.54 -2.58 -0.08 0.00 -0.63 0.00 0.00 39.34 36.59 3hbp n TYR 252 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 3hbp s GLY 253 N 0.54 0.19 0.07 2.98 0.00 -1.26 -0.45 107.32 109.38 3hbp s GLY 253 Ca 0.66 -0.76 -0.26 0.00 0.00 0.00 0.00 44.72 44.36 3hbp s GLY 253 CO 0.47 -0.92 0.83 0.00 0.00 0.00 0.00 173.10 173.48 3hbp s ALA 254 N -3.88 -1.72 0.17 3.20 0.00 -0.83 -4.41 121.76 114.30 3hbp s ALA 254 Ca 0.06 0.68 0.02 0.00 0.00 0.00 0.00 51.96 52.72 3hbp s ALA 254 Cb 0.05 0.58 -0.05 0.00 0.00 0.00 0.00 23.12 23.71 3hbp s ALA 254 CO -0.10 -0.79 -0.02 -1.54 0.00 0.00 0.00 175.76 173.31 3hbp s SER 255 N -2.64 1.35 0.08 0.00 1.04 -1.26 0.24 113.70 112.52 3hbp s SER 255 Ca 0.06 -1.15 0.01 0.00 0.48 0.00 0.00 55.95 55.35 3hbp s SER 255 Cb -0.01 0.09 -0.04 0.00 0.10 0.00 0.00 66.02 66.16 3hbp s SER 255 CO -0.07 -0.53 -0.06 0.27 0.98 0.00 0.00 173.24 173.83 3hbp s ILE 256 N -3.59 0.60 0.50 -1.02 -4.36 -0.80 -4.94 121.20 107.59 3hbp s ILE 256 Ca 0.23 -1.78 -0.23 0.00 -0.26 0.00 0.00 60.65 58.60 3hbp s ILE 256 Cb 0.06 -1.49 -0.06 0.00 1.25 0.00 0.00 42.46 42.22 3hbp s ILE 256 CO 0.03 -0.82 1.34 -2.84 0.24 0.00 0.00 174.94 172.90 3hbp s PRO 257 N -3.49 3.42 0.21 0.37 0.02 -1.26 -0.53 135.00 133.74 3hbp s PRO 257 Ca 0.08 2.20 -0.09 0.00 0.02 0.00 0.00 61.00 63.21 3hbp s PRO 257 Cb 0.03 -2.41 0.28 0.00 0.02 0.00 0.00 34.50 32.42 3hbp s PRO 257 CO -0.05 -0.95 1.76 -0.92 -0.33 0.00 0.00 177.00 176.51 3hbp h TYR 258 N 1.84 0.48 -0.92 6.54 3.20 -1.18 -2.20 116.97 124.73 3hbp h TYR 258 Ca -0.51 0.03 0.12 0.00 3.14 0.00 0.00 58.73 61.52 3hbp h TYR 258 Cb 1.28 -0.12 -0.08 0.00 1.54 0.00 0.00 36.73 39.35 3hbp h TYR 258 CO 0.48 0.15 0.55 0.78 -1.64 0.00 0.00 178.16 178.48 3hbp h GLY 259 N 0.48 1.50 1.02 1.82 0.00 -1.91 -1.20 103.07 104.78 3hbp h GLY 259 Ca 0.31 -0.36 -0.09 0.00 0.00 0.00 0.00 47.33 47.20 3hbp h GLY 259 CO -0.28 0.10 -0.04 -0.09 0.00 0.00 0.00 176.54 176.23 3hbp h ARG 260 N 0.85 0.89 -0.92 4.80 2.43 -1.79 -2.23 114.38 118.42 3hbp h ARG 260 Ca 0.47 -0.30 0.06 0.00 -0.81 0.00 0.00 59.98 59.40 3hbp h ARG 260 Cb 0.52 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 29.94 3hbp h ARG 260 CO -0.29 0.94 0.60 0.00 -1.51 0.00 0.00 179.97 179.71 3hbp h ALA 261 N 0.91 1.50 -0.00 2.80 0.00 -0.78 -3.00 119.26 120.69 3hbp h ALA 261 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3hbp h ALA 261 Cb 0.57 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3hbp h ALA 261 CO 0.03 0.36 -0.67 1.28 0.00 0.00 0.00 179.25 180.26 3hbp n LEU 262 N -4.49 0.67 -4.69 0.00 4.32 -0.65 -2.89 117.00 109.27 3hbp n LEU 262 Ca 0.14 -0.17 -0.42 0.00 -0.02 0.00 0.00 56.01 55.54 3hbp n LEU 262 Cb 0.20 -0.17 -0.03 0.00 -1.62 0.00 0.00 43.42 41.80 3hbp n LEU 262 CO 0.33 0.17 1.05 -0.55 -1.22 0.00 0.00 177.39 177.17 3hbp s SER 263 N -3.00 6.92 0.18 -1.43 0.15 -0.85 -4.85 113.70 110.83 3hbp s SER 263 Ca 0.10 2.03 -0.12 0.00 0.70 0.00 0.00 55.95 58.66 3hbp s SER 263 Cb 0.17 -2.56 0.10 0.00 -1.71 0.00 0.00 66.02 62.02 3hbp s SER 263 CO 0.76 -0.66 1.80 -0.65 1.20 0.00 0.00 173.24 175.68 3hbp h PRO 264 N 7.61 0.89 0.00 5.44 0.11 -1.92 -2.78 132.00 141.36 3hbp h PRO 264 Ca -0.37 -0.10 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 3hbp h PRO 264 Cb 1.18 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 3hbp h PRO 264 CO 0.89 0.67 -0.06 0.00 -0.21 0.00 0.00 178.00 179.30 3hbp h ALA 265 N 1.17 1.15 0.00 -0.75 0.00 -1.96 -3.06 119.26 115.81 3hbp h ALA 265 Ca 0.22 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3hbp h ALA 265 Cb 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3hbp h ALA 265 CO -0.04 0.07 -0.09 0.00 0.00 0.00 0.00 179.25 179.20 3hbp n ALA 266 N -2.18 2.39 -2.63 0.00 0.00 -1.05 -4.91 120.51 112.13 3hbp n ALA 266 Ca -0.02 -0.07 -0.20 0.00 0.00 0.00 0.00 53.44 53.16 3hbp n ALA 266 Cb 0.20 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.23 3hbp n ALA 266 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3hbp n ASP 267 N -2.14 -5.45 -4.67 0.00 8.00 -1.16 -4.39 116.55 106.74 3hbp n ASP 267 Ca 0.05 -0.07 -0.42 0.00 0.71 0.00 0.00 54.79 55.06 3hbp n ASP 267 Cb 0.42 -4.51 -0.03 0.00 -0.02 0.00 0.00 41.12 36.98 3hbp n ASP 267 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3hbp s VAL 268 N -2.99 3.99 0.08 2.53 1.01 -1.26 -4.57 120.40 119.19 3hbp s VAL 268 Ca 0.10 1.27 0.06 0.00 0.00 0.00 0.00 61.98 63.42 3hbp s VAL 268 Cb -0.05 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 3hbp s VAL 268 CO 0.13 -0.06 -0.08 -0.76 0.00 0.00 0.00 175.10 174.32 3hbp s LEU 269 N 3.06 3.12 -0.74 3.92 1.43 -0.75 -0.86 118.68 127.86 3hbp s LEU 269 Ca 0.61 -0.31 -0.17 0.00 -1.03 0.00 0.00 54.13 53.22 3hbp s LEU 269 Cb -0.27 -1.89 0.15 0.00 0.03 0.00 0.00 46.19 44.21 3hbp s LEU 269 CO 0.22 0.20 0.80 -0.76 0.23 0.00 0.00 176.35 177.04 3hbp s LEU 270 N -2.08 5.81 0.01 1.79 1.43 0.66 -0.60 118.68 125.71 3hbp s LEU 270 Ca 0.21 -1.99 -0.20 0.00 -1.03 0.00 0.00 54.13 51.12 3hbp s LEU 270 Cb -0.11 -2.29 -0.06 0.00 0.03 0.00 0.00 46.19 43.76 3hbp s LEU 270 CO 0.13 -0.92 0.58 0.00 0.23 0.00 0.00 176.35 176.38 3hbp s ALA 271 N 1.82 3.52 0.00 4.21 0.00 0.84 -1.55 121.76 130.60 3hbp s ALA 271 Ca 0.18 0.02 0.00 0.00 0.00 0.00 0.00 51.96 52.15 3hbp s ALA 271 Cb -0.16 -2.70 0.00 0.00 0.00 0.00 0.00 23.12 20.26 3hbp s ALA 271 CO -0.02 0.23 0.90 2.48 0.00 0.00 0.00 175.76 179.34 3hbp n TYR 272 N 2.46 0.00 -3.83 0.00 0.18 -0.84 -1.48 117.16 113.65 3hbp n TYR 272 Ca -0.08 -0.40 -0.13 0.00 1.88 0.00 0.00 57.90 59.18 3hbp n TYR 272 Cb 0.51 -0.04 -0.14 0.00 -0.38 0.00 0.00 39.34 39.29 3hbp n TYR 272 CO 0.00 0.00 0.00 -2.00 -2.08 0.00 0.00 176.86 172.78 3hbp s GLU 273 N -0.79 0.05 -0.07 -3.48 2.12 -0.74 -2.46 118.70 113.33 3hbp s GLU 273 Ca 0.00 0.13 -0.03 0.00 0.36 0.00 0.00 54.97 55.43 3hbp s GLU 273 Cb 0.00 -0.03 0.04 0.00 0.26 0.00 0.00 34.13 34.40 3hbp s GLU 273 CO 0.00 -0.05 0.10 1.41 -0.54 0.00 0.00 175.26 176.18 3hbp s MET 274 N 0.31 -0.02 -1.74 4.30 -2.45 0.32 -0.97 119.30 119.05 3hbp s MET 274 Ca -0.02 0.36 -0.18 0.00 -1.25 0.00 0.00 55.69 54.59 3hbp s MET 274 Cb -0.03 -0.65 0.17 0.00 1.25 0.00 0.00 34.83 35.56 3hbp s MET 274 CO -0.01 -0.38 0.66 0.09 1.05 0.00 0.00 175.02 176.42 3hbp n ASN 275 N 5.30 -2.38 0.00 1.11 3.02 0.47 -1.96 115.26 120.82 3hbp n ASN 275 Ca -0.04 -1.11 0.00 0.00 -0.03 0.00 0.00 54.58 53.40 3hbp n ASN 275 Cb 0.50 -2.33 0.00 0.00 -0.61 0.00 0.00 39.78 37.34 3hbp n ASN 275 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hbp n GLY 276 N -1.40 1.13 3.70 7.41 0.00 -1.26 -5.02 105.19 109.76 3hbp n GLY 276 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 3hbp n GLY 276 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hbp s THR 277 N -3.22 1.88 0.63 2.61 -4.23 -0.83 -5.11 115.64 107.36 3hbp s THR 277 Ca 0.00 -1.88 -0.16 0.00 -1.18 0.00 0.00 61.69 58.47 3hbp s THR 277 Cb 0.00 -2.76 -0.01 0.00 1.34 0.00 0.00 72.50 71.07 3hbp s THR 277 CO 0.00 0.00 1.10 -1.83 -0.54 0.00 0.00 174.62 173.35 3hbp s GLU 278 N -3.84 2.97 0.01 3.99 -1.05 -1.26 -0.52 118.70 119.00 3hbp s GLU 278 Ca 0.30 1.37 -0.34 0.00 -0.15 0.00 0.00 54.97 56.16 3hbp s GLU 278 Cb 0.06 -1.97 -0.12 0.00 -0.44 0.00 0.00 34.13 31.65 3hbp s GLU 278 CO 0.16 -1.12 1.77 1.28 0.95 0.00 0.00 175.26 178.31 3hbp n LEU 279 N -2.22 3.34 -4.73 1.83 4.77 -1.03 -4.58 117.00 114.39 3hbp n LEU 279 Ca 0.10 1.01 -0.35 0.00 -0.03 0.00 0.00 56.01 56.75 3hbp n LEU 279 Cb 0.52 -1.40 0.08 0.00 -2.33 0.00 0.00 43.42 40.29 3hbp n LEU 279 CO 0.47 -0.13 0.82 -2.84 -1.33 0.00 0.00 177.39 174.37 3hbp s PRO 280 N 2.90 2.32 0.16 3.23 0.02 -1.26 -4.21 135.00 138.15 3hbp s PRO 280 Ca 0.87 1.79 -0.17 0.00 0.02 0.00 0.00 61.00 63.51 3hbp s PRO 280 Cb -0.68 -1.85 0.08 0.00 0.02 0.00 0.00 34.50 32.07 3hbp s PRO 280 CO 0.46 -1.71 1.67 0.00 -0.33 0.00 0.00 177.00 177.09 3hbp h ARG 281 N -0.03 -0.01 -0.09 5.54 3.08 -1.92 -1.07 114.38 119.88 3hbp h ARG 281 Ca -0.48 0.00 0.03 0.00 0.07 0.00 0.00 59.98 59.59 3hbp h ARG 281 Cb 1.30 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.35 3hbp h ARG 281 CO 0.51 -0.00 0.11 -0.44 -1.07 0.00 0.00 179.97 179.08 3hbp h ASP 282 N -0.01 0.00 -0.61 7.04 3.32 -1.96 -1.74 116.42 122.46 3hbp h ASP 282 Ca 0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.23 3hbp h ASP 282 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 3hbp h ASP 282 CO -0.39 0.00 0.00 1.41 -1.72 0.00 0.00 179.24 178.54 3hbp n HIS 283 N -3.78 0.89 0.00 4.55 8.25 -0.47 -4.83 115.22 119.82 3hbp n HIS 283 Ca -0.01 -0.52 0.00 0.00 -0.26 0.00 0.00 57.72 56.94 3hbp n HIS 283 Cb 0.21 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.28 3hbp n HIS 283 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hbp n GLY 284 N 1.25 1.68 3.59 -1.41 0.00 -0.65 -4.81 105.19 104.84 3hbp n GLY 284 Ca 0.21 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.73 3hbp n GLY 284 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3hbp n PHE 285 N -0.47 1.47 1.00 1.61 7.35 -0.92 -1.44 117.46 126.08 3hbp n PHE 285 Ca 0.00 0.63 0.11 0.00 -0.76 0.00 0.00 57.45 57.43 3hbp n PHE 285 Cb 0.00 -2.32 0.07 0.00 0.35 0.00 0.00 39.48 37.58 3hbp n PHE 285 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 3hbp n PRO 286 N 2.22 0.02 -3.76 -7.13 -0.04 -1.26 -4.70 135.00 120.35 3hbp n PRO 286 Ca 0.17 -0.01 -0.13 0.00 -0.04 0.00 0.00 63.50 63.49 3hbp n PRO 286 Cb 0.22 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.06 3hbp n PRO 286 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3hbp s VAL 287 N -2.99 -0.02 0.10 0.52 1.01 -0.52 -4.23 120.40 114.27 3hbp s VAL 287 Ca 0.10 0.08 0.03 0.00 0.00 0.00 0.00 61.98 62.19 3hbp s VAL 287 Cb 0.17 -0.35 -0.04 0.00 0.00 0.00 0.00 36.38 36.16 3hbp s VAL 287 CO 0.78 0.03 -0.08 0.00 0.00 0.00 0.00 175.10 175.83 3hbp s ARG 288 N 0.72 0.84 0.32 2.72 1.70 -0.55 -1.00 118.95 123.70 3hbp s ARG 288 Ca -0.05 -1.24 -0.25 0.00 -0.47 0.00 0.00 55.73 53.72 3hbp s ARG 288 Cb -0.06 -0.38 -0.10 0.00 -0.57 0.00 0.00 34.95 33.84 3hbp s ARG 288 CO -0.04 0.03 0.92 0.08 -1.08 0.00 0.00 175.30 175.21 3hbp s VAL 289 N -2.98 4.26 -0.14 4.99 1.01 -0.55 -0.11 120.40 126.89 3hbp s VAL 289 Ca 0.08 1.75 0.01 0.00 0.00 0.00 0.00 61.98 63.82 3hbp s VAL 289 Cb 0.01 -3.97 0.02 0.00 0.00 0.00 0.00 36.38 32.43 3hbp s VAL 289 CO -0.02 0.12 -0.17 -0.69 0.00 0.00 0.00 175.10 174.35 3hbp s VAL 290 N -1.64 1.71 -0.52 2.92 1.01 0.23 -3.95 120.40 120.17 3hbp s VAL 290 Ca 0.50 -0.75 -0.04 0.00 0.00 0.00 0.00 61.98 61.69 3hbp s VAL 290 Cb -0.18 -1.56 0.14 0.00 0.00 0.00 0.00 36.38 34.78 3hbp s VAL 290 CO 0.23 0.48 0.34 -0.69 0.00 0.00 0.00 175.10 175.46 3hbp s VAL 291 N 1.13 3.62 0.42 2.92 1.01 -1.26 -1.81 120.40 126.42 3hbp s VAL 291 Ca -0.02 -2.46 -0.27 0.00 0.00 0.00 0.00 61.98 59.23 3hbp s VAL 291 Cb -0.14 -3.41 -0.10 0.00 0.00 0.00 0.00 36.38 32.73 3hbp s VAL 291 CO -0.06 -0.79 1.47 -2.84 0.00 0.00 0.00 175.10 172.88 3hbp s PRO 292 N 0.58 3.89 0.00 2.72 0.02 -1.26 -2.92 135.00 138.02 3hbp s PRO 292 Ca 0.12 2.52 0.00 0.00 0.02 0.00 0.00 61.00 63.67 3hbp s PRO 292 Cb -0.22 -2.81 0.00 0.00 0.02 0.00 0.00 34.50 31.49 3hbp s PRO 292 CO -0.04 -0.69 0.00 0.41 -0.33 0.00 0.00 177.00 176.35 3hbp n GLY 293 N 0.50 0.70 3.35 0.52 0.00 -1.26 -4.82 105.19 104.18 3hbp n GLY 293 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 3hbp n GLY 293 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hbp s VAL 294 N -2.63 1.92 0.45 1.61 1.01 -1.15 -1.25 120.40 120.38 3hbp s VAL 294 Ca 0.00 -1.94 -0.23 0.00 0.00 0.00 0.00 61.98 59.80 3hbp s VAL 294 Cb 0.00 -1.90 -0.09 0.00 0.00 0.00 0.00 36.38 34.39 3hbp s VAL 294 CO 0.00 -0.28 1.05 0.55 0.00 0.00 0.00 175.10 176.42 3hbp n VAL 295 N 0.28 2.68 -0.11 2.92 3.14 0.89 -4.68 118.33 123.45 3hbp n VAL 295 Ca -0.13 -0.50 0.12 0.00 -2.96 0.00 0.00 64.34 60.87 3hbp n VAL 295 Cb 0.57 -1.23 0.49 0.00 -1.06 0.00 0.00 33.84 32.61 3hbp n VAL 295 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 3hbp h GLY 296 N 1.45 0.63 -1.57 7.55 0.00 -1.53 -2.76 103.07 106.85 3hbp h GLY 296 Ca -0.46 -0.18 0.52 0.00 0.00 0.00 0.00 47.33 47.21 3hbp h GLY 296 CO 0.56 0.10 1.28 0.00 0.00 0.00 0.00 176.54 178.48 3hbp h ALA 297 N 1.68 3.68 -0.00 3.60 0.00 -1.89 0.11 119.26 126.43 3hbp h ALA 297 Ca 0.30 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3hbp h ALA 297 Cb 0.59 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3hbp h ALA 297 CO -0.09 -2.19 -0.59 0.54 0.00 0.00 0.00 179.25 176.92 3hbp n ARG 298 N -4.01 0.11 -2.45 0.00 5.12 -1.04 -4.52 116.66 109.88 3hbp n ARG 298 Ca 0.40 -0.08 -0.43 0.00 -1.93 0.00 0.00 57.85 55.81 3hbp n ARG 298 Cb 1.82 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 31.63 3hbp n ARG 298 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 3hbp n SER 299 N -1.38 4.89 -4.65 0.55 7.64 0.38 -4.80 113.62 116.26 3hbp n SER 299 Ca 0.06 -2.99 -0.42 0.00 1.01 0.00 0.00 58.87 56.52 3hbp n SER 299 Cb 0.34 -1.58 -0.03 0.00 -1.01 0.00 0.00 64.21 61.93 3hbp n SER 299 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3hbp s VAL 300 N 1.85 3.30 0.60 0.44 1.01 -1.25 -4.63 120.40 121.72 3hbp s VAL 300 Ca 0.44 0.36 -0.09 0.00 0.00 0.00 0.00 61.98 62.69 3hbp s VAL 300 Cb 0.06 -3.26 -0.02 0.00 0.00 0.00 0.00 36.38 33.16 3hbp s VAL 300 CO -0.00 -0.07 0.97 -0.54 0.00 0.00 0.00 175.10 175.46 3hbp s LYS 301 N 4.61 3.32 -1.39 2.72 1.02 -1.26 -1.48 119.74 127.29 3hbp s LYS 301 Ca 0.83 0.45 -0.06 0.00 0.02 0.00 0.00 55.97 57.20 3hbp s LYS 301 Cb -0.36 -2.16 0.03 0.00 -0.52 0.00 0.00 37.83 34.83 3hbp s LYS 301 CO 0.35 -0.61 0.91 0.91 -0.92 0.00 0.00 175.35 175.99 3hbp n TRP 302 N -2.67 -2.24 -1.69 3.18 8.01 -0.90 -4.30 117.44 116.83 3hbp n TRP 302 Ca 0.05 0.90 -0.44 0.00 -1.31 0.00 0.00 57.50 56.70 3hbp n TRP 302 Cb 0.55 -4.42 -0.03 0.00 -2.01 0.00 0.00 31.31 25.40 3hbp n TRP 302 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.69 176.57 3hbp n LEU 303 N -4.52 3.79 -0.00 -0.99 7.94 -0.17 0.06 117.00 123.12 3hbp n LEU 303 Ca -0.13 1.01 0.00 0.00 -1.11 0.00 0.00 56.01 55.79 3hbp n LEU 303 Cb 0.60 -1.51 -0.00 0.00 0.53 0.00 0.00 43.42 43.04 3hbp n LEU 303 CO 0.70 0.06 -0.11 -2.11 -1.11 0.00 0.00 177.39 174.82 3hbp n ARG 304 N 5.09 5.30 -3.63 1.96 1.85 0.17 -4.80 116.66 122.60 3hbp n ARG 304 Ca 0.18 -0.00 -0.11 0.00 -1.00 0.00 0.00 57.85 56.92 3hbp n ARG 304 Cb 0.34 -0.64 -0.07 0.00 -1.05 0.00 0.00 32.46 31.05 3hbp n ARG 304 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 3hbp s ARG 305 N -1.28 0.72 -0.15 2.89 3.52 -1.16 -2.75 118.95 120.74 3hbp s ARG 305 Ca 0.00 0.95 0.02 0.00 -0.13 0.00 0.00 55.73 56.58 3hbp s ARG 305 Cb 0.00 0.30 0.01 0.00 -1.56 0.00 0.00 34.95 33.71 3hbp s ARG 305 CO 0.03 -0.10 -0.21 0.08 -0.81 0.00 0.00 175.30 174.28 3hbp s VAL 306 N 0.69 2.09 0.01 7.11 1.01 -0.35 -1.57 120.40 129.38 3hbp s VAL 306 Ca -0.02 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 61.04 3hbp s VAL 306 Cb -0.05 -1.84 -0.01 0.00 0.00 0.00 0.00 36.38 34.47 3hbp s VAL 306 CO -0.06 0.55 -0.14 0.00 0.00 0.00 0.00 175.10 175.44 3hbp s ALA 307 N 0.96 1.19 -0.16 5.51 0.00 -0.27 -2.16 121.76 126.83 3hbp s ALA 307 Ca -0.03 -0.68 -0.13 0.00 0.00 0.00 0.00 51.96 51.11 3hbp s ALA 307 Cb -0.15 -0.27 -0.05 0.00 0.00 0.00 0.00 23.12 22.66 3hbp s ALA 307 CO -0.05 0.27 0.26 0.08 0.00 0.00 0.00 175.76 176.32 3hbp s VAL 308 N -0.49 5.32 -0.01 0.00 1.01 -1.26 0.24 120.40 125.22 3hbp s VAL 308 Ca 0.04 0.48 -0.09 0.00 0.00 0.00 0.00 61.98 62.42 3hbp s VAL 308 Cb -0.06 -3.59 0.01 0.00 0.00 0.00 0.00 36.38 32.73 3hbp s VAL 308 CO 0.00 0.41 0.17 -0.55 0.00 0.00 0.00 175.10 175.14 3hbp s SER 309 N 0.33 -0.03 0.61 3.32 0.15 -0.13 -4.98 113.70 112.97 3hbp s SER 309 Ca 0.15 -0.10 0.31 0.00 0.70 0.00 0.00 55.95 57.01 3hbp s SER 309 Cb -0.13 0.24 1.81 0.00 -1.71 0.00 0.00 66.02 66.23 3hbp s SER 309 CO 0.03 -0.35 2.16 -0.65 1.20 0.00 0.00 173.24 175.63 3hbp h PRO 310 N 4.36 0.00 -5.52 5.44 0.11 -1.84 0.15 132.00 134.70 3hbp h PRO 310 Ca -0.30 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 65.17 3hbp h PRO 310 Cb 1.19 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.21 3hbp h PRO 310 CO 0.40 0.00 -0.43 -0.51 -0.21 0.00 0.00 178.00 177.25 3hbp s ASP 311 N -5.68 4.34 0.98 -2.05 1.01 -1.26 -4.44 116.67 109.57 3hbp s ASP 311 Ca -0.05 -1.47 -0.13 0.00 0.71 0.00 0.00 52.55 51.61 3hbp s ASP 311 Cb 0.14 0.45 0.18 0.00 1.01 0.00 0.00 42.92 44.70 3hbp s ASP 311 CO 0.51 -0.95 1.12 -1.61 0.21 0.00 0.00 175.17 174.45 3hbp s GLU 312 N -4.04 0.59 0.13 8.23 2.02 -1.26 -4.20 118.70 120.17 3hbp s GLU 312 Ca 0.18 0.33 -0.31 0.00 0.02 0.00 0.00 54.97 55.19 3hbp s GLU 312 Cb 0.00 -1.77 -0.11 0.00 0.10 0.00 0.00 34.13 32.35 3hbp s GLU 312 CO 0.11 -2.58 1.82 0.45 0.02 0.00 0.00 175.26 175.08 3hbp n SER 313 N -4.04 4.01 0.00 -0.19 2.88 -1.26 -4.86 113.62 110.16 3hbp n SER 313 Ca 0.07 1.00 0.11 0.00 -1.33 0.00 0.00 58.87 58.71 3hbp n SER 313 Cb 0.58 -1.54 0.64 0.00 -0.75 0.00 0.00 64.21 63.14 3hbp n SER 313 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3hbp n PRO 314 N 5.34 0.76 -2.31 -1.46 -0.04 -1.26 -4.28 135.00 131.75 3hbp n PRO 314 Ca 0.18 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.28 3hbp n PRO 314 Cb 0.37 -1.44 -0.01 0.00 -0.04 0.00 0.00 33.50 32.37 3hbp n PRO 314 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3hbp s SER 315 N -1.92 6.11 0.35 3.54 1.04 -1.26 -4.84 113.70 116.72 3hbp s SER 315 Ca 0.32 2.21 0.14 0.00 0.48 0.00 0.00 55.95 59.11 3hbp s SER 315 Cb 0.15 -2.59 1.04 0.00 0.10 0.00 0.00 66.02 64.72 3hbp s SER 315 CO 0.25 -0.96 1.70 -0.74 0.98 0.00 0.00 173.24 174.47 3hbp h HIS 316 N 1.80 0.90 0.00 5.02 2.76 -1.91 -1.13 115.15 122.60 3hbp h HIS 316 Ca -0.49 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 57.71 3hbp h HIS 316 Cb 1.25 -0.25 0.00 0.00 1.55 0.00 0.00 27.41 29.96 3hbp h HIS 316 CO 0.53 -0.06 -0.15 0.91 -1.30 0.00 0.00 177.93 177.86 3hbp n TRP 317 N -4.91 0.39 -0.08 5.26 8.01 -1.26 -0.41 117.44 124.43 3hbp n TRP 317 Ca 0.30 0.11 -0.13 0.00 -1.31 0.00 0.00 57.50 56.47 3hbp n TRP 317 Cb 0.91 -0.64 -0.14 0.00 -2.01 0.00 0.00 31.31 29.43 3hbp n TRP 317 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.69 177.62 3hbp n GLN 318 N -1.84 0.68 -0.11 -0.99 -0.06 -0.49 -4.31 117.38 110.26 3hbp n GLN 318 Ca 0.06 0.11 -0.13 0.00 -2.00 0.00 0.00 57.00 55.04 3hbp n GLN 318 Cb 0.38 -1.59 -0.14 0.00 -4.06 0.00 0.00 30.24 24.83 3hbp n GLN 318 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 3hbp n GLN 319 N -2.99 0.67 -2.38 3.69 1.13 -0.82 -4.69 117.38 111.98 3hbp n GLN 319 Ca -0.33 0.06 -0.14 0.00 -1.94 0.00 0.00 57.00 54.65 3hbp n GLN 319 Cb 1.09 -1.53 0.03 0.00 0.11 0.00 0.00 30.24 29.94 3hbp n GLN 319 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 3hbp n ASN 320 N -2.96 3.50 -3.59 1.08 4.13 0.45 -4.79 115.26 113.07 3hbp n ASN 320 Ca -0.38 -3.04 0.01 0.00 1.68 0.00 0.00 54.58 52.86 3hbp n ASN 320 Cb 1.09 -0.41 -0.01 0.00 -1.54 0.00 0.00 39.78 38.92 3hbp n ASN 320 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 3hbp s ASP 321 N -3.66 -0.03 -1.26 6.41 2.15 -1.19 -4.84 116.67 114.24 3hbp s ASP 321 Ca 0.41 -0.04 -0.06 0.00 0.43 0.00 0.00 52.55 53.28 3hbp s ASP 321 Cb 0.38 0.07 -0.01 0.00 -0.30 0.00 0.00 42.92 43.06 3hbp s ASP 321 CO -0.00 -0.12 0.68 -1.22 -0.17 0.00 0.00 175.17 174.33 3hbp n TYR 322 N -0.37 -1.89 -3.85 -5.34 4.01 -1.26 -4.51 117.16 103.94 3hbp n TYR 322 Ca -0.06 0.72 -0.12 0.00 -0.16 0.00 0.00 57.90 58.27 3hbp n TYR 322 Cb 0.62 -3.98 -0.14 0.00 -0.31 0.00 0.00 39.34 35.53 3hbp n TYR 322 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 3hbp s LYS 323 N -5.98 0.05 -0.03 -0.72 1.02 -1.26 -1.35 119.74 111.46 3hbp s LYS 323 Ca 0.16 0.07 -0.09 0.00 0.02 0.00 0.00 55.97 56.13 3hbp s LYS 323 Cb -0.05 0.01 -0.05 0.00 -0.52 0.00 0.00 37.83 37.22 3hbp s LYS 323 CO 0.84 -0.01 0.27 0.20 -0.92 0.00 0.00 175.35 175.73 3hbp s GLY 324 N 0.08 2.29 0.40 -3.33 0.00 -1.26 -4.95 107.32 100.55 3hbp s GLY 324 Ca -0.00 -0.48 0.04 0.00 0.00 0.00 0.00 44.72 44.27 3hbp s GLY 324 CO -0.00 -0.21 0.07 -1.36 0.00 0.00 0.00 173.10 171.59 3hbp s PHE 325 N -1.15 1.94 0.64 1.90 0.08 -1.26 -4.87 117.98 115.26 3hbp s PHE 325 Ca 0.22 -1.04 -0.16 0.00 0.12 0.00 0.00 56.93 56.07 3hbp s PHE 325 Cb -0.14 -1.36 -0.01 0.00 -0.57 0.00 0.00 43.02 40.94 3hbp s PHE 325 CO 0.11 -0.01 1.13 0.45 -0.10 0.00 0.00 175.22 176.80 3hbp s SER 326 N -3.64 5.17 0.00 1.36 0.15 -1.26 -4.71 113.70 110.77 3hbp s SER 326 Ca 0.25 2.09 0.00 0.00 0.70 0.00 0.00 55.95 58.99 3hbp s SER 326 Cb 0.05 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 3hbp s SER 326 CO 0.13 -1.59 0.64 -0.81 1.20 0.00 0.00 173.24 172.81 3hbp n PRO 327 N -2.15 0.00 -0.00 5.44 -0.04 -1.10 -2.69 135.00 134.45 3hbp n PRO 327 Ca 0.11 0.19 0.06 0.00 -0.04 0.00 0.00 63.50 63.82 3hbp n PRO 327 Cb 0.51 -1.55 -0.09 0.00 -0.04 0.00 0.00 33.50 32.34 3hbp n PRO 327 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3hbp s VAL 329 N -2.61 3.71 0.52 0.00 1.01 -1.10 -5.03 120.40 116.89 3hbp s VAL 329 Ca -0.01 1.03 0.07 0.00 0.00 0.00 0.00 61.98 63.07 3hbp s VAL 329 Cb 0.09 -3.66 0.05 0.00 0.00 0.00 0.00 36.38 32.86 3hbp s VAL 329 CO 0.54 -0.03 0.71 -0.62 0.00 0.00 0.00 175.10 175.69 3hbp s ASP 330 N 2.25 5.30 0.21 3.32 3.68 -1.26 -4.42 116.67 125.75 3hbp s ASP 330 Ca 0.65 -0.50 -0.02 0.00 2.13 0.00 0.00 52.55 54.82 3hbp s ASP 330 Cb -0.31 -0.31 0.18 0.00 -1.45 0.00 0.00 42.92 41.03 3hbp s ASP 330 CO 0.26 -1.11 1.56 -0.50 0.13 0.00 0.00 175.17 175.50 3hbp h TRP 331 N 0.30 0.65 0.00 -5.34 -0.00 -1.98 -2.47 115.95 107.11 3hbp h TRP 331 Ca -0.37 -0.21 0.00 0.00 -0.00 0.00 0.00 58.89 58.31 3hbp h TRP 331 Cb 1.28 -0.13 0.00 0.00 -0.00 0.00 0.00 29.16 30.31 3hbp h TRP 331 CO 0.35 0.91 0.00 -0.40 -0.00 0.00 0.00 178.44 179.30 3hbp n ASP 332 N -3.99 0.00 -0.29 -3.49 5.68 -1.26 -3.66 116.55 109.54 3hbp n ASP 332 Ca -0.02 0.49 0.03 0.00 -0.50 0.00 0.00 54.79 54.78 3hbp n ASP 332 Cb 0.56 -0.50 0.06 0.00 -1.14 0.00 0.00 41.12 40.10 3hbp n ASP 332 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3hbp n THR 333 N -1.50 0.75 -2.13 2.12 -2.24 -1.13 -5.05 114.28 105.11 3hbp n THR 333 Ca 0.07 -0.88 -0.41 0.00 -2.27 0.00 0.00 64.05 60.56 3hbp n THR 333 Cb 0.32 0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 69.17 3hbp n THR 333 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3hbp s VAL 334 N -0.86 3.00 -0.30 2.28 0.11 -0.94 -4.82 120.40 118.86 3hbp s VAL 334 Ca 0.10 0.81 -0.02 0.00 -2.93 0.00 0.00 61.98 59.94 3hbp s VAL 334 Cb 0.05 -3.52 0.10 0.00 -1.53 0.00 0.00 36.38 31.49 3hbp s VAL 334 CO 0.07 0.12 0.11 -0.62 -3.33 0.00 0.00 175.10 171.45 3hbp s ASP 335 N 0.46 3.81 0.19 3.54 -1.08 -1.26 -5.00 116.67 117.32 3hbp s ASP 335 Ca 0.59 -1.48 0.23 0.00 -0.52 0.00 0.00 52.55 51.37 3hbp s ASP 335 Cb -0.39 -0.63 0.90 0.00 -1.46 0.00 0.00 42.92 41.34 3hbp s ASP 335 CO 0.39 -0.43 1.69 -1.22 0.52 0.00 0.00 175.17 176.13 3hbp n TYR 336 N 5.03 0.65 0.36 -5.34 4.02 -1.26 -2.16 117.16 118.46 3hbp n TYR 336 Ca -0.04 0.24 0.14 0.00 -0.01 0.00 0.00 57.90 58.23 3hbp n TYR 336 Cb 0.42 -0.88 0.54 0.00 -0.02 0.00 0.00 39.34 39.39 3hbp n TYR 336 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3hbp h ARG 337 N 0.00 0.00 0.00 -0.72 3.08 -1.95 -3.33 114.38 111.46 3hbp h ARG 337 Ca 0.00 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.85 3hbp h ARG 337 Cb 0.42 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.44 3hbp h ARG 337 CO 0.00 0.00 -1.50 0.25 -1.07 0.00 0.00 179.97 177.65 3hbp n THR 338 N -2.62 1.29 -4.27 2.04 -2.24 -0.92 -4.92 114.28 102.63 3hbp n THR 338 Ca 0.02 -0.72 -0.30 0.00 -2.27 0.00 0.00 64.05 60.78 3hbp n THR 338 Cb 0.30 -0.81 -0.10 0.00 -2.10 0.00 0.00 70.33 67.63 3hbp n THR 338 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hbp s ALA 339 N -2.84 3.02 0.27 6.98 0.00 -1.25 -5.11 121.76 122.83 3hbp s ALA 339 Ca -0.03 -1.17 -0.29 0.00 0.00 0.00 0.00 51.96 50.46 3hbp s ALA 339 Cb 0.08 -0.99 -0.10 0.00 0.00 0.00 0.00 23.12 22.11 3hbp s ALA 339 CO 0.82 0.65 1.31 -1.25 0.00 0.00 0.00 175.76 177.28 3hbp s PRO 340 N -2.04 4.37 0.28 0.00 0.04 -1.26 -4.99 135.00 131.41 3hbp s PRO 340 Ca 0.21 2.15 -0.26 0.00 0.04 0.00 0.00 61.00 63.14 3hbp s PRO 340 Cb -0.11 -3.12 -0.15 0.00 0.04 0.00 0.00 34.50 31.15 3hbp s PRO 340 CO 0.13 -0.21 0.63 0.00 0.04 0.00 0.00 177.00 177.59 3hbp n ALA 341 N 1.62 -1.88 -2.36 8.56 0.00 -1.26 -4.49 120.51 120.71 3hbp n ALA 341 Ca 0.03 0.35 -0.42 0.00 0.00 0.00 0.00 53.44 53.40 3hbp n ALA 341 Cb 0.42 -1.75 -0.03 0.00 0.00 0.00 0.00 19.45 18.10 3hbp n ALA 341 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3hbp s ILE 342 N -1.16 3.93 0.00 0.00 1.01 -0.46 -4.94 121.20 119.59 3hbp s ILE 342 Ca 0.62 1.35 0.00 0.00 0.00 0.00 0.00 60.65 62.62 3hbp s ILE 342 Cb -0.78 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 37.82 3hbp s ILE 342 CO 0.58 0.05 0.00 0.00 0.00 0.00 0.00 174.94 175.57 3hbp n GLN 343 N 4.60 0.00 -2.15 2.79 1.13 -1.26 -4.76 117.38 117.72 3hbp n GLN 343 Ca 0.11 0.00 -0.38 0.00 -1.94 0.00 0.00 57.00 54.78 3hbp n GLN 343 Cb 0.45 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.80 3hbp n GLN 343 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 3hbp s GLU 344 N 0.00 3.84 0.18 -1.09 2.02 -1.26 -0.08 118.70 122.31 3hbp s GLU 344 Ca 0.00 1.96 0.04 0.00 0.02 0.00 0.00 54.97 56.99 3hbp s GLU 344 Cb 0.00 -2.58 -0.04 0.00 0.10 0.00 0.00 34.13 31.62 3hbp s GLU 344 CO 0.00 -0.54 0.23 -0.51 0.02 0.00 0.00 175.26 174.47 3hbp s LEU 345 N -2.74 4.09 0.79 1.80 1.43 -1.25 -4.84 118.68 117.95 3hbp s LEU 345 Ca 0.60 0.01 -0.08 0.00 -1.03 0.00 0.00 54.13 53.64 3hbp s LEU 345 Cb -0.33 -2.67 0.12 0.00 0.03 0.00 0.00 46.19 43.34 3hbp s LEU 345 CO 0.42 0.03 1.10 -2.16 0.23 0.00 0.00 176.35 175.97 3hbp s PRO 346 N -3.36 1.58 0.34 1.29 0.04 -1.26 -1.69 135.00 131.94 3hbp s PRO 346 Ca 0.33 -0.56 -0.28 0.00 0.04 0.00 0.00 61.00 60.53 3hbp s PRO 346 Cb -0.10 -2.12 -0.12 0.00 0.04 0.00 0.00 34.50 32.19 3hbp s PRO 346 CO 0.26 -1.65 1.34 1.55 0.04 0.00 0.00 177.00 178.54 3hbp n VAL 347 N -3.14 1.92 -3.84 -0.36 3.14 -1.26 -4.25 118.33 110.53 3hbp n VAL 347 Ca 0.12 -0.48 -0.12 0.00 -2.96 0.00 0.00 64.34 60.91 3hbp n VAL 347 Cb 0.60 -1.64 -0.11 0.00 -1.06 0.00 0.00 33.84 31.63 3hbp n VAL 347 CO 0.00 0.00 0.00 -1.58 -6.46 0.00 0.00 176.83 168.79 3hbp s GLN 348 N -1.80 0.39 0.06 1.45 2.00 0.21 -4.78 119.66 117.19 3hbp s GLN 348 Ca 0.56 -0.15 -0.27 0.00 -2.00 0.00 0.00 55.36 53.50 3hbp s GLN 348 Cb -0.56 0.17 0.07 0.00 0.80 0.00 0.00 33.01 33.50 3hbp s GLN 348 CO 0.62 -0.09 0.65 -1.54 -0.50 0.00 0.00 175.29 174.43 3hbp s SER 349 N -0.85 -0.60 0.03 6.67 1.04 -1.26 -1.46 113.70 117.28 3hbp s SER 349 Ca -0.09 0.32 -0.16 0.00 0.48 0.00 0.00 55.95 56.50 3hbp s SER 349 Cb -0.05 0.56 0.03 0.00 0.10 0.00 0.00 66.02 66.66 3hbp s SER 349 CO 0.01 -0.79 0.35 0.00 0.98 0.00 0.00 173.24 173.79 3hbp s ALA 350 N -2.56 -0.84 -0.19 5.32 0.00 -1.00 -4.46 121.76 118.03 3hbp s ALA 350 Ca -0.04 0.18 -0.20 0.00 0.00 0.00 0.00 51.96 51.90 3hbp s ALA 350 Cb -0.01 0.29 -0.03 0.00 0.00 0.00 0.00 23.12 23.38 3hbp s ALA 350 CO -0.03 -0.41 0.58 0.08 0.00 0.00 0.00 175.76 175.99 3hbp s VAL 351 N -2.33 5.07 -0.03 0.00 1.01 -1.26 -2.12 120.40 120.74 3hbp s VAL 351 Ca -0.06 1.09 0.15 0.00 0.00 0.00 0.00 61.98 63.15 3hbp s VAL 351 Cb -0.01 -3.90 -0.22 0.00 0.00 0.00 0.00 36.38 32.24 3hbp s VAL 351 CO -0.02 0.16 0.30 0.35 0.00 0.00 0.00 175.10 175.89 3hbp n THR 352 N 4.53 0.08 -3.71 3.92 -2.24 0.07 -4.95 114.28 111.99 3hbp n THR 352 Ca -0.03 -0.36 -0.15 0.00 -2.27 0.00 0.00 64.05 61.24 3hbp n THR 352 Cb 0.50 0.09 -0.15 0.00 -2.10 0.00 0.00 70.33 68.67 3hbp n THR 352 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 3hbp s GLN 353 N -2.97 0.05 0.91 -0.78 0.74 -0.83 -4.41 119.66 112.37 3hbp s GLN 353 Ca -0.06 0.44 -0.12 0.00 0.05 0.00 0.00 55.36 55.68 3hbp s GLN 353 Cb 0.09 -0.24 0.20 0.00 1.10 0.00 0.00 33.01 34.15 3hbp s GLN 353 CO 0.61 -0.23 1.25 -1.25 -0.55 0.00 0.00 175.29 175.11 3hbp s PRO 354 N 1.69 0.75 0.21 1.67 0.04 -1.26 -0.58 135.00 137.52 3hbp s PRO 354 Ca -0.03 -0.73 -0.04 0.00 0.04 0.00 0.00 61.00 60.24 3hbp s PRO 354 Cb -0.12 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.39 3hbp s PRO 354 CO -0.05 -2.25 0.45 1.03 0.04 0.00 0.00 177.00 176.22 3hbp s ARG 355 N -5.71 3.61 0.28 4.56 1.81 -1.26 -5.02 118.95 117.22 3hbp s ARG 355 Ca 0.74 -0.09 -0.29 0.00 -1.72 0.00 0.00 55.73 54.36 3hbp s ARG 355 Cb -0.03 -2.76 -0.14 0.00 -0.45 0.00 0.00 34.95 31.57 3hbp s ARG 355 CO 0.51 0.35 1.18 -2.30 -0.68 0.00 0.00 175.30 174.37 3hbp n PRO 356 N -0.47 1.69 0.00 3.54 -0.02 -1.26 -2.73 135.00 135.75 3hbp n PRO 356 Ca -0.03 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 3hbp n PRO 356 Cb 0.53 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 3hbp n PRO 356 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hbp n GLY 357 N 1.36 2.37 3.73 -1.23 0.00 -0.02 -5.02 105.19 106.39 3hbp n GLY 357 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 3hbp n GLY 357 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hbp s ALA 358 N -2.57 2.14 -0.16 4.61 0.00 -1.10 -4.72 121.76 119.95 3hbp s ALA 358 Ca 0.00 0.75 -0.09 0.00 0.00 0.00 0.00 51.96 52.63 3hbp s ALA 358 Cb 0.00 -3.43 -0.05 0.00 0.00 0.00 0.00 23.12 19.65 3hbp s ALA 358 CO 0.00 -1.83 0.13 0.00 0.00 0.00 0.00 175.76 174.06 3hbp s ALA 359 N -2.17 3.77 -0.02 0.00 0.00 -1.26 -2.19 121.76 119.89 3hbp s ALA 359 Ca 0.71 -0.67 0.08 0.00 0.00 0.00 0.00 51.96 52.08 3hbp s ALA 359 Cb -0.26 -2.07 -0.02 0.00 0.00 0.00 0.00 23.12 20.77 3hbp s ALA 359 CO 0.46 0.38 -0.25 0.14 0.00 0.00 0.00 175.76 176.48 3hbp s VAL 360 N -0.29 2.01 0.39 0.00 -7.23 -0.29 -4.97 120.40 110.02 3hbp s VAL 360 Ca 0.11 -1.08 -0.27 0.00 -1.81 0.00 0.00 61.98 58.93 3hbp s VAL 360 Cb -0.11 -1.67 -0.10 0.00 0.56 0.00 0.00 36.38 35.06 3hbp s VAL 360 CO 0.01 0.57 1.39 -2.84 -0.31 0.00 0.00 175.10 173.92 3hbp s PRO 361 N -0.57 4.04 1.10 4.82 0.02 -1.26 -2.14 135.00 141.00 3hbp s PRO 361 Ca 0.09 2.36 -0.12 0.00 0.02 0.00 0.00 61.00 63.35 3hbp s PRO 361 Cb -0.10 -2.87 0.25 0.00 0.02 0.00 0.00 34.50 31.79 3hbp s PRO 361 CO -0.01 -0.51 1.06 -1.25 -0.33 0.00 0.00 177.00 175.96 3hbp s PRO 362 N -2.14 -0.38 0.42 5.54 0.04 -1.26 -4.42 135.00 132.79 3hbp s PRO 362 Ca 0.55 0.92 0.00 0.00 0.04 0.00 0.00 61.00 62.51 3hbp s PRO 362 Cb -0.42 -1.61 0.00 0.00 0.04 0.00 0.00 34.50 32.51 3hbp s PRO 362 CO 0.56 -3.39 0.00 0.41 0.04 0.00 0.00 177.00 174.62 3hbp n GLY 363 N 0.41 0.83 3.01 0.56 0.00 0.15 -4.93 105.19 105.22 3hbp n GLY 363 Ca 0.05 -0.58 -0.23 0.00 0.00 0.00 0.00 46.02 45.26 3hbp n GLY 363 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hbp s GLU 364 N 0.00 1.33 -0.08 1.61 2.02 -1.26 -0.52 118.70 121.80 3hbp s GLU 364 Ca 0.00 -0.35 0.05 0.00 0.02 0.00 0.00 54.97 54.69 3hbp s GLU 364 Cb 0.00 -1.17 -0.00 0.00 0.10 0.00 0.00 34.13 33.06 3hbp s GLU 364 CO 0.00 0.06 -0.24 -1.17 0.02 0.00 0.00 175.26 173.93 3hbp s LEU 365 N 0.48 2.07 -0.43 1.80 2.96 -0.62 -4.93 118.68 120.00 3hbp s LEU 365 Ca -0.09 -0.53 -0.13 0.00 -0.22 0.00 0.00 54.13 53.16 3hbp s LEU 365 Cb -0.13 -1.37 0.05 0.00 0.50 0.00 0.00 46.19 45.25 3hbp s LEU 365 CO 0.02 0.20 0.32 -0.89 -1.32 0.00 0.00 176.35 174.67 3hbp s THR 366 N 0.11 4.95 -0.09 3.68 2.01 -1.26 -1.28 115.64 123.76 3hbp s THR 366 Ca -0.11 -0.99 -0.19 0.00 0.31 0.00 0.00 61.69 60.71 3hbp s THR 366 Cb -0.16 -3.89 -0.04 0.00 0.01 0.00 0.00 72.50 68.42 3hbp s THR 366 CO 0.06 -0.44 0.54 -0.69 -0.69 0.00 0.00 174.62 173.40 3hbp s VAL 367 N 1.60 5.12 0.14 3.82 1.01 -0.47 -4.50 120.40 127.12 3hbp s VAL 367 Ca 0.04 1.09 0.06 0.00 0.00 0.00 0.00 61.98 63.17 3hbp s VAL 367 Cb -0.22 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 3hbp s VAL 367 CO 0.07 0.33 -0.14 -0.54 0.00 0.00 0.00 175.10 174.81 3hbp s LYS 368 N 0.53 1.07 0.02 2.72 1.02 0.25 -0.72 119.74 124.64 3hbp s LYS 368 Ca 0.29 -1.31 -0.03 0.00 0.02 0.00 0.00 55.97 54.94 3hbp s LYS 368 Cb -0.16 -0.92 0.01 0.00 -0.52 0.00 0.00 37.83 36.24 3hbp s LYS 368 CO 0.13 0.17 0.12 0.41 -0.92 0.00 0.00 175.35 175.26 3hbp n GLY 369 N 0.33 1.13 3.42 -3.33 0.00 -0.32 -0.75 105.19 105.68 3hbp n GLY 369 Ca -0.14 -0.93 -0.22 0.00 0.00 0.00 0.00 46.02 44.73 3hbp n GLY 369 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hbp s TYR 370 N -5.19 2.01 0.04 1.61 -0.85 -0.90 -1.20 117.35 112.88 3hbp s TYR 370 Ca 0.03 -0.52 -0.14 0.00 -0.52 0.00 0.00 57.07 55.92 3hbp s TYR 370 Cb -0.00 -0.98 0.02 0.00 0.38 0.00 0.00 41.96 41.38 3hbp s TYR 370 CO 0.01 0.48 0.32 0.00 -1.52 0.00 0.00 175.55 174.83 3hbp s ALA 371 N -2.80 -0.73 -0.12 9.51 0.00 0.86 -2.37 121.76 126.11 3hbp s ALA 371 Ca 0.27 0.06 -0.30 0.00 0.00 0.00 0.00 51.96 51.99 3hbp s ALA 371 Cb -0.01 0.32 0.12 0.00 0.00 0.00 0.00 23.12 23.55 3hbp s ALA 371 CO 0.11 -0.41 0.96 -0.46 0.00 0.00 0.00 175.76 175.96 3hbp s TRP 372 N -2.50 -0.38 0.06 0.00 -0.00 -0.53 0.48 118.94 116.06 3hbp s TRP 372 Ca -0.05 0.58 0.01 0.00 -0.00 0.00 0.00 56.10 56.63 3hbp s TRP 372 Cb -0.01 0.47 -0.03 0.00 -0.00 0.00 0.00 33.47 33.89 3hbp s TRP 372 CO -0.03 -0.40 -0.05 0.45 -0.00 0.00 0.00 176.95 176.92 3hbp s SER 373 N -1.40 0.70 0.87 5.86 0.15 -1.26 -0.62 113.70 118.01 3hbp s SER 373 Ca -0.01 -0.80 -0.13 0.00 0.70 0.00 0.00 55.95 55.71 3hbp s SER 373 Cb -0.01 0.11 0.12 0.00 -1.71 0.00 0.00 66.02 64.54 3hbp s SER 373 CO 0.00 -0.41 1.21 -0.83 1.20 0.00 0.00 173.24 174.40 3hbp s GLY 374 N -2.36 1.63 -0.53 9.45 0.00 -0.68 -4.35 107.32 110.48 3hbp s GLY 374 Ca -0.00 -0.77 0.00 0.00 0.00 0.00 0.00 44.72 43.95 3hbp s GLY 374 CO -0.04 -0.19 0.00 0.61 0.00 0.00 0.00 173.10 173.47 3hbp n GLY 375 N -3.20 0.76 2.39 0.20 0.00 -0.38 -2.28 105.19 102.68 3hbp n GLY 375 Ca 0.10 -0.68 -0.03 0.00 0.00 0.00 0.00 46.02 45.41 3hbp n GLY 375 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hbp n GLY 376 N -2.22 0.52 3.68 -0.02 0.00 -1.26 -4.81 105.19 101.08 3hbp n GLY 376 Ca -0.05 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.36 3hbp n GLY 376 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hbp s ARG 377 N -1.46 4.39 0.44 1.61 0.52 -0.96 -1.11 118.95 122.38 3hbp s ARG 377 Ca 0.00 1.40 -0.23 0.00 -0.52 0.00 0.00 55.73 56.38 3hbp s ARG 377 Cb 0.00 -3.56 -0.08 0.00 0.52 0.00 0.00 34.95 31.83 3hbp s ARG 377 CO 0.00 -0.38 1.12 -2.00 0.02 0.00 0.00 175.30 174.06 3hbp s GLU 378 N 2.23 3.88 -0.19 3.54 2.12 -1.26 -4.15 118.70 124.88 3hbp s GLU 378 Ca 0.48 1.66 -0.29 0.00 0.36 0.00 0.00 54.97 57.18 3hbp s GLU 378 Cb -0.18 -2.42 -0.00 0.00 0.26 0.00 0.00 34.13 31.79 3hbp s GLU 378 CO 0.16 -0.42 1.13 0.08 -0.54 0.00 0.00 175.26 175.67 3hbp s VAL 379 N -1.61 4.52 -0.07 3.70 1.01 -1.26 -0.14 120.40 126.55 3hbp s VAL 379 Ca 0.62 1.83 0.20 0.00 0.00 0.00 0.00 61.98 64.63 3hbp s VAL 379 Cb -0.26 -4.18 -0.30 0.00 0.00 0.00 0.00 36.38 31.65 3hbp s VAL 379 CO 0.31 -0.14 0.36 1.33 0.00 0.00 0.00 175.10 176.96 3hbp n VAL 380 N 5.25 0.31 -3.63 2.92 0.24 0.53 -4.94 118.33 119.01 3hbp n VAL 380 Ca 0.12 -0.54 -0.15 0.00 -2.04 0.00 0.00 64.34 61.73 3hbp n VAL 380 Cb 0.46 -0.09 -0.07 0.00 -1.47 0.00 0.00 33.84 32.66 3hbp n VAL 380 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3hbp s ARG 381 N -3.19 0.84 -0.10 7.34 3.52 -1.16 -5.02 118.95 121.19 3hbp s ARG 381 Ca -0.08 0.37 0.00 0.00 -0.13 0.00 0.00 55.73 55.90 3hbp s ARG 381 Cb 0.11 0.40 0.02 0.00 -1.56 0.00 0.00 34.95 33.92 3hbp s ARG 381 CO 0.83 -0.21 -0.08 0.08 -0.81 0.00 0.00 175.30 175.11 3hbp s VAL 382 N -0.66 1.00 -0.09 7.11 1.01 -1.26 -0.93 120.40 126.59 3hbp s VAL 382 Ca -0.07 -0.30 -0.09 0.00 0.00 0.00 0.00 61.98 61.51 3hbp s VAL 382 Cb -0.03 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.31 3hbp s VAL 382 CO 0.05 0.35 0.21 -1.81 0.00 0.00 0.00 175.10 173.91 3hbp s ASP 383 N 1.46 6.49 -0.04 3.32 1.01 -0.30 -0.39 116.67 128.22 3hbp s ASP 383 Ca 0.00 0.59 0.04 0.00 0.71 0.00 0.00 52.55 53.89 3hbp s ASP 383 Cb -0.13 -2.11 -0.00 0.00 1.01 0.00 0.00 42.92 41.68 3hbp s ASP 383 CO -0.05 0.38 -0.14 -0.69 0.21 0.00 0.00 175.17 174.88 3hbp s VAL 384 N -1.05 1.21 0.06 -1.27 1.01 0.70 -1.67 120.40 119.38 3hbp s VAL 384 Ca 0.18 -0.59 0.09 0.00 0.00 0.00 0.00 61.98 61.66 3hbp s VAL 384 Cb -0.13 -1.05 -0.03 0.00 0.00 0.00 0.00 36.38 35.17 3hbp s VAL 384 CO 0.07 0.36 -0.24 -0.55 0.00 0.00 0.00 175.10 174.73 3hbp s SER 385 N 0.13 2.94 -0.00 3.32 0.15 0.75 -0.96 113.70 120.02 3hbp s SER 385 Ca -0.04 -0.60 0.12 0.00 0.70 0.00 0.00 55.95 56.13 3hbp s SER 385 Cb -0.11 -0.24 -0.15 0.00 -1.71 0.00 0.00 66.02 63.81 3hbp s SER 385 CO 0.02 0.21 0.43 0.18 1.20 0.00 0.00 173.24 175.28 3hbp n LEU 386 N 1.64 0.39 -1.93 3.45 4.77 -1.25 -0.52 117.00 123.55 3hbp n LEU 386 Ca -0.17 -0.35 -0.23 0.00 -0.03 0.00 0.00 56.01 55.23 3hbp n LEU 386 Cb 0.53 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.73 3hbp n LEU 386 CO 0.23 0.10 0.91 -0.90 -1.33 0.00 0.00 177.39 176.39 3hbp n ASP 387 N -1.47 5.05 -0.05 -1.43 5.68 -1.22 -1.26 116.55 121.84 3hbp n ASP 387 Ca 0.01 -3.76 -0.01 0.00 -0.50 0.00 0.00 54.79 50.53 3hbp n ASP 387 Cb 0.22 -0.71 -0.00 0.00 -1.14 0.00 0.00 41.12 39.49 3hbp n ASP 387 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3hbp n GLY 388 N -0.96 0.44 0.00 6.12 0.00 -0.78 -3.74 105.19 106.28 3hbp n GLY 388 Ca 0.50 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.39 3hbp n GLY 388 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hbp n GLY 389 N -2.17 1.28 0.09 -0.02 0.00 -1.26 -5.03 105.19 98.08 3hbp n GLY 389 Ca -0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.85 3hbp n GLY 389 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3hbp h ARG 390 N 1.23 0.00 -6.33 1.61 3.08 -1.99 -3.48 114.38 108.50 3hbp h ARG 390 Ca 0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 3hbp h ARG 390 Cb 0.00 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 29.93 3hbp h ARG 390 CO 0.00 0.83 -0.69 0.95 -1.07 0.00 0.00 179.97 179.99 3hbp s THR 391 N -2.26 3.29 0.03 2.04 -4.23 -1.26 -5.13 115.64 108.13 3hbp s THR 391 Ca -0.23 -1.77 -0.00 0.00 -1.18 0.00 0.00 61.69 58.51 3hbp s THR 391 Cb 0.03 -2.69 -0.03 0.00 1.34 0.00 0.00 72.50 71.15 3hbp s THR 391 CO 0.54 -0.22 -0.03 0.26 -0.54 0.00 0.00 174.62 174.63 3hbp s TRP 392 N -1.98 0.38 0.04 3.99 0.52 -1.26 -4.32 118.94 116.32 3hbp s TRP 392 Ca 0.28 -0.77 0.02 0.00 0.02 0.00 0.00 56.10 55.65 3hbp s TRP 392 Cb -0.08 -0.28 -0.03 0.00 -1.15 0.00 0.00 33.47 31.94 3hbp s TRP 392 CO 0.17 -0.27 -0.08 0.15 0.02 0.00 0.00 176.95 176.95 3hbp s LYS 393 N -2.54 0.54 0.04 4.98 1.02 -0.13 -4.93 119.74 118.71 3hbp s LYS 393 Ca -0.06 -0.79 -0.30 0.00 0.02 0.00 0.00 55.97 54.84 3hbp s LYS 393 Cb -0.02 -0.27 -0.04 0.00 -0.52 0.00 0.00 37.83 36.97 3hbp s LYS 393 CO -0.05 0.04 0.98 0.08 -0.92 0.00 0.00 175.35 175.48 3hbp s VAL 394 N -1.52 4.75 0.58 3.17 1.01 -1.26 -0.21 120.40 126.91 3hbp s VAL 394 Ca -0.09 2.06 -0.07 0.00 0.00 0.00 0.00 61.98 63.88 3hbp s VAL 394 Cb -0.09 -4.32 -0.02 0.00 0.00 0.00 0.00 36.38 31.96 3hbp s VAL 394 CO 0.00 0.21 0.92 0.00 0.00 0.00 0.00 175.10 176.23 3hbp s ALA 395 N 0.69 3.24 0.02 5.51 0.00 0.47 -4.92 121.76 126.76 3hbp s ALA 395 Ca 0.50 -0.46 -0.26 0.00 0.00 0.00 0.00 51.96 51.75 3hbp s ALA 395 Cb -0.22 -2.76 -0.05 0.00 0.00 0.00 0.00 23.12 20.10 3hbp s ALA 395 CO 0.29 -0.68 0.79 0.50 0.00 0.00 0.00 175.76 176.66 3hbp s ARG 396 N -5.00 4.51 -0.13 0.00 3.52 -0.16 -4.75 118.95 116.93 3hbp s ARG 396 Ca 0.53 1.10 -0.06 0.00 -0.13 0.00 0.00 55.73 57.17 3hbp s ARG 396 Cb -0.11 -3.39 -0.04 0.00 -1.56 0.00 0.00 34.95 29.85 3hbp s ARG 396 CO 0.48 0.19 0.08 -0.51 -0.81 0.00 0.00 175.30 174.73 3hbp s LEU 397 N 0.26 4.02 -0.08 -0.88 1.43 -1.26 -1.94 118.68 120.23 3hbp s LEU 397 Ca 0.41 0.27 0.03 0.00 -1.03 0.00 0.00 54.13 53.80 3hbp s LEU 397 Cb -0.20 -1.98 0.01 0.00 0.03 0.00 0.00 46.19 44.04 3hbp s LEU 397 CO 0.23 0.32 -0.17 -0.04 0.23 0.00 0.00 176.35 176.92 3hbp s MET 398 N -0.51 2.30 0.18 1.70 -1.94 0.62 -5.00 119.30 116.65 3hbp s MET 398 Ca 0.11 -0.62 -0.09 0.00 -1.71 0.00 0.00 55.69 53.37 3hbp s MET 398 Cb -0.12 -1.81 0.04 0.00 2.01 0.00 0.00 34.83 34.95 3hbp s MET 398 CO 0.02 0.09 0.48 0.41 -0.01 0.00 0.00 175.02 176.01 3hbp n GLY 399 N 3.71 1.26 1.23 -0.03 0.00 -1.26 -0.92 105.19 109.18 3hbp n GLY 399 Ca -0.21 -1.11 0.08 0.00 0.00 0.00 0.00 46.02 44.78 3hbp n GLY 399 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hbp n ASP 400 N -1.18 4.50 -3.37 1.61 5.68 -1.26 -5.01 116.55 117.51 3hbp n ASP 400 Ca -0.04 -2.95 -0.30 0.00 -0.50 0.00 0.00 54.79 51.00 3hbp n ASP 400 Cb 0.32 -0.58 0.02 0.00 -1.14 0.00 0.00 41.12 39.74 3hbp n ASP 400 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 3hbp n LYS 401 N -0.07 -1.57 -1.73 0.11 3.00 -1.26 -4.96 118.16 111.67 3hbp n LYS 401 Ca 0.23 1.03 -0.31 0.00 -0.00 0.00 0.00 58.31 59.27 3hbp n LYS 401 Cb 0.98 -1.81 0.05 0.00 0.00 0.00 0.00 35.03 34.24 3hbp n LYS 401 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3hbp s ALA 402 N -1.84 2.77 0.75 3.14 0.00 -1.26 -5.07 121.76 120.25 3hbp s ALA 402 Ca 0.22 -0.13 -0.14 0.00 0.00 0.00 0.00 51.96 51.91 3hbp s ALA 402 Cb -0.02 -3.10 0.05 0.00 0.00 0.00 0.00 23.12 20.05 3hbp s ALA 402 CO 0.78 -1.14 1.20 -2.14 0.00 0.00 0.00 175.76 174.46 3hbp s PRO 403 N -5.18 2.04 0.23 0.00 0.02 -1.26 -4.85 135.00 125.99 3hbp s PRO 403 Ca 0.58 1.74 -0.31 0.00 0.02 0.00 0.00 61.00 63.03 3hbp s PRO 403 Cb -0.12 -1.82 -0.14 0.00 0.02 0.00 0.00 34.50 32.43 3hbp s PRO 403 CO 0.54 -1.91 1.20 -2.30 -0.33 0.00 0.00 177.00 174.20 3hbp n PRO 404 N -2.86 1.49 -0.96 5.54 -0.01 -1.26 -1.59 135.00 135.35 3hbp n PRO 404 Ca 0.13 0.53 0.00 0.00 -0.01 0.00 0.00 63.50 64.15 3hbp n PRO 404 Cb 0.50 -2.04 0.00 0.00 -0.01 0.00 0.00 33.50 31.95 3hbp n PRO 404 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 3hbp n GLY 405 N 1.81 0.75 0.84 -1.23 0.00 -1.23 -4.85 105.19 101.28 3hbp n GLY 405 Ca 0.12 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.19 3hbp n GLY 405 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hbp n ARG 406 N -2.17 0.85 -2.55 1.61 1.74 -0.62 -4.31 116.66 111.21 3hbp n ARG 406 Ca 0.00 -2.55 -0.42 0.00 -0.77 0.00 0.00 57.85 54.11 3hbp n ARG 406 Cb 0.02 -0.93 -0.01 0.00 -1.02 0.00 0.00 32.46 30.52 3hbp n ARG 406 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hbp s ALA 407 N -1.76 3.14 -0.23 7.54 0.00 -0.27 -4.70 121.76 125.48 3hbp s ALA 407 Ca 0.32 -2.77 0.19 0.00 0.00 0.00 0.00 51.96 49.69 3hbp s ALA 407 Cb 0.33 -4.63 0.08 0.00 0.00 0.00 0.00 23.12 18.90 3hbp s ALA 407 CO -0.09 -3.45 1.30 -1.49 0.00 0.00 0.00 175.76 172.03 3hbp h TRP 408 N 8.04 0.00 -2.84 0.00 -0.00 -1.84 -3.37 115.95 115.93 3hbp h TRP 408 Ca 0.40 0.00 -0.64 0.00 -0.00 0.00 0.00 58.89 58.65 3hbp h TRP 408 Cb 0.90 0.00 -0.05 0.00 -0.00 0.00 0.00 29.16 30.00 3hbp h TRP 408 CO 1.40 0.31 -0.50 0.00 -0.00 0.00 0.00 178.44 179.65 3hbp s ALA 409 N -3.08 3.95 1.11 1.49 0.00 -1.25 -1.46 121.76 122.53 3hbp s ALA 409 Ca 0.03 -0.78 -0.12 0.00 0.00 0.00 0.00 51.96 51.08 3hbp s ALA 409 Cb 0.07 -1.86 0.24 0.00 0.00 0.00 0.00 23.12 21.58 3hbp s ALA 409 CO 0.75 0.76 0.97 -2.67 0.00 0.00 0.00 175.76 175.57 3hbp n TRP 410 N 0.83 -0.81 -4.48 0.00 2.14 -1.26 -4.90 117.44 108.96 3hbp n TRP 410 Ca -0.10 -0.01 -0.34 0.00 2.07 0.00 0.00 57.50 59.13 3hbp n TRP 410 Cb 0.52 -1.76 -0.12 0.00 -0.81 0.00 0.00 31.31 29.14 3hbp n TRP 410 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 3hbp s ALA 411 N -2.45 2.99 0.10 -1.67 0.00 0.18 -4.74 121.76 116.18 3hbp s ALA 411 Ca 0.67 -0.84 -0.08 0.00 0.00 0.00 0.00 51.96 51.71 3hbp s ALA 411 Cb -0.24 -1.45 -0.06 0.00 0.00 0.00 0.00 23.12 21.38 3hbp s ALA 411 CO 0.64 0.34 0.39 -0.51 0.00 0.00 0.00 175.76 176.62 3hbp s LEU 412 N -0.04 4.32 0.04 0.00 1.43 -0.10 -0.09 118.68 124.24 3hbp s LEU 412 Ca 0.01 0.74 0.02 0.00 -1.03 0.00 0.00 54.13 53.86 3hbp s LEU 412 Cb -0.13 -3.07 -0.02 0.00 0.03 0.00 0.00 46.19 42.99 3hbp s LEU 412 CO 0.03 0.14 -0.06 -1.66 0.23 0.00 0.00 176.35 175.02 3hbp s TRP 413 N -1.47 0.55 -0.01 0.29 1.48 -0.34 -0.28 118.94 119.16 3hbp s TRP 413 Ca 0.35 -0.51 -0.04 0.00 -1.06 0.00 0.00 56.10 54.84 3hbp s TRP 413 Cb -0.13 -0.34 -0.00 0.00 -1.16 0.00 0.00 33.47 31.84 3hbp s TRP 413 CO 0.20 -0.12 0.08 -1.83 -4.06 0.00 0.00 176.95 171.22 3hbp s GLU 414 N -1.56 0.33 -0.07 3.25 -1.05 -0.82 -1.17 118.70 117.61 3hbp s GLU 414 Ca -0.12 -0.29 -0.03 0.00 -0.15 0.00 0.00 54.97 54.39 3hbp s GLU 414 Cb -0.10 0.13 0.04 0.00 -0.44 0.00 0.00 34.13 33.76 3hbp s GLU 414 CO -0.00 -0.07 0.10 -1.17 0.95 0.00 0.00 175.26 175.07 3hbp s LEU 415 N -0.96 0.08 -0.26 1.83 2.96 0.10 -0.99 118.68 121.45 3hbp s LEU 415 Ca -0.11 0.09 -0.14 0.00 -0.22 0.00 0.00 54.13 53.76 3hbp s LEU 415 Cb -0.06 -0.01 -0.04 0.00 0.50 0.00 0.00 46.19 46.58 3hbp s LEU 415 CO 0.00 -0.26 0.31 -0.89 -1.32 0.00 0.00 176.35 174.19 3hbp s THR 416 N 2.21 5.23 0.01 3.68 2.01 -1.26 -1.36 115.64 126.16 3hbp s THR 416 Ca 0.04 0.45 0.00 0.00 0.31 0.00 0.00 61.69 62.49 3hbp s THR 416 Cb -0.12 -3.64 -0.01 0.00 0.01 0.00 0.00 72.50 68.74 3hbp s THR 416 CO -0.05 0.22 -0.02 0.54 -0.69 0.00 0.00 174.62 174.62 3hbp s VAL 417 N 1.75 0.10 0.17 3.82 0.11 -0.40 -4.97 120.40 120.98 3hbp s VAL 417 Ca 0.13 -0.36 -0.30 0.00 -2.93 0.00 0.00 61.98 58.52 3hbp s VAL 417 Cb -0.15 -0.15 -0.08 0.00 -1.53 0.00 0.00 36.38 34.47 3hbp s VAL 417 CO 0.09 -0.17 1.27 -2.16 -3.33 0.00 0.00 175.10 170.80 3hbp s PRO 418 N -0.55 4.42 -0.09 1.54 0.04 -1.26 -1.60 135.00 137.50 3hbp s PRO 418 Ca -0.05 1.97 0.02 0.00 0.04 0.00 0.00 61.00 62.98 3hbp s PRO 418 Cb -0.04 -3.23 0.01 0.00 0.04 0.00 0.00 34.50 31.28 3hbp s PRO 418 CO -0.00 -0.22 -0.15 0.14 0.04 0.00 0.00 177.00 176.80 3hbp s VAL 419 N 0.28 1.45 0.16 -0.36 -7.23 0.32 -4.93 120.40 110.08 3hbp s VAL 419 Ca 0.57 -0.64 -0.20 0.00 -1.81 0.00 0.00 61.98 59.90 3hbp s VAL 419 Cb -0.34 -1.31 -0.08 0.00 0.56 0.00 0.00 36.38 35.21 3hbp s VAL 419 CO 0.36 0.43 0.66 -1.61 -0.31 0.00 0.00 175.10 174.62 3hbp s GLU 420 N 0.79 4.25 -0.02 4.82 0.41 -1.26 -0.67 118.70 127.01 3hbp s GLU 420 Ca -0.11 0.82 -0.34 0.00 -0.41 0.00 0.00 54.97 54.93 3hbp s GLU 420 Cb -0.16 -3.06 -0.12 0.00 -1.78 0.00 0.00 34.13 29.01 3hbp s GLU 420 CO 0.02 0.51 1.82 0.00 -0.49 0.00 0.00 175.26 177.12 3hbp n ALA 421 N 1.18 1.04 -2.58 5.21 0.00 -1.26 -3.23 120.51 120.86 3hbp n ALA 421 Ca -0.06 0.32 -0.03 0.00 0.00 0.00 0.00 53.44 53.67 3hbp n ALA 421 Cb 0.51 -2.47 0.01 0.00 0.00 0.00 0.00 19.45 17.49 3hbp n ALA 421 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hbp n GLY 422 N 4.18 0.70 3.42 0.00 0.00 -0.97 -4.90 105.19 107.63 3hbp n GLY 422 Ca 0.21 -0.58 -0.27 0.00 0.00 0.00 0.00 46.02 45.38 3hbp n GLY 422 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hbp s THR 423 N -2.94 2.33 -0.11 2.61 -4.23 -1.20 -4.96 115.64 107.14 3hbp s THR 423 Ca 0.07 -1.99 -0.11 0.00 -1.18 0.00 0.00 61.69 58.48 3hbp s THR 423 Cb -0.03 -2.10 -0.05 0.00 1.34 0.00 0.00 72.50 71.66 3hbp s THR 423 CO 0.09 -0.09 0.25 -1.61 -0.54 0.00 0.00 174.62 172.72 3hbp s GLU 424 N -2.57 3.84 0.01 3.99 0.41 -1.26 -1.18 118.70 121.94 3hbp s GLU 424 Ca 0.19 0.06 0.08 0.00 -0.41 0.00 0.00 54.97 54.90 3hbp s GLU 424 Cb -0.08 -3.28 -0.02 0.00 -1.78 0.00 0.00 34.13 28.97 3hbp s GLU 424 CO 0.09 0.58 -0.26 -0.51 -0.49 0.00 0.00 175.26 174.67 3hbp s LEU 425 N -0.54 2.10 -0.43 1.80 1.43 -0.25 -5.02 118.68 117.78 3hbp s LEU 425 Ca 0.17 -0.52 -0.06 0.00 -1.03 0.00 0.00 54.13 52.70 3hbp s LEU 425 Cb -0.13 -1.28 0.11 0.00 0.03 0.00 0.00 46.19 44.92 3hbp s LEU 425 CO 0.06 0.28 0.25 -0.70 0.23 0.00 0.00 176.35 176.47 3hbp s GLU 426 N -0.90 2.23 -0.13 1.70 2.12 -0.39 -1.35 118.70 121.99 3hbp s GLU 426 Ca 0.10 -1.75 -0.27 0.00 0.36 0.00 0.00 54.97 53.41 3hbp s GLU 426 Cb -0.10 -3.71 -0.01 0.00 0.26 0.00 0.00 34.13 30.57 3hbp s GLU 426 CO 0.00 -1.09 0.91 0.42 -0.54 0.00 0.00 175.26 174.97 3hbp s ILE 427 N 1.25 4.84 0.00 -3.70 1.01 0.13 -1.87 121.20 122.86 3hbp s ILE 427 Ca 0.06 1.83 0.02 0.00 0.00 0.00 0.00 60.65 62.57 3hbp s ILE 427 Cb -0.24 -4.22 -0.01 0.00 0.01 0.00 0.00 42.46 38.00 3hbp s ILE 427 CO -0.02 0.03 -0.08 -0.69 0.00 0.00 0.00 174.94 174.18 3hbp s VAL 428 N 1.98 0.61 0.06 2.92 1.01 0.33 0.68 120.40 127.99 3hbp s VAL 428 Ca 0.43 -0.42 0.04 0.00 0.00 0.00 0.00 61.98 62.04 3hbp s VAL 428 Cb -0.18 -0.53 -0.03 0.00 0.00 0.00 0.00 36.38 35.65 3hbp s VAL 428 CO 0.16 0.11 -0.11 0.00 0.00 0.00 0.00 175.10 175.25 3hbp s LYS 430 N -1.69 0.50 0.27 0.00 -2.85 -0.67 -3.55 119.74 111.76 3hbp s LYS 430 Ca -0.05 0.53 0.10 0.00 -1.00 0.00 0.00 55.97 55.55 3hbp s LYS 430 Cb -0.10 0.24 -0.05 0.00 -2.06 0.00 0.00 37.83 35.87 3hbp s LYS 430 CO 0.01 -0.07 -0.08 0.00 0.10 0.00 0.00 175.35 175.32 3hbp s ALA 431 N 0.11 3.01 -0.06 0.59 0.00 -1.26 -1.15 121.76 123.00 3hbp s ALA 431 Ca -0.01 -1.74 0.00 0.00 0.00 0.00 0.00 51.96 50.21 3hbp s ALA 431 Cb -0.03 -0.58 0.02 0.00 0.00 0.00 0.00 23.12 22.54 3hbp s ALA 431 CO 0.01 0.27 -0.05 0.08 0.00 0.00 0.00 175.76 176.07 3hbp s VAL 432 N -2.40 0.66 0.53 0.00 1.01 -0.10 -3.92 120.40 116.18 3hbp s VAL 432 Ca 0.31 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.16 3hbp s VAL 432 Cb -0.06 -0.70 0.10 0.00 0.00 0.00 0.00 36.38 35.73 3hbp s VAL 432 CO 0.18 0.27 0.72 -0.90 0.00 0.00 0.00 175.10 175.38 3hbp n ASP 433 N 4.43 1.04 0.07 3.32 5.68 -0.85 -0.35 116.55 129.90 3hbp n ASP 433 Ca -0.18 -1.86 0.11 0.00 -0.50 0.00 0.00 54.79 52.36 3hbp n ASP 433 Cb 0.51 -0.46 0.44 0.00 -1.14 0.00 0.00 41.12 40.47 3hbp n ASP 433 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3hbp n SER 434 N -2.90 0.44 -1.09 -1.12 3.41 0.80 -0.56 113.62 112.60 3hbp n SER 434 Ca 0.12 0.58 0.10 0.00 -0.26 0.00 0.00 58.87 59.41 3hbp n SER 434 Cb 0.44 -0.68 0.26 0.00 -0.26 0.00 0.00 64.21 63.96 3hbp n SER 434 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3hbp n SER 435 N -1.95 3.16 -2.14 4.04 3.41 -1.26 -4.94 113.62 113.92 3hbp n SER 435 Ca 0.04 -2.00 -0.20 0.00 -0.26 0.00 0.00 58.87 56.45 3hbp n SER 435 Cb 0.27 -0.39 -0.03 0.00 -0.26 0.00 0.00 64.21 63.80 3hbp n SER 435 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3hbp n TYR 436 N 1.23 -0.76 -2.25 7.33 4.01 0.28 -4.99 117.16 122.00 3hbp n TYR 436 Ca 0.20 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.58 3hbp n TYR 436 Cb 0.50 -3.77 -0.00 0.00 -0.31 0.00 0.00 39.34 35.76 3hbp n TYR 436 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 3hbp s ASN 437 N -2.23 5.87 0.28 7.72 -0.87 -1.26 -4.82 114.94 119.63 3hbp s ASN 437 Ca 0.00 2.23 0.03 0.00 -1.57 0.00 0.00 52.86 53.55 3hbp s ASN 437 Cb 0.00 -2.59 -0.06 0.00 -0.02 0.00 0.00 41.25 38.58 3hbp s ASN 437 CO 0.00 -1.12 0.04 0.68 -2.57 0.00 0.00 177.10 174.14 3hbp s VAL 438 N -1.68 1.00 -0.03 1.60 -7.23 -1.26 -2.01 120.40 110.78 3hbp s VAL 438 Ca 0.70 -2.02 -0.07 0.00 -1.81 0.00 0.00 61.98 58.78 3hbp s VAL 438 Cb -0.26 -2.60 -0.05 0.00 0.56 0.00 0.00 36.38 34.04 3hbp s VAL 438 CO 0.30 -0.12 0.23 -1.10 -0.31 0.00 0.00 175.10 174.11 3hbp s GLN 439 N -3.91 3.56 0.59 4.82 -0.21 -1.25 -4.85 119.66 118.41 3hbp s GLN 439 Ca 0.34 -0.07 -0.13 0.00 0.02 0.00 0.00 55.36 55.52 3hbp s GLN 439 Cb 0.07 -3.13 -0.04 0.00 1.00 0.00 0.00 33.01 30.91 3hbp s GLN 439 CO 0.13 0.70 1.02 -1.25 -2.12 0.00 0.00 175.29 173.77 3hbp s PRO 440 N -1.48 3.58 0.10 2.91 0.04 -1.26 -4.84 135.00 134.04 3hbp s PRO 440 Ca 0.23 0.90 -0.19 0.00 0.04 0.00 0.00 61.00 61.98 3hbp s PRO 440 Cb -0.13 -2.08 -0.07 0.00 0.04 0.00 0.00 34.50 32.26 3hbp s PRO 440 CO 0.12 -0.58 1.60 -0.44 0.04 0.00 0.00 177.00 177.74 3hbp h ASP 441 N 0.10 0.37 -3.86 6.66 5.19 -1.97 -2.71 116.42 120.22 3hbp h ASP 441 Ca -0.45 -0.22 -0.36 0.00 -0.62 0.00 0.00 57.03 55.38 3hbp h ASP 441 Cb 1.19 -0.10 -0.14 0.00 0.18 0.00 0.00 39.33 40.46 3hbp h ASP 441 CO 0.61 0.49 -0.69 -0.94 -3.12 0.00 0.00 179.24 175.58 3hbp s SER 442 N -5.76 1.88 -0.02 6.45 1.04 -1.26 -3.85 113.70 112.17 3hbp s SER 442 Ca -0.14 -1.09 -0.06 0.00 0.48 0.00 0.00 55.95 55.14 3hbp s SER 442 Cb 0.08 -0.01 -0.29 0.00 0.10 0.00 0.00 66.02 65.89 3hbp s SER 442 CO 0.73 -0.38 0.77 0.58 0.98 0.00 0.00 173.24 175.91 3hbp h VAL 443 N 2.65 1.05 -0.71 5.02 2.07 -1.94 -3.39 116.25 121.00 3hbp h VAL 443 Ca -0.37 -2.66 0.16 0.00 0.82 0.00 0.00 66.70 64.64 3hbp h VAL 443 Cb 1.20 2.75 -0.11 0.00 -1.52 0.00 0.00 31.29 33.62 3hbp h VAL 443 CO 0.64 0.83 0.10 0.00 0.02 0.00 0.00 177.57 179.16 3hbp h ALA 444 N 0.33 0.84 0.00 1.67 0.00 -1.96 -0.46 119.26 119.68 3hbp h ALA 444 Ca -0.29 0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3hbp h ALA 444 Cb 2.06 0.29 0.00 0.00 0.00 0.00 0.00 17.79 20.14 3hbp h ALA 444 CO 0.17 -0.37 0.00 -2.30 0.00 0.00 0.00 179.25 176.75 3hbp n PRO 445 N -5.22 0.00 -0.15 0.00 -0.02 -1.26 -2.16 135.00 126.18 3hbp n PRO 445 Ca 0.13 0.22 0.05 0.00 -2.02 0.00 0.00 63.50 61.88 3hbp n PRO 445 Cb 0.44 -1.50 0.13 0.00 -0.02 0.00 0.00 33.50 32.55 3hbp n PRO 445 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 3hbp n ILE 446 N -1.51 0.94 -1.81 4.25 -5.35 -0.24 -4.59 119.36 111.05 3hbp n ILE 446 Ca 0.04 -0.97 -0.40 0.00 -0.27 0.00 0.00 62.75 61.15 3hbp n ILE 446 Cb 0.19 0.54 0.02 0.00 -1.74 0.00 0.00 39.64 38.65 3hbp n ILE 446 CO 0.00 0.00 0.00 0.86 -1.76 0.00 0.00 176.55 175.65 3hbp s TRP 447 N -0.99 2.45 0.06 4.28 -0.00 -0.84 -4.85 118.94 119.05 3hbp s TRP 447 Ca 0.20 1.28 -0.18 0.00 -0.00 0.00 0.00 56.10 57.40 3hbp s TRP 447 Cb 0.11 -3.89 0.04 0.00 -0.00 0.00 0.00 33.47 29.72 3hbp s TRP 447 CO 0.14 -2.89 0.43 0.54 -0.00 0.00 0.00 176.95 175.17 3hbp s ASN 448 N -0.58 -0.30 0.44 5.86 2.20 -1.26 -2.73 114.94 118.57 3hbp s ASN 448 Ca 0.62 -0.02 0.18 0.00 -0.94 0.00 0.00 52.86 52.69 3hbp s ASN 448 Cb -0.43 0.44 1.03 0.00 -2.00 0.00 0.00 41.25 40.29 3hbp s ASN 448 CO 0.55 -0.71 1.95 0.17 -2.94 0.00 0.00 177.10 176.12 3hbp h LEU 449 N 2.86 0.00 0.00 3.54 8.10 -1.86 -1.35 115.31 126.61 3hbp h LEU 449 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.67 3hbp h LEU 449 Cb 1.22 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.44 3hbp h LEU 449 CO 0.44 0.23 -0.02 0.54 -4.11 0.00 0.00 178.44 175.51 3hbp n ARG 450 N -4.04 0.22 -1.51 0.17 5.12 -1.26 -2.64 116.66 112.71 3hbp n ARG 450 Ca -0.02 0.17 -0.12 0.00 -1.93 0.00 0.00 57.85 55.96 3hbp n ARG 450 Cb 0.30 -1.75 -0.04 0.00 -1.16 0.00 0.00 32.46 29.81 3hbp n ARG 450 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3hbp n GLY 451 N 1.34 0.99 3.96 -0.13 0.00 -0.51 -4.69 105.19 106.16 3hbp n GLY 451 Ca 0.06 -0.48 -0.23 0.00 0.00 0.00 0.00 46.02 45.37 3hbp n GLY 451 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hbp s VAL 452 N -2.46 2.40 -1.11 1.61 -7.23 -1.26 -4.42 120.40 107.93 3hbp s VAL 452 Ca 0.00 -0.51 -0.12 0.00 -1.81 0.00 0.00 61.98 59.54 3hbp s VAL 452 Cb 0.00 -2.89 -0.04 0.00 0.56 0.00 0.00 36.38 34.01 3hbp s VAL 452 CO 0.00 0.00 0.86 0.18 -0.31 0.00 0.00 175.10 175.83 3hbp n LEU 453 N -2.68 -4.30 -4.19 1.32 4.77 -0.52 -4.82 117.00 106.58 3hbp n LEU 453 Ca 0.10 -0.84 -0.40 0.00 -0.03 0.00 0.00 56.01 54.84 3hbp n LEU 453 Cb 0.60 -2.84 -0.09 0.00 -2.33 0.00 0.00 43.42 38.76 3hbp n LEU 453 CO 0.46 0.28 -0.01 -0.55 -1.33 0.00 0.00 177.39 176.24 3hbp s SER 454 N -3.51 5.64 -0.01 -1.43 0.15 -1.26 -4.86 113.70 108.42 3hbp s SER 454 Ca 0.42 -2.08 0.01 0.00 0.70 0.00 0.00 55.95 55.01 3hbp s SER 454 Cb -0.10 -1.98 0.02 0.00 -1.71 0.00 0.00 66.02 62.26 3hbp s SER 454 CO 0.79 -0.63 0.77 0.35 1.20 0.00 0.00 173.24 175.72 3hbp n THR 455 N 4.65 0.25 -0.86 6.45 -2.24 -1.26 -4.74 114.28 116.53 3hbp n THR 455 Ca -0.04 -0.28 -0.30 0.00 -2.27 0.00 0.00 64.05 61.15 3hbp n THR 455 Cb 0.41 0.69 0.16 0.00 -2.10 0.00 0.00 70.33 69.49 3hbp n THR 455 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hbp s ALA 456 N -0.33 1.32 0.22 6.98 0.00 -1.26 -4.25 121.76 124.44 3hbp s ALA 456 Ca 0.02 0.31 -0.32 0.00 0.00 0.00 0.00 51.96 51.98 3hbp s ALA 456 Cb 0.02 -3.34 -0.14 0.00 0.00 0.00 0.00 23.12 19.66 3hbp s ALA 456 CO 0.00 -2.68 1.29 0.91 0.00 0.00 0.00 175.76 175.28 3hbp n TRP 457 N -4.15 1.79 -2.82 0.00 8.01 -1.02 -4.93 117.44 114.31 3hbp n TRP 457 Ca 0.09 0.54 -0.41 0.00 -1.31 0.00 0.00 57.50 56.41 3hbp n TRP 457 Cb 0.53 -2.38 -0.04 0.00 -2.01 0.00 0.00 31.31 27.42 3hbp n TRP 457 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.69 175.10 3hbp s HIS 458 N -0.19 3.63 -0.13 -5.99 5.65 -1.23 -4.96 115.29 112.07 3hbp s HIS 458 Ca 0.69 1.55 0.02 0.00 0.25 0.00 0.00 55.06 57.58 3hbp s HIS 458 Cb -0.73 -3.02 0.01 0.00 -1.18 0.00 0.00 32.58 27.67 3hbp s HIS 458 CO 0.51 0.02 -0.20 1.03 -0.65 0.00 0.00 174.74 175.45 3hbp s ARG 459 N 0.93 2.83 -0.19 2.88 0.52 -1.26 -2.53 118.95 122.14 3hbp s ARG 459 Ca 0.47 -0.79 0.01 0.00 -0.52 0.00 0.00 55.73 54.91 3hbp s ARG 459 Cb -0.20 -2.31 0.03 0.00 0.52 0.00 0.00 34.95 32.99 3hbp s ARG 459 CO 0.25 -0.03 -0.15 0.08 0.02 0.00 0.00 175.30 175.47 3hbp s VAL 460 N 0.86 1.82 -0.26 3.52 1.01 0.22 -4.94 120.40 122.62 3hbp s VAL 460 Ca -0.07 -0.96 -0.16 0.00 0.00 0.00 0.00 61.98 60.80 3hbp s VAL 460 Cb -0.15 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.43 3hbp s VAL 460 CO -0.02 0.35 0.42 -0.13 0.00 0.00 0.00 175.10 175.71 3hbp s ARG 461 N 1.35 4.04 0.27 2.72 0.52 -1.26 0.21 118.95 126.80 3hbp s ARG 461 Ca 0.02 0.13 0.03 0.00 -0.52 0.00 0.00 55.73 55.38 3hbp s ARG 461 Cb -0.15 -3.65 -0.06 0.00 0.52 0.00 0.00 34.95 31.62 3hbp s ARG 461 CO -0.10 -0.29 0.05 0.14 0.02 0.00 0.00 175.30 175.12 3hbp s VAL 462 N 2.11 0.93 0.20 3.52 -7.23 -0.45 -0.84 120.40 118.64 3hbp s VAL 462 Ca 0.17 -2.01 0.10 0.00 -1.81 0.00 0.00 61.98 58.43 3hbp s VAL 462 Cb -0.16 -2.60 -0.04 0.00 0.56 0.00 0.00 36.38 34.14 3hbp s VAL 462 CO 0.10 -0.10 -0.19 -0.94 -0.31 0.00 0.00 175.10 173.65 3hbp s SER 463 N -3.37 3.04 -0.09 4.85 1.04 -0.93 -1.09 113.70 117.14 3hbp s SER 463 Ca 0.34 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.85 3hbp s SER 463 Cb 0.07 -0.21 -0.03 0.00 0.10 0.00 0.00 66.02 65.96 3hbp s SER 463 CO 0.13 -0.00 -0.08 -0.69 0.98 0.00 0.00 173.24 173.57 3hbp s VAL 464 N -2.19 3.54 0.92 5.02 1.01 -0.33 -1.13 120.40 127.24 3hbp s VAL 464 Ca 0.21 -0.52 -0.13 0.00 0.00 0.00 0.00 61.98 61.54 3hbp s VAL 464 Cb -0.05 -2.47 0.14 0.00 0.00 0.00 0.00 36.38 34.00 3hbp s VAL 464 CO 0.09 0.56 1.14 -1.10 0.00 0.00 0.00 175.10 175.79 3hbp s GLN 465 N -0.35 1.06 0.00 2.72 -0.21 -0.91 -2.43 119.66 119.54 3hbp s GLN 465 Ca 0.05 0.27 0.31 0.00 0.02 0.00 0.00 55.36 56.01 3hbp s GLN 465 Cb -0.12 -1.83 1.67 0.00 1.00 0.00 0.00 33.01 33.72 3hbp s GLN 465 CO 0.02 -2.25 2.09 -0.25 -2.12 0.00 0.00 175.29 172.79